USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 675 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 43 LYS NZ :NH3+ -171:sc= 1.68 (180deg=1.01) USER MOD Set 1.2: A 45 THR OG1 : rot 170:sc= -0.883 USER MOD Set 2.1: A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 39 LYS NZ :NH3+ 173:sc= -1.62 (180deg=-1.84) USER MOD Single : A 12 THR OG1 : rot 56:sc= 0.348 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -1.15 K(o=-1.1,f=-0.32) USER MOD Single : A 25 LYS NZ :NH3+ -123:sc= -0.243 (180deg=-2.82!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -63:sc= 0.234 USER MOD Single : A 35 ASN : amide:sc= -0.358 X(o=-0.36,f=-0.028) USER MOD Single : A 41 CYS SG : rot 105:sc= -4.6! USER MOD Single : A 42 MET CE :methyl -167:sc= 0 (180deg=-0.151) USER MOD Single : A 44 LYS NZ :NH3+ -156:sc= 0.28 (180deg=0.00554) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.0111 X(o=-0.011,f=-0.016) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot -175:sc= -1.24 USER MOD Single : A 58 TYR OH : rot 19:sc= 0.515 USER MOD Single : A 59 GLN : amide:sc= -0.779 K(o=-0.78,f=-3.1!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 30:sc= -1.04 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 49 N GLU A 4 146.562 -6.763 10.787 1.00 0.00 N ATOM 50 CA GLU A 4 146.456 -7.667 9.648 1.00 0.00 C ATOM 51 C GLU A 4 145.035 -7.683 9.093 1.00 0.00 C ATOM 52 O GLU A 4 144.143 -8.305 9.668 1.00 0.00 O ATOM 53 CB GLU A 4 146.874 -9.086 10.050 1.00 0.00 C ATOM 54 CG GLU A 4 147.193 -9.986 8.867 1.00 0.00 C ATOM 55 CD GLU A 4 148.093 -11.146 9.243 1.00 0.00 C ATOM 56 OE1 GLU A 4 149.073 -10.922 9.985 1.00 0.00 O ATOM 57 OE2 GLU A 4 147.819 -12.280 8.796 1.00 0.00 O ATOM 0 HA GLU A 4 147.127 -7.305 8.869 1.00 0.00 H new ATOM 0 HB2 GLU A 4 147.749 -9.028 10.698 1.00 0.00 H new ATOM 0 HB3 GLU A 4 146.074 -9.539 10.635 1.00 0.00 H new ATOM 0 HG2 GLU A 4 146.264 -10.373 8.449 1.00 0.00 H new ATOM 0 HG3 GLU A 4 147.673 -9.397 8.086 1.00 0.00 H new ATOM 64 N ILE A 5 144.849 -7.010 7.959 1.00 0.00 N ATOM 65 CA ILE A 5 143.557 -6.942 7.288 1.00 0.00 C ATOM 66 C ILE A 5 142.406 -6.613 8.245 1.00 0.00 C ATOM 67 O ILE A 5 142.566 -6.629 9.464 1.00 0.00 O ATOM 68 CB ILE A 5 143.289 -8.264 6.546 1.00 0.00 C ATOM 69 CG1 ILE A 5 142.227 -8.074 5.463 1.00 0.00 C ATOM 70 CG2 ILE A 5 142.888 -9.375 7.511 1.00 0.00 C ATOM 71 CD1 ILE A 5 142.442 -8.949 4.249 1.00 0.00 C ATOM 0 H ILE A 5 145.591 -6.498 7.482 1.00 0.00 H new ATOM 0 HA ILE A 5 143.603 -6.122 6.572 1.00 0.00 H new ATOM 0 HB ILE A 5 144.219 -8.566 6.064 1.00 0.00 H new ATOM 0 HG12 ILE A 5 141.245 -8.288 5.886 1.00 0.00 H new ATOM 0 HG13 ILE A 5 142.219 -7.029 5.152 1.00 0.00 H new ATOM 0 HG21 ILE A 5 142.706 -10.294 6.953 1.00 0.00 H new ATOM 0 HG22 ILE A 5 143.691 -9.540 8.230 1.00 0.00 H new ATOM 0 HG23 ILE A 5 141.980 -9.087 8.041 1.00 0.00 H new ATOM 0 HD11 ILE A 5 141.652 -8.762 3.521 1.00 0.00 H new ATOM 0 HD12 ILE A 5 143.409 -8.719 3.802 1.00 0.00 H new ATOM 0 HD13 ILE A 5 142.420 -9.997 4.547 1.00 0.00 H new ATOM 83 N ILE A 6 141.244 -6.305 7.675 1.00 0.00 N ATOM 84 CA ILE A 6 140.065 -5.968 8.466 1.00 0.00 C ATOM 85 C ILE A 6 138.791 -6.111 7.637 1.00 0.00 C ATOM 86 O