USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1106 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 108 SER OG : rot 180:sc= 0.835 USER MOD Set 1.2: A 124 THR OG1 : rot -100:sc= 1.1 USER MOD Set 2.1: A 95 CYS SG : rot -171:sc= -1.49 USER MOD Set 2.2: A 97 GLN : amide:sc= -1.72 K(o=-3.2,f=-4.3) USER MOD Set 3.1: A 75 THR OG1 : rot 0:sc= 0.975 USER MOD Set 3.2: A 81 CYS SG : rot 31:sc= -1.13 USER MOD Set 4.1: A 49 THR OG1 : rot 160:sc= -0.919 USER MOD Set 4.2: A 66 LYS NZ :NH3+ -146:sc= -0.245 (180deg=-1.7!) USER MOD Set 5.1: A 53 LYS NZ :NH3+ -139:sc= 0.0962 (180deg=0) USER MOD Set 5.2: A 55 SER OG : rot 139:sc= 0.0993 USER MOD Set 6.1: A 25 ASN : amide:sc= -1.68 K(o=-1.7,f=-6.5!) USER MOD Set 6.2: A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.763 K(o=-0.76,f=-5.3!) USER MOD Single : A 4 SER OG : rot -1:sc= 0.841! USER MOD Single : A 6 ASN : amide:sc= -2.03 K(o=-2,f=-3.1) USER MOD Single : A 8 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.413) USER MOD Single : A 12 SER OG : rot -170:sc= -1.37 USER MOD Single : A 14 ASN :FLIP amide:sc= -3.45 F(o=-4,f=-3.4) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -3.02 K(o=-3,f=-9.2!) USER MOD Single : A 51 TYR OH : rot 180:sc= -0.877 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.00578 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot -21:sc= 0.498 USER MOD Single : A 60 THR OG1 : rot 1:sc= -1.64 USER MOD Single : A 61 THR OG1 : rot -38:sc= 0.404 USER MOD Single : A 64 ASN :FLIP amide:sc= -0.586 F(o=-2.4,f=-0.59) USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 82 LYS NZ :NH3+ -145:sc= -0.0162 (180deg=-1.23!) USER MOD Single : A 83 SER OG : rot 140:sc= 0.566 USER MOD Single : A 86 LYS NZ :NH3+ -168:sc= -0.279 (180deg=-0.424) USER MOD Single : A 89 SER OG : rot 180:sc= -0.0344 USER MOD Single : A 91 ASN : amide:sc= -2.7 K(o=-2.7,f=-11!) USER MOD Single : A 92 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.287) USER MOD Single : A 93 MET CE :methyl 175:sc= -4.66! (180deg=-4.82!) USER MOD Single : A 98 LYS NZ :NH3+ -162:sc=-0.00596 (180deg=-0.0938) USER MOD Single : A 101 LYS NZ :NH3+ -178:sc= -1.01 (180deg=-1.04) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.0272 USER MOD Single : A 110 THR OG1 : rot 45:sc= 0.77! USER MOD Single : A 114 THR OG1 : rot 68:sc= 0.679 USER MOD Single : A 115 ASN : amide:sc= -0.0293 X(o=-0.029,f=-0.32) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.423 USER MOD Single : A 123 MET CE :methyl -166:sc= -1.46 (180deg=-2.01!) USER MOD Single : A 130 CYS SG : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.556 USER MOD Single : A 134 TYR OH : rot 130:sc= -2.72 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -15.446 0.692 10.610 1.00 0.00 N ATOM 2 CA PRO A 1 -14.029 0.636 10.115 1.00 0.00 C ATOM 3 C PRO A 1 -13.670 1.906 9.324 1.00 0.00 C ATOM 4 O PRO A 1 -12.522 2.294 9.282 1.00 0.00 O ATOM 5 CB PRO A 1 -13.894 -0.580 9.193 1.00 0.00 C ATOM 6 CG PRO A 1 -15.266 -1.239 9.116 1.00 0.00 C ATOM 7 CD PRO A 1 -16.241 -0.348 9.888 1.00 0.00 C ATOM 0 H2 PRO A 1 -15.842 1.618 10.447 1.00 0.00 H new ATOM 0 H3 PRO A 1 -15.477 0.527 11.616 1.00 0.00 H new ATOM 0 HA PRO A 1 -13.354 0.561 10.968 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -13.556 -0.276 8.202 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -13.153 -1.278 9.582 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -15.583 -1.347 8.079 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -15.237 -2.240 9.546 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -16.950 0.120 9.206 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -16.822 -0.941 10.594 1.00 0.00 H new ATOM 17 N ASN A 2 -14.632 2.530 8.668 1.00 0.00 N ATOM 18 CA ASN A 2 -14.342 3.751 7.850 1.00 0.00 C ATOM 19 C ASN A 2 -13.599 3.313 6.581 1.00 0.00 C ATOM 20 O ASN A 2 -13.930 2.290 6.027 1.00 0.00 O ATOM 21 CB ASN A 2 -13.574 4.797 8.684 1.00 0.00 C ATOM 22 CG ASN A 2 -14.418 5.195 9.896 1.00 0.00 C ATOM 23 OD1 ASN A 2 -15.024 4.355 10.532 1.00 0.00 O ATOM 24 ND2 ASN A 2 -14.482 6.450 10.246 1.00 0.00 N ATOM 0 H ASN A 2 -15.610 2.239 8.668 1.00 0.00 H new ATOM 0 HA ASN A 2 -15.265 4.245 7.546 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -12.618 4.388 9.011 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -13.354 5.674 8.075 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -15.041 6.726 11.053 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -13.973 7.155 9.712 1.00 0.00 H new ATOM 31 N PHE A 3 -12.634 4.068 6.117 1.00 0.00 N ATOM 32 CA PHE A 3 -11.863 3.731 4.859 1.00 0.00 C ATOM 33 C PHE A 3 -12.649 4.162 3.603 1.00 0.00 C ATOM 34 O PHE A 3 -12.095 4.754 2.697 1.00 0.00 O ATOM 35 CB PHE A 3 -11.545 2.230 4.720 1.00 0.00 C ATOM 36 CG PHE A 3 -10.679 1.731 5.854 1.00 0.00 C ATOM 37 CD1 PHE A 3 -11.256 1.326 7.063 1.00 0.00 C ATOM 38 CD2 PHE A 3 -9.292 1.626 5.677 1.00 0.00 C ATOM 39 CE1 PHE A 3 -10.469 0.817 8.077 1.00 0.00 C ATOM 40 CE2 PHE A 3 -8.496 1.122 6.712 1.00 0.00 C ATOM 41 CZ PHE A 3 -9.093 0.709 7.916 1.00 0.00 C ATOM 0 H PHE A 3 -12.333 4.933 6.566 1.00 0.00 H new ATOM 0 HA PHE A 3 -10.924 4.277 4.943 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -12.475 1.662 4.696 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -11.039 2.052 3.771 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -12.323 1.412 7.204 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -8.840 1.933 4.746 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -10.927 0.500 9.003 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -7.426 1.051 6.586 1.00 0.00 H new ATOM 0 HZ PHE A 3 -8.484 0.309 8.713 1.00 0.00 H new ATOM 51 N SER A 4 -13.924 3.847 3.524 1.00 0.00 N ATOM 52 CA SER A 4 -14.743 4.204 2.321 1.00 0.00 C ATOM 53 C SER A 4 -14.565 5.682 1.947 1.00 0.00 C ATOM 54 O SER A 4 -14.905 6.565 2.713 1.00 0.00 O ATOM 55 CB SER A 4 -16.222 3.947 2.629 1.00 0.00 C ATOM 56 OG SER A 4 -16.733 5.006 3.432 1.00 0.00 O ATOM 0 H SER A 4 -14.436 3.351 4.253 1.00 0.00 H new ATOM 0 HA SER A 4 -14.410 3.591 1.484 1.00 0.00 H new ATOM 0 HB2 SER A 4 -16.790 3.874 1.701 1.00 0.00 H new ATOM 0 HB3 SER A 4 -16.336 2.996 3.148 1.00 0.00 H new ATOM 0 HG SER A 4 -16.018 5.650 3.618 1.00 0.00 H new ATOM 62 N GLY A 5 -14.051 5.956 0.773 1.00 0.00 N ATOM 63 CA GLY A 5 -13.872 7.375 0.351 1.00 0.00 C ATOM 64 C GLY A 5 -12.608 7.519 -0.482 1.00 0.00 C ATOM 65 O GLY A 5 -11.658 6.774 -0.333 1.00 0.00 O ATOM 0 H GLY A 5 -13.749 5.259 0.092 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -14.736 7.702 -0.227 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -13.813 8.019 1.229 1.00 0.00 H new ATOM 69 N ASN A 6 -12.589 8.503 -1.331 1.00 0.00 N ATOM 70 CA ASN A 6 -11.386 8.758 -2.162 1.00 0.00 C ATOM 71 C ASN A 6 -10.372 9.417 -1.249 1.00 0.00 C ATOM 72 O ASN A 6 -10.752 10.041 -0.273 1.00 0.00 O ATOM 73 CB ASN A 6 -11.737 9.693 -3.323 1.00 0.00 C ATOM 74 CG ASN A 6 -10.504 9.904 -4.203 1.00 0.00 C ATOM 75 OD1 ASN A 6 -9.574 10.582 -3.812 1.00 0.00 O ATOM 76 ND2 ASN A 6 -10.457 9.350 -5.383 1.00 0.00 N ATOM 0 H ASN A 6 -13.364 9.148 -1.486 1.00 0.00 H new ATOM 0 HA ASN A 6 -10.994 7.835 -2.589 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -12.549 9.268 -3.913 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -12.090 10.650 -2.939 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -9.640 9.486 -5.978 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -11.238 8.781 -5.711 1.00 0.00 H new ATOM 83 N TRP A 7 -9.097 9.260 -1.503 1.00 0.00 N ATOM 84 CA TRP A 7 -8.109 9.869 -0.559 1.00 0.00 C ATOM 85 C TRP A 7 -7.064 10.717 -1.254 1.00 0.00 C ATOM 86 O TRP A 7 -6.480 10.337 -2.251 1.00 0.00 O ATOM 87 CB TRP A 7 -7.409 8.760 0.197 1.00 0.00 C ATOM 88 CG TRP A 7 -8.412 7.946 0.926 1.00 0.00 C ATOM 89 CD1 TRP A 7 -8.974 6.804 0.482 1.00 0.00 C ATOM 90 CD2 TRP A 7 -8.996 8.220 2.213 1.00 0.00 C ATOM 91 NE1 TRP A 7 -9.835 6.329 1.455 1.00 0.00 N ATOM 92 CE2 TRP A 7 -9.890 7.182 2.543 1.00 0.00 C ATOM 93 CE3 TRP A 7 -8.817 9.263 3.117 1.00 0.00 C ATOM 94 CZ2 TRP A 7 -10.590 7.187 3.751 1.00 0.00 C ATOM 95 CZ3 TRP A 7 -9.518 9.292 4.321 1.00 0.00 C ATOM 96 CH2 TRP A 7 -10.408 8.253 4.645 1.00 0.00 C ATOM 0 H TRP A 7 -8.705 8.753 -2.297 1.00 0.00 H new ATOM 0 HA TRP A 7 -8.666 10.525 0.109 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -6.849 8.131 -0.495 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -6.689 9.182 0.898 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -8.784 6.338 -0.474 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -10.363 5.459 1.380 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -8.126 10.060 2.882 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -11.264 6.379 3.995 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -9.377 10.114 5.007 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -10.950 8.275 5.579 1.00 0.00 H new ATOM 107 N LYS A 8 -6.810 11.865 -0.688 1.00 0.00 N ATOM 108 CA LYS A 8 -5.781 12.772 -1.246 1.00 0.00 C ATOM 109 C LYS A 8 -4.494 12.575 -0.446 1.00 0.00 C ATOM 110 O LYS A 8 -4.532 12.380 0.755 1.00 0.00 O ATOM 111 CB LYS A 8 -6.245 14.231 -1.127 1.00 0.00 C ATOM 112 CG LYS A 8 -7.736 14.339 -1.465 1.00 0.00 C ATOM 113 CD LYS A 8 -7.965 13.935 -2.924 1.00 0.00 C ATOM 114 CE LYS A 8 -7.817 15.162 -3.825 1.00 0.00 C ATOM 115 NZ LYS A 8 -8.089 14.777 -5.239 1.00 0.00 N ATOM 0 H LYS A 8 -7.280 12.213 0.148 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.614 12.547 -2.299 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.066 14.596 -0.116 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.665 14.861 -1.801 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.316 13.695 -0.804 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.083 15.359 -1.301 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.248 13.168 -3.216 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.959 13.503 -3.041 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -8.509 15.943 -3.510 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.811 15.573 -3.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -7.427 15.275 -5.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -7.965 13.750 -5.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.065 15.037 -5.488 1.00 0.00 H new ATOM 129 N ILE A 9 -3.360 12.610 -1.097 1.00 0.00 N ATOM 130 CA ILE A 9 -2.074 12.410 -0.367 1.00 0.00 C ATOM 131 C ILE A 9 -1.873 13.540 0.639 1.00 0.00 C ATOM 132 O ILE A 9 -2.298 14.659 0.435 1.00 0.00 O ATOM 133 CB ILE A 9 -0.913 12.361 -1.368 1.00 0.00 C ATOM 134 CG1 ILE A 9 0.411 12.057 -0.624 1.00 0.00 C ATOM 135 CG2 ILE A 9 -0.826 13.678 -2.146 1.00 0.00 C ATOM 136 CD1 ILE A 9 1.040 13.315 0.019 1.00 0.00 C ATOM 0 H ILE A 9 -3.270 12.768 -2.101 1.00 0.00 H new ATOM 0 HA ILE A 9 -2.104 11.465 0.175 1.00 0.00 H new ATOM 0 HB ILE A 9 -1.091 11.561 -2.087 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.225 11.313 0.151 1.00 0.00 H new ATOM 0 HG13 ILE A 9 1.123 11.618 -1.323 1.00 0.00 H new ATOM 0 HG21 ILE A 9 0.002 13.629 -2.853 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -1.757 13.842 -2.689 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -0.662 14.501 -1.451 1.00 0.00 H new ATOM 0 HD11 ILE A 9 1.965 13.041 0.526 1.00 0.00 H new ATOM 0 HD12 ILE A 9 1.255 14.051 -0.756 1.00 0.00 H new ATOM 0 HD13 ILE A 9 0.343 13.742 0.741 1.00 0.00 H new ATOM 148 N ILE A 10 -1.215 13.237 1.719 1.00 0.00 N ATOM 149 CA ILE A 10 -0.954 14.246 2.774 1.00 0.00 C ATOM 150 C ILE A 10 0.225 13.727 3.613 1.00 0.00 C ATOM 151 O ILE A 10 0.143 12.695 4.246 1.00 0.00 O ATOM 152 CB ILE A 10 -2.248 14.430 3.613 1.00 0.00 C ATOM 153 CG1 ILE A 10 -3.144 15.491 2.937 1.00 0.00 C ATOM 154 CG2 ILE A 10 -1.946 14.883 5.054 1.00 0.00 C ATOM 155 CD1 ILE A 10 -4.366 14.825 2.288 1.00 0.00 C ATOM 0 H ILE A 10 -0.839 12.310 1.918 1.00 0.00 H new ATOM 0 HA ILE A 10 -0.691 15.223 2.367 1.00 0.00 H new ATOM 0 HB ILE A 10 -2.751 13.464 3.661 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -3.470 16.224 3.675 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -2.573 16.031 2.182 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -2.881 14.999 5.603 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.325 14.135 5.548 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.418 15.836 5.033 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.987 15.586 1.816 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.034 14.110 1.536 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.946 14.306 3.051 1.00 0.00 H new ATOM 167 N ARG A 11 1.324 14.432 3.593 1.00 0.00 N ATOM 168 CA ARG A 11 2.533 14.000 4.362 1.00 0.00 C ATOM 169 C ARG A 11 3.054 12.680 3.787 1.00 0.00 C ATOM 170 O ARG A 11 2.837 11.621 4.345 1.00 0.00 O ATOM 171 CB ARG A 11 2.178 13.822 5.847 1.00 0.00 C ATOM 172 CG ARG A 11 2.697 15.020 6.649 1.00 0.00 C ATOM 173 CD ARG A 11 1.969 16.289 6.202 1.00 0.00 C ATOM 174 NE ARG A 11 2.267 17.394 7.156 1.00 0.00 N ATOM 175 CZ ARG A 11 1.300 17.953 7.831 1.00 0.00 C ATOM 176 NH1 ARG A 11 0.185 18.272 7.231 1.00 0.00 N ATOM 177 NH2 ARG A 11 1.447 18.194 9.105 1.00 0.00 N ATOM 0 H ARG A 11 1.439 15.300 3.071 1.00 0.00 H new ATOM 0 HA ARG A 11 3.307 14.763 4.277 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.098 13.734 5.965 1.00 0.00 H new ATOM 0 HB3 ARG A 11 2.617 12.900 6.228 1.00 0.00 H new ATOM 0 HG2 ARG A 11 2.539 14.854 7.715 1.00 0.00 H new ATOM 0 HG3 ARG A 11 3.771 15.133 6.500 1.00 0.00 H new ATOM 0 HD2 ARG A 11 2.285 16.567 5.196 1.00 0.00 H new ATOM 0 HD3 ARG A 11 0.895 16.110 6.161 1.00 0.00 H new ATOM 0 HE ARG A 11 3.227 17.714 7.282 1.00 0.00 H new ATOM 0 HH11 ARG A 11 0.070 18.084 6.235 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -0.571 18.709 7.758 1.00 0.00 H new ATOM 0 HH21 ARG A 11 2.318 17.945 9.574 1.00 0.00 H new ATOM 0 HH22 ARG A 11 0.691 18.631 9.632 1.00 0.00 H new ATOM 191 N SER A 12 3.742 12.743 2.674 1.00 0.00 N ATOM 192 CA SER A 12 4.287 11.502 2.051 1.00 0.00 C ATOM 193 C SER A 12 5.814 11.593 1.982 1.00 0.00 C ATOM 194 O SER A 12 6.371 12.634 1.691 1.00 0.00 O ATOM 195 CB SER A 12 3.723 11.346 0.634 1.00 0.00 C ATOM 196 OG SER A 12 3.894 10.001 0.207 1.00 0.00 O ATOM 0 H SER A 12 3.949 13.605 2.170 1.00 0.00 H new ATOM 0 HA SER A 12 3.999 10.640 2.653 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.666 11.613 0.619 1.00 0.00 H new ATOM 0 HB3 SER A 12 4.233 12.025 -0.050 1.00 0.00 H new ATOM 0 HG SER A 12 3.682 9.931 -0.747 1.00 0.00 H new ATOM 202 N GLU A 13 6.488 10.506 2.250 1.00 0.00 N ATOM 203 CA GLU A 13 7.979 10.502 2.208 1.00 0.00 C ATOM 204 C GLU A 13 8.475 9.090 2.517 1.00 0.00 C ATOM 205 O GLU A 13 8.377 8.626 3.636 1.00 0.00 O ATOM 206 CB GLU A 13 8.524 11.476 3.255 1.00 0.00 C ATOM 207 CG GLU A 13 9.820 12.109 2.742 1.00 0.00 C ATOM 208 CD GLU A 13 10.598 12.704 3.917 1.00 0.00 C ATOM 209 OE1 GLU A 13 10.850 11.976 4.863 1.00 0.00 O ATOM 210 OE2 GLU A 13 10.928 13.876 3.850 1.00 0.00 O ATOM 0 H GLU A 13 6.064 9.612 2.499 1.00 0.00 H new ATOM 0 HA GLU A 13 8.323 10.810 1.221 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.787 12.251 3.464 1.00 0.00 H new ATOM 0 HB3 GLU A 13 8.710 10.952 4.192 1.00 0.00 H new ATOM 0 HG2 GLU A 13 10.426 11.360 2.233 1.00 0.00 H new ATOM 0 HG3 GLU A 13 9.593 12.886 2.012 1.00 0.00 H new ATOM 217 N ASN A 14 9.001 8.401 1.532 1.00 0.00 N ATOM 218 CA ASN A 14 9.498 7.005 1.766 1.00 0.00 C ATOM 219 C ASN A 14 10.037 6.385 0.464 1.00 0.00 C ATOM 220 O ASN A 14 10.857 5.494 0.518 1.00 0.00 O ATOM 221 CB ASN A 14 8.352 6.131 2.299 1.00 0.00 C ATOM 222 CG ASN A 14 8.523 5.909 3.806 1.00 0.00 C ATOM 223 OD1 ASN A 14 7.610 6.352 4.626 1.00 0.00 O flip ATOM 224 ND2 ASN A 14 9.497 5.326 4.239 1.00 0.00 N flip ATOM 0 H ASN A 14 9.108 8.743 0.577 1.00 0.00 H new ATOM 0 HA ASN A 14 10.307 7.051 2.495 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.394 6.611 2.100 1.00 0.00 H new ATOM 0 HB3 ASN A 14 8.342 5.172 1.780 1.00 0.00 H new ATOM 0 HD21 ASN A 14 10.211 4.980 3.598 1.00 0.00 H new ATOM 0 HD22 ASN A 14 9.601 5.183 5.244 1.00 0.00 H new ATOM 231 N PHE A 15 9.571 6.826 -0.697 1.00 0.00 N ATOM 232 CA PHE A 15 10.042 6.239 -2.010 1.00 0.00 C ATOM 233 C PHE A 15 11.570 6.008 -2.004 1.00 0.00 C ATOM 234 O PHE A 15 12.036 4.952 -2.365 1.00 0.00 O ATOM 235 CB PHE A 15 9.637 7.186 -3.188 1.00 0.00 C ATOM 236 CG PHE A 15 10.760 7.274 -4.215 1.00 0.00 C ATOM 237 CD1 PHE A 15 11.057 6.167 -5.022 1.00 0.00 C ATOM 238 CD2 PHE A 15 11.555 8.426 -4.293 1.00 0.00 C ATOM 239 CE1 PHE A 15 12.134 6.221 -5.907 1.00 0.00 C ATOM 240 CE2 PHE A 15 12.644 8.465 -5.168 1.00 0.00 C ATOM 241 CZ PHE A 15 12.928 7.360 -5.974 1.00 0.00 C ATOM 0 H PHE A 15 8.881 7.571 -0.790 1.00 0.00 H new ATOM 0 HA PHE A 15 9.561 5.270 -2.146 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.729 6.815 -3.664 1.00 0.00 H new ATOM 0 HB3 PHE A 15 9.411 8.180 -2.802 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.453 5.274 -4.959 1.00 0.00 H new ATOM 0 HD2 PHE A 15 11.326 9.283 -3.677 1.00 0.00 H new ATOM 0 HE1 PHE A 15 12.352 5.375 -6.542 1.00 0.00 H new ATOM 0 HE2 PHE A 15 13.265 9.347 -5.221 1.00 0.00 H new ATOM 0 HZ PHE A 15 13.768 7.391 -6.652 1.00 0.00 H new ATOM 251 N GLU A 16 12.334 6.987 -1.630 1.00 0.00 N ATOM 252 CA GLU A 16 13.811 6.808 -1.641 1.00 0.00 C ATOM 253 C GLU A 16 14.191 5.802 -0.567 1.00 0.00 C ATOM 254 O GLU A 16 15.046 4.959 -0.766 1.00 0.00 O ATOM 255 CB GLU A 16 14.504 8.146 -1.381 1.00 0.00 C ATOM 256 CG GLU A 16 14.011 9.184 -2.392 1.00 0.00 C ATOM 257 CD GLU A 16 14.586 10.556 -2.036 1.00 0.00 C ATOM 258 OE1 GLU A 16 15.774 10.628 -1.768 1.00 0.00 O ATOM 259 OE2 GLU A 16 13.828 11.513 -2.037 1.00 0.00 O ATOM 0 H GLU A 16 12.005 7.901 -1.318 1.00 0.00 H new ATOM 0 HA GLU A 16 14.130 6.440 -2.616 1.00 0.00 H new ATOM 0 HB2 GLU A 16 14.295 8.484 -0.366 1.00 0.00 H new ATOM 0 HB3 GLU A 16 15.585 8.029 -1.462 1.00 0.00 H new ATOM 0 HG2 GLU A 16 14.316 8.900 -3.399 1.00 0.00 H new ATOM 0 HG3 GLU A 16 12.922 9.222 -2.388 1.00 0.00 H new ATOM 266 N GLU A 17 13.534 5.859 0.560 1.00 0.00 N ATOM 267 CA GLU A 17 13.816 4.880 1.648 1.00 0.00 C ATOM 268 C GLU A 17 13.573 3.458 1.116 1.00 0.00 C ATOM 269 O GLU A 17 14.093 2.495 1.641 1.00 0.00 O ATOM 270 CB GLU A 17 12.871 5.154 2.817 1.00 0.00 C ATOM 271 CG GLU A 17 13.365 4.423 4.064 1.00 0.00 C ATOM 272 CD GLU A 17 12.495 4.810 5.261 1.00 0.00 C ATOM 273 OE1 GLU A 17 12.387 5.995 5.531 1.00 0.00 O ATOM 274 OE2 GLU A 17 11.950 3.916 5.886 1.00 0.00 O ATOM 0 H GLU A 17 12.810 6.545 0.774 1.00 0.00 H new ATOM 0 HA GLU A 17 14.850 4.975 1.981 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.817 6.225 3.010 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.863 4.824 2.566 1.00 0.00 H new ATOM 0 HG2 GLU A 17 13.326 3.345 3.906 1.00 0.00 H new ATOM 0 HG3 GLU A 17 14.406 4.679 4.260 1.00 0.00 H new ATOM 281 N LEU A 18 12.785 3.331 0.071 1.00 0.00 N ATOM 282 CA LEU A 18 12.496 1.995 -0.512 1.00 0.00 C ATOM 283 C LEU A 18 13.667 1.544 -1.351 1.00 0.00 C ATOM 284 O LEU A 18 14.081 0.407 -1.279 1.00 0.00 O ATOM 285 CB LEU A 18 11.253 2.049 -1.411 1.00 0.00 C ATOM 286 CG LEU A 18 10.199 3.039 -0.915 1.00 0.00 C ATOM 287 CD1 LEU A 18 8.931 2.826 -1.723 1.00 0.00 C ATOM 288 CD2 LEU A 18 9.878 2.847 0.563 1.00 0.00 C ATOM 0 H LEU A 18 12.328 4.111 -0.402 1.00 0.00 H new ATOM 0 HA LEU A 18 12.320 1.299 0.308 1.00 0.00 H new ATOM 0 HB2 LEU A 18 11.554 2.324 -2.422 1.00 0.00 H new ATOM 0 HB3 LEU A 18 10.810 1.055 -1.470 1.00 0.00 H new ATOM 0 HG LEU A 18 10.592 4.048 -1.040 1.00 0.00 H new ATOM 0 HD11 LEU A 18 8.163 3.523 -1.386 1.00 0.00 H new ATOM 0 HD12 LEU A 18 9.139 2.998 -2.779 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.579 1.804 -1.585 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.125 3.573 0.869 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.497 1.839 0.725 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.783 2.992 1.154 1.00 0.00 H new ATOM 300 N LEU A 19 14.215 2.420 -2.140 1.00 0.00 N ATOM 301 CA LEU A 19 15.372 2.014 -2.965 1.00 0.00 C ATOM 302 C LEU A 19 16.671 2.172 -2.150 1.00 0.00 C ATOM 303 O LEU A 19 17.760 1.980 -2.655 1.00 0.00 O ATOM 304 CB LEU A 19 15.415 2.852 -4.249 1.00 0.00 C ATOM 305 CG LEU A 19 14.097 2.713 -5.060 1.00 0.00 C ATOM 306 CD1 LEU A 19 13.450 1.331 -4.901 1.00 0.00 C ATOM 307 CD2 LEU A 19 13.086 3.736 -4.581 1.00 0.00 C ATOM 0 H LEU A 19 13.914 3.389 -2.247 1.00 0.00 H new ATOM 0 HA LEU A 19 15.272 0.966 -3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 19 15.580 3.899 -3.997 1.00 0.00 H new ATOM 0 HB3 LEU A 19 16.258 2.536 -4.864 1.00 0.00 H new ATOM 0 HG LEU A 19 14.364 2.865 -6.106 1.00 0.00 H new ATOM 0 HD11 LEU A 19 12.533 1.289 -5.488 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.141 0.564 -5.251 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.216 1.157 -3.851 1.00 0.00 H new ATOM 0 HD21 LEU A 19 12.165 3.633 -5.154 1.00 0.00 H new ATOM 0 HD22 LEU A 19 12.876 3.573 -3.524 1.00 0.00 H new ATOM 0 HD23 LEU A 19 13.489 4.739 -4.720 1.00 0.00 H new ATOM 319 N LYS A 20 16.553 2.506 -0.882 1.00 0.00 N ATOM 320 CA LYS A 20 17.739 2.663 -0.006 1.00 0.00 C ATOM 321 C LYS A 20 17.810 1.471 0.959 1.00 0.00 C ATOM 322 O LYS A 20 18.866 1.102 1.435 1.00 0.00 O ATOM 323 CB LYS A 20 17.570 3.953 0.797 1.00 0.00 C ATOM 324 CG LYS A 20 18.230 5.108 0.047 1.00 0.00 C ATOM 325 CD LYS A 20 18.538 6.259 1.019 1.00 0.00 C ATOM 326 CE LYS A 20 20.041 6.550 1.022 1.00 0.00 C ATOM 327 NZ LYS A 20 20.743 5.525 1.845 1.00 0.00 N ATOM 0 H LYS A 20 15.661 2.677 -0.419 1.00 0.00 H new ATOM 0 HA LYS A 20 18.652 2.704 -0.601 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.511 4.163 0.951 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.020 3.842 1.784 1.00 0.00 H new ATOM 0 HG2 LYS A 20 19.150 4.766 -0.427 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.572 5.459 -0.748 1.00 0.00 H new ATOM 0 HD2 LYS A 20 17.986 7.152 0.725 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.208 5.996 2.024 1.00 0.00 H new ATOM 0 HE2 LYS A 20 20.426 6.540 0.002 1.00 0.00 H new ATOM 0 HE3 LYS A 20 20.229 7.546 1.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 21.764 5.722 1.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 20.382 5.556 2.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.573 4.581 1.443 1.00 0.00 H new ATOM 341 N VAL A 21 16.680 0.874 1.245 1.00 0.00 N ATOM 342 CA VAL A 21 16.632 -0.286 2.168 1.00 0.00 C ATOM 343 C VAL A 21 16.605 -1.574 1.347 1.00 0.00 C ATOM 344 O VAL A 21 17.128 -2.593 1.757 1.00 0.00 O ATOM 345 CB VAL A 21 15.376 -0.176 3.032 1.00 0.00 C ATOM 346 CG1 VAL A 21 15.434 1.126 3.826 1.00 0.00 C ATOM 347 CG2 VAL A 21 14.118 -0.181 2.156 1.00 0.00 C ATOM 0 H VAL A 21 15.775 1.152 0.867 1.00 0.00 H new ATOM 0 HA VAL A 21 17.510 -0.298 2.814 1.00 0.00 H new ATOM 0 HB VAL A 21 15.333 -1.030 3.708 1.00 0.00 H new ATOM 0 HG11 VAL A 21 14.542 1.214 4.446 1.00 0.00 H new ATOM 0 HG12 VAL A 21 16.319 1.125 4.462 1.00 0.00 H new ATOM 0 HG13 VAL A 21 15.482 1.970 3.138 1.00 0.00 H new ATOM 0 HG21 VAL A 21 13.234 -0.102 2.789 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.150 0.665 1.469 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.075 -1.109 1.587 1.00 0.00 H new ATOM 357 N LEU A 22 16.030 -1.521 0.166 1.00 0.00 N ATOM 358 CA LEU A 22 16.005 -2.727 -0.711 1.00 0.00 C ATOM 359 C LEU A 22 17.457 -3.126 -1.036 1.00 0.00 C ATOM 360 O LEU A 22 17.725 -4.237 -1.454 1.00 0.00 O ATOM 361 CB LEU A 22 15.157 -2.426 -1.987 1.00 0.00 C ATOM 362 CG LEU A 22 15.958 -1.852 -3.192 1.00 0.00 C ATOM 363 CD1 LEU A 22 16.954 -0.764 -2.765 1.00 0.00 C ATOM 364 CD2 LEU A 22 16.703 -2.986 -3.909 1.00 0.00 C ATOM 0 H LEU A 22 15.579 -0.693 -0.224 1.00 0.00 H new ATOM 0 HA LEU A 22 15.532 -3.572 -0.210 1.00 0.00 H new ATOM 0 HB2 LEU A 22 14.665 -3.346 -2.303 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.371 -1.719 -1.723 1.00 0.00 H new ATOM 0 HG LEU A 22 15.240 -1.390 -3.870 1.00 0.00 H new ATOM 0 HD11 LEU A 22 17.488 -0.396 -3.641 1.00 0.00 H new ATOM 0 HD12 LEU A 22 16.415 0.059 -2.296 1.00 0.00 H new ATOM 0 HD13 LEU A 22 17.667 -1.182 -2.055 1.00 0.00 H new ATOM 0 HD21 LEU A 22 17.262 -2.579 -4.751 1.00 0.00 H new ATOM 0 HD22 LEU A 22 17.392 -3.465 -3.214 1.00 0.00 H new ATOM 0 HD23 LEU A 22 15.985 -3.721 -4.272 1.00 0.00 H new ATOM 376 N GLY A 23 18.395 -2.220 -0.836 1.00 0.00 N ATOM 377 CA GLY A 23 19.808 -2.528 -1.116 1.00 0.00 C ATOM 378 C GLY A 23 20.336 -1.571 -2.165 1.00 0.00 C ATOM 379 O GLY A 23 20.521 -1.937 -3.310 1.00 0.00 O ATOM 0 H GLY A 23 18.222 -1.277 -0.487 1.00 0.00 H new ATOM 0 HA2 GLY A 23 20.397 -2.444 -0.203 1.00 0.00 H new ATOM 0 HA3 GLY A 23 19.905 -3.556 -1.465 1.00 0.00 H new ATOM 383 N VAL A 24 20.570 -0.341 -1.784 1.00 0.00 N ATOM 384 CA VAL A 24 21.089 0.677 -2.756 1.00 0.00 C ATOM 385 C VAL A 24 22.269 0.092 -3.569 1.00 0.00 C ATOM 386 O VAL A 24 23.040 -0.714 -3.087 1.00 0.00 O ATOM 387 CB VAL A 24 21.483 1.962 -1.971 1.00 0.00 C ATOM 388 CG1 VAL A 24 23.002 2.232 -1.978 1.00 0.00 C ATOM 389 CG2 VAL A 24 20.774 3.169 -2.593 1.00 0.00 C ATOM 0 H VAL A 24 20.424 0.007 -0.836 1.00 0.00 H new ATOM 0 HA VAL A 24 20.317 0.943 -3.478 1.00 0.00 H new ATOM 0 HB VAL A 24 21.179 1.807 -0.936 1.00 0.00 H new ATOM 0 HG11 VAL A 24 23.213 3.141 -1.415 1.00 0.00 H new ATOM 0 HG12 VAL A 24 23.523 1.392 -1.519 1.00 0.00 H new ATOM 0 HG13 VAL A 24 23.345 2.354 -3.005 1.00 0.00 H new ATOM 0 HG21 VAL A 24 21.046 4.072 -2.047 1.00 0.00 H new ATOM 0 HG22 VAL A 24 21.075 3.271 -3.636 1.00 0.00 H new ATOM 0 HG23 VAL A 24 19.695 3.024 -2.540 1.00 0.00 H new ATOM 399 N ASN A 25 22.381 0.502 -4.796 1.00 0.00 N ATOM 400 CA ASN A 25 23.468 0.005 -5.692 1.00 0.00 C ATOM 401 C ASN A 25 23.196 0.604 -7.060 1.00 0.00 C ATOM 402 O ASN A 25 22.724 -0.062 -7.958 1.00 0.00 O ATOM 403 CB ASN A 25 23.438 -1.529 -5.774 1.00 0.00 C ATOM 404 CG ASN A 25 22.022 -2.009 -6.119 1.00 0.00 C ATOM 405 OD1 ASN A 25 21.112 -1.216 -6.269 1.00 0.00 O ATOM 406 ND2 ASN A 25 21.798 -3.287 -6.252 1.00 0.00 N ATOM 0 H ASN A 25 21.752 1.177 -5.231 1.00 0.00 H new ATOM 0 HA ASN A 25 24.450 0.292 -5.316 1.00 0.00 H new ATOM 0 HB2 ASN A 25 24.142 -1.875 -6.531 1.00 0.00 H new ATOM 0 HB3 ASN A 25 23.755 -1.958 -4.824 1.00 0.00 H new ATOM 0 HD21 ASN A 25 20.861 -3.619 -6.481 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.559 -3.954 -6.127 1.00 0.00 H new ATOM 413 N VAL A 26 23.434 1.892 -7.170 1.00 0.00 N ATOM 414 CA VAL A 26 23.156 2.677 -8.417 1.00 0.00 C ATOM 415 C VAL A 26 21.739 3.248 -8.331 1.00 0.00 C ATOM 416 O VAL A 26 21.411 4.198 -9.018 1.00 0.00 O ATOM 417 CB VAL A 26 23.307 1.857 -9.708 1.00 0.00 C ATOM 418 CG1 VAL A 26 23.179 2.792 -10.907 1.00 0.00 C ATOM 419 CG2 VAL A 26 24.679 1.179 -9.729 1.00 0.00 C ATOM 0 H VAL A 26 23.826 2.452 -6.413 1.00 0.00 H new ATOM 0 HA VAL A 26 23.901 3.470 -8.472 1.00 0.00 H new ATOM 0 HB VAL A 26 22.531 1.093 -9.752 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.285 2.219 -11.828 1.00 0.00 H new ATOM 0 HG12 VAL A 26 22.202 3.274 -10.890 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.959 3.552 -10.861 1.00 0.00 H new ATOM 0 HG21 VAL A 26 24.784 0.598 -10.645 1.00 0.00 H new ATOM 0 HG22 VAL A 26 25.460 1.938 -9.689 1.00 0.00 H new ATOM 0 HG23 VAL A 26 24.771 0.518 -8.868 1.00 0.00 H new ATOM 429 N MET A 27 20.904 2.721 -7.453 1.00 0.00 N ATOM 430 CA MET A 27 19.541 3.281 -7.285 1.00 0.00 C ATOM 431 C MET A 27 19.736 4.704 -6.785 1.00 0.00 C ATOM 432 O MET A 27 19.323 5.662 -7.410 1.00 0.00 O ATOM 433 CB MET A 27 18.774 2.475 -6.226 1.00 0.00 C ATOM 434 CG MET A 27 18.871 0.964 -6.511 1.00 0.00 C ATOM 435 SD MET A 27 17.318 0.369 -7.232 1.00 0.00 S ATOM 436 CE MET A 27 18.046 -0.776 -8.430 1.00 0.00 C ATOM 0 H MET A 27 21.121 1.926 -6.851 1.00 0.00 H new ATOM 0 HA MET A 27 18.977 3.247 -8.217 1.00 0.00 H new ATOM 0 HB2 MET A 27 19.178 2.690 -5.237 1.00 0.00 H new ATOM 0 HB3 MET A 27 17.728 2.781 -6.217 1.00 0.00 H new ATOM 0 HG2 MET A 27 19.698 0.766 -7.193 1.00 0.00 H new ATOM 0 HG3 MET A 27 19.084 0.424 -5.588 1.00 0.00 H new ATOM 0 HE1 MET A 27 17.252 -1.263 -8.996 1.00 0.00 H new ATOM 0 HE2 MET A 27 18.693 -0.225 -9.113 1.00 0.00 H new ATOM 0 HE3 MET A 27 18.632 -1.530 -7.904 1.00 0.00 H new ATOM 446 N LEU A 28 20.418 4.841 -5.670 1.00 0.00 N ATOM 447 CA LEU A 28 20.701 6.194 -5.120 1.00 0.00 C ATOM 448 C LEU A 28 19.385 6.948 -4.941 1.00 0.00 C ATOM 449 O LEU A 28 19.157 7.986 -5.533 1.00 0.00 O ATOM 450 CB LEU A 28 21.634 6.915 -6.100 1.00 0.00 C ATOM 451 CG LEU A 28 22.981 7.236 -5.432 1.00 0.00 C ATOM 452 CD1 LEU A 28 22.760 8.119 -4.201 1.00 0.00 C ATOM 453 CD2 LEU A 28 23.668 5.934 -5.008 1.00 0.00 C ATOM 0 H LEU A 28 20.789 4.066 -5.120 1.00 0.00 H new ATOM 0 HA LEU A 28 21.186 6.134 -4.145 1.00 0.00 H new ATOM 0 HB2 LEU A 28 21.798 6.292 -6.979 1.00 0.00 H new ATOM 0 HB3 LEU A 28 21.165 7.836 -6.445 1.00 0.00 H new ATOM 0 HG LEU A 28 23.612 7.767 -6.145 1.00 0.00 H new ATOM 0 HD11 LEU A 28 23.720 8.341 -3.735 1.00 0.00 H new ATOM 0 HD12 LEU A 28 22.279 9.050 -4.502 1.00 0.00 H new ATOM 0 HD13 LEU A 28 22.123 7.596 -3.488 1.00 0.00 H new ATOM 0 HD21 LEU A 28 24.623 6.164 -4.535 1.00 0.00 H new ATOM 0 HD22 LEU A 28 23.032 5.400 -4.302 1.00 0.00 H new ATOM 0 HD23 LEU A 28 23.839 5.310 -5.885 1.00 0.00 H new ATOM 465 N ARG A 29 18.493 6.393 -4.151 1.00 0.00 N ATOM 466 CA ARG A 29 17.157 7.030 -3.955 1.00 0.00 C ATOM 467 C ARG A 29 16.476 7.159 -5.326 1.00 0.00 C ATOM 468 O ARG A 29 15.611 7.990 -5.520 1.00 0.00 O ATOM 469 CB ARG A 29 17.338 8.422 -3.338 1.00 0.00 C ATOM 470 CG ARG A 29 18.166 8.315 -2.052 1.00 0.00 C ATOM 471 CD ARG A 29 19.088 9.530 -1.932 1.00 0.00 C ATOM 472 NE ARG A 29 19.223 9.910 -0.498 1.00 0.00 N ATOM 473 CZ ARG A 29 18.491 10.873 -0.006 1.00 0.00 C ATOM 474 NH1 ARG A 29 18.492 12.048 -0.573 1.00 0.00 N ATOM 475 NH2 ARG A 29 17.759 10.660 1.053 1.00 0.00 N ATOM 0 H ARG A 29 18.637 5.525 -3.635 1.00 0.00 H new ATOM 0 HA ARG A 29 16.545 6.423 -3.288 1.00 0.00 H new ATOM 0 HB2 ARG A 29 17.835 9.083 -4.048 1.00 0.00 H new ATOM 0 HB3 ARG A 29 16.365 8.863 -3.120 1.00 0.00 H new ATOM 0 HG2 ARG A 29 17.506 8.260 -1.186 1.00 0.00 H new ATOM 0 HG3 ARG A 29 18.755 7.398 -2.062 1.00 0.00 H new ATOM 0 HD2 ARG A 29 20.067 9.300 -2.352 1.00 0.00 H new ATOM 0 HD3 ARG A 29 18.684 10.365 -2.504 1.00 0.00 H new ATOM 0 HE ARG A 29 19.887 9.418 0.100 1.00 0.00 H new ATOM 0 HH11 ARG A 29 19.065 12.214 -1.401 1.00 0.00 H new ATOM 0 HH12 ARG A 29 17.920 12.800 -0.189 1.00 0.00 H new ATOM 0 HH21 ARG A 29 17.759 9.741 1.496 1.00 0.00 H new ATOM 0 HH22 ARG A 29 17.187 11.412 1.437 1.00 0.00 H new ATOM 489 N LYS A 30 16.891 6.334 -6.281 1.00 0.00 N ATOM 490 CA LYS A 30 16.337 6.363 -7.674 1.00 0.00 C ATOM 491 C LYS A 30 16.103 7.803 -8.134 1.00 0.00 C ATOM 492 O LYS A 30 15.005 8.299 -8.116 1.00 0.00 O ATOM 493 CB LYS A 30 15.050 5.548 -7.732 1.00 0.00 C ATOM 494 CG LYS A 30 15.369 4.135 -8.225 1.00 0.00 C ATOM 495 CD LYS A 30 14.088 3.466 -8.716 1.00 0.00 C ATOM 496 CE LYS A 30 13.781 3.933 -10.140 1.00 0.00 C ATOM 497 NZ LYS A 30 12.650 3.134 -10.692 1.00 0.00 N ATOM 0 H LYS A 30 17.611 5.626 -6.137 1.00 0.00 H new ATOM 0 HA LYS A 30 17.061 5.916 -8.355 1.00 0.00 H new ATOM 0 HB2 LYS A 30 14.588 5.506 -6.746 1.00 0.00 H new ATOM 0 HB3 LYS A 30 14.333 6.026 -8.400 1.00 0.00 H new ATOM 0 HG2 LYS A 30 16.102 4.176 -9.031 1.00 0.00 H new ATOM 0 HG3 LYS A 30 15.813 3.549 -7.420 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.200 2.382 -8.694 1.00 0.00 H new ATOM 0 HD3 LYS A 30 13.259 3.715 -8.054 1.00 0.00 H new ATOM 0 HE2 LYS A 30 13.526 4.993 -10.140 1.00 0.00 H new ATOM 0 HE3 LYS A 30 14.663 3.818 -10.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 12.441 3.451 -11.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 12.911 2.127 -10.