ILE A 6 137.904 -6.893 7.979 1.00 0.00 O ATOM 87 CB ILE A 6 140.140 -4.532 9.035 1.00 0.00 C ATOM 88 CG1 ILE A 6 140.972 -3.621 8.124 1.00 0.00 C ATOM 89 CG2 ILE A 6 140.723 -4.554 10.439 1.00 0.00 C ATOM 90 CD1 ILE A 6 140.392 -2.234 7.966 1.00 0.00 C ATOM 0 H ILE A 6 141.094 -6.282 6.666 1.00 0.00 H new ATOM 0 HA ILE A 6 140.039 -6.670 9.299 1.00 0.00 H new ATOM 0 HB ILE A 6 139.128 -4.129 9.079 1.00 0.00 H new ATOM 0 HG12 ILE A 6 141.981 -3.540 8.528 1.00 0.00 H new ATOM 0 HG13 ILE A 6 141.058 -4.084 7.141 1.00 0.00 H new ATOM 0 HG21 ILE A 6 140.771 -3.537 10.829 1.00 0.00 H new ATOM 0 HG22 ILE A 6 140.090 -5.162 11.086 1.00 0.00 H new ATOM 0 HG23 ILE A 6 141.726 -4.979 10.410 1.00 0.00 H new ATOM 0 HD11 ILE A 6 141.032 -1.645 7.309 1.00 0.00 H new ATOM 0 HD12 ILE A 6 139.394 -2.304 7.533 1.00 0.00 H new ATOM 0 HD13 ILE A 6 140.331 -1.752 8.942 1.00 0.00 H new ATOM 102 N GLU A 7 138.710 -5.357 6.545 1.00 0.00 N ATOM 103 CA GLU A 7 137.545 -5.407 5.667 1.00 0.00 C ATOM 104 C GLU A 7 137.938 -5.889 4.273 1.00 0.00 C ATOM 105 O GLU A 7 139.089 -6.250 4.034 1.00 0.00 O ATOM 106 CB GLU A 7 136.882 -4.032 5.579 1.00 0.00 C ATOM 107 CG GLU A 7 135.779 -3.822 6.602 1.00 0.00 C ATOM 108 CD GLU A 7 134.924 -2.607 6.296 1.00 0.00 C ATOM 109 OE1 GLU A 7 134.006 -2.722 5.457 1.00 0.00 O ATOM 110 OE2 GLU A 7 135.175 -1.540 6.895 1.00 0.00 O ATOM 0 H GLU A 7 139.436 -4.705 6.247 1.00 0.00 H new ATOM 0 HA GLU A 7 136.832 -6.115 6.090 1.00 0.00 H new ATOM 0 HB2 GLU A 7 137.642 -3.262 5.713 1.00 0.00 H new ATOM 0 HB3 GLU A 7 136.468 -3.901 4.579 1.00 0.00 H new ATOM 0 HG2 GLU A 7 135.146 -4.708 6.635 1.00 0.00 H new ATOM 0 HG3 GLU A 7 136.223 -3.710 7.591 1.00 0.00 H new ATOM 117 N ILE A 8 136.971 -5.896 3.361 1.00 0.00 N ATOM 118 CA ILE A 8 137.218 -6.342 1.991 1.00 0.00 C ATOM 119 C ILE A 8 136.713 -5.331 0.961 1.00 0.00 C ATOM 120 O ILE A 8 137.153 -5.336 -0.188 1.00 0.00 O ATOM 121 CB ILE A 8 136.552 -7.706 1.717 1.00 0.00 C ATOM 122 CG1 ILE A 8 136.926 -8.715 2.805 1.00 0.00 C ATOM 123 CG2 ILE A 8 136.959 -8.226 0.346 1.00 0.00 C ATOM 124 CD1 ILE A 8 135.795 -9.649 3.174 1.00 0.00 C ATOM 0 H ILE A 8 136.012 -5.599 3.543 1.00 0.00 H new ATOM 0 HA ILE A 8 138.299 -6.437 1.891 1.00 0.00 H new ATOM 0 HB ILE A 8 135.470 -7.572 1.731 1.00 0.00 H new ATOM 0 HG12 ILE A 8 137.778 -9.304 2.466 1.00 0.00 H new ATOM 0 HG13 ILE A 8 137.246 -8.175 3.696 1.00 0.00 H new ATOM 0 HG21 ILE A 8 136.482 -9.189 0.166 1.00 0.00 H new ATOM 0 HG22 ILE A 8 136.645 -7.517 -0.420 1.00 0.00 H new ATOM 0 HG23 ILE A 8 138.042 -8.345 0.309 1.00 0.00 H new ATOM 0 HD11 ILE A 8 136.130 -10.337 3.950 1.00 0.00 H new ATOM 0 HD12 ILE A 8 134.950 -9.069 3.544 1.00 0.00 H new ATOM 0 HD13 ILE A 8 135.489 -10.216 2.294 1.00 0.00 H new ATOM 136 N GLY A 9 135.782 -4.471 1.369 1.00 0.00 N ATOM 137 CA GLY A 9 135.239 -3.481 0.456 1.00 0.00 C ATOM 138 C GLY A 9 136.141 -2.269 0.302 1.00 0.00 C ATOM 139 O GLY A 9 137.116 -2.311 -0.451 1.00 0.00 O ATOM 0 H GLY A 9 135.396 -4.443 2.313 1.00 0.00 H new ATOM 0 HA2 GLY A 9 135.084 -3.940 -0.521 1.00 0.00 H new ATOM 0 HA3 GLY A 9 134.262 -3.158 0.816 1.00 0.00 H new ATOM 143 N PRO A 10 135.843 -1.165 1.009 1.00 0.00 N ATOM 144 CA PRO A 10 136.650 0.056 0.936 1.00 0.00 C ATOM 145 C PRO A 10 138.098 -0.199 1.331 1.00 0.00 C ATOM 146 O PRO A 10 139.015 0.427 0.804 1.00 0.00 O ATOM 147 CB PRO A 10 135.977 1.004 1.938 1.00 0.00 C ATOM 148 CG PRO A 10 135.133 0.129 2.802 1.00 0.00 C ATOM 149 CD PRO A 10 134.709 -1.018 1.934 1.00 0.00 C ATOM 0 HA PRO A 10 136.690 0.459 -0.076 1.00 0.00 H new ATOM 0 HB2 PRO A 10 136.718 1.543 2.529 1.00 0.00 H new ATOM 0 HB3 PRO A 10 135.372 1.752 1.426 1.00 0.00 H new ATOM 0 HG2 PRO A 10 135.694 -0.223 3.668 1.00 0.00 H new ATOM 0 HG3 PRO A 10 134.268 0.672 3.182 1.00 0.00 H new ATOM 0 HD2 PRO A 10 134.542 -1.925 2.515 1.00 0.00 H new ATOM 0 HD3 PRO A 10 133.781 -0.803 1.405 1.00 0.00 H new ATOM 157 N PHE A 11 138.294 -1.131 2.259 1.00 0.00 N ATOM 158 CA PHE A 11 139.628 -1.486 2.734 1.00 0.00 C ATOM 159 C PHE A 11 140.609 -1.639 1.571 1.00 0.00 C ATOM 160 O PHE A 11 141.807 -1.400 1.723 1.00 0.00 O ATOM 161 CB PHE A 11 139.564 -2.783 3.543 1.00 0.00 C ATOM 162 CG PHE A 11 140.883 -3.196 4.129 1.00 0.00 C ATOM 163 CD1 PHE A 11 141.451 -2.474 5.166 1.00 0.00 C ATOM 164 CD2 PHE A 11 141.552 -4.306 3.643 1.00 0.00 C ATOM 165 CE1 PHE A 11 142.666 -2.851 5.705 1.00 0.00 C ATOM 166 CE2 PHE A 11 142.767 -4.688 4.180 1.00 0.00 C ATOM 167 CZ PHE A 11 143.326 -3.959 5.212 1.00 0.00 C ATOM 0 H PHE A 11 137.540 -1.658 2.700 1.00 0.00 H new ATOM 0 HA PHE A 11 139.988 -0.679 3.372 1.00 0.00 H new ATOM 0 HB2 PHE A 11 138.840 -2.662 4.349 1.00 0.00 H new ATOM 0 HB3 PHE A 11 139.195 -3.583 2.901 1.00 0.00 H new ATOM 0 HD1 PHE A 11 140.939 -1.607 5.557 1.00 0.00 H new ATOM 0 HD2 PHE A 11 141.120 -4.879 2.836 1.00 0.00 H new ATOM 0 HE1 PHE A 11 143.100 -2.279 6.512 1.00 0.00 H new ATOM 0 HE2 PHE A 11 143.279 -5.556 3.793 1.00 0.00 H new ATOM 0 HZ PHE A 11 144.276 -4.255 5.632 1.00 0.00 H new ATOM 177 N THR A 12 140.091 -2.033 0.412 1.00 0.00 N ATOM 178 CA THR A 12 140.919 -2.212 -0.775 1.00 0.00 C ATOM 179 C THR A 12 140.854 -0.977 -1.672 1.00 0.00 C ATOM 180 O THR A 12 141.872 -0.340 -1.950 1.00 0.00 O ATOM 181 CB THR A 12 140.469 -3.451 -1.556 1.00 0.00 C ATOM 182 OG1 THR A 12 139.250 -3.960 -1.040 1.00 0.00 O ATOM 183 CG2 THR A 12 141.482 -4.576 -1.538 1.00 0.00 C ATOM 0 H THR A 12 139.101 -2.234 0.270 1.00 0.00 H new ATOM 0 HA THR A 12 141.951 -2.352 -0.452 1.00 0.00 H new ATOM 0 HB THR A 12 140.349 -3.110 -2.584 1.00 0.00 H new ATOM 0 HG1 THR A 12 138.572 -3.253 -1.046 1.00 0.00 H new ATOM 0 HG21 THR A 12 141.098 -5.421 -2.110 1.00 0.00 H new ATOM 0 HG22 THR A 12 142.416 -4.232 -1.982 1.00 0.00 H new ATOM 0 HG23 THR A 12 141.662 -4.887 -0.509 1.00 0.00 H new ATOM 191 N GLN A 13 139.648 -0.646 -2.122 1.00 0.00 N ATOM 192 CA GLN A 13 139.439 0.508 -2.993 1.00 0.00 C ATOM 193 C GLN A 13 140.146 1.754 -2.457 1.00 0.00 C ATOM 194 O GLN A 13 140.742 2.516 -3.220 1.00 0.00 O ATOM 195 CB GLN A 13 137.943 0.779 -3.150 1.00 0.00 C ATOM 196 CG GLN A 13 137.627 1.950 -4.066 1.00 0.00 C ATOM 197 CD GLN A 13 136.308 2.617 -3.724 1.00 0.00 C ATOM 198 OE1 GLN A 13 136.268 3.797 -3.377 1.00 0.00 O ATOM 199 NE2 GLN A 13 135.221 1.863 -3.825 1.00 0.00 N ATOM 0 H GLN A 13 138.797 -1.162 -1.898 1.00 0.00 H new ATOM 0 HA GLN A 13 139.870 