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 11.808 3.265 -10.095 1.00 0.00 H new ATOM 511 N ILE A 31 17.156 8.474 -8.520 1.00 0.00 N ATOM 512 CA ILE A 31 17.055 9.910 -8.968 1.00 0.00 C ATOM 513 C ILE A 31 15.843 10.168 -9.898 1.00 0.00 C ATOM 514 O ILE A 31 15.412 11.297 -10.038 1.00 0.00 O ATOM 515 CB ILE A 31 18.342 10.299 -9.700 1.00 0.00 C ATOM 516 CG1 ILE A 31 19.567 9.946 -8.833 1.00 0.00 C ATOM 517 CG2 ILE A 31 18.333 11.806 -9.982 1.00 0.00 C ATOM 518 CD1 ILE A 31 20.306 8.752 -9.442 1.00 0.00 C ATOM 0 H ILE A 31 18.100 8.088 -8.547 1.00 0.00 H new ATOM 0 HA ILE A 31 16.912 10.518 -8.075 1.00 0.00 H new ATOM 0 HB ILE A 31 18.399 9.750 -10.640 1.00 0.00 H new ATOM 0 HG12 ILE A 31 20.236 10.804 -8.766 1.00 0.00 H new ATOM 0 HG13 ILE A 31 19.249 9.709 -7.817 1.00 0.00 H new ATOM 0 HG21 ILE A 31 19.249 12.084 -10.503 1.00 0.00 H new ATOM 0 HG22 ILE A 31 17.472 12.055 -10.603 1.00 0.00 H new ATOM 0 HG23 ILE A 31 18.271 12.352 -9.041 1.00 0.00 H new ATOM 0 HD11 ILE A 31 21.171 8.507 -8.826 1.00 0.00 H new ATOM 0 HD12 ILE A 31 19.636 7.893 -9.486 1.00 0.00 H new ATOM 0 HD13 ILE A 31 20.638 9.005 -10.449 1.00 0.00 H new ATOM 530 N ALA A 32 15.300 9.156 -10.543 1.00 0.00 N ATOM 531 CA ALA A 32 14.136 9.385 -11.464 1.00 0.00 C ATOM 532 C ALA A 32 12.793 9.421 -10.701 1.00 0.00 C ATOM 533 O ALA A 32 11.743 9.287 -11.301 1.00 0.00 O ATOM 534 CB ALA A 32 14.090 8.258 -12.498 1.00 0.00 C ATOM 0 H ALA A 32 15.611 8.187 -10.471 1.00 0.00 H new ATOM 0 HA ALA A 32 14.275 10.353 -11.946 1.00 0.00 H new ATOM 0 HB1 ALA A 32 13.248 8.416 -13.171 1.00 0.00 H new ATOM 0 HB2 ALA A 32 15.017 8.252 -13.072 1.00 0.00 H new ATOM 0 HB3 ALA A 32 13.973 7.301 -11.989 1.00 0.00 H new ATOM 540 N VAL A 33 12.806 9.609 -9.400 1.00 0.00 N ATOM 541 CA VAL A 33 11.516 9.663 -8.626 1.00 0.00 C ATOM 542 C VAL A 33 11.725 10.502 -7.359 1.00 0.00 C ATOM 543 O VAL A 33 11.037 10.323 -6.371 1.00 0.00 O ATOM 544 CB VAL A 33 11.019 8.244 -8.225 1.00 0.00 C ATOM 545 CG1 VAL A 33 9.612 8.009 -8.774 1.00 0.00 C ATOM 546 CG2 VAL A 33 11.948 7.145 -8.763 1.00 0.00 C ATOM 0 H VAL A 33 13.650 9.727 -8.840 1.00 0.00 H new ATOM 0 HA VAL A 33 10.758 10.114 -9.267 1.00 0.00 H new ATOM 0 HB VAL A 33 11.015 8.196 -7.136 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.272 7.014 -8.489 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.932 8.756 -8.364 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.627 8.090 -9.861 1.00 0.00 H new ATOM 0 HG21 VAL A 33 11.568 6.168 -8.463 1.00 0.00 H new ATOM 0 HG22 VAL A 33 11.986 7.201 -9.851 1.00 0.00 H new ATOM 0 HG23 VAL A 33 12.950 7.285 -8.358 1.00 0.00 H new ATOM 556 N ALA A 34 12.662 11.418 -7.382 1.00 0.00 N ATOM 557 CA ALA A 34 12.912 12.270 -6.183 1.00 0.00 C ATOM 558 C ALA A 34 12.543 13.720 -6.501 1.00 0.00 C ATOM 559 O ALA A 34 13.363 14.490 -6.965 1.00 0.00 O ATOM 560 CB ALA A 34 14.392 12.194 -5.801 1.00 0.00 C ATOM 0 H ALA A 34 13.264 11.611 -8.182 1.00 0.00 H new ATOM 0 HA ALA A 34 12.303 11.913 -5.352 1.00 0.00 H new ATOM 0 HB1 ALA A 34 14.574 12.817 -4.925 1.00 0.00 H new ATOM 0 HB2 ALA A 34 14.656 11.161 -5.574 1.00 0.00 H new ATOM 0 HB3 ALA A 34 15.001 12.550 -6.632 1.00 0.00 H new ATOM 566 N ALA A 35 11.314 14.096 -6.253 1.00 0.00 N ATOM 567 CA ALA A 35 10.881 15.495 -6.538 1.00 0.00 C ATOM 568 C ALA A 35 9.495 15.733 -5.935 1.00 0.00 C ATOM 569 O ALA A 35 8.948 14.879 -5.263 1.00 0.00 O ATOM 570 CB ALA A 35 10.822 15.712 -8.051 1.00 0.00 C ATOM 0 H ALA A 35 10.590 13.491 -5.864 1.00 0.00 H new ATOM 0 HA ALA A 35 11.594 16.193 -6.098 1.00 0.00 H new ATOM 0 HB1 ALA A 35 10.506 16.734 -8.260 1.00 0.00 H new ATOM 0 HB2 ALA A 35 11.809 15.542 -8.482 1.00 0.00 H new ATOM 0 HB3 ALA A 35 10.109 15.014 -8.491 1.00 0.00 H new ATOM 576 N ALA A 36 8.927 16.888 -6.172 1.00 0.00 N ATOM 577 CA ALA A 36 7.575 17.192 -5.617 1.00 0.00 C ATOM 578 C ALA A 36 6.517 16.406 -6.393 1.00 0.00 C ATOM 579 O ALA A 36 5.959 16.890 -7.361 1.00 0.00 O ATOM 580 CB ALA A 36 7.296 18.691 -5.748 1.00 0.00 C ATOM 0 H ALA A 36 9.343 17.635 -6.728 1.00 0.00 H new ATOM 0 HA ALA A 36 7.540 16.907 -4.566 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.309 18.914 -5.343 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.050 19.251 -5.195 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.330 18.977 -6.799 1.00 0.00 H new ATOM 586 N SER A 37 6.239 15.197 -5.975 1.00 0.00 N ATOM 587 CA SER A 37 5.217 14.370 -6.683 1.00 0.00 C ATOM 588 C SER A 37 3.879 14.472 -5.947 1.00 0.00 C ATOM 589 O SER A 37 3.798 15.020 -4.864 1.00 0.00 O ATOM 590 CB SER A 37 5.673 12.910 -6.709 1.00 0.00 C ATOM 591 OG SER A 37 7.037 12.852 -7.106 1.00 0.00 O ATOM 0 H SER A 37 6.677 14.747 -5.172 1.00 0.00 H new ATOM 0 HA SER A 37 5.099 14.733 -7.704 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.549 12.461 -5.724 1.00 0.00 H new ATOM 0 HB3 SER A 37 5.056 12.336 -7.401 1.00 0.00 H new ATOM 0 HG SER A 37 7.334 11.918 -7.122 1.00 0.00 H new ATOM 597 N LYS A 38 2.831 13.946 -6.530 1.00 0.00 N ATOM 598 CA LYS A 38 1.493 14.007 -5.872 1.00 0.00 C ATOM 599 C LYS A 38 0.634 12.819 -6.342 1.00 0.00 C ATOM 600 O LYS A 38 -0.128 12.955 -7.278 1.00 0.00 O ATOM 601 CB LYS A 38 0.800 15.319 -6.247 1.00 0.00 C ATOM 602 CG LYS A 38 1.281 16.433 -5.316 1.00 0.00 C ATOM 603 CD LYS A 38 0.484 17.710 -5.590 1.00 0.00 C ATOM 604 CE LYS A 38 0.963 18.822 -4.655 1.00 0.00 C ATOM 605 NZ LYS A 38 0.732 20.146 -5.299 1.00 0.00 N ATOM 0 H LYS A 38 2.846 13.476 -7.435 1.00 0.00 H new ATOM 0 HA LYS A 38 1.618 13.958 -4.790 1.00 0.00 H new ATOM 0 HB2 LYS A 38 1.020 15.576 -7.283 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.281 15.207 -6.169 1.00 0.00 H new ATOM 0 HG2 LYS A 38 1.157 16.131 -4.276 1.00 0.00 H new ATOM 0 HG3 LYS A 38 2.344 16.616 -5.470 1.00 0.00 H new ATOM 0 HD2 LYS A 38 0.611 18.014 -6.629 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.580 17.527 -5.439 1.00 0.00 H new ATOM 0 HE2 LYS A 38 0.429 18.769 -3.706 1.00 0.00 H new ATOM 0 HE3 LYS A 38 2.022 18.694 -4.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.057 20.902 -4.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.260 20.194 -6.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -0.283 20.267 -5.490 1.00 0.00 H new ATOM 619 N PRO A 39 0.773 11.679 -5.684 1.00 0.00 N ATOM 620 CA PRO A 39 0.002 10.475 -6.045 1.00 0.00 C ATOM 621 C PRO A 39 -1.429 10.582 -5.511 1.00 0.00 C ATOM 622 O PRO A 39 -1.830 11.608 -4.994 1.00 0.00 O ATOM 623 CB PRO A 39 0.761 9.337 -5.355 1.00 0.00 C ATOM 624 CG PRO A 39 1.561 9.981 -4.200 1.00 0.00 C ATOM 625 CD PRO A 39 1.694 11.477 -4.536 1.00 0.00 C ATOM 0 HA PRO A 39 -0.084 10.327 -7.121 1.00 0.00 H new ATOM 0 HB2 PRO A 39 0.070 8.584 -4.976 1.00 0.00 H new ATOM 0 HB3 PRO A 39 1.428 8.834 -6.056 1.00 0.00 H new ATOM 0 HG2 PRO A 39 1.047 9.842 -3.249 1.00 0.00 H new ATOM 0 HG3 PRO A 39 2.543 9.517 -4.103 1.00 0.00 H new ATOM 0 HD2 PRO A 39 1.415 12.102 -3.687 1.00 0.00 H new ATOM 0 HD3 PRO A 39 2.720 11.736 -4.799 1.00 0.00 H new ATOM 633 N ALA A 40 -2.200 9.531 -5.635 1.00 0.00 N ATOM 634 CA ALA A 40 -3.607 9.568 -5.138 1.00 0.00 C ATOM 635 C ALA A 40 -4.165 8.145 -5.060 1.00 0.00 C ATOM 636 O ALA A 40 -3.526 7.195 -5.470 1.00 0.00 O ATOM 637 CB ALA A 40 -4.462 10.396 -6.099 1.00 0.00 C ATOM 0 H ALA A 40 -1.914 8.649 -6.060 1.00 0.00 H new ATOM 0 HA ALA A 40 -3.628 10.019 -4.146 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.490 10.425 -5.739 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -4.068 11.411 -6.154 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.438 9.943 -7.090 1.00 0.00 H new ATOM 643 N VAL A 41 -5.355 7.999 -4.538 1.00 0.00 N ATOM 644 CA VAL A 41 -5.973 6.645 -4.427 1.00 0.00 C ATOM 645 C VAL A 41 -7.495 6.796 -4.338 1.00 0.00 C ATOM 646 O VAL A 41 -8.016 7.895 -4.281 1.00 0.00 O ATOM 647 CB VAL A 41 -5.404 5.924 -3.173 1.00 0.00 C ATOM 648 CG1 VAL A 41 -6.170 6.303 -1.903 1.00 0.00 C ATOM 649 CG2 VAL A 41 -5.479 4.405 -3.365 1.00 0.00 C ATOM 0 H VAL A 41 -5.928 8.764 -4.182 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.736 6.043 -5.305 1.00 0.00 H new ATOM 0 HB VAL A 41 -4.367 6.240 -3.057 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.741 5.778 -1.049 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.097 7.379 -1.742 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.218 6.023 -2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.079 3.906 -2.482 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -6.518 4.107 -3.510 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.894 4.119 -4.240 1.00 0.00 H new ATOM 659 N GLU A 42 -8.197 5.701 -4.294 1.00 0.00 N ATOM 660 CA GLU A 42 -9.675 5.771 -4.169 1.00 0.00 C ATOM 661 C GLU A 42 -10.172 4.491 -3.508 1.00 0.00 C ATOM 662 O GLU A 42 -9.907 3.397 -3.959 1.00 0.00 O ATOM 663 CB GLU A 42 -10.297 5.992 -5.560 1.00 0.00 C ATOM 664 CG GLU A 42 -11.766 5.526 -5.639 1.00 0.00 C ATOM 665 CD GLU A 42 -12.641 6.439 -4.778 1.00 0.00 C ATOM 666 OE1 GLU A 42 -12.714 6.203 -3.583 1.00 0.00 O ATOM 667 OE2 GLU A 42 -13.224 7.359 -5.328 1.00 0.00 O ATOM 0 H GLU A 42 -7.809 4.759 -4.339 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.975 6.611 -3.543 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -10.242 7.051 -5.813 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -9.710 5.455 -6.305 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -12.109 5.546 -6.673 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.850 4.495 -5.295 1.00 0.00 H new ATOM 674 N ILE A 43 -10.901 4.639 -2.444 1.00 0.00 N ATOM 675 CA ILE A 43 -11.432 3.448 -1.732 1.00 0.00 C ATOM 676 C ILE A 43 -12.948 3.380 -1.903 1.00 0.00 C ATOM 677 O ILE A 43 -13.626 4.383 -2.009 1.00 0.00 O ATOM 678 CB ILE A 43 -11.078 3.533 -0.243 1.00 0.00 C ATOM 679 CG1 ILE A 43 -9.551 3.589 -0.081 1.00 0.00 C ATOM 680 CG2 ILE A 43 -11.631 2.311 0.509 1.00 0.00 C ATOM 681 CD1 ILE A 43 -8.906 2.313 -0.636 1.00 0.00 C ATOM 0 H ILE A 43 -11.154 5.538 -2.033 1.00 0.00 H new ATOM 0 HA ILE A 43 -10.984 2.548 -2.153 1.00 0.00 H new ATOM 0 HB ILE A 43 -11.525 4.435 0.175 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -9.156 4.460 -0.603 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -9.295 3.705 0.972 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -11.372 2.386 1.565 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -12.715 2.279 0.403 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -11.199 1.401 0.093 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -7.824 2.369 -0.513 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.288 1.447 -0.095 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -9.147 2.215 -1.695 1.00 0.00 H new ATOM 693 N LYS A 44 -13.467 2.190 -1.923 1.00 0.00 N ATOM 694 CA LYS A 44 -14.929 1.981 -2.083 1.00 0.00 C ATOM 695 C LYS A 44 -15.277 0.710 -1.311 1.00 0.00 C ATOM 696 O LYS A 44 -14.787 -0.351 -1.633 1.00 0.00 O ATOM 697 CB LYS A 44 -15.232 1.803 -3.575 1.00 0.00 C ATOM 698 CG LYS A 44 -14.655 2.991 -4.353 1.00 0.00 C ATOM 699 CD LYS A 44 -15.326 3.100 -5.720 1.00 0.00 C ATOM 700 CE LYS A 44 -15.054 1.844 -6.552 1.00 0.00 C ATOM 701 NZ LYS A 44 -16.290 1.462 -7.292 1.00 0.00 N ATOM 0 H LYS A 44 -12.925 1.330 -1.833 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.511 2.823 -1.708 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.799 0.871 -3.937 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -16.308 1.737 -3.734 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.807 3.912 -3.790 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.579 2.867 -4.476 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -16.400 3.235 -5.595 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.954 3.979 -6.246 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.240 2.028 -7.253 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.738 1.027 -5.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.106 0.609 -7.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.055 1.270 -6.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.572 2.240 -7.921 1.00 0.00 H new ATOM 715 N GLN A 45 -16.061 0.797 -0.263 1.00 0.00 N ATOM 716 CA GLN A 45 -16.332 -0.442 0.524 1.00 0.00 C ATOM 717 C GLN A 45 -17.743 -0.483 1.114 1.00 0.00 C ATOM 718 O GLN A 45 -18.352 0.528 1.403 1.00 0.00 O ATOM 719 CB GLN A 45 -15.313 -0.502 1.662 1.00 0.00 C ATOM 720 CG GLN A 45 -15.440 0.747 2.538 1.00 0.00 C ATOM 721 CD GLN A 45 -16.332 0.440 3.749 1.00 0.00 C ATOM 722 OE1 GLN A 45 -17.048 -0.542 3.762 1.00 0.00 O ATOM 723 NE2 GLN A 45 -16.318 1.245 4.776 1.00 0.00 N ATOM 0 H GLN A 45 -16.513 1.648 0.073 1.00 0.00 H new ATOM 0 HA GLN A 45 -16.249 -1.295 -0.149 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.477 -1.397 2.262 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.304 -0.571 1.256 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -14.454 1.070 2.873 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -15.865 1.567 1.959 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -15.718 2.070 4.769 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -16.907 1.049 5.586 1.00 0.00 H new ATOM 732 N GLU A 46 -18.234 -1.677 1.320 1.00 0.00 N ATOM 733 CA GLU A 46 -19.575 -1.872 1.922 1.00 0.00 C ATOM 734 C GLU A 46 -19.444 -2.922 3.033 1.00 0.00 C ATOM 735 O GLU A 46 -19.610 -4.106 2.802 1.00 0.00 O ATOM 736 CB GLU A 46 -20.540 -2.376 0.851 1.00 0.00 C ATOM 737 CG GLU A 46 -21.975 -2.075 1.279 1.00 0.00 C ATOM 738 CD GLU A 46 -22.916 -2.258 0.086 1.00 0.00 C ATOM 739 OE1 GLU A 46 -22.540 -1.862 -1.005 1.00 0.00 O ATOM 740 OE2 GLU A 46 -23.995 -2.790 0.284 1.00 0.00 O ATOM 0 H GLU A 46 -17.745 -2.542 1.089 1.00 0.00 H new ATOM 0 HA GLU A 46 -19.955 -0.935 2.329 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -20.325 -1.895 -0.103 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -20.410 -3.448 0.704 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -22.269 -2.738 2.092 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -22.046 -1.055 1.658 1.00 0.00 H new ATOM 747 N GLY A 47 -19.125 -2.499 4.232 1.00 0.00 N ATOM 748 CA GLY A 47 -18.962 -3.471 5.357 1.00 0.00 C ATOM 749 C GLY A 47 -17.582 -4.130 5.262 1.00 0.00 C ATOM 750 O GLY A 47 -16.580 -3.462 5.095 1.00 0.00 O ATOM 0 H GLY A 47 -18.970 -1.522 4.480 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -19.068 -2.959 6.313 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -19.744 -4.230 5.313 1.00 0.00 H new ATOM 754 N ASP A 48 -17.525 -5.437 5.362 1.00 0.00 N ATOM 755 CA ASP A 48 -16.215 -6.145 5.273 1.00 0.00 C ATOM 756 C ASP A 48 -15.751 -6.246 3.815 1.00 0.00 C ATOM 757 O ASP A 48 -14.674 -6.743 3.546 1.00 0.00 O ATOM 758 CB ASP A 48 -16.359 -7.542 5.858 1.00 0.00 C ATOM 759 CG ASP A 48 -17.487 -8.290 5.144 1.00 0.00 C ATOM 760 OD1 ASP A 48 -17.250 -8.776 4.050 1.00 0.00 O ATOM 761 OD2 ASP A 48 -18.569 -8.364 5.702 1.00 0.00 O ATOM 0 H ASP A 48 -18.334 -6.043 5.502 1.00 0.00 H new ATOM 0 HA ASP A 48 -15.472 -5.580 5.835 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -15.423 -8.089 5.751 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -16.571 -7.479 6.925 1.00 0.00 H new ATOM 766 N THR A 49 -16.529 -5.764 2.875 1.00 0.00 N ATOM 767 CA THR A 49 -16.099 -5.817 1.453 1.00 0.00 C ATOM 768 C THR A 49 -15.381 -4.509 1.134 1.00 0.00 C ATOM 769 O THR A 49 -15.819 -3.454 1.541 1.00 0.00 O ATOM 770 CB THR A 49 -17.331 -5.960 0.558 1.00 0.00 C ATOM 771 OG1 THR A 49 -18.056 -7.122 0.937 1.00 0.00 O ATOM 772 CG2 THR A 49 -16.902 -6.078 -0.904 1.00 0.00 C ATOM 0 H THR A 49 -17.441 -5.338 3.037 1.00 0.00 H new ATOM 0 HA THR A 49 -15.437 -6.665 1.281 1.00 0.00 H new ATOM 0 HB THR A 49 -17.964 -5.080 0.673 1.00 0.00 H new ATOM 0 HG1 THR A 49 -18.978 -7.054 0.611 1.00 0.00 H new ATOM 0 HG21 THR A 49 -17.785 -6.180 -1.535 1.00 0.00 H new ATOM 0 HG22 THR A 49 -16.349 -5.185 -1.194 1.00 0.00 H new ATOM 0 HG23 THR A 49 -16.265 -6.954 -1.027 1.00 0.00 H new ATOM 780 N PHE A 50 -14.279 -4.559 0.431 1.00 0.00 N ATOM 781 CA PHE A 50 -13.555 -3.290 0.120 1.00 0.00 C ATOM 782 C PHE A 50 -13.029 -3.284 -1.313 1.00 0.00 C ATOM 783 O PHE A 50 -12.865 -4.306 -1.951 1.00 0.00 O ATOM 784 CB PHE A 50 -12.372 -3.111 1.075 1.00 0.00 C ATOM 785 CG PHE A 50 -12.877 -3.095 2.490 1.00 0.00 C ATOM 786 CD1 PHE A 50 -13.107 -4.299 3.145 1.00 0.00 C ATOM 787 CD2 PHE A 50 -13.136 -1.882 3.138 1.00 0.00 C ATOM 788 CE1 PHE A 50 -13.601 -4.303 4.446 1.00 0.00 C ATOM 789 CE2 PHE A 50 -13.626 -1.883 4.451 1.00 0.00 C ATOM 790 CZ PHE A 50 -13.861 -3.100 5.102 1.00 0.00 C ATOM 0 H PHE A 50 -13.854 -5.410 0.063 1.00 0.00 H new ATOM 0 HA PHE A 50 -14.265 -2.472 0.240 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.655 -3.921 0.941 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -11.847 -2.182 0.853 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -12.902 -5.233 2.643 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -12.959 -0.947 2.627 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -13.784 -5.241 4.949 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -13.821 -0.950 4.958 1.00 0.00 H new ATOM 0 HZ PHE A 50 -14.244 -3.107 6.112 1.00 0.00 H new ATOM 800 N TYR A 51 -12.733 -2.113 -1.789 1.00 0.00 N ATOM 801 CA TYR A 51 -12.171 -1.934 -3.148 1.00 0.00 C ATOM 802 C TYR A 51 -11.073 -0.888 -2.983 1.00 0.00 C ATOM 803 O TYR A 51 -11.192 0.011 -2.171 1.00 0.00 O ATOM 804 CB TYR A 51 -13.296 -1.477 -4.118 1.00 0.00 C ATOM 805 CG TYR A 51 -12.796 -0.574 -5.241 1.00 0.00 C ATOM 806 CD1 TYR A 51 -12.468 0.761 -4.978 1.00 0.00 C ATOM 807 CD2 TYR A 51 -12.706 -1.062 -6.546 1.00 0.00 C ATOM 808 CE1 TYR A 51 -12.053 1.601 -6.006 1.00 0.00 C ATOM 809 CE2 TYR A 51 -12.279 -0.213 -7.581 1.00 0.00 C ATOM 810 CZ TYR A 51 -11.955 1.116 -7.309 1.00 0.00 C ATOM 811 OH TYR A 51 -11.548 1.950 -8.330 1.00 0.00 O ATOM 0 H TYR A 51 -12.863 -1.243 -1.273 1.00 0.00 H new ATOM 0 HA TYR A 51 -11.762 -2.849 -3.576 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -13.770 -2.357 -4.553 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -14.063 -0.949 -3.551 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -12.538 1.142 -3.970 