0.275 -3.967 1.00 0.00 H new ATOM 0 HB2 GLN A 13 137.459 -0.117 -3.540 1.00 0.00 H new ATOM 0 HB3 GLN A 13 137.513 0.971 -2.167 1.00 0.00 H new ATOM 0 HG2 GLN A 13 138.429 2.685 -4.001 1.00 0.00 H new ATOM 0 HG3 GLN A 13 137.597 1.602 -5.098 1.00 0.00 H new ATOM 0 HE21 GLN A 13 135.301 0.889 -4.117 1.00 0.00 H new ATOM 0 HE22 GLN A 13 134.305 2.257 -3.611 1.00 0.00 H new ATOM 208 N ASN A 14 140.078 1.956 -1.142 1.00 0.00 N ATOM 209 CA ASN A 14 140.713 3.111 -0.513 1.00 0.00 C ATOM 210 C ASN A 14 142.144 3.273 -0.993 1.00 0.00 C ATOM 211 O ASN A 14 142.492 4.287 -1.600 1.00 0.00 O ATOM 212 CB ASN A 14 140.689 2.973 1.009 1.00 0.00 C ATOM 213 CG ASN A 14 140.499 4.304 1.710 1.00 0.00 C ATOM 214 OD1 ASN A 14 139.387 4.658 2.103 1.00 0.00 O ATOM 215 ND2 ASN A 14 141.585 5.051 1.869 1.00 0.00 N ATOM 0 H ASN A 14 139.591 1.337 -0.494 1.00 0.00 H new ATOM 0 HA ASN A 14 140.149 3.999 -0.798 1.00 0.00 H new ATOM 0 HB2 ASN A 14 139.884 2.296 1.297 1.00 0.00 H new ATOM 0 HB3 ASN A 14 141.622 2.519 1.344 1.00 0.00 H new ATOM 0 HD21 ASN A 14 141.517 5.957 2.332 1.00 0.00 H new ATOM 0 HD22 ASN A 14 142.487 4.719 1.528 1.00 0.00 H new ATOM 222 N LEU A 15 142.972 2.266 -0.736 1.00 0.00 N ATOM 223 CA LEU A 15 144.360 2.310 -1.169 1.00 0.00 C ATOM 224 C LEU A 15 144.425 2.696 -2.639 1.00 0.00 C ATOM 225 O LEU A 15 145.378 3.333 -3.088 1.00 0.00 O ATOM 226 CB LEU A 15 145.042 0.964 -0.935 1.00 0.00 C ATOM 227 CG LEU A 15 145.745 0.826 0.415 1.00 0.00 C ATOM 228 CD1 LEU A 15 146.697 1.989 0.644 1.00 0.00 C ATOM 229 CD2 LEU A 15 144.720 0.745 1.537 1.00 0.00 C ATOM 0 H LEU A 15 142.708 1.418 -0.235 1.00 0.00 H new ATOM 0 HA LEU A 15 144.890 3.060 -0.582 1.00 0.00 H new ATOM 0 HB2 LEU A 15 144.295 0.175 -1.022 1.00 0.00 H new ATOM 0 HB3 LEU A 15 145.773 0.800 -1.727 1.00 0.00 H new ATOM 0 HG LEU A 15 146.328 -0.095 0.410 1.00 0.00 H new ATOM 0 HD11 LEU A 15 147.188 1.873 1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 15 147.449 2.005 -0.145 1.00 0.00 H new ATOM 0 HD13 LEU A 15 146.138 2.925 0.631 1.00 0.00 H new ATOM 0 HD21 LEU A 15 145.234 0.647 2.493 1.00 0.00 H new ATOM 0 HD22 LEU A 15 144.114 1.651 1.542 1.00 0.00 H new ATOM 0 HD23 LEU A 15 144.077 -0.121 1.380 1.00 0.00 H new ATOM 241 N GLY A 16 143.377 2.332 -3.380 1.00 0.00 N ATOM 242 CA GLY A 16 143.312 2.682 -4.784 1.00 0.00 C ATOM 243 C GLY A 16 143.471 4.174 -4.974 1.00 0.00 C ATOM 244 O GLY A 16 144.205 4.623 -5.855 1.00 0.00 O ATOM 0 H GLY A 16 142.578 1.803 -3.031 1.00 0.00 H new ATOM 0 HA2 GLY A 16 144.094 2.156 -5.331 1.00 0.00 H new ATOM 0 HA3 GLY A 16 142.358 2.357 -5.200 1.00 0.00 H new ATOM 248 N LYS A 17 142.803 4.949 -4.117 1.00 0.00 N ATOM 249 CA LYS A 17 142.906 6.400 -4.179 1.00 0.00 C ATOM 250 C LYS A 17 144.344 6.816 -3.894 1.00 0.00 C ATOM 251 O LYS A 17 144.929 7.629 -4.614 1.00 0.00 O ATOM 252 CB LYS A 17 141.957 7.051 -3.172 1.00 0.00 C ATOM 253 CG LYS A 17 141.406 8.390 -3.635 1.00 0.00 C ATOM 254 CD LYS A 17 142.189 9.550 -3.044 1.00 0.00 C ATOM 255 CE LYS A 17 141.940 10.840 -3.811 1.00 0.00 C ATOM 256 NZ LYS A 17 143.064 11.805 -3.654 1.00 0.00 N ATOM 0 H LYS A 17 142.192 4.596 -3.380 1.00 0.00 H new ATOM 0 HA LYS A 17 142.622 6.735 -5.177 1.00 0.00 H new ATOM 0 HB2 LYS A 17 141.126 6.373 -2.977 1.00 0.00 H new ATOM 0 HB3 LYS A 17 142.483 7.191 -2.227 1.00 0.00 H new ATOM 0 HG2 LYS A 17 141.442 8.443 -4.723 1.00 0.00 H new ATOM 0 HG3 LYS A 17 140.358 8.473 -3.346 1.00 0.00 H new ATOM 0 HD2 LYS A 17 141.907 9.686 -2.000 1.00 0.00 H new ATOM 0 HD3 LYS A 17 143.254 9.317 -3.059 1.00 0.00 H new ATOM 0 HE2 LYS A 17 141.801 10.613 -4.868 1.00 0.00 H new ATOM 0 HE3 LYS A 17 141.016 11.299 -3.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 142.856 12.671 -4.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 143.180 12.042 -2.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 143.941 11.377 -4.013 1.00 0.00 H new ATOM 270 N PHE A 18 144.916 6.225 -2.850 1.00 0.00 N ATOM 271 CA PHE A 18 146.295 6.503 -2.473 1.00 0.00 C ATOM 272 C PHE A 18 147.249 5.995 -3.548 1.00 0.00 C ATOM 273 O PHE A 18 148.413 6.394 -3.604 1.00 0.00 O ATOM 274 CB PHE A 18 146.624 5.851 -1.128 1.00 0.00 C ATOM 275 CG PHE A 18 146.758 6.833 0.001 1.00 0.00 C ATOM 276 CD1 PHE A 18 145.639 7.285 0.681 1.00 0.00 C ATOM 277 CD2 PHE A 18 148.004 7.303 0.382 1.00 0.00 C ATOM 278 CE1 PHE A 18 145.760 8.188 1.720 1.00 0.00 C ATOM 279 CE2 PHE A 18 148.132 8.205 1.420 1.00 0.00 C ATOM 280 CZ PHE A 18 147.009 8.649 2.091 1.00 0.00 C ATOM 0 H PHE A 18 144.444 5.549 -2.250 1.00 0.00 H new ATOM 0 HA PHE A 18 146.415 7.582 -2.376 1.00 0.00 H new ATOM 0 HB2 PHE A 18 145.843 5.132 -0.882 1.00 0.00 H new ATOM 0 HB3 PHE A 18 147.554 5.291 -1.223 1.00 0.00 H new ATOM 0 HD1 PHE A 18 144.661 6.928 0.396 1.00 0.00 H new ATOM 0 HD2 PHE A 18 148.886 6.960 -0.139 1.00 0.00 H new ATOM 0 HE1 PHE A 18 144.880 8.533 2.242 1.00 0.00 H new ATOM 0 HE2 PHE A 18 149.110 8.563 1.707 1.00 0.00 H new ATOM 0 HZ PHE A 18 147.107 9.354 2.903 1.00 0.00 H new ATOM 290 N ALA A 19 146.740 5.117 -4.403 1.00 0.00 N ATOM 291 CA ALA A 19 147.531 4.551 -5.487 1.00 0.00 C ATOM 292 C ALA A 19 147.937 5.634 -6.477 1.00 0.00 C ATOM 293 O ALA A 19 149.124 5.885 -6.684 1.00 0.00 O ATOM 294 CB ALA A 19 146.752 3.451 -6.192 1.00 0.00 C ATOM 0 H ALA A 19 145.778 4.780 -4.366 1.00 0.00 H new ATOM 0 HA ALA A 19 148.437 4.118 -5.063 1.00 0.00 H new ATOM 0 HB1 ALA A 19 147.356 3.038 -7.000 1.00 0.00 H new ATOM 0 HB2 ALA A 19 146.510 2.662 -5.479 1.00 0.00 H new ATOM 0 HB3 ALA A 19 145.831 3.864 -6.603 1.00 0.00 H new ATOM 300 N VAL A 20 146.944 6.282 -7.079 1.00 0.00 N ATOM 301 CA VAL A 20 147.208 7.347 -8.040 1.00 0.00 C ATOM 302 C VAL A 20 148.038 8.451 -7.395 1.00 0.00 C ATOM 303 O VAL A 20 148.825 9.121 -8.064 1.00 0.00 O ATOM 304 CB VAL A 20 145.901 7.945 -8.602 1.00 0.00 C ATOM 305 CG1 VAL A 20 145.063 8.566 -7.493 1.00 0.00 C ATOM 306 CG2 VAL A 20 146.208 8.968 -9.686 1.00 0.00 C ATOM 0 H VAL A 20 145.955 6.090 -6.920 1.00 0.00 H new ATOM 0 HA VAL A 20 147.765 6.907 -8.867 1.00 0.00 H new ATOM 0 HB VAL A 20 145.320 7.137 -9.046 1.00 0.00 H new ATOM 0 HG11 VAL A 20 144.148 8.980 -7.917 1.00 0.00 H new ATOM 0 HG12 VAL A 20 144.809 7.802 -6.758 1.00 0.00 H new ATOM 0 HG13 VAL A 20 145.631 9.361 -7.010 1.00 0.00 H new ATOM 0 HG21 VAL A 20 145.276 9.380 -10.072 1.00 0.00 H new ATOM 0 HG22 VAL A 20 146.814 9.771 -9.267 1.00 0.00 H new