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -12.964 -2.089 -6.759 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -11.806 2.631 -5.794 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -12.201 -0.591 -8.590 1.00 0.00 H new ATOM 0 HH TYR A 51 -11.534 1.451 -9.174 1.00 0.00 H new ATOM 821 N ILE A 52 -10.015 -0.999 -3.719 1.00 0.00 N ATOM 822 CA ILE A 52 -8.917 -0.006 -3.577 1.00 0.00 C ATOM 823 C ILE A 52 -8.428 0.376 -4.965 1.00 0.00 C ATOM 824 O ILE A 52 -8.398 -0.442 -5.860 1.00 0.00 O ATOM 825 CB ILE A 52 -7.766 -0.604 -2.746 1.00 0.00 C ATOM 826 CG1 ILE A 52 -8.340 -1.345 -1.519 1.00 0.00 C ATOM 827 CG2 ILE A 52 -6.842 0.525 -2.273 1.00 0.00 C ATOM 828 CD1 ILE A 52 -7.205 -1.841 -0.605 1.00 0.00 C ATOM 0 H ILE A 52 -9.858 -1.730 -4.413 1.00 0.00 H new ATOM 0 HA ILE A 52 -9.282 0.882 -3.060 1.00 0.00 H new ATOM 0 HB ILE A 52 -7.203 -1.307 -3.360 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -8.999 -0.680 -0.961 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.945 -2.190 -1.848 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.026 0.105 -1.684 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.434 1.048 -3.138 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.408 1.226 -1.660 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.630 -2.360 0.254 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.563 -2.524 -1.161 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.618 -0.990 -0.260 1.00 0.00 H new ATOM 840 N LYS A 53 -8.071 1.616 -5.157 1.00 0.00 N ATOM 841 CA LYS A 53 -7.606 2.059 -6.503 1.00 0.00 C ATOM 842 C LYS A 53 -6.394 2.980 -6.360 1.00 0.00 C ATOM 843 O LYS A 53 -6.507 4.188 -6.467 1.00 0.00 O ATOM 844 CB LYS A 53 -8.745 2.803 -7.208 1.00 0.00 C ATOM 845 CG LYS A 53 -8.316 3.228 -8.622 1.00 0.00 C ATOM 846 CD LYS A 53 -9.060 4.511 -9.026 1.00 0.00 C ATOM 847 CE LYS A 53 -8.065 5.666 -9.177 1.00 0.00 C ATOM 848 NZ LYS A 53 -7.395 5.576 -10.506 1.00 0.00 N ATOM 0 H LYS A 53 -8.081 2.342 -4.441 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.317 1.189 -7.093 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -9.625 2.162 -7.266 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -9.028 3.681 -6.628 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -7.239 3.396 -8.651 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -8.533 2.431 -9.333 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -9.592 4.353 -9.964 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -9.808 4.760 -8.273 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -8.583 6.621 -9.083 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -7.322 5.626 -8.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -6.384 5.798 -10.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -7.501 4.613 -10.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -7.832 6.255 -11.162 1.00 0.00 H new ATOM 862 N THR A 54 -5.236 2.418 -6.123 1.00 0.00 N ATOM 863 CA THR A 54 -4.008 3.254 -5.979 1.00 0.00 C ATOM 864 C THR A 54 -3.491 3.621 -7.366 1.00 0.00 C ATOM 865 O THR A 54 -3.536 2.823 -8.282 1.00 0.00 O ATOM 866 CB THR A 54 -2.937 2.466 -5.227 1.00 0.00 C ATOM 867 OG1 THR A 54 -3.559 1.592 -4.295 1.00 0.00 O ATOM 868 CG2 THR A 54 -2.014 3.434 -4.486 1.00 0.00 C ATOM 0 H THR A 54 -5.089 1.414 -6.023 1.00 0.00 H new ATOM 0 HA THR A 54 -4.244 4.160 -5.422 1.00 0.00 H new ATOM 0 HB THR A 54 -2.351 1.882 -5.937 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.872 1.085 -3.813 1.00 0.00 H new ATOM 0 HG21 THR A 54 -1.250 2.870 -3.950 1.00 0.00 H new ATOM 0 HG22 THR A 54 -1.536 4.102 -5.203 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.597 4.021 -3.776 1.00 0.00 H new ATOM 876 N SER A 55 -3.006 4.824 -7.526 1.00 0.00 N ATOM 877 CA SER A 55 -2.489 5.251 -8.854 1.00 0.00 C ATOM 878 C SER A 55 -1.774 6.598 -8.724 1.00 0.00 C ATOM 879 O SER A 55 -1.497 7.062 -7.634 1.00 0.00 O ATOM 880 CB SER A 55 -3.658 5.389 -9.830 1.00 0.00 C ATOM 881 OG SER A 55 -4.502 6.450 -9.404 1.00 0.00 O ATOM 0 H SER A 55 -2.947 5.529 -6.791 1.00 0.00 H new ATOM 0 HA SER A 55 -1.785 4.505 -9.224 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.286 5.586 -10.835 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.221 4.457 -9.875 1.00 0.00 H new ATOM 0 HG SER A 55 -4.791 6.970 -10.182 1.00 0.00 H new ATOM 887 N THR A 56 -1.477 7.227 -9.833 1.00 0.00 N ATOM 888 CA THR A 56 -0.782 8.547 -9.794 1.00 0.00 C ATOM 889 C THR A 56 -1.546 9.548 -10.664 1.00 0.00 C ATOM 890 O THR A 56 -1.765 10.680 -10.275 1.00 0.00 O ATOM 891 CB THR A 56 0.641 8.387 -10.327 1.00 0.00 C ATOM 892 OG1 THR A 56 1.309 7.371 -9.592 1.00 0.00 O ATOM 893 CG2 THR A 56 1.400 9.708 -10.184 1.00 0.00 C ATOM 0 H THR A 56 -1.688 6.880 -10.769 1.00 0.00 H new ATOM 0 HA THR A 56 -0.745 8.912 -8.768 1.00 0.00 H new ATOM 0 HB THR A 56 0.603 8.109 -11.380 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.221 7.266 -9.934 1.00 0.00 H new ATOM 0 HG21 THR A 56 2.414 9.588 -10.566 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.888 10.485 -10.752 1.00 0.00 H new ATOM 0 HG23 THR A 56 1.439 9.993 -9.133 1.00 0.00 H new ATOM 901 N THR A 57 -1.949 9.136 -11.838 1.00 0.00 N ATOM 902 CA THR A 57 -2.698 10.053 -12.746 1.00 0.00 C ATOM 903 C THR A 57 -3.512 9.228 -13.744 1.00 0.00 C ATOM 904 O THR A 57 -4.670 9.504 -13.994 1.00 0.00 O ATOM 905 CB THR A 57 -1.709 10.944 -13.495 1.00 0.00 C ATOM 906 OG1 THR A 57 -0.878 11.616 -12.559 1.00 0.00 O ATOM 907 CG2 THR A 57 -2.470 11.971 -14.335 1.00 0.00 C ATOM 0 H THR A 57 -1.790 8.199 -12.208 1.00 0.00 H new ATOM 0 HA THR A 57 -3.373 10.677 -12.161 1.00 0.00 H new ATOM 0 HB THR A 57 -1.095 10.329 -14.153 1.00 0.00 H new ATOM 0 HG1 THR A 57 -1.318 11.633 -11.684 1.00 0.00 H new ATOM 0 HG21 THR A 57 -1.760 12.604 -14.867 1.00 0.00 H new ATOM 0 HG22 THR A 57 -3.105 11.454 -15.054 1.00 0.00 H new ATOM 0 HG23 THR A 57 -3.088 12.588 -13.683 1.00 0.00 H new ATOM 915 N VAL A 58 -2.910 8.218 -14.309 1.00 0.00 N ATOM 916 CA VAL A 58 -3.630 7.356 -15.293 1.00 0.00 C ATOM 917 C VAL A 58 -4.001 6.031 -14.619 1.00 0.00 C ATOM 918 O VAL A 58 -3.895 5.893 -13.415 1.00 0.00 O ATOM 919 CB VAL A 58 -2.718 7.094 -16.494 1.00 0.00 C ATOM 920 CG1 VAL A 58 -2.494 8.400 -17.258 1.00 0.00 C ATOM 921 CG2 VAL A 58 -1.375 6.559 -15.999 1.00 0.00 C ATOM 0 H VAL A 58 -1.942 7.950 -14.131 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.538 7.854 -15.634 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.184 6.362 -17.154 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.845 8.214 -18.113 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.452 8.786 -17.607 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -2.026 9.131 -16.599 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.722 6.371 -16.851 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.911 7.294 -15.341 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -1.533 5.630 -15.451 1.00 0.00 H new ATOM 931 N ARG A 59 -4.435 5.053 -15.382 1.00 0.00 N ATOM 932 CA ARG A 59 -4.815 3.734 -14.783 1.00 0.00 C ATOM 933 C ARG A 59 -3.636 3.166 -13.983 1.00 0.00 C ATOM 934 O ARG A 59 -2.501 3.558 -14.177 1.00 0.00 O ATOM 935 CB ARG A 59 -5.188 2.757 -15.900 1.00 0.00 C ATOM 936 CG ARG A 59 -6.456 3.249 -16.605 1.00 0.00 C ATOM 937 CD ARG A 59 -7.243 2.055 -17.159 1.00 0.00 C ATOM 938 NE ARG A 59 -8.595 2.022 -16.533 1.00 0.00 N ATOM 939 CZ ARG A 59 -9.617 2.538 -17.159 1.00 0.00 C ATOM 940 NH1 ARG A 59 -9.806 2.282 -18.424 1.00 0.00 N ATOM 941 NH2 ARG A 59 -10.451 3.311 -16.518 1.00 0.00 N ATOM 0 H ARG A 59 -4.542 5.113 -16.395 1.00 0.00 H new ATOM 0 HA ARG A 59 -5.667 3.874 -14.117 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.369 2.676 -16.615 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.351 1.761 -15.488 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -7.076 3.811 -15.907 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -6.192 3.929 -17.415 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -7.333 2.136 -18.242 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.711 1.127 -16.952 1.00 0.00 H new ATOM 0 HE ARG A 59 -8.722 1.596 -15.615 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -9.155 1.678 -18.925 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -10.605 2.686 -18.912 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.303 3.511 -15.529 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -11.250 3.715 -17.006 1.00 0.00 H new ATOM 955 N THR A 60 -3.902 2.255 -13.081 1.00 0.00 N ATOM 956 CA THR A 60 -2.804 1.668 -12.259 1.00 0.00 C ATOM 957 C THR A 60 -3.197 0.240 -11.826 1.00 0.00 C ATOM 958 O THR A 60 -2.920 -0.715 -12.526 1.00 0.00 O ATOM 959 CB THR A 60 -2.562 2.581 -11.043 1.00 0.00 C ATOM 960 OG1 THR A 60 -2.086 3.841 -11.496 1.00 0.00 O ATOM 961 CG2 THR A 60 -1.528 1.963 -10.097 1.00 0.00 C ATOM 0 H THR A 60 -4.834 1.893 -12.879 1.00 0.00 H new ATOM 0 HA THR A 60 -1.881 1.600 -12.834 1.00 0.00 H new ATOM 0 HB THR A 60 -3.501 2.702 -10.503 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.036 3.839 -12.475 1.00 0.00 H new ATOM 0 HG21 THR A 60 -1.373 2.625 -9.245 1.00 0.00 H new ATOM 0 HG22 THR A 60 -1.889 0.997 -9.745 1.00 0.00 H new ATOM 0 HG23 THR A 60 -0.585 1.827 -10.627 1.00 0.00 H new ATOM 969 N THR A 61 -3.839 0.086 -10.689 1.00 0.00 N ATOM 970 CA THR A 61 -4.244 -1.276 -10.225 1.00 0.00 C ATOM 971 C THR A 61 -5.284 -1.137 -9.114 1.00 0.00 C ATOM 972 O THR A 61 -5.254 -0.192 -8.348 1.00 0.00 O ATOM 973 CB THR A 61 -3.025 -2.018 -9.677 1.00 0.00 C ATOM 974 OG1 THR A 61 -1.945 -1.909 -10.593 1.00 0.00 O ATOM 975 CG2 THR A 61 -3.376 -3.492 -9.469 1.00 0.00 C ATOM 0 H THR A 61 -4.099 0.849 -10.064 1.00 0.00 H new ATOM 0 HA THR A 61 -4.663 -1.834 -11.062 1.00 0.00 H new ATOM 0 HB THR A 61 -2.732 -1.577 -8.724 1.00 0.00 H new ATOM 0 HG1 THR A 61 -2.286 -1.971 -11.510 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.507 -4.021 -9.078 1.00 0.00 H new ATOM 0 HG22 THR A 61 -4.200 -3.573 -8.760 1.00 0.00 H new ATOM 0 HG23 THR A 61 -3.672 -3.933 -10.421 1.00 0.00 H new ATOM 983 N GLU A 62 -6.202 -2.068 -9.017 1.00 0.00 N ATOM 984 CA GLU A 62 -7.240 -1.981 -7.948 1.00 0.00 C ATOM 985 C GLU A 62 -7.538 -3.365 -7.379 1.00 0.00 C ATOM 986 O GLU A 62 -7.772 -4.306 -8.115 1.00 0.00 O ATOM 987 CB GLU A 62 -8.539 -1.418 -8.527 1.00 0.00 C ATOM 988 CG GLU A 62 -8.283 -0.075 -9.208 1.00 0.00 C ATOM 989 CD GLU A 62 -8.170 -0.275 -10.721 1.00 0.00 C ATOM 990 OE1 GLU A 62 -8.948 -1.047 -11.256 1.00 0.00 O ATOM 991 OE2 GLU A 62 -7.307 0.347 -11.318 1.00 0.00 O ATOM 0 H GLU A 62 -6.276 -2.880 -9.630 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.859 -1.330 -7.161 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.959 -2.122 -9.245 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.275 -1.295 -7.733 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -9.094 0.618 -8.983 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -7.366 0.371 -8.821 1.00 0.00 H new ATOM 998 N ILE A 63 -7.578 -3.489 -6.073 1.00 0.00 N ATOM 999 CA ILE A 63 -7.917 -4.809 -5.469 1.00 0.00 C ATOM 1000 C ILE A 63 -9.384 -4.787 -5.072 1.00 0.00 C ATOM 1001 O ILE A 63 -9.762 -4.202 -4.075 1.00 0.00 O ATOM 1002 CB ILE A 63 -7.058 -5.130 -4.233 1.00 0.00 C ATOM 1003 CG1 ILE A 63 -6.828 -3.878 -3.377 1.00 0.00 C ATOM 1004 CG2 ILE A 63 -5.721 -5.696 -4.693 1.00 0.00 C ATOM 1005 CD1 ILE A 63 -6.034 -4.248 -2.119 1.00 0.00 C ATOM 0 H ILE A 63 -7.392 -2.738 -5.408 1.00 0.00 H new ATOM 0 HA ILE A 63 -7.716 -5.584 -6.208 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.584 -5.862 -3.620 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -6.286 -3.127 -3.952 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -7.785 -3.436 -3.098 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.105 -5.927 -3.824 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -5.890 -6.605 -5.270 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.210 -4.962 -5.315 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.873 -3.355 -1.515 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -6.592 -4.983 -1.539 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.071 -4.669 -2.407 1.00 0.00 H new ATOM 1017 N ASN A 64 -10.211 -5.433 -5.844 1.00 0.00 N ATOM 1018 CA ASN A 64 -11.657 -5.486 -5.513 1.00 0.00 C ATOM 1019 C ASN A 64 -11.843 -6.782 -4.753 1.00 0.00 C ATOM 1020 O ASN A 64 -12.143 -7.819 -5.315 1.00 0.00 O ATOM 1021 CB ASN A 64 -12.518 -5.478 -6.787 1.00 0.00 C ATOM 1022 CG ASN A 64 -11.929 -4.520 -7.837 1.00 0.00 C ATOM 1023 OD1 ASN A 64 -11.227 -3.484 -7.453 1.00 0.00 O flip ATOM 1024 ND2 ASN A 64 -12.111 -4.720 -9.021 1.00 0.00 N flip ATOM 0 H ASN A 64 -9.944 -5.929 -6.694 1.00 0.00 H new ATOM 0 HA ASN A 64 -11.967 -4.619 -4.929 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -12.576 -6.486 -7.199 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -13.536 -5.175 -6.542 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -12.657 -5.526 -9.324 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -11.717 -4.082 -9.712 1.00 0.00 H new ATOM 1031 N PHE A 65 -11.576 -6.733 -3.485 1.00 0.00 N ATOM 1032 CA PHE A 65 -11.629 -7.966 -2.657 1.00 0.00 C ATOM 1033 C PHE A 65 -12.584 -7.806 -1.464 1.00 0.00 C ATOM 1034 O PHE A 65 -13.362 -6.882 -1.380 1.00 0.00 O ATOM 1035 CB PHE A 65 -10.194 -8.220 -2.137 1.00 0.00 C ATOM 1036 CG PHE A 65 -9.814 -7.140 -1.125 1.00 0.00 C ATOM 1037 CD1 PHE A 65 -9.366 -5.891 -1.563 1.00 0.00 C ATOM 1038 CD2 PHE A 65 -9.973 -7.374 0.247 1.00 0.00 C ATOM 1039 CE1 PHE A 65 -9.075 -4.887 -0.645 1.00 0.00 C ATOM 1040 CE2 PHE A 65 -9.691 -6.359 1.170 1.00 0.00 C ATOM 1041 CZ PHE A 65 -9.241 -5.112 0.721 1.00 0.00 C ATOM 0 H PHE A 65 -11.321 -5.885 -2.979 1.00 0.00 H new ATOM 0 HA PHE A 65 -11.998 -8.798 -3.257 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -10.134 -9.204 -1.673 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -9.490 -8.217 -2.969 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.245 -5.704 -2.620 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -10.314 -8.339 0.594 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.719 -3.928 -0.992 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.821 -6.538 2.227 1.00 0.00 H new ATOM 0 HZ PHE A 65 -9.023 -4.327 1.430 1.00 0.00 H new ATOM 1051 N LYS A 66 -12.459 -8.706 -0.530 1.00 0.00 N ATOM 1052 CA LYS A 66 -13.252 -8.676 0.718 1.00 0.00 C ATOM 1053 C LYS A 66 -12.254 -9.034 1.810 1.00 0.00 C ATOM 1054 O LYS A 66 -11.558 -10.024 1.700 1.00 0.00 O ATOM 1055 CB LYS A 66 -14.364 -9.718 0.654 1.00 0.00 C ATOM 1056 CG LYS A 66 -15.693 -9.042 0.303 1.00 0.00 C ATOM 1057 CD LYS A 66 -16.498 -9.950 -0.631 1.00 0.00 C ATOM 1058 CE LYS A 66 -17.993 -9.793 -0.344 1.00 0.00 C ATOM 1059 NZ LYS A 66 -18.266 -10.110 1.089 1.00 0.00 N ATOM 0 H LYS A 66 -11.811 -9.491 -0.589 1.00 0.00 H new ATOM 0 HA LYS A 66 -13.728 -7.711 0.891 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -14.123 -10.475 -0.093 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -14.449 -10.231 1.612 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -16.262 -8.841 1.211 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -15.509 -8.081 -0.177 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -16.289 -9.695 -1.670 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -16.198 -10.989 -0.491 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -18.311 -8.775 -0.568 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -18.569 -10.456 -0.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -19.200 -10.560 1.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -17.536 -10.759 1.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -18.252 -9.233 1.647 1.00 0.00 H new ATOM 1073 N VAL A 67 -12.118 -8.210 2.818 1.00 0.00 N ATOM 1074 CA VAL A 67 -11.095 -8.459 3.890 1.00 0.00 C ATOM 1075 C VAL A 67 -11.024 -9.938 4.316 1.00 0.00 C ATOM 1076 O VAL A 67 -9.991 -10.391 4.776 1.00 0.00 O ATOM 1077 CB VAL A 67 -11.389 -7.549 5.083 1.00 0.00 C ATOM 1078 CG1 VAL A 67 -10.498 -7.934 6.271 1.00 0.00 C ATOM 1079 CG2 VAL A 67 -11.067 -6.118 4.672 1.00 0.00 C ATOM 0 H VAL A 67 -12.676 -7.366 2.949 1.00 0.00 H new ATOM 0 HA VAL A 67 -10.112 -8.223 3.482 1.00 0.00 H new ATOM 0 HB VAL A 67 -12.434 -7.648 5.376 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.715 -7.280 7.116 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -10.695 -8.968 6.553 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.450 -7.828 5.990 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -11.268 -5.446 5.506 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -10.015 -6.047 4.394 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -11.687 -5.836 3.821 1.00 0.00 H new ATOM 1089 N GLY A 68 -12.072 -10.697 4.148 1.00 0.00 N ATOM 1090 CA GLY A 68 -12.004 -12.137 4.525 1.00 0.00 C ATOM 1091 C GLY A 68 -11.465 -12.949 3.339 1.00 0.00 C ATOM 1092 O GLY A 68 -11.945 -14.032 3.063 1.00 0.00 O ATOM 0 H GLY A 68 -12.966 -10.385 3.769 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -11.357 -12.267 5.393 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -12.993 -12.498 4.807 1.00 0.00 H new ATOM 1096 N GLU A 69 -10.478 -12.435 2.628 1.00 0.00 N ATOM 1097 CA GLU A 69 -9.934 -13.189 1.455 1.00 0.00 C ATOM 1098 C GLU A 69 -8.519 -12.715 1.074 1.00 0.00 C ATOM 1099 O GLU A 69 -8.039 -11.675 1.506 1.00 0.00 O ATOM 1100 CB GLU A 69 -10.859 -12.981 0.253 1.00 0.00 C ATOM 1101 CG GLU A 69 -12.043 -13.944 0.342 1.00 0.00 C ATOM 1102 CD GLU A 69 -12.538 -14.279 -1.066 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -12.577 -13.378 -1.889 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -12.871 -15.429 -1.298 1.00 0.00 O ATOM 0 H GLU A 69 -10.034 -11.535 2.811 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.880 -14.242 1.732 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.216 -11.951 0.230 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -10.310 -13.149 -0.674 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -11.745 -14.855 0.860 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.848 -13.495 0.924 1.00 0.00 H new ATOM 1111 N GLU A 70 -7.860 -13.498 0.254 1.00 0.00 N ATOM 1112 CA GLU A 70 -6.475 -13.167 -0.212 1.00 0.00 C ATOM 1113 C GLU A 70 -6.476 -12.828 -1.698 1.00 0.00 C ATOM 1114 O GLU A 70 -7.432 -13.078 -2.408 1.00 0.00 O ATOM 1115 CB GLU A 70 -5.551 -14.384 -0.047 1.00 0.00 C ATOM 1116 CG GLU A 70 -6.258 -15.659 -0.520 1.00 0.00 C ATOM 1117 CD GLU A 70 -6.866 -16.386 0.681 1.00 0.00 C ATOM 1118 OE1 GLU A 70 -6.105 -16.878 1.499 1.00 0.00 O ATOM 1119 OE2 GLU A 70 -8.082 -16.439 0.763 1.00 0.00 O ATOM 0 H GLU A 70 -8.232 -14.371 -0.120 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.129 -12.322 0.383 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.636 -14.234 -0.620 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.260 -14.488 0.998 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -7.038 -15.409 -1.239 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -5.550 -16.311 -1.032 1.00 0.00 H new ATOM 1126 N PHE A 71 -5.370 -12.320 -2.181 1.00 0.00 N ATOM 1127 CA PHE A 71 -5.238 -12.025 -3.633 1.00 0.00 C ATOM 1128 C PHE A 71 -4.040 -12.818 -4.126 1.00 0.00 C ATOM 1129 O PHE A 71 -3.426 -13.548 -3.376 1.00 0.00 O ATOM 1130 CB PHE A 71 -4.969 -10.531 -3.930 1.00 0.00 C ATOM 1131 CG PHE A 71 -5.579 -9.597 -2.904 1.00 0.00 C ATOM 1132 CD1 PHE A 71 -6.827 -9.864 -2.331 1.00 0.00 C ATOM 1133 CD2 PHE A 71 -4.886 -8.431 -2.552 1.00 0.00 C ATOM 1134 CE1 PHE A 71 -7.370 -8.968 -1.403 1.00 0.00 C ATOM 1135 CE2 PHE A 71 -5.437 -7.536 -1.634 1.00 0.00 C ATOM 1136 CZ PHE A 71 -6.673 -7.804 -1.059 1.00 0.00 C ATOM 0 H PHE A 71 -4.547 -12.096 -1.622 1.00 0.00 H new ATOM 0 HA PHE A 71 -6.174 -12.288 -4.125 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -3.893 -10.363 -3.969 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -5.366 -10.286 -4.915 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -7.369 -10.758 -2.604 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -3.922 -8.224 -2.993 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -8.329 -9.175 -0.951 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.903 -6.635 -1.371 1.00 0.00 H new ATOM 0 HZ PHE A 71 -7.097 -7.113 -0.345 1.00 0.00 H new ATOM 1146 N GLU A 72 -3.687 -12.662 -5.365 1.00 0.00 N ATOM 1147 CA GLU A 72 -2.499 -13.386 -5.894 1.00 0.00 C ATOM 1148 C GLU A 72 -1.701 -12.447 -6.776 1.00 0.00 C ATOM 1149 O GLU A 72 -2.231 -11.518 -7.356 1.00 0.00 O ATOM 1150 CB GLU A 72 -2.913 -14.599 -6.715 1.00 0.00 C ATOM 1151 CG GLU A 72 -3.919 -15.430 -5.928 1.00 0.00 C ATOM 1152 CD GLU A 72 -4.571 -16.461 -6.851 1.00 0.00 C ATOM 1153 OE1 GLU A 72 -3.864 -17.026 -7.669 1.00 0.00 O ATOM 1154 OE2 GLU A 72 -5.767 -16.669 -6.724 1.00 0.00 O ATOM 0 H GLU A 72 -4.168 -12.065 -6.038 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.900 -13.727 -5.050 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -3.351 -14.279 -7.660 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.038 -15.202 -6.957 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -3.420 -15.933 -5.100 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.681 -14.782 -5.495 1.00 0.00 H new ATOM 1161 N GLU A 73 -0.431 -12.691 -6.880 1.00 0.00 N ATOM 1162 CA GLU A 73 0.428 -11.816 -7.731 1.00 0.00 C ATOM 1163 C GLU A 73 1.840 -12.392 -7.832 1.00 0.00 C ATOM 1164 O GLU A 73 2.138 -13.439 -7.294 1.00 0.00 O ATOM 1165 CB GLU A 73 0.490 -10.412 -7.112 1.00 0.00 C ATOM 1166 CG GLU A 73 -0.434 -9.462 -7.881 1.00 0.00 C ATOM 1167 CD GLU A 73 0.163 -8.054 -7.876 1.00 0.00 C ATOM 1168 OE1 GLU A 73 1.160 -7.852 -8.550 1.00 0.00 O ATOM 1169 OE2 GLU A 73 -0.386 -7.202 -7.197 1.00 0.00 O ATOM 0 H GLU A 73 0.055 -13.457 -6.415 1.00 0.00 H new ATOM 0 HA GLU A 73 -0.001 -11.762 -8.732 1.00 0.00 H new ATOM 0 HB2 GLU A 73 0.193 -10.454 -6.064 1.00 0.00 H new ATOM 0 HB3 GLU A 73 1.514 -10.038 -7.138 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -0.561 -9.811 -8.906 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -1.423 -9.451 -7.424 1.00 0.00 H new ATOM 1176 N GLN A 74 2.706 -11.702 -8.525 1.00 0.00 N ATOM 1177 CA GLN A 74 4.113 -12.177 -8.679 1.00 0.00 C ATOM 1178 C GLN A 74 5.052 -11.197 -7.974 1.00 0.00 C ATOM 1179 O GLN A 74 4.785 -10.011 -7.911 1.00 0.00 O ATOM 1180 CB GLN A 74 4.473 -12.244 -10.163 1.00 0.00 C ATOM 1181 CG GLN A 74 3.896 -13.522 -10.773 1.00 0.00 C ATOM 1182 CD GLN A 74 4.308 -13.616 -12.244 1.00 0.00 C ATOM 1183 OE1 GLN A 74 5.325 -13.080 -12.637 1.00 0.00 O ATOM 1184 NE2 GLN A 74 3.554 -14.279 -13.078 1.00 0.00 N ATOM 0 H GLN A 74 2.497 -10.821 -8.995 1.00 0.00 H new ATOM 0 HA GLN A 74 4.214 -13.169 -8.238 1.00 0.00 H new ATOM 0 HB2 GLN A 74 4.079 -11.371 -10.683 1.00 0.00 H new ATOM 0 HB3 GLN A 74 5.556 -12.227 -10.286 1.00 0.00 H new ATOM 0 HG2 GLN A 74 4.257 -14.394 -10.227 1.00 0.00 H new ATOM 0 HG3 GLN A 74 2.809 -13.520 -10.688 1.00 0.00 H new ATOM 0 HE21 GLN A 74 2.700 -14.729 -12.747 1.00 0.00 H new ATOM 0 HE22 GLN A 74 3.818 -14.348 -14.061 1.00 0.00 H new ATOM 1193 N THR A 75 6.144 -11.682 -7.435 1.00 0.00 N ATOM 1194 CA THR A 75 7.094 -10.778 -6.724 1.00 0.00 C ATOM 1195 C THR A 75 7.815 -9.877 -7.744 1.00 0.00 C ATOM 1196 O THR A 75 7.358 -8.788 -8.037 1.00 0.00 O ATOM 1197 CB THR A 75 8.094 -11.625 -5.921 1.00 0.00 C ATOM 1198 OG1 THR A 75 7.385 -12.405 -4.969 1.00 0.00 O ATOM 1199 CG2 THR A 75 9.085 -10.713 -5.193 1.00 0.00 C ATOM 0 H THR A 75 6.416 -12.665 -7.458 1.00 0.00 H new ATOM 0 HA THR A 75 6.552 -10.135 -6.031 1.00 0.00 H new ATOM 0 HB THR A 75 8.642 -12.277 -6.601 1.00 0.00 H new ATOM 0 HG1 THR A 75 6.425 -12.223 -5.046 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.790 -11.321 -4.626 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.628 -10.111 -5.921 1.00 0.00 H new ATOM 0 HG23 THR A 75 8.543 -10.057 -4.512 1.00 0.00 H new ATOM 1207 N VAL A 76 8.932 -10.310 -8.281 1.00 0.00 N ATOM 1208 CA VAL A 76 9.669 -9.475 -9.264 1.00 0.00 C ATOM 1209 C VAL A 76 10.393 -10.385 -10.261 1.00 0.00 C ATOM 1210 O VAL A 76 10.066 -10.421 -11.433 1.00 0.00 O ATOM 1211 CB VAL A 76 10.684 -8.617 -8.517 1.00 0.00 C ATOM 1212 CG1 VAL A 76 11.384 -7.685 -9.498 1.00 0.00 C ATOM 1213 CG2 VAL A 76 9.966 -7.788 -7.451 1.00 0.00 C ATOM 0 H VAL A 76 9.361 -11.212 -8.075 1.00 0.00 H new ATOM 0 HA VAL A 76 8.974 -8.833 -9.806 1.00 0.00 H new ATOM 0 HB VAL A 76 11.422 -9.262 -8.040 1.00 0.00 H new ATOM 0 HG11 VAL A 76 12.109 -7.072 -8.963 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.897 -8.275 -10.257 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.647 -7.040 -9.976 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.692 -7.175 -6.917 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.227 -7.144 -7.928 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.466 -8.454 -6.747 1.00 0.00 H new ATOM 1223 N ASP A 77 11.374 -11.120 -9.801 1.00 0.00 N ATOM 1224 CA ASP A 77 12.127 -12.032 -10.710 1.00 0.00 C ATOM 1225 C ASP A 77 12.684 -13.211 -9.906 1.00 0.00 C ATOM 1226 O ASP A 77 13.703 -13.780 -10.250 1.00 0.00 O ATOM 1227 CB ASP A 77 13.282 -11.266 -11.361 1.00 0.00 C ATOM 1228 CG ASP A 77 14.154 -10.631 -10.276 1.00 0.00 C ATOM 1229 OD1 ASP A 77 13.624 -9.862 -9.491 1.00 0.00 O ATOM 1230 OD2 ASP A 77 15.338 -10.926 -10.248 1.00 0.00 O ATOM 0 H ASP A 77 11.686 -11.126 -8.830 1.00 0.00 H new ATOM 0 HA ASP A 77 11.457 -12.406 -11.485 1.00 0.00 H new ATOM 0 HB2 ASP A 77 13.880 -11.941 -11.973 1.00 0.00 H new ATOM 0 HB3 ASP A 77 12.892 -10.495 -12.025 1.00 0.00 H new ATOM 1235 N GLY A 78 12.020 -13.581 -8.839 1.00 0.00 N ATOM 1236 CA GLY A 78 12.501 -14.723 -8.006 1.00 0.00 C ATOM 1237 C GLY A 78 11.360 -15.721 -7.810 1.00 0.00 C ATOM 1238 O GLY A 78 11.211 -16.661 -8.569 1.00 0.00 O ATOM 0 H GLY A 78 11.162 -13.139 -8.509 1.00 0.00 H new ATOM 0 HA2 GLY A 78 13.347 -15.211 -8.491 1.00 0.00 H new ATOM 0 HA3 GLY A 78 12.853 -14.361 -7.040 1.00 0.00 H new ATOM 1242 N ARG A 79 10.551 -15.521 -6.800 1.00 0.00 N ATOM 1243 CA ARG A 79 9.412 -16.451 -6.551 1.00 0.00 C ATOM 1244 C ARG A 79 8.095 -15.663 -6.635 1.00 0.00 C ATOM 1245 O ARG A 79 8.119 -14.449 -6.641 1.00 0.00 O ATOM 1246 CB ARG A 79 9.554 -17.066 -5.155 1.00 0.00 C ATOM 1247 CG ARG A 79 10.182 -18.457 -5.268 1.00 0.00 C ATOM 1248 CD ARG A 79 11.697 -18.324 -5.436 1.00 0.00 C ATOM 1249 NE ARG A 79 12.375 -19.440 -4.719 1.00 0.00 N ATOM 1250 CZ ARG A 79 13.075 -19.195 -3.645 1.00 0.00 C ATOM 1251 NH1 ARG A 79 12.586 -18.428 -2.710 1.00 0.00 N ATOM 1252 NH2 ARG A 79 14.263 -19.718 -3.507 1.00 0.00 N ATOM 0 H ARG A 79 10.632 -14.751 -6.136 1.00 0.00 H new ATOM 0 HA ARG A 79 9.412 -17.246 -7.297 1.00 0.00 H new ATOM 0 HB2 ARG A 79 10.173 -16.426 -4.526 1.00 0.00 H new ATOM 0 HB3 ARG A 79 8.577 -17.135 -4.676 1.00 0.00 H new ATOM 0 HG2 ARG A 79 9.955 -19.043 -4.378 1.00 0.00 H new ATOM 0 HG3 ARG A 79 9.757 -18.991 -6.118 1.00 0.00 H new ATOM 0 HD2 ARG A 79 11.960 -18.344 -6.494 1.00 0.00 H new ATOM 0 HD3 ARG A 79 12.035 -17.366 -5.042 1.00 0.00 H new ATOM 0 HE ARG A 79 12.292 -20.395 -5.067 1.00 0.00 H new ATOM 0 HH11 ARG A 79 11.657 -18.020 -2.819 1.00 0.00 H new ATOM 0 HH12 ARG A 79 13.132 -18.236 -1.870 1.00 0.00 H new ATOM 0 HH21 ARG A 79 14.644 -20.318 -4.238 1.00 0.00 H new ATOM 0 HH22 ARG A 79 14.810 -19.527 -2.668 1.00 0.00 H new ATOM 1266 N PRO A 80 6.975 -16.359 -6.692 1.00 0.00 N ATOM 1267 CA PRO A 80 5.661 -15.699 -6.765 1.00 0.00 C ATOM 1268 C PRO A 80 5.283 -15.144 -5.391 1.00 0.00 C ATOM 1269 O PRO A 80 6.084 -15.155 -4.474 1.00 0.00 O ATOM 1270 CB PRO A 80 4.711 -16.818 -7.198 1.00 0.00 C ATOM 1271 CG PRO A 80 5.397 -18.148 -6.811 1.00 0.00 C ATOM 1272 CD PRO A 80 6.901 -17.843 -6.682 1.00 0.00 C ATOM 0 HA PRO A 80 5.636 -14.854 -7.453 1.00 0.00 H new ATOM 0 HB2 PRO A 80 3.745 -16.721 -6.702 1.00 0.00 H new ATOM 0 HB3 PRO A 80 4.524 -16.775 -8.271 1.00 0.00 H new ATOM 0 HG2 PRO A 80 4.997 -18.532 -5.872 1.00 0.00 H new ATOM 0 HG3 PRO A 80 5.220 -18.911 -7.569 1.00 0.00 H new ATOM 0 HD2 PRO A 80 7.313 -18.256 -5.761 1.00 0.00 H new ATOM 0 HD3 PRO A 80 7.467 -18.275 -7.507 1.00 0.00 H new ATOM 1280 N CYS A 81 4.078 -14.655 -5.238 1.00 0.00 N ATOM 1281 CA CYS A 81 3.664 -14.097 -3.916 1.00 0.00 C ATOM 1282 C CYS A 81 2.199 -13.675 -3.945 1.00 0.00 C ATOM 1283 O CYS A 81 1.724 -13.062 -4.881 1.00 0.00 O ATOM 1284 CB CYS A 81 4.536 -12.880 -3.577 1.00 0.00 C ATOM 1285 SG CYS A 81 4.428 -11.654 -4.904 1.00 0.00 S ATOM 0 H CYS A 81 3.367 -14.618 -5.968 1.00 0.00 H new ATOM 0 HA CYS A 81 3.792 -14.869 -3.158 1.00 0.00 H new ATOM 0 HB2 CYS A 81 4.209 -12.439 -2.635 1.00 0.00 H new ATOM 0 HB3 CYS A 81 5.572 -13.191 -3.441 1.00 0.00 H new ATOM 0 HG CYS A 81 3.255 -11.720 -5.461 1.00 0.00 H new ATOM 1291 N LYS A 82 1.496 -13.993 -2.900 1.00 0.00 N ATOM 1292 CA LYS A 82 0.063 -13.621 -2.797 1.00 0.00 C ATOM 1293 C LYS A 82 -0.100 -12.617 -1.663 1.00 0.00 C ATOM 1294 O LYS A 82 0.867 -12.143 -1.098 1.00 0.00 O ATOM 1295 CB LYS A 82 -0.764 -14.868 -2.498 1.00 0.00 C ATOM 1296 CG LYS A 82 -0.254 -15.556 -1.218 1.00 0.00 C ATOM 1297 CD LYS A 82 -1.022 -16.870 -0.958 1.00 0.00 C ATOM 1298 CE LYS A 82 -2.522 -16.694 -1.240 1.00 0.00 C ATOM 1299 NZ LYS A 82 -3.309 -17.611 -0.367 1.00 0.00 N ATOM 0 H LYS A 82 1.861 -14.505 -2.097 1.00 0.00 H new ATOM 0 HA LYS A 82 -0.278 -13.181 -3.734 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.813 -14.597 -2.379 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.707 -15.560 -3.338 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.812 -15.765 -1.312 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -0.373 -14.885 -0.367 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -0.620 -17.662 -1.590 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -0.877 -17.182 0.076 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.817 -15.661 -1.058 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.732 -16.905 -2.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.146 -17.949 -0.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -2.719 -18.423 -0.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -3.612 -17.102 0.487 1.00 0.00 H new ATOM 1313 N SER A 83 -1.314 -12.290 -1.336 1.00 0.00 N ATOM 1314 CA SER A 83 -1.555 -11.310 -0.240 1.00 0.00 C ATOM 1315 C SER A 83 -2.793 -11.691 0.555 1.00 0.00 C ATOM 1316 O SER A 83 -3.462 -12.654 0.254 1.00 0.00 O ATOM 1317 CB SER A 83 -1.769 -9.926 -0.847 1.00 0.00 C ATOM 1318 OG SER A 83 -2.791 -10.010 -1.835 1.00 0.00 O ATOM 0 H SER A 83 -2.155 -12.659 -1.780 1.00 0.00 H new ATOM 0 HA SER A 83 -0.691 -11.308 0.425 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.051 -9.214 -0.072 1.00 0.00 H new ATOM 0 HB3 SER A 83 -0.843 -9.562 -1.292 1.00 0.00 H new ATOM 0 HG SER A 83 -3.363 -9.216 -1.782 1.00 0.00 H new ATOM 1324 N LEU A 84 -3.104 -10.924 1.563 1.00 0.00 N ATOM 1325 CA LEU A 84 -4.322 -11.219 2.378 1.00 0.00 C ATOM 1326 C LEU A 84 -4.619 -10.051 3.305 1.00 0.00 C ATOM 1327 O LEU A 84 -3.806 -9.682 4.126 1.00 0.00 O ATOM 1328 CB LEU A 84 -4.117 -12.492 3.193 1.00 0.00 C ATOM 1329 CG LEU A 84 -5.410 -13.306 3.171 1.00 0.00 C ATOM 1330 CD1 LEU A 84 -5.085 -14.778 3.397 1.00 0.00 C ATOM 1331 CD2 LEU A 84 -6.353 -12.811 4.264 1.00 0.00 C ATOM 0 H LEU A 84 -2.570 -10.107 1.859 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.168 -11.366 1.706 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.296 -13.077 2.779 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.845 -12.243 4.219 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.896 -13.186 2.203 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.006 -15.361 3.382 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.420 -15.129 2.608 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.596 -14.898 4.364 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.273 -13.395 4.243 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -5.874 -12.924 5.236 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.587 -11.760 4.094 1.00 0.00 H new ATOM 1343 N VAL A 85 -5.782 -9.467 3.168 1.00 0.00 N ATOM 1344 CA VAL A 85 -6.144 -8.299 4.022 1.00 0.00 C ATOM 1345 C VAL A 85 -6.886 -8.764 5.287 1.00 0.00 C ATOM 1346 O VAL A 85 -7.656 -9.703 5.266 1.00 0.00 O ATOM 1347 CB VAL A 85 -7.012 -7.337 3.189 1.00 0.00 C ATOM 1348 CG1 VAL A 85 -7.659 -6.260 4.074 1.00 0.00 C ATOM 1349 CG2 VAL A 85 -6.131 -6.652 2.143 1.00 0.00 C ATOM 0 H VAL A 85 -6.498 -9.751 2.499 1.00 0.00 H new ATOM 0 HA VAL A 85 -5.242 -7.781 4.349 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.804 -7.915 2.712 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -8.265 -5.597 3.456 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -8.291 -6.736 4.823 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.880 -5.682 4.571 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -6.737 -5.969 1.548 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -5.340 -6.094 2.643 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -5.688 -7.405 1.491 1.00 0.00 H new ATOM 1359 N LYS A 86 -6.650 -8.085 6.383 1.00 0.00 N ATOM 1360 CA LYS A 86 -7.315 -8.431 7.668 1.00 0.00 C ATOM 1361 C LYS A 86 -7.493 -7.151 8.495 1.00 0.00 C ATOM 1362 O LYS A 86 -7.471 -6.057 7.971 1.00 0.00 O ATOM 1363 CB LYS A 86 -6.441 -9.430 8.428 1.00 0.00 C ATOM 1364 CG LYS A 86 -7.314 -10.520 9.055 1.00 0.00 C ATOM 1365 CD LYS A 86 -8.022 -11.325 7.956 1.00 0.00 C ATOM 1366 CE LYS A 86 -9.514 -10.969 7.921 1.00 0.00 C ATOM 1367 NZ LYS A 86 -10.315 -12.210 7.722 1.00 0.00 N ATOM 0 H LYS A 86 -6.012 -7.291 6.437 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.291 -8.879 7.482 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -5.715 -9.879 7.750 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.876 -8.914 9.204 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.700 -11.183 9.664 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -8.052 -10.069 9.719 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -7.567 -11.113 6.989 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.899 -12.392 8.139 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -9.805 -10.481 8.851 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.712 -10.262 7.