ATOM 0 HG23 VAL A 20 146.755 8.486 -10.497 1.00 0.00 H new ATOM 316 N ASP A 21 147.869 8.624 -6.087 1.00 0.00 N ATOM 317 CA ASP A 21 148.614 9.635 -5.348 1.00 0.00 C ATOM 318 C ASP A 21 150.006 9.119 -4.986 1.00 0.00 C ATOM 319 O ASP A 21 150.929 9.904 -4.756 1.00 0.00 O ATOM 320 CB ASP A 21 147.857 10.033 -4.079 1.00 0.00 C ATOM 321 CG ASP A 21 148.384 11.316 -3.470 1.00 0.00 C ATOM 322 OD1 ASP A 21 147.896 12.400 -3.854 1.00 0.00 O ATOM 323 OD2 ASP A 21 149.287 11.238 -2.609 1.00 0.00 O ATOM 0 H ASP A 21 147.223 8.077 -5.519 1.00 0.00 H new ATOM 0 HA ASP A 21 148.722 10.513 -5.984 1.00 0.00 H new ATOM 0 HB2 ASP A 21 146.799 10.153 -4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 21 147.932 9.229 -3.347 1.00 0.00 H new ATOM 328 N GLU A 22 150.150 7.798 -4.940 1.00 0.00 N ATOM 329 CA GLU A 22 151.425 7.172 -4.608 1.00 0.00 C ATOM 330 C GLU A 22 152.291 7.016 -5.855 1.00 0.00 C ATOM 331 O GLU A 22 153.516 7.131 -5.790 1.00 0.00 O ATOM 332 CB GLU A 22 151.185 5.806 -3.956 1.00 0.00 C ATOM 333 CG GLU A 22 152.439 4.955 -3.826 1.00 0.00 C ATOM 334 CD GLU A 22 152.155 3.585 -3.243 1.00 0.00 C ATOM 335 OE1 GLU A 22 151.332 2.848 -3.829 1.00 0.00 O ATOM 336 OE2 GLU A 22 152.754 3.247 -2.201 1.00 0.00 O ATOM 0 H GLU A 22 149.396 7.138 -5.129 1.00 0.00 H new ATOM 0 HA GLU A 22 151.952 7.815 -3.903 1.00 0.00 H new ATOM 0 HB2 GLU A 22 150.757 5.958 -2.965 1.00 0.00 H new ATOM 0 HB3 GLU A 22 150.446 5.259 -4.542 1.00 0.00 H new ATOM 0 HG2 GLU A 22 152.899 4.840 -4.807 1.00 0.00 H new ATOM 0 HG3 GLU A 22 153.161 5.472 -3.194 1.00 0.00 H new ATOM 343 N GLU A 23 151.647 6.753 -6.988 1.00 0.00 N ATOM 344 CA GLU A 23 152.357 6.578 -8.253 1.00 0.00 C ATOM 345 C GLU A 23 153.327 7.732 -8.499 1.00 0.00 C ATOM 346 O GLU A 23 154.368 7.558 -9.134 1.00 0.00 O ATOM 347 CB GLU A 23 151.362 6.480 -9.411 1.00 0.00 C ATOM 348 CG GLU A 23 151.829 5.579 -10.543 1.00 0.00 C ATOM 349 CD GLU A 23 152.592 6.336 -11.613 1.00 0.00 C ATOM 350 OE1 GLU A 23 153.774 6.667 -11.377 1.00 0.00 O ATOM 351 OE2 GLU A 23 152.009 6.595 -12.686 1.00 0.00 O ATOM 0 H GLU A 23 150.634 6.656 -7.057 1.00 0.00 H new ATOM 0 HA GLU A 23 152.929 5.652 -8.193 1.00 0.00 H new ATOM 0 HB2 GLU A 23 150.411 6.107 -9.031 1.00 0.00 H new ATOM 0 HB3 GLU A 23 151.178 7.479 -9.806 1.00 0.00 H new ATOM 0 HG2 GLU A 23 152.464 4.791 -10.137 1.00 0.00 H new ATOM 0 HG3 GLU A 23 150.965 5.091 -10.994 1.00 0.00 H new ATOM 358 N ASN A 24 152.974 8.909 -7.996 1.00 0.00 N ATOM 359 CA ASN A 24 153.807 10.092 -8.160 1.00 0.00 C ATOM 360 C ASN A 24 155.063 10.014 -7.293 1.00 0.00 C ATOM 361 O ASN A 24 156.058 10.687 -7.567 1.00 0.00 O ATOM 362 CB ASN A 24 153.011 11.351 -7.808 1.00 0.00 C ATOM 363 CG ASN A 24 152.330 11.963 -9.016 1.00 0.00 C ATOM 364 OD1 ASN A 24 152.607 13.102 -9.388 1.00 0.00 O ATOM 365 ND2 ASN A 24 151.433 11.205 -9.636 1.00 0.00 N ATOM 0 H ASN A 24 152.115 9.069 -7.470 1.00 0.00 H new ATOM 0 HA ASN A 24 154.117 10.139 -9.204 1.00 0.00 H new ATOM 0 HB2 ASN A 24 152.260 11.104 -7.058 1.00 0.00 H new ATOM 0 HB3 ASN A 24 153.679 12.086 -7.360 1.00 0.00 H new ATOM 0 HD21 ASN A 24 150.942 11.562 -10.456 1.00 0.00 H new ATOM 0 HD22 ASN A 24 151.235 10.265 -9.292 1.00 0.00 H new ATOM 372 N LYS A 25 155.014 9.194 -6.245 1.00 0.00 N ATOM 373 CA LYS A 25 156.151 9.043 -5.344 1.00 0.00 C ATOM 374 C LYS A 25 157.254 8.196 -5.988 1.00 0.00 C ATOM 375 O LYS A 25 158.077 8.720 -6.739 1.00 0.00 O ATOM 376 CB LYS A 25 155.695 8.432 -4.016 1.00 0.00 C ATOM 377 CG LYS A 25 154.795 9.353 -3.207 1.00 0.00 C ATOM 378 CD LYS A 25 155.081 9.250 -1.719 1.00 0.00 C ATOM 379 CE LYS A 25 156.456 9.801 -1.376 1.00 0.00 C ATOM 380 NZ LYS A 25 157.474 8.722 -1.242 1.00 0.00 N ATOM 0 H LYS A 25 154.202 8.627 -6.001 1.00 0.00 H new ATOM 0 HA LYS A 25 156.567 10.031 -5.145 1.00 0.00 H new ATOM 0 HB2 LYS A 25 155.165 7.501 -4.216 1.00 0.00 H new ATOM 0 HB3 LYS A 25 156.572 8.178 -3.421 1.00 0.00 H new ATOM 0 HG2 LYS A 25 154.938 10.383 -3.535 1.00 0.00 H new ATOM 0 HG3 LYS A 25 153.752 9.101 -3.396 1.00 0.00 H new ATOM 0 HD2 LYS A 25 154.320 9.797 -1.163 1.00 0.00 H new ATOM 0 HD3 LYS A 25 155.017 8.208 -1.407 1.00 0.00 H new ATOM 0 HE2 LYS A 25 156.770 10.500 -2.151 1.00 0.00 H new ATOM 0 HE3 LYS A 25 156.399 10.363 -0.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 157.910 8.772 -0.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 157.016 7.796 -1.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 158.207 8.844 -1.970 1.00 0.00 H new ATOM 394 N ILE A 26 157.274 6.891 -5.700 1.00 0.00 N ATOM 395 CA ILE A 26 158.284 5.999 -6.267 1.00 0.00 C ATOM 396 C ILE A 26 158.460 6.238 -7.765 1.00 0.00 C ATOM 397 O ILE A 26 159.561 6.109 -8.301 1.00 0.00 O ATOM 398 CB ILE A 26 157.923 4.517 -6.026 1.00 0.00 C ATOM 399 CG1 ILE A 26 159.090 3.603 -6.426 1.00 0.00 C ATOM 400 CG2 ILE A 26 156.653 4.142 -6.781 1.00 0.00 C ATOM 401 CD1 ILE A 26 159.238 3.397 -7.922 1.00 0.00 C ATOM 0 H ILE A 26 156.605 6.433 -5.081 1.00 0.00 H new ATOM 0 HA ILE A 26 159.223 6.223 -5.760 1.00 0.00 H new ATOM 0 HB ILE A 26 157.735 4.379 -4.961 1.00 0.00 H new ATOM 0 HG12 ILE A 26 160.016 4.024 -6.036 1.00 0.00 H new ATOM 0 HG13 ILE A 26 158.956 2.632 -5.949 1.00 0.00 H new ATOM 0 HG21 ILE A 26 156.417 3.094 -6.597 1.00 0.00 H new ATOM 0 HG22 ILE A 26 155.828 4.766 -6.437 1.00 0.00 H new ATOM 0 HG23 ILE A 26 156.805 4.298 -7.849 1.00 0.00 H new ATOM 0 HD11 ILE A 26 160.085 2.739 -8.117 1.00 0.00 H new ATOM 0 HD12 ILE A 26 158.329 2.945 -8.319 1.00 0.00 H new ATOM 0 HD13 ILE A 26 159.406 4.359 -8.407 1.00 0.00 H new ATOM 413 N GLY A 27 157.366 6.589 -8.433 1.00 0.00 N ATOM 414 CA GLY A 27 157.417 6.843 -9.861 1.00 0.00 C ATOM 415 C GLY A 27 157.744 8.288 -10.184 1.00 0.00 C ATOM 416 O GLY A 27 157.596 9.168 -9.337 1.00 0.00 O ATOM 0 H GLY A 27 156.444 6.702 -8.011 1.00 0.00 H new ATOM 0 HA2 GLY A 27 158.166 6.194 -10.315 1.00 0.00 H new ATOM 0 HA3 GLY A 27 156.457 6.583 -10.307 1.00 0.00 H new ATOM 420 N GLN A 28 158.188 8.532 -11.411 1.00 0.00 N ATOM 421 CA GLN A 28 158.535 9.880 -11.845 1.00 0.00 C ATOM 422 C GLN A 28 157.302 10.623 -12.350 1.00 0.00 C ATOM 423 O GLN A 28 156.969 11.700 -11.857 1.00 0.00 O ATOM 424 CB GLN A 28 159.601 9.828 -12.942 1.00 0.00 C ATOM 425 CG GLN A 28 160.690 10.875 -12.782 1.00 0.00 C ATOM 426 CD GLN A 28 161.416 11.163 -14.082 1.00 0.00 C ATOM 427 OE1 GLN A 28 161.522 10.299 -14.951 1.00 0.00 O ATOM 