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -11.298 -11.956 7.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -9.911 -12.762 6.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -10.296 -12.779 8.593 1.00 0.00 H new ATOM 1381 N TRP A 87 -7.684 -7.288 9.779 1.00 0.00 N ATOM 1382 CA TRP A 87 -7.876 -6.095 10.660 1.00 0.00 C ATOM 1383 C TRP A 87 -6.927 -6.149 11.854 1.00 0.00 C ATOM 1384 O TRP A 87 -6.205 -7.106 12.057 1.00 0.00 O ATOM 1385 CB TRP A 87 -9.294 -6.099 11.201 1.00 0.00 C ATOM 1386 CG TRP A 87 -10.234 -6.052 10.071 1.00 0.00 C ATOM 1387 CD1 TRP A 87 -10.832 -7.122 9.528 1.00 0.00 C ATOM 1388 CD2 TRP A 87 -10.681 -4.895 9.322 1.00 0.00 C ATOM 1389 NE1 TRP A 87 -11.653 -6.695 8.513 1.00 0.00 N ATOM 1390 CE2 TRP A 87 -11.586 -5.329 8.339 1.00 0.00 C ATOM 1391 CE3 TRP A 87 -10.396 -3.523 9.406 1.00 0.00 C ATOM 1392 CZ2 TRP A 87 -12.192 -4.436 7.467 1.00 0.00 C ATOM 1393 CZ3 TRP A 87 -11.001 -2.620 8.525 1.00 0.00 C ATOM 1394 CH2 TRP A 87 -11.899 -3.076 7.556 1.00 0.00 C ATOM 0 H TRP A 87 -7.716 -8.185 10.263 1.00 0.00 H new ATOM 0 HA TRP A 87 -7.679 -5.199 10.071 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -9.467 -6.994 11.799 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -9.450 -5.243 11.857 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -10.692 -8.147 9.837 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -12.241 -7.314 7.955 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -9.706 -3.163 10.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -12.888 -4.793 6.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -10.773 -1.567 8.594 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -12.365 -2.376 6.878 1.00 0.00 H new ATOM 1405 N GLU A 88 -6.965 -5.126 12.660 1.00 0.00 N ATOM 1406 CA GLU A 88 -6.116 -5.077 13.882 1.00 0.00 C ATOM 1407 C GLU A 88 -7.024 -4.651 15.040 1.00 0.00 C ATOM 1408 O GLU A 88 -7.162 -5.338 16.034 1.00 0.00 O ATOM 1409 CB GLU A 88 -4.943 -4.082 13.640 1.00 0.00 C ATOM 1410 CG GLU A 88 -4.740 -3.078 14.795 1.00 0.00 C ATOM 1411 CD GLU A 88 -3.302 -2.555 14.771 1.00 0.00 C ATOM 1412 OE1 GLU A 88 -2.402 -3.361 14.596 1.00 0.00 O ATOM 1413 OE2 GLU A 88 -3.125 -1.359 14.929 1.00 0.00 O ATOM 0 H GLU A 88 -7.558 -4.308 12.521 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.669 -6.042 14.122 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.022 -4.647 13.494 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.129 -3.531 12.718 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.441 -2.249 14.698 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -4.947 -3.560 15.750 1.00 0.00 H new ATOM 1420 N SER A 89 -7.636 -3.513 14.895 1.00 0.00 N ATOM 1421 CA SER A 89 -8.543 -2.993 15.950 1.00 0.00 C ATOM 1422 C SER A 89 -9.975 -2.970 15.417 1.00 0.00 C ATOM 1423 O SER A 89 -10.889 -3.496 16.019 1.00 0.00 O ATOM 1424 CB SER A 89 -8.121 -1.567 16.300 1.00 0.00 C ATOM 1425 OG SER A 89 -7.920 -0.832 15.093 1.00 0.00 O ATOM 0 H SER A 89 -7.544 -2.911 14.076 1.00 0.00 H new ATOM 0 HA SER A 89 -8.490 -3.630 16.833 1.00 0.00 H new ATOM 0 HB2 SER A 89 -8.886 -1.087 16.910 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.205 -1.580 16.890 1.00 0.00 H new ATOM 0 HG SER A 89 -7.651 0.085 15.309 1.00 0.00 H new ATOM 1431 N GLU A 90 -10.154 -2.348 14.286 1.00 0.00 N ATOM 1432 CA GLU A 90 -11.500 -2.229 13.641 1.00 0.00 C ATOM 1433 C GLU A 90 -11.379 -1.193 12.525 1.00 0.00 C ATOM 1434 O GLU A 90 -11.965 -1.320 11.469 1.00 0.00 O ATOM 1435 CB GLU A 90 -12.563 -1.758 14.647 1.00 0.00 C ATOM 1436 CG GLU A 90 -12.073 -0.501 15.372 1.00 0.00 C ATOM 1437 CD GLU A 90 -12.555 -0.525 16.824 1.00 0.00 C ATOM 1438 OE1 GLU A 90 -13.751 -0.651 17.029 1.00 0.00 O ATOM 1439 OE2 GLU A 90 -11.720 -0.415 17.706 1.00 0.00 O ATOM 0 H GLU A 90 -9.401 -1.902 13.762 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.808 -3.202 13.260 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -13.499 -1.548 14.129 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -12.768 -2.548 15.369 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -10.985 -0.452 15.340 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.447 0.390 14.869 1.00 0.00 H new ATOM 1446 N ASN A 91 -10.581 -0.186 12.756 1.00 0.00 N ATOM 1447 CA ASN A 91 -10.349 0.867 11.729 1.00 0.00 C ATOM 1448 C ASN A 91 -8.905 0.760 11.226 1.00 0.00 C ATOM 1449 O ASN A 91 -8.464 1.573 10.438 1.00 0.00 O ATOM 1450 CB ASN A 91 -10.565 2.241 12.348 1.00 0.00 C ATOM 1451 CG ASN A 91 -12.004 2.375 12.855 1.00 0.00 C ATOM 1452 OD1 ASN A 91 -12.735 1.408 12.926 1.00 0.00 O ATOM 1453 ND2 ASN A 91 -12.443 3.553 13.207 1.00 0.00 N ATOM 0 H ASN A 91 -10.072 -0.047 13.629 1.00 0.00 H new ATOM 0 HA ASN A 91 -11.044 0.732 10.900 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -9.867 2.390 13.171 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -10.358 3.016 11.610 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.400 3.661 13.542 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -11.829 4.365 13.147 1.00 0.00 H new ATOM 1460 N LYS A 92 -8.162 -0.235 11.674 1.00 0.00 N ATOM 1461 CA LYS A 92 -6.768 -0.395 11.207 1.00 0.00 C ATOM 1462 C LYS A 92 -6.626 -1.788 10.591 1.00 0.00 C ATOM 1463 O LYS A 92 -6.571 -2.776 11.291 1.00 0.00 O ATOM 1464 CB LYS A 92 -5.814 -0.265 12.390 1.00 0.00 C ATOM 1465 CG LYS A 92 -4.407 -0.017 11.866 1.00 0.00 C ATOM 1466 CD LYS A 92 -3.718 -1.353 11.581 1.00 0.00 C ATOM 1467 CE LYS A 92 -2.216 -1.122 11.405 1.00 0.00 C ATOM 1468 NZ LYS A 92 -1.489 -2.406 11.613 1.00 0.00 N ATOM 0 H LYS A 92 -8.476 -0.937 12.344 1.00 0.00 H new ATOM 0 HA LYS A 92 -6.528 0.372 10.471 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.125 0.556 13.036 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.837 -1.172 12.994 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.448 0.583 10.957 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -3.832 0.551 12.597 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -3.897 -2.049 12.401 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -4.135 -1.806 10.682 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -2.011 -0.733 10.408 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.866 -0.374 12.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.689 -2.251 12.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.136 -3.109 12.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -1.133 -2.755 10.700 1.00 0.00 H new ATOM 1482 N MET A 93 -6.584 -1.874 9.289 1.00 0.00 N ATOM 1483 CA MET A 93 -6.458 -3.199 8.628 1.00 0.00 C ATOM 1484 C MET A 93 -5.065 -3.386 8.060 1.00 0.00 C ATOM 1485 O MET A 93 -4.307 -2.453 7.880 1.00 0.00 O ATOM 1486 CB MET A 93 -7.476 -3.375 7.493 1.00 0.00 C ATOM 1487 CG MET A 93 -7.730 -2.057 6.752 1.00 0.00 C ATOM 1488 SD MET A 93 -8.023 -2.390 4.997 1.00 0.00 S ATOM 1489 CE MET A 93 -9.360 -3.581 5.236 1.00 0.00 C ATOM 0 H MET A 93 -6.632 -1.077 8.654 1.00 0.00 H new ATOM 0 HA MET A 93 -6.654 -3.948 9.395 1.00 0.00 H new ATOM 0 HB2 MET A 93 -7.112 -4.124 6.790 1.00 0.00 H new ATOM 0 HB3 MET A 93 -8.415 -3.750 7.901 1.00 0.00 H new ATOM 0 HG2 MET A 93 -8.591 -1.546 7.184 1.00 0.00 H new ATOM 0 HG3 MET A 93 -6.874 -1.393 6.868 1.00 0.00 H new ATOM 0 HE1 MET A 93 -9.770 -3.867 4.267 1.00 0.00 H new ATOM 0 HE2 MET A 93 -8.973 -4.466 5.742 1.00 0.00 H new ATOM 0 HE3 MET A 93 -10.145 -3.130 5.843 1.00 0.00 H new ATOM 1499 N VAL A 94 -4.739 -4.610 7.788 1.00 0.00 N ATOM 1500 CA VAL A 94 -3.405 -4.948 7.233 1.00 0.00 C ATOM 1501 C VAL A 94 -3.577 -5.684 5.915 1.00 0.00 C ATOM 1502 O VAL A 94 -4.671 -5.873 5.423 1.00 0.00 O ATOM 1503 CB VAL A 94 -2.666 -5.867 8.208 1.00 0.00 C ATOM 1504 CG1 VAL A 94 -2.124 -5.055 9.383 1.00 0.00 C ATOM 1505 CG2 VAL A 94 -3.634 -6.931 8.719 1.00 0.00 C ATOM 0 H VAL A 94 -5.355 -5.411 7.930 1.00 0.00 H new ATOM 0 HA VAL A 94 -2.838 -4.030 7.079 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.830 -6.344 7.696 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -1.600 -5.717 10.072 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -1.434 -4.296 9.013 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -2.951 -4.571 9.903 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -3.115 -7.591 9.415 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -4.468 -6.449 9.229 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.011 -7.514 7.879 1.00 0.00 H new ATOM 1515 N CYS A 95 -2.489 -6.113 5.363 1.00 0.00 N ATOM 1516 CA CYS A 95 -2.521 -6.870 4.091 1.00 0.00 C ATOM 1517 C CYS A 95 -1.176 -7.555 3.956 1.00 0.00 C ATOM 1518 O CYS A 95 -0.315 -7.107 3.231 1.00 0.00 O ATOM 1519 CB CYS A 95 -2.751 -5.924 2.922 1.00 0.00 C ATOM 1520 SG CYS A 95 -2.966 -6.887 1.403 1.00 0.00 S ATOM 0 H CYS A 95 -1.556 -5.968 5.748 1.00 0.00 H new ATOM 0 HA CYS A 95 -3.332 -7.599 4.089 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -3.633 -5.310 3.105 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -1.905 -5.244 2.818 1.00 0.00 H new ATOM 0 HG CYS A 95 -2.969 -6.087 0.379 1.00 0.00 H new ATOM 1526 N GLU A 96 -0.975 -8.613 4.693 1.00 0.00 N ATOM 1527 CA GLU A 96 0.343 -9.298 4.655 1.00 0.00 C ATOM 1528 C GLU A 96 0.565 -9.990 3.314 1.00 0.00 C ATOM 1529 O GLU A 96 -0.054 -10.991 3.005 1.00 0.00 O ATOM 1530 CB GLU A 96 0.436 -10.330 5.775 1.00 0.00 C ATOM 1531 CG GLU A 96 1.877 -10.835 5.858 1.00 0.00 C ATOM 1532 CD GLU A 96 1.950 -12.030 6.809 1.00 0.00 C ATOM 1533 OE1 GLU A 96 1.288 -11.989 7.832 1.00 0.00 O ATOM 1534 OE2 GLU A 96 2.668 -12.967 6.498 1.00 0.00 O ATOM 0 H GLU A 96 -1.666 -9.030 5.317 1.00 0.00 H new ATOM 0 HA GLU A 96 1.114 -8.540 4.791 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.136 -9.886 6.724 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.245 -11.159 5.582 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.229 -11.124 4.868 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.532 -10.038 6.209 1.00 0.00 H new ATOM 1541 N GLN A 97 1.469 -9.469 2.531 1.00 0.00 N ATOM 1542 CA GLN A 97 1.781 -10.082 1.222 1.00 0.00 C ATOM 1543 C GLN A 97 3.040 -10.939 1.382 1.00 0.00 C ATOM 1544 O GLN A 97 4.064 -10.460 1.832 1.00 0.00 O ATOM 1545 CB GLN A 97 2.037 -8.972 0.207 1.00 0.00 C ATOM 1546 CG GLN A 97 0.810 -8.062 0.120 1.00 0.00 C ATOM 1547 CD GLN A 97 0.632 -7.571 -1.319 1.00 0.00 C ATOM 1548 OE1 GLN A 97 1.565 -7.576 -2.098 1.00 0.00 O ATOM 1549 NE2 GLN A 97 -0.538 -7.142 -1.708 1.00 0.00 N ATOM 0 H GLN A 97 2.009 -8.632 2.752 1.00 0.00 H new ATOM 0 HA GLN A 97 0.953 -10.701 0.877 1.00 0.00 H new ATOM 0 HB2 GLN A 97 2.912 -8.392 0.500 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.253 -9.402 -0.771 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -0.080 -8.603 0.442 1.00 0.00 H new ATOM 0 HG3 GLN A 97 0.927 -7.212 0.792 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -1.322 -7.137 -1.056 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -0.668 -6.812 -2.664 1.00 0.00 H new ATOM 1558 N LYS A 98 2.976 -12.204 1.043 1.00 0.00 N ATOM 1559 CA LYS A 98 4.185 -13.074 1.207 1.00 0.00 C ATOM 1560 C LYS A 98 4.517 -13.784 -0.108 1.00 0.00 C ATOM 1561 O LYS A 98 3.702 -13.858 -1.005 1.00 0.00 O ATOM 1562 CB LYS A 98 3.913 -14.118 2.292 1.00 0.00 C ATOM 1563 CG LYS A 98 2.642 -14.899 1.946 1.00 0.00 C ATOM 1564 CD LYS A 98 1.430 -14.215 2.583 1.00 0.00 C ATOM 1565 CE LYS A 98 1.110 -14.881 3.923 1.00 0.00 C ATOM 1566 NZ LYS A 98 0.428 -16.184 3.680 1.00 0.00 N ATOM 0 H LYS A 98 2.150 -12.668 0.664 1.00 0.00 H new ATOM 0 HA LYS A 98 5.032 -12.450 1.493 1.00 0.00 H new ATOM 0 HB2 LYS A 98 4.759 -14.800 2.375 1.00 0.00 H new ATOM 0 HB3 LYS A 98 3.800 -13.630 3.260 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.517 -14.949 0.864 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.724 -15.925 2.305 1.00 0.00 H new ATOM 0 HD2 LYS A 98 1.635 -13.155 2.732 1.00 0.00 H new ATOM 0 HD3 LYS A 98 0.570 -14.283 1.917 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.027 -15.039 4.491 1.00 0.00 H new ATOM 0 HE3 LYS A 98 0.472 -14.231 4.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.056 -16.490 4.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.269 -16.074 2.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 1.132 -16.899 3.406 1.00 0.00 H new ATOM 1580 N LEU A 99 5.709 -14.324 -0.215 1.00 0.00 N ATOM 1581 CA LEU A 99 6.096 -15.053 -1.469 1.00 0.00 C ATOM 1582 C LEU A 99 5.937 -16.558 -1.255 1.00 0.00 C ATOM 1583 O LEU A 99 6.661 -17.356 -1.813 1.00 0.00 O ATOM 1584 CB LEU A 99 7.539 -14.736 -1.914 1.00 0.00 C ATOM 1585 CG LEU A 99 8.454 -14.508 -0.711 1.00 0.00 C ATOM 1586 CD1 LEU A 99 9.850 -15.059 -1.012 1.00 0.00 C ATOM 1587 CD2 LEU A 99 8.551 -13.008 -0.429 1.00 0.00 C ATOM 0 H LEU A 99 6.428 -14.292 0.507 1.00 0.00 H new ATOM 0 HA LEU A 99 5.432 -14.713 -2.264 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.925 -15.558 -2.516 1.00 0.00 H new ATOM 0 HB3 LEU A 99 7.540 -13.849 -2.548 1.00 0.00 H new ATOM 0 HG LEU A 99 8.044 -15.021 0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 99 10.499 -14.895 -0.152 1.00 0.00 H new ATOM 0 HD12 LEU A 99 9.783 -16.127 -1.217 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.263 -14.548 -1.882 1.00 0.00 H new ATOM 0 HD21 LEU A 99 9.203 -12.840 0.428 1.00 0.00 H new ATOM 0 HD22 LEU A 99 8.961 -12.500 -1.302 1.00 0.00 H new ATOM 0 HD23 LEU A 99 7.558 -12.614 -0.213 1.00 0.00 H new ATOM 1599 N LEU A 100 4.969 -16.942 -0.458 1.00 0.00 N ATOM 1600 CA LEU A 100 4.701 -18.392 -0.192 1.00 0.00 C ATOM 1601 C LEU A 100 5.862 -19.060 0.566 1.00 0.00 C ATOM 1602 O LEU A 100 5.879 -20.267 0.726 1.00 0.00 O ATOM 1603 CB LEU A 100 4.469 -19.127 -1.513 1.00 0.00 C ATOM 1604 CG LEU A 100 3.363 -18.424 -2.305 1.00 0.00 C ATOM 1605 CD1 LEU A 100 3.536 -18.713 -3.798 1.00 0.00 C ATOM 1606 CD2 LEU A 100 1.998 -18.938 -1.839 1.00 0.00 C ATOM 0 H LEU A 100 4.342 -16.301 0.028 1.00 0.00 H new ATOM 0 HA LEU A 100 3.810 -18.453 0.433 1.00 0.00 H new ATOM 0 HB2 LEU A 100 5.390 -19.148 -2.096 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.190 -20.163 -1.320 1.00 0.00 H new ATOM 0 HG LEU A 100 3.424 -17.349 -2.137 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.748 -18.212 -4.359 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.507 -18.346 -4.130 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.476 -19.788 -3.970 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.210 -18.438 -2.402 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.938 -20.013 -2.006 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.874 -18.729 -0.777 1.00 0.00 H new ATOM 1618 N LYS A 101 6.819 -18.302 1.037 1.00 0.00 N ATOM 1619 CA LYS A 101 7.962 -18.907 1.788 1.00 0.00 C ATOM 1620 C LYS A 101 8.824 -17.793 2.383 1.00 0.00 C ATOM 1621 O LYS A 101 9.230 -17.852 3.529 1.00 0.00 O ATOM 1622 CB LYS A 101 8.808 -19.761 0.841 1.00 0.00 C ATOM 1623 CG LYS A 101 9.194 -18.934 -0.387 1.00 0.00 C ATOM 1624 CD LYS A 101 9.771 -19.851 -1.467 1.00 0.00 C ATOM 1625 CE LYS A 101 8.704 -20.847 -1.941 1.00 0.00 C ATOM 1626 NZ LYS A 101 8.497 -20.690 -3.408 1.00 0.00 N ATOM 0 H LYS A 101 6.859 -17.288 0.934 1.00 0.00 H new ATOM 0 HA LYS A 101 7.576 -19.537 2.590 1.00 0.00 H new ATOM 0 HB2 LYS A 101 9.704 -20.111 1.353 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.249 -20.646 0.536 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.320 -18.408 -0.772 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.927 -18.176 -0.111 1.00 0.00 H new ATOM 0 HD2 LYS A 101 10.123 -19.256 -2.309 1.00 0.00 H new ATOM 0 HD3 LYS A 101 10.633 -20.390 -1.074 1.00 0.00 H new ATOM 0 HE2 LYS A 101 9.016 -21.866 -1.714 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.768 -20.674 -1.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.750 -21.341 -3.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 8.214 -19.711 -3.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 9.382 -20.909 -3.909 1.00 0.00 H new ATOM 1640 N GLY A 102 9.095 -16.775 1.612 1.00 0.00 N ATOM 1641 CA GLY A 102 9.921 -15.639 2.114 1.00 0.00 C ATOM 1642 C GLY A 102 11.398 -16.033 2.141 1.00 0.00 C ATOM 1643 O GLY A 102 11.748 -17.154 2.460 1.00 0.00 O ATOM 0 H GLY A 102 8.777 -16.681 0.647 1.00 0.00 H new ATOM 0 HA2 GLY A 102 9.781 -14.767 1.475 1.00 0.00 H new ATOM 0 HA3 GLY A 102 9.594 -15.356 3.115 1.00 0.00 H new ATOM 1647 N GLU A 103 12.263 -15.108 1.821 1.00 0.00 N ATOM 1648 CA GLU A 103 13.724 -15.395 1.835 1.00 0.00 C ATOM 1649 C GLU A 103 14.414 -14.390 2.757 1.00 0.00 C ATOM 1650 O GLU A 103 15.255 -14.745 3.561 1.00 0.00 O ATOM 1651 CB GLU A 103 14.298 -15.285 0.417 1.00 0.00 C ATOM 1652 CG GLU A 103 13.875 -13.957 -0.218 1.00 0.00 C ATOM 1653 CD GLU A 103 14.323 -13.927 -1.680 1.00 0.00 C ATOM 1654 OE1 GLU A 103 15.509 -14.081 -1.919 1.00 0.00 O ATOM 1655 OE2 GLU A 103 13.472 -13.751 -2.536 1.00 0.00 O ATOM 0 H GLU A 103 12.016 -14.157 1.548 1.00 0.00 H new ATOM 0 HA GLU A 103 13.895 -16.408 2.198 1.00 0.00 H new ATOM 0 HB2 GLU A 103 15.385 -15.352 0.450 1.00 0.00 H new ATOM 0 HB3 GLU A 103 13.946 -16.117 -0.192 1.00 0.00 H new ATOM 0 HG2 GLU A 103 12.793 -13.840 -0.155 1.00 0.00 H new ATOM 0 HG3 GLU A 103 14.318 -13.123 0.327 1.00 0.00 H new ATOM 1662 N GLY A 104 14.044 -13.141 2.657 1.00 0.00 N ATOM 1663 CA GLY A 104 14.642 -12.097 3.529 1.00 0.00 C ATOM 1664 C GLY A 104 13.520 -11.159 4.004 1.00 0.00 C ATOM 1665 O GLY A 104 12.901 -11.425 5.015 1.00 0.00 O ATOM 0 H GLY A 104 13.344 -12.799 1.999 1.00 0.00 H new ATOM 0 HA2 GLY A 104 15.139 -12.556 4.383 1.00 0.00 H new ATOM 0 HA3 GLY A 104 15.400 -11.535 2.983 1.00 0.00 H new ATOM 1669 N PRO A 105 13.265 -10.090 3.267 1.00 0.00 N ATOM 1670 CA PRO A 105 12.202 -9.140 3.625 1.00 0.00 C ATOM 1671 C PRO A 105 10.847 -9.653 3.121 1.00 0.00 C ATOM 1672 O PRO A 105 10.687 -10.830 2.855 1.00 0.00 O ATOM 1673 CB PRO A 105 12.611 -7.855 2.907 1.00 0.00 C ATOM 1674 CG PRO A 105 13.539 -8.271 1.740 1.00 0.00 C ATOM 1675 CD PRO A 105 14.001 -9.715 2.032 1.00 0.00 C ATOM 0 HA PRO A 105 12.091 -8.996 4.700 1.00 0.00 H new ATOM 0 HB2 PRO A 105 11.735 -7.325 2.534 1.00 0.00 H new ATOM 0 HB3 PRO A 105 13.127 -7.179 3.589 1.00 0.00 H new ATOM 0 HG2 PRO A 105 13.010 -8.219 0.788 1.00 0.00 H new ATOM 0 HG3 PRO A 105 14.394 -7.599 1.667 1.00 0.00 H new ATOM 0 HD2 PRO A 105 13.761 -10.385 1.206 1.00 0.00 H new ATOM 0 HD3 PRO A 105 15.080 -9.766 2.180 1.00 0.00 H new ATOM 1683 N LYS A 106 9.866 -8.787 3.000 1.00 0.00 N ATOM 1684 CA LYS A 106 8.526 -9.236 2.529 1.00 0.00 C ATOM 1685 C LYS A 106 7.658 -8.025 2.179 1.00 0.00 C ATOM 1686 O LYS A 106 7.995 -6.896 2.482 1.00 0.00 O ATOM 1687 CB LYS A 106 7.865 -10.026 3.654 1.00 0.00 C ATOM 1688 CG LYS A 106 7.269 -11.328 3.106 1.00 0.00 C ATOM 1689 CD LYS A 106 7.518 -12.465 4.100 1.00 0.00 C ATOM 1690 CE LYS A 106 6.600 -12.294 5.311 1.00 0.00 C ATOM 1691 NZ LYS A 106 6.240 -13.634 5.855 1.00 0.00 N ATOM 0 H LYS A 106 9.941 -7.791 3.208 1.00 0.00 H new ATOM 0 HA LYS A 106 8.635 -9.856 1.639 1.00 0.00 H new ATOM 0 HB2 LYS A 106 8.597 -10.251 4.430 1.00 0.00 H new ATOM 0 HB3 LYS A 106 7.082 -9.426 4.119 1.00 0.00 H new ATOM 0 HG2 LYS A 106 6.199 -11.207 2.937 1.00 0.00 H new ATOM 0 HG3 LYS A 106 7.719 -11.569 2.143 1.00 0.00 H new ATOM 0 HD2 LYS A 106 7.332 -13.427 3.622 1.00 0.00 H new ATOM 0 HD3 LYS A 106 8.561 -12.463 4.418 1.00 0.00 H new ATOM 0 HE2 LYS A 106 7.098 -11.700 6.077 1.00 0.00 H new ATOM 0 HE3 LYS A 106 5.699 -11.752 5.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 5.616 -13.518 6.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 5.748 -14.185 5.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 7.104 -14.135 6.144 1.00 0.00 H new ATOM 1705 N THR A 107 6.536 -8.261 1.549 1.00 0.00 N ATOM 1706 CA THR A 107 5.627 -7.144 1.172 1.00 0.00 C ATOM 1707 C THR A 107 4.398 -7.160 2.078 1.00 0.00 C ATOM 1708 O THR A 107 4.104 -8.147 2.720 1.00 0.00 O ATOM 1709 CB THR A 107 5.183 -7.335 -0.283 1.00 0.00 C ATOM 1710 OG1 THR A 107 5.117 -8.722 -0.581 1.00 0.00 O ATOM 1711 CG2 THR A 107 6.175 -6.668 -1.229 1.00 0.00 C ATOM 0 H THR A 107 6.210 -9.189 1.279 1.00 0.00 H new ATOM 0 HA THR A 107 6.147 -6.192 1.282 1.00 0.00 H new ATOM 0 HB THR A 107 4.201 -6.880 -0.413 1.00 0.00 H new ATOM 0 HG1 THR A 107 4.831 -8.844 -1.511 1.00 0.00 H new ATOM 0 HG21 THR A 107 5.848 -6.811 -2.259 1.00 0.00 H new ATOM 0 HG22 THR A 107 6.227 -5.602 -1.009 1.00 0.00 H new ATOM 0 HG23 THR A 107 7.161 -7.114 -1.096 1.00 0.00 H new ATOM 1719 N SER A 108 3.679 -6.066 2.135 1.00 0.00 N ATOM 1720 CA SER A 108 2.455 -5.994 2.995 1.00 0.00 C ATOM 1721 C SER A 108 1.937 -4.554 3.003 1.00 0.00 C ATOM 1722 O SER A 108 2.605 -3.653 2.535 1.00 0.00 O ATOM 1723 CB SER A 108 2.798 -6.401 4.433 1.00 0.00 C ATOM 1724 OG SER A 108 4.099 -5.928 4.756 1.00 0.00 O ATOM 0 H SER A 108 3.889 -5.212 1.618 1.00 0.00 H new ATOM 0 HA SER A 108 1.698 -6.670 2.598 1.00 0.00 H new ATOM 0 HB2 SER A 108 2.065 -5.986 5.125 1.00 0.00 H new ATOM 0 HB3 SER A 108 2.756 -7.485 4.536 1.00 0.00 H new ATOM 0 HG SER A 108 4.322 -6.185 5.675 1.00 0.00 H new ATOM 1730 N TRP A 109 0.778 -4.319 3.572 1.00 0.00 N ATOM 1731 CA TRP A 109 0.261 -2.919 3.659 1.00 0.00 C ATOM 1732 C TRP A 109 -0.822 -2.831 4.702 1.00 0.00 C ATOM 1733 O TRP A 109 -1.633 -3.724 4.853 1.00 0.00 O ATOM 1734 CB TRP A 109 -0.239 -2.361 2.308 1.00 0.00 C ATOM 1735 CG TRP A 109 -1.487 -2.995 1.762 1.00 0.00 C ATOM 1736 CD1 TRP A 109 -1.523 -3.672 0.595 1.00 0.00 C ATOM 1737 CD2 TRP A 109 -2.875 -2.957 2.256 1.00 0.00 C ATOM 1738 NE1 TRP A 109 -2.822 -4.063 0.334 1.00 0.00 N ATOM 1739 CE2 TRP A 109 -3.692 -3.655 1.324 1.00 0.00 C ATOM 1740 CE3 TRP A 109 -3.509 -2.411 3.401 1.00 0.00 C ATOM 1741 CZ2 TRP A 109 -5.070 -3.797 1.516 1.00 0.00 C ATOM 1742 CZ3 TRP A 109 -4.890 -2.562 3.588 1.00 0.00 C ATOM 1743 CH2 TRP A 109 -5.663 -3.250 2.649 1.00 0.00 C ATOM 0 H TRP A 109 0.172 -5.033 3.977 1.00 0.00 H new ATOM 0 HA TRP A 109 1.105 -2.293 3.950 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -0.417 -1.292 2.421 1.00 0.00 H new ATOM 0 HB3 TRP A 109 0.557 -2.476 1.572 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -0.670 -3.876 -0.036 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -3.104 -4.590 -0.492 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -2.924 -1.875 4.134 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -5.669 -4.327 0.790 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -5.361 -2.143 4.465 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -6.726 -3.358 2.804 1.00 0.00 H new ATOM 1754 N THR A 110 -0.830 -1.751 5.439 1.00 0.00 N ATOM 1755 CA THR A 110 -1.860 -1.586 6.495 1.00 0.00 C ATOM 1756 C THR A 110 -2.523 -0.223 6.378 1.00 0.00 C ATOM 1757 O THR A 110 -1.935 0.800 6.662 1.00 0.00 O ATOM 1758 CB THR A 110 -1.227 -1.723 7.873 1.00 0.00 C ATOM 1759 OG1 THR A 110 -0.437 -0.575 8.149 1.00 0.00 O ATOM 1760 CG2 THR A 110 -0.352 -2.976 7.918 1.00 0.00 C ATOM 0 H THR A 110 -0.168 -0.980 5.352 1.00 0.00 H new ATOM 0 HA THR A 110 -2.613 -2.363 6.365 1.00 0.00 H new ATOM 0 HB THR A 110 -2.012 -1.810 8.624 1.00 0.00 H new ATOM 0 HG1 THR A 110 -0.935 0.232 7.902 1.00 0.00 H new ATOM 0 HG21 THR A 110 0.099 -3.070 8.906 1.00 0.00 H new ATOM 0 HG22 THR A 110 -0.964 -3.855 7.713 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.434 -2.898 7.167 1.00 0.00 H new ATOM 1768 N ARG A 111 -3.762 -0.223 5.992 1.00 0.00 N ATOM 1769 CA ARG A 111 -4.523 1.052 5.872 1.00 0.00 C ATOM 1770 C ARG A 111 -5.095 1.370 7.247 1.00 0.00 C ATOM 1771 O ARG A 111 -5.650 0.508 7.883 1.00 0.00 O ATOM 1772 CB ARG A 111 -5.655 0.859 4.854 1.00 0.00 C ATOM 1773 CG ARG A 111 -5.087 0.930 3.436 1.00 0.00 C ATOM 1774 CD ARG A 111 -6.223 0.777 2.422 1.00 0.00 C ATOM 1775 NE ARG A 111 -5.762 1.245 1.082 1.00 0.00 N ATOM 1776 CZ ARG A 111 -4.778 0.634 0.476 1.00 0.00 C ATOM 1777 NH1 ARG A 111 -4.699 -0.668 0.505 1.00 0.00 N ATOM 1778 NH2 ARG A 111 -3.872 1.327 -0.157 1.00 0.00 N ATOM 0 H ARG A 111 -4.290 -1.061 5.750 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.886 1.869 5.534 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -6.142 -0.103 5.014 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.416 1.628 4.991 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -4.576 1.881 3.285 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -4.347 0.144 3.290 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -6.537 -0.265 2.367 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -7.090 1.355 2.742 1.00 0.00 H new ATOM 0 HE ARG A 111 -6.216 2.043 0.638 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -5.406 -1.211 1.001 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -3.930 -1.143 0.032 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -3.932 2.345 -0.179 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -3.104 0.851 -0.630 1.00 0.00 H new ATOM 1792 N GLU A 112 -4.962 2.580 7.728 1.00 0.00 N ATOM 1793 CA GLU A 112 -5.509 2.886 9.083 1.00 0.00 C ATOM 1794 C GLU A 112 -6.274 4.201 9.053 1.00 0.00 C ATOM 1795 O GLU A 112 -5.985 5.082 8.275 1.00 0.00 O ATOM 1796 CB GLU A 112 -4.368 2.972 10.099 1.00 0.00 C ATOM 1797 CG GLU A 112 -4.949 3.031 11.514 1.00 0.00 C ATOM 1798 CD GLU A 112 -3.814 3.022 12.542 1.00 0.00 C ATOM 1799 OE1 GLU A 112 -2.748 3.525 12.227 1.00 0.00 O ATOM 1800 OE2 GLU A 112 -4.033 2.513 13.629 1.00 0.00 O ATOM 0 H GLU A 112 -4.506 3.357 7.250 1.00 0.00 H new ATOM 0 HA GLU A 112 -6.190 2.087 9.377 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -3.712 2.107 9.999 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -3.761 3.857 9.906 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.552 3.931 11.632 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -5.610 2.181 11.681 1.00 0.00 H new ATOM 1807 N LEU A 113 -7.262 4.320 9.892 1.00 0.00 N ATOM 1808 CA LEU A 113 -8.085 5.555 9.939 1.00 0.00 C ATOM 1809 C LEU A 113 -7.761 6.311 11.231 1.00 0.00 C ATOM 1810 O LEU A 113 -7.117 5.778 12.116 1.00 0.00 O ATOM 1811 CB LEU A 113 -9.561 5.133 9.933 1.00 0.00 C ATOM 1812 CG LEU A 113 -10.074 4.801 8.517 1.00 0.00 C ATOM 1813 CD1 LEU A 113 -10.511 6.081 7.810 1.00 0.00 C ATOM 1814 CD2 LEU A 113 -9.016 4.079 7.680 1.00 0.00 C ATOM 0 H LEU A 113 -7.538 3.599 10.559 1.00 0.00 H new ATOM 0 HA LEU A 113 -7.879 6.202 9.086 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -9.689 4.262 10.576 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -10.166 5.934 10.357 1.00 0.00 H new ATOM 0 HG LEU A 113 -10.926 4.129 8.623 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -10.872 5.839 6.810 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -11.310 6.557 8.379 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -9.664 6.763 7.735 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -9.419 3.864 6.690 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -8.134 4.712 7.583 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.740 3.145 8.170 1.00 0.00 H new ATOM 1826 N THR A 114 -8.195 7.540 11.350 1.00 0.00 N ATOM 1827 CA THR A 114 -7.902 8.319 12.592 1.00 0.00 C ATOM 1828 C THR A 114 -9.214 8.761 13.244 1.00 0.00 C ATOM 1829 O THR A 114 -9.593 8.268 14.289 1.00 0.00 O ATOM 1830 CB THR A 114 -7.055 9.546 12.239 1.00 0.00 C ATOM 1831 OG1 THR A 114 -5.889 9.129 11.544 1.00 0.00 O ATOM 1832 CG2 THR A 114 -6.652 10.280 13.520 1.00 0.00 C ATOM 0 H THR A 114 -8.738 8.037 10.644 1.00 0.00 H new ATOM 0 HA THR A 114 -7.350 7.692 13.292 1.00 0.00 H new ATOM 0 HB THR A 114 -7.636 10.218 11.607 1.00 0.00 H new ATOM 0 HG1 THR A 114 -6.140 8.780 10.664 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.050 11.152 13.265 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.547 10.600 14.053 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.072 9.611 14.155 1.00 0.00 H new ATOM 1840 N ASN A 115 -9.909 9.684 12.631 1.00 0.00 N ATOM 1841 CA ASN A 115 -11.200 10.162 13.203 1.00 0.00 C ATOM 1842 C ASN A 115 -12.290 10.018 12.146 1.00 0.00 C ATOM 1843 O ASN A 115 -13.215 9.241 12.293 1.00 0.00 O ATOM 1844 CB ASN A 115 -11.068 11.632 13.609 1.00 0.00 C ATOM 1845 CG ASN A 115 -10.324 11.729 14.942 1.00 0.00 C ATOM 1846 OD1 ASN A 115 -10.680 11.069 15.898 1.00 0.00 O ATOM 1847 ND2 ASN A 115 -9.300 12.530 15.048 1.00 0.00 N ATOM 0 H ASN A 115 -9.635 10.128 11.755 1.00 0.00 H new ATOM 0 HA ASN A 115 -11.457 9.571 14.082 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -10.530 12.186 12.839 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -12.055 12.086 13.698 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -8.798 12.602 15.933 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -9.001 13.084 14.246 1.00 0.00 H new ATOM 1854 N ASP A 116 -12.177 10.758 11.078 1.00 0.00 N ATOM 1855 CA ASP A 116 -13.192 10.674 9.990 1.00 0.00 C ATOM 1856 C ASP A 116 -12.650 11.354 8.731 1.00 0.00 C ATOM 1857 O ASP A 116 -13.397 11.902 7.942 1.00 0.00 O ATOM 1858 CB ASP A 116 -14.479 11.373 10.435 1.00 0.00 C ATOM 1859 CG ASP A 116 -15.660 10.829 9.629 1.00 0.00 C ATOM 1860 OD1 ASP A 116 -15.668 9.640 9.356 1.00 0.00 O ATOM 1861 OD2 ASP A 116 -16.537 11.610 9.299 1.00 0.00 O ATOM 0 H ASP A 116 -11.420 11.421 10.911 1.00 0.00 H new ATOM 0 HA ASP A 116 -13.405 9.627 9.774 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -14.645 11.209 11.500 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -14.390 12.449 10.289 1.00 0.00 H new ATOM 1866 N GLY A 117 -11.355 11.317 8.538 1.00 0.00 N ATOM 1867 CA GLY A 117 -10.755 11.956 7.329 1.00 0.00 C ATOM 1868 C GLY A 117 -9.236 12.049 7.488 1.00 0.00 C ATOM 1869 O GLY A 117 -8.621 13.033 7.126 1.00 0.00 O ATOM 0 H GLY A 117 -10.687 10.871 9.167 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -11.001 11.375 6.440 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -11.176 12.951 7.186 1.00 0.00 H new ATOM 1873 N GLU A 118 -8.634 11.021 8.013 1.00 0.00 N ATOM 1874 CA GLU A 118 -7.154 11.008 8.190 1.00 0.00 C ATOM 1875 C GLU A 118 -6.697 9.557 8.056 1.00 0.00 C ATOM 1876 O GLU A 118 -6.400 8.888 9.027 1.00 0.00 O ATOM 1877 CB GLU A 118 -6.790 11.554 9.575 1.00 0.00 C ATOM 1878 CG GLU A 118 -6.205 12.962 9.436 1.00 0.00 C ATOM 1879 CD GLU A 118 -5.801 13.486 10.816 1.00 0.00 C ATOM 1880 OE1 GLU A 118 -5.122 12.764 11.526 1.00 0.00 O ATOM 1881 OE2 GLU A 118 -6.179 14.601 11.137 1.00 0.00 O ATOM 0 H GLU A 118 -9.110 10.177 8.332 1.00 0.00 H new ATOM 0 HA GLU A 118 -6.666 11.634 7.444 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -7.675 11.578 10.211 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -6.068 10.896 10.058 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -5.339 12.944 8.774 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -6.938 13.629 8.983 1.00 0.00 H new ATOM 1888 N LEU A 119 -6.694 9.063 6.851 1.00 0.00 N ATOM 1889 CA LEU A 119 -6.322 7.644 6.602 1.00 0.00 C ATOM 1890 C LEU A 119 -4.815 7.493 6.365 1.00 0.00 C ATOM 1891 O LEU A 119 -4.319 7.813 5.309 1.00 0.00 O ATOM 1892 CB LEU A 119 -7.080 7.187 5.355 1.00 0.00 C ATOM 1893 CG LEU A 119 -7.096 5.659 5.265 1.00 0.00 C ATOM 1894 CD1 LEU A 119 -8.488 5.176 4.845 1.00 0.00 C ATOM 1895 CD2 LEU A 119 -6.070 5.205 4.229 1.00 0.00 C ATOM 0 H LEU A 119 -6.938 9.592 6.014 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.579 7.041 7.473 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.102 7.566 5.384 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.611 7.604 4.464 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.849 5.238 6.240 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.492 4.088 4.783 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.223 5.500 5.582 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.740 5.596 3.871 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.078 4.117 4.162 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.321 5.631 3.257 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.078 5.543 4.528 1.00 0.00 H new ATOM 1907 N ILE A 120 -4.088 6.974 7.325 1.00 0.00 N ATOM 1908 CA ILE A 120 -2.618 6.771 7.122 1.00 0.00 C ATOM 1909 C ILE A 120 -2.415 5.365 6.557 1.00 0.00 C ATOM 1910 O ILE A 120 -2.661 4.379 7.217 1.00 0.00 O ATOM 1911 CB ILE A 120 -1.873 6.952 8.449 1.00 0.00 C ATOM 1912 CG1 ILE A 120 -2.328 5.900 9.466 1.00 0.00 C ATOM 1913 CG2 ILE A 120 -2.187 8.339 8.993 1.00 0.00 C ATOM 1914 CD1 ILE A 120 -1.297 4.771 9.528 1.00 0.00 C ATOM 0 H ILE A 120 -4.446 6.684 8.235 1.00 0.00 H new ATOM 0 HA ILE A 120 -2.218 7.506 6.424 1.00 0.00 H new ATOM 0 HB ILE A 120 -0.802 6.837 8.281 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -2.444 6.356 10.449 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -3.302 5.502 9.182 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -1.665 8.486 9.938 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -1.860 9.093 8.277 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -3.261 8.432 9.154 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -1.620 4.022 10.251 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -1.204 4.309 8.545 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -0.332 5.176 9.832 1.00 0.00 H new ATOM 1926 N LEU A 121 -2.021 5.276 5.319 1.00 0.00 N ATOM 1927 CA LEU A 121 -1.865 3.947 4.671 1.00 0.00 C ATOM 1928 C LEU A 121 -0.378 3.632 4.408 1.00 0.00 C ATOM 1929 O LEU A 121 0.342 4.393 3.790 1.00 0.00 O ATOM 1930 CB LEU A 121 -2.709 3.980 3.373 1.00 0.00 C ATOM 1931 CG LEU A 121 -2.403 2.820 2.408 1.00 0.00 C ATOM 1932 CD1 LEU A 121 -1.181 3.175 1.562 1.00 0.00 C ATOM 1933 CD2 LEU A 121 -2.138 1.520 3.168 1.00 0.00 C ATOM 0 H LEU A 121 -1.799 6.074 4.724 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.220 3.144 5.318 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.766 3.953 3.637 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.533 4.925 2.859 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.272 2.668 1.768 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -0.962 2.355 0.878 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.385 4.080 0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.324 3.343 2.214 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -1.925 0.721 2.458 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.283 1.654 3.831 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.017 1.258 3.757 1.00 0.00 H new ATOM 1945 N THR A 122 0.066 2.495 4.895 1.00 0.00 N ATOM 1946 CA THR A 122 1.486 2.054 4.721 1.00 0.00 C ATOM 1947 C THR A 122 1.529 0.860 3.769 1.00 0.00 C ATOM 1948 O THR A 122 0.566 0.148 3.624 1.00 0.00 O ATOM 1949 CB THR A 122 2.028 1.585 6.064 1.00 0.00 C ATOM 1950 OG1 THR A 122 1.807 2.584 7.050 1.00 0.00 O ATOM 1951 CG2 THR A 122 3.521 1.292 5.944 1.00 0.00 C ATOM 0 H THR A 122 -0.514 1.839 5.419 1.00 0.00 H new ATOM 0 HA THR A 122 2.075 2.884 4.329 1.00 0.00 H new ATOM 0 HB THR A 122 1.509 0.674 6.361 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.156 2.276 7.912 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.905 0.957 6.908 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.680 0.512 5.199 1.00 0.00 H new ATOM 0 HG23 THR A 122 4.046 2.197 5.640 1.00 0.00 H new ATOM 1959 N MET A 123 2.647 0.612 3.152 1.00 0.00 N ATOM 1960 CA MET A 123 2.747 -0.564 2.235 1.00 0.00 C ATOM 1961 C MET A 123 4.208 -0.973 2.095 1.00 0.00 C ATOM 1962 O MET A 123 4.940 -0.439 1.284 1.00 0.00 O ATOM 1963 CB MET A 123 2.169 -0.209 0.868 1.00 0.00 C ATOM 1964 CG MET A 123 2.134 -1.463 -0.016 1.00 0.00 C ATOM 1965 SD MET A 123 3.458 -1.392 -1.253 1.00 0.00 S ATOM 1966 CE MET A 123 3.624 -3.176 -1.510 1.00 0.00 C ATOM 0 H MET A 123 3.497 1.169 3.240 1.00 0.00 H new ATOM 0 HA MET A 123 2.178 -1.396 2.650 1.00 0.00 H new ATOM 0 HB2 MET A 123 1.164 0.197 0.981 1.00 0.00 H new ATOM 0 HB3 MET A 123 2.774 0.565 0.396 1.00 0.00 H new ATOM 0 HG2 MET A 123 2.249 -2.355 0.600 1.00 0.00 H new ATOM 0 HG3 MET A 123 1.166 -1.541 -0.512 1.00 0.00 H new ATOM 0 HE1 MET A 123 4.549 -3.382 -2.048 1.00 0.00 H new ATOM 0 HE2 MET A 123 3.645 -3.682 -0.545 1.00 0.00 H new ATOM 0 HE3 MET A 123 2.777 -3.540 -2.092 1.00 0.00 H new ATOM 1976 N THR A 124 4.634 -1.910 2.897 1.00 0.00 N ATOM 1977 CA THR A 124 6.060 -2.354 2.845 1.00 0.00 C ATOM 1978 C THR A 124 6.308 -3.189 1.601 1.00 0.00 C ATOM 1979 O THR A 124 5.392 -3.586 0.905 1.00 0.00 O ATOM 1980 CB THR A 124 6.463 -3.171 4.102 1.00 0.00 C ATOM 1981 OG1 THR A 124 6.347 -4.568 3.849 1.00 0.00 O ATOM 1982 CG2 THR A 124 5.593 -2.822 5.315 1.00 0.00 C ATOM 0 H THR A 124 4.057 -2.389 3.588 1.00 0.00 H new ATOM 0 HA THR A 124 6.674 -1.454 2.816 1.00 0.00 H new ATOM 0 HB THR A 124 7.498 -2.913 4.325 1.00 0.00 H new ATOM 0 HG1 THR A 124 5.507 -4.901 4.229 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.909 -3.416 6.172 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.702 -1.763 5.548 1.00 0.00 H new ATOM 0 HG23 THR A 124 4.549 -3.038 5.088 1.00 0.00 H new ATOM 1990 N ALA A 125 7.556 -3.457 1.329 1.00 0.00 N ATOM 1991 CA ALA A 125 7.894 -4.276 0.128 1.00 0.00 C ATOM 1992 C ALA A 125 9.393 -4.561 0.032 1.00 0.00 C ATOM 1993 O ALA A 125 10.173 -3.722 -0.367 1.00 0.00 O ATOM 1994 CB ALA A 125 7.452 -3.541 -1.132 1.00 0.00 C ATOM 0 H ALA A 125 8.354 -3.146 1.883 1.00 0.00 H new ATOM 0 HA ALA A 125 7.371 -5.228 0.223 1.00 0.00 H new ATOM 0 HB1 ALA A 125 7.699 -4.140 -2.008 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.375 -3.375 -1.098 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.965 -2.581 -1.192 1.00 0.00 H new ATOM 2000 N ASP A 126 9.803 -5.760 0.358 1.00 0.00 N ATOM 2001 CA ASP A 126 11.257 -6.106 0.264 1.00 0.00 C ATOM 2002 C ASP A 126 12.038 -5.281 1.289 1.00 0.00 C ATOM 2003 O ASP A 126 13.176 -4.918 1.067 1.00 0.00 O ATOM 2004 CB ASP A 126 11.780 -5.800 -1.143 1.00 0.00 C ATOM 2005 CG ASP A 126 12.701 -6.930 -1.613 1.00 0.00 C ATOM 2006 OD1 ASP A 126 12.355 -8.079 -1.394 1.00 0.00 O ATOM 2007 OD2 ASP A 126 13.735 -6.625 -2.184 1.00 0.00 O ATOM 0 H ASP A 126 9.198 -6.513 0.684 1.00 0.00 H new ATOM 0 HA ASP A 126 11.387 -7.169 0.468 1.00 0.00 H new ATOM 0 HB2 ASP A 126 10.945 -5.688 -1.835 1.00 0.00 H new ATOM 0 HB3 ASP A 126 12.322 -4.854 -1.142 1.00 0.00 H new ATOM 2012 N ASP A 127 11.407 -4.997 2.408 1.00 0.00 N ATOM 2013 CA ASP A 127 12.024 -4.204 3.531 1.00 0.00 C ATOM 2014 C ASP A 127 11.739 -2.712 3.357 1.00 0.00 C ATOM 2015 O ASP A 127 12.057 -1.920 4.227 1.00 0.00 O ATOM 2016 CB ASP A 127 13.542 -4.427 3.633 1.00 0.00 C ATOM 2017 CG ASP A 127 13.968 -4.419 5.102 1.00 0.00 C ATOM 2018 OD1 ASP A 127 13.918 -5.470 5.719 1.00 0.00 O ATOM 2019 OD2 ASP A 127 14.336 -3.361 5.586 1.00 0.00 O ATOM 0 H ASP A 127 10.450 -5.295 2.597 1.00 0.00 H new ATOM 0 HA ASP A 127 11.568 -4.559 4.455 1.00 0.00 H new ATOM 0 HB2 ASP A 127 13.811 -5.377 3.172 1.00 0.00 H new ATOM 0 HB3 ASP A 127 14.071 -3.646 3.087 1.00 0.00 H new ATOM 2024 N VAL A 128 11.129 -2.313 2.266 1.00 0.00 N ATOM 2025 CA VAL A 128 10.818 -0.878 2.082 1.00 0.00 C ATOM 2026 C VAL A 128 9.499 -0.586 2.796 1.00 0.00 C ATOM 2027 O VAL A 128 8.844 -1.482 3.293 1.00 0.00 O ATOM 2028 CB VAL A 128 10.689 -0.563 0.576 1.00 0.00 C ATOM 2029 CG1 VAL A 128 11.892 -1.127 -0.182 1.00 0.00 C ATOM 2030 CG2 VAL A 128 9.415 -1.181 -0.003 1.00 0.00 C ATOM 0 H VAL A 128 10.838 -2.924 1.503 1.00 0.00 H new ATOM 0 HA VAL A 128 11.613 -0.258 2.496 1.00 0.00 H new ATOM 0 HB VAL A 128 10.648 0.520 0.464 1.00 0.00 H new ATOM 0 HG11 VAL A 128 11.792 -0.900 -1.243 1.00 0.00 H new ATOM 0 HG12 VAL A 128 12.807 -0.676 0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 128 11.935 -2.207 -0.045 1.00 0.00 H new ATOM 0 HG21 VAL A 128 9.346 -0.945 -1.065 1.00 0.00 H new ATOM 0 HG22 VAL A 128 9.444 -2.263 0.128 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.546 -0.776 0.515 1.00 0.00 H new ATOM 2040 N VAL A 129 9.100 0.647 2.826 1.00 0.00 N ATOM 2041 CA VAL A 129 7.811 0.997 3.468 1.00 0.00 C ATOM 2042 C VAL A 129 7.306 2.322 2.898 1.00 0.00 C ATOM 2043 O VAL A 129 7.938 3.353 3.013 1.00 0.00 O ATOM 2044 CB VAL A 129 7.990 1.017 5.003 1.00 0.00 C ATOM 2045 CG1 VAL A 129 7.169 2.139 5.676 1.00 0.00 C ATOM 2046 CG2 VAL A 129 7.523 -0.333 5.548 1.00 0.00 C ATOM 0 H VAL A 129 9.615 1.434 2.431 1.00 0.00 H new ATOM 0 HA VAL A 129 7.049 0.248 3.251 1.00 0.00 H new ATOM 0 HB VAL A 129 9.041 1.204 5.225 1.00 0.00 H new ATOM 0 HG11 VAL A 129 7.329 2.110 6.754 1.00 0.00 H new ATOM 0 HG12 VAL A 129 7.488 3.106 5.287 1.00 0.00 H new ATOM 0 HG13 VAL A 129 6.110 1.993 5.462 1.00 0.00 H new ATOM 0 HG21 VAL A 129 7.638 -0.347 6.632 1.00 0.00 H new ATOM 0 HG22 VAL A 129 6.474 -0.485 5.293 1.00 0.00 H new ATOM 0 HG23 VAL A 129 8.123 -1.130 5.109 1.00 0.00 H new ATOM 2056 N CYS A 130 6.154 2.275 2.295 1.00 0.00 N ATOM 2057 CA CYS A 130 5.552 3.506 1.709 1.00 0.00 C ATOM 2058 C CYS A 130 4.499 4.040 2.678 1.00 0.00 C ATOM 2059 O CYS A 130 3.358 3.617 2.661 1.00 0.00 O ATOM 2060 CB CYS A 130 4.892 3.168 0.371 1.00 0.00 C ATOM 2061 SG CYS A 130 4.928 4.625 -0.703 1.00 0.00 S ATOM 0 H CYS A 130 5.596 1.429 2.181 1.00 0.00 H new ATOM 0 HA CYS A 130 6.324 4.257 1.544 1.00 0.00 H new ATOM 0 HB2 CYS A 130 5.415 2.339 -0.105 1.00 0.00 H new ATOM 0 HB3 CYS A 130 3.863 2.846 0.532 1.00 0.00 H new ATOM 0 HG CYS A 130 4.369 4.339 -1.841 1.00 0.00 H new ATOM 2067 N THR A 131 4.879 4.952 3.535 1.00 0.00 N ATOM 2068 CA THR A 131 3.911 5.504 4.527 1.00 0.00 C ATOM 2069 C THR A 131 3.536 6.938 4.160 1.00 0.00 C ATOM 2070 O THR A 131 4.388 7.772 3.918 1.00 0.00 O ATOM 2071 CB THR A 131 4.557 5.505 5.913 1.00 0.00 C ATOM 2072 OG1 THR A 131 5.328 4.323 6.077 1.00 0.00 O ATOM 2073 CG2 THR A 131 3.472 5.566 6.993 1.00 0.00 C ATOM 0 H THR A 131 5.821 5.339 3.590 1.00 0.00 H new ATOM 0 HA THR A 131 3.014 4.885 4.526 1.00 0.00 H new ATOM 0 HB THR A 131 5.204 6.377 6.008 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.744 4.324 6.965 1.00 0.00 H new ATOM 0 HG21 THR A 131 3.939 5.566 7.978 1.00 0.00 H new ATOM 0 HG22 THR A 131 2.886 6.477 6.869 1.00 0.00 H new ATOM 0 HG23 THR A 131 2.818 4.698 6.902 1.00 0.00 H new ATOM 2081 N ARG A 132 2.263 7.229 4.138 1.00 0.00 N ATOM 2082 CA ARG A 132 1.808 8.615 3.812 1.00 0.00 C ATOM 2083 C ARG A 132 0.399 8.811 4.360 1.00 0.00 C ATOM 2084 O ARG A 132 -0.459 7.962 4.201 1.00 0.00 O ATOM 2085 CB ARG A 132 1.817 8.868 2.291 1.00 0.00 C ATOM 2086 CG ARG A 132 1.542 7.582 1.507 1.00 0.00 C ATOM 2087 CD ARG A 132 1.308 7.932 0.039 1.00 0.00 C ATOM 2088 NE ARG A 132 1.363 6.691 -0.784 1.00 0.00 N ATOM 2089 CZ ARG A 132 1.560 6.770 -2.072 1.00 0.00 C ATOM 2090 NH1 ARG A 132 2.773 6.885 -2.540 1.00 0.00 N ATOM 2091 NH2 ARG A 132 0.544 6.735 -2.890 1.00 0.00 N ATOM 0 H ARG A 132 1.514 6.564 4.332 1.00 0.00 H new ATOM 0 HA ARG A 132 2.496 9.326 4.270 1.00 0.00 H new ATOM 0 HB2 ARG A 132 1.064 9.616 2.041 1.00 0.00 H new ATOM 0 HB3 ARG A 132 2.783 9.277 1.995 1.00 0.00 H new ATOM 0 HG2 ARG A 132 2.385 6.897 1.601 1.00 0.00 H new ATOM 0 HG3 ARG A 132 0.670 7.072 1.916 1.00 0.00 H new ATOM 0 HD2 ARG A 132 0.339 8.417 -0.080 1.00 0.00 H new ATOM 0 HD3 ARG A 132 2.063 8.640 -0.302 1.00 0.00 H new ATOM 0 HE ARG A 132 1.247 5.780 -0.341 1.00 0.00 H new ATOM 0 HH11 ARG A 132 3.566 6.913 -1.899 1.00 0.00 H new ATOM 0 HH12 ARG A 132 2.928 6.947 -3.546 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -0.403 6.646 -2.523 1.00 0.00 H new ATOM 0 HH22 ARG A 132 0.697 6.797 -3.897 1.00 0.00 H new ATOM 2105 N VAL A 133 0.155 9.922 5.008 1.00 0.00 N ATOM 2106 CA VAL A 133 -1.199 10.171 5.572 1.00 0.00 C ATOM 2107 C VAL A 133 -2.132 10.585 4.443 1.00 0.00 C ATOM 2108 O VAL A 133 -1.706 11.095 3.429 1.00 0.00 O ATOM 2109 CB VAL A 133 -1.121 11.277 6.638 1.00 0.00 C ATOM 2110 CG1 VAL A 133 -2.527 11.653 7.117 1.00 0.00 C ATOM 2111 CG2 VAL A 133 -0.304 10.768 7.825 1.00 0.00 C ATOM 0 H VAL A 133 0.836 10.664 5.169 1.00 0.00 H new ATOM 0 HA VAL A 133 -1.581 9.265 6.042 1.00 0.00 H new ATOM 0 HB VAL A 133 -0.647 12.158 6.205 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -2.457 12.437 7.871 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -3.115 12.013 6.273 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -3.011 10.777 7.548 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -0.244 11.546 8.586 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.785 9.885 8.246 1.00 0.00 H new ATOM 0 HG23 VAL A 133 0.701 10.509 7.491 1.00 0.00 H new ATOM 2121 N TYR A 134 -3.401 10.369 4.625 1.00 0.00 N ATOM 2122 CA TYR A 134 -4.379 10.749 3.581 1.00 0.00 C ATOM 2123 C TYR A 134 -5.536 11.498 4.222 1.00 0.00 C ATOM 2124 O TYR A 134 -5.641 11.600 5.430 1.00 0.00 O ATOM 2125 CB TYR A 134 -4.969 9.512 2.926 1.00 0.00 C ATOM 2126 CG TYR A 134 -3.949 8.808 2.073 1.00 0.00 C ATOM 2127 CD1 TYR A 134 -2.907 8.096 2.671 1.00 0.00 C ATOM 2128 CD2 TYR A 134 -4.067 8.840 0.680 1.00 0.00 C ATOM 2129 CE1 TYR A 134 -1.982 7.417 1.879 1.00 0.00 C ATOM 2130 CE2 TYR A 134 -3.139 8.166 -0.115 1.00 0.00 C ATOM 2131 CZ TYR A 134 -2.095 7.451 0.484 1.00 0.00 C ATOM 2132 OH TYR A 134 -1.182 6.776 -0.300 1.00 0.00 O ATOM 0 H TYR A 134 -3.803 9.942 5.459 1.00 0.00 H new ATOM 0 HA TYR A 134 -3.861 11.362 2.843 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -5.337 8.831 3.694 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -5.826 9.795 2.314 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -2.818 8.071 3.747 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -4.877 9.387 0.219 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -1.178 6.864 2.342 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -3.226 8.196 -1.191 1.00 0.00 H new ATOM 0 HH TYR A 134 -1.658 6.223 -0.954 1.00 0.00 H new ATOM 2142 N VAL A 135 -6.429 11.976 3.410 1.00 0.00 N ATOM 2143 CA VAL A 135 -7.625 12.673 3.918 1.00 0.00 C ATOM 2144 C VAL A 135 -8.758 12.356 2.963 1.00 0.00 C ATOM 2145 O VAL A 135 -8.519 11.935 1.852 1.00 0.00 O ATOM 2146 CB VAL A 135 -7.388 14.163 3.959 1.00 0.00 C ATOM 2147 CG1 VAL A 135 -8.618 14.840 4.543 1.00 0.00 C ATOM 2148 CG2 VAL A 135 -6.182 14.442 4.843 1.00 0.00 C ATOM 0 H VAL A 135 -6.375 11.909 2.394 1.00 0.00 H new ATOM 0 HA VAL A 135 -7.861 12.347 4.931 1.00 0.00 H new ATOM 0 HB VAL A 135 -7.203 14.547 2.956 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -8.458 15.918 4.578 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -9.484 14.621 3.919 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -8.794 14.467 5.552 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -6.000 15.516 4.881 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -6.375 14.071 5.849 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -5.306 13.940 4.433 1.00 0.00 H new ATOM 2158 N ARG A 136 -9.977 12.529 3.366 1.00 0.00 N ATOM 2159 CA ARG A 136 -11.078 12.191 2.427 1.00 0.00 C ATOM 2160 C ARG A 136 -11.359 13.376 1.513 1.00 0.00 C ATOM 2161 O ARG A 136 -11.760 14.437 1.949 1.00 0.00 O ATOM 2162 CB ARG A 136 -12.357 11.793 3.166 1.00 0.00 C ATOM 2163 CG ARG A 136 -12.518 10.272 3.124 1.00 0.00 C ATOM 2164 CD ARG A 136 -13.184 9.790 4.414 1.00 0.00 C ATOM 2165 NE ARG A 136 -14.639 10.112 4.368 1.00 0.00 N ATOM 2166 CZ ARG A 136 -15.469 9.498 5.166 1.00 0.00 C ATOM 2167 NH1 ARG A 136 -15.413 8.200 5.294 1.00 0.00 N ATOM 2168 NH2 ARG A 136 -16.356 10.182 5.836 1.00 0.00 N ATOM 0 H ARG A 136 -10.259 12.881 4.281 1.00 0.00 H new ATOM 0 HA ARG A 136 -10.756 11.334 1.835 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -12.314 12.136 4.200 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -13.220 12.274 2.706 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -13.120 9.984 2.262 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -11.544 9.796 3.006 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -13.041 8.716 4.531 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -12.721 10.269 5.277 1.00 0.00 H new ATOM 0 HE ARG A 136 -14.986 10.812 3.713 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -14.720 7.665 4.770 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -16.062 7.721 5.918 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -16.400 11.196 5.736 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -17.005 9.702 6.460 1.00 0.00 H new ATOM 2182 N GLU A 137 -11.143 13.183 0.241 1.00 0.00 N ATOM 2183 CA GLU A 137 -11.382 14.264 -0.772 1.00 0.00 C ATOM 2184 C GLU A 137 -12.731 14.959 -0.527 1.00 0.00 C ATOM 2185 O GLU A 137 -12.844 16.125 -0.870 1.00 0.00 O ATOM 2186 CB GLU A 137 -11.400 13.643 -2.169 1.00 0.00 C ATOM 2187 CG GLU A 137 -11.143 14.731 -3.219 1.00 0.00 C ATOM 2188 CD GLU A 137 -12.467 15.161 -3.857 1.00 0.00 C ATOM 2189 OE1 GLU A 137 -13.467 15.164 -3.157 1.00 0.00 O ATOM 2190 OE2 GLU A 137 -12.459 15.480 -5.034 1.00 0.00 O ATOM 2191 OXT GLU A 137 -13.623 14.312 -0.004 1.00 0.00 O ATOM 0 H GLU A 137 -10.804 12.305 -0.152 1.00 0.00 H new ATOM 0 HA GLU A 137 -10.584 15.001 -0.685 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -10.639 12.866 -2.242 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -12.362 13.166 -2.353 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -10.657 15.589 -2.755 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -10.464 14.356 -3.985 1.00 0.00 H new TER 2198 GLU A 137