428 NE2 GLN A 28 161.920 12.384 -14.220 1.00 0.00 N ATOM 0 H GLN A 28 158.316 7.814 -12.124 1.00 0.00 H new ATOM 0 HA GLN A 28 158.935 10.420 -10.987 1.00 0.00 H new ATOM 0 HB2 GLN A 28 160.058 8.838 -12.946 1.00 0.00 H new ATOM 0 HB3 GLN A 28 159.120 9.961 -13.911 1.00 0.00 H new ATOM 0 HG2 GLN A 28 160.249 11.798 -12.404 1.00 0.00 H new ATOM 0 HG3 GLN A 28 161.409 10.536 -12.036 1.00 0.00 H new ATOM 0 HE21 GLN A 28 161.808 13.069 -13.473 1.00 0.00 H new ATOM 0 HE22 GLN A 28 162.419 12.636 -15.073 1.00 0.00 H new ATOM 437 N TYR A 29 156.629 10.037 -13.336 1.00 0.00 N ATOM 438 CA TYR A 29 155.431 10.642 -13.909 1.00 0.00 C ATOM 439 C TYR A 29 154.198 9.802 -13.598 1.00 0.00 C ATOM 440 O TYR A 29 154.128 8.626 -13.959 1.00 0.00 O ATOM 441 CB TYR A 29 155.589 10.797 -15.422 1.00 0.00 C ATOM 442 CG TYR A 29 154.995 12.078 -15.965 1.00 0.00 C ATOM 443 CD1 TYR A 29 155.471 13.317 -15.556 1.00 0.00 C ATOM 444 CD2 TYR A 29 153.956 12.045 -16.888 1.00 0.00 C ATOM 445 CE1 TYR A 29 154.929 14.489 -16.049 1.00 0.00 C ATOM 446 CE2 TYR A 29 153.411 13.214 -17.388 1.00 0.00 C ATOM 447 CZ TYR A 29 153.901 14.431 -16.967 1.00 0.00 C ATOM 448 OH TYR A 29 153.358 15.596 -17.461 1.00 0.00 O ATOM 0 H TYR A 29 156.893 9.145 -13.754 1.00 0.00 H new ATOM 0 HA TYR A 29 155.300 11.627 -13.461 1.00 0.00 H new ATOM 0 HB2 TYR A 29 156.649 10.763 -15.674 1.00 0.00 H new ATOM 0 HB3 TYR A 29 155.116 9.949 -15.917 1.00 0.00 H new ATOM 0 HD1 TYR A 29 156.278 13.366 -14.840 1.00 0.00 H new ATOM 0 HD2 TYR A 29 153.569 11.093 -17.220 1.00 0.00 H new ATOM 0 HE1 TYR A 29 155.308 15.444 -15.717 1.00 0.00 H new ATOM 0 HE2 TYR A 29 152.605 13.173 -18.105 1.00 0.00 H new ATOM 0 HH TYR A 29 152.645 15.380 -18.098 1.00 0.00 H new ATOM 458 N GLY A 30 153.227 10.409 -12.925 1.00 0.00 N ATOM 459 CA GLY A 30 152.009 9.701 -12.576 1.00 0.00 C ATOM 460 C GLY A 30 151.116 9.458 -13.776 1.00 0.00 C ATOM 461 O GLY A 30 151.356 9.999 -14.856 1.00 0.00 O ATOM 0 H GLY A 30 153.261 11.380 -12.614 1.00 0.00 H new ATOM 0 HA2 GLY A 30 152.266 8.745 -12.119 1.00 0.00 H new ATOM 0 HA3 GLY A 30 151.460 10.274 -11.829 1.00 0.00 H new ATOM 465 N ARG A 31 150.084 8.643 -13.589 1.00 0.00 N ATOM 466 CA ARG A 31 149.153 8.330 -14.666 1.00 0.00 C ATOM 467 C ARG A 31 147.865 7.721 -14.114 1.00 0.00 C ATOM 468 O ARG A 31 147.670 7.652 -12.901 1.00 0.00 O ATOM 469 CB ARG A 31 149.802 7.368 -15.664 1.00 0.00 C ATOM 470 CG ARG A 31 149.707 7.833 -17.108 1.00 0.00 C ATOM 471 CD ARG A 31 149.500 6.665 -18.060 1.00 0.00 C ATOM 472 NE ARG A 31 150.501 6.642 -19.123 1.00 0.00 N ATOM 473 CZ ARG A 31 150.459 7.427 -20.197 1.00 0.00 C ATOM 474 NH1 ARG A 31 149.472 8.301 -20.352 1.00 0.00 N ATOM 475 NH2 ARG A 31 151.410 7.341 -21.119 1.00 0.00 N ATOM 0 H ARG A 31 149.871 8.187 -12.702 1.00 0.00 H new ATOM 0 HA ARG A 31 148.902 9.259 -15.178 1.00 0.00 H new ATOM 0 HB2 ARG A 31 150.852 7.239 -15.401 1.00 0.00 H new ATOM 0 HB3 ARG A 31 149.328 6.390 -15.574 1.00 0.00 H new ATOM 0 HG2 ARG A 31 148.881 8.537 -17.210 1.00 0.00 H new ATOM 0 HG3 ARG A 31 150.617 8.367 -17.379 1.00 0.00 H new ATOM 0 HD2 ARG A 31 149.543 5.730 -17.501 1.00 0.00 H new ATOM 0 HD3 ARG A 31 148.505 6.728 -18.500 1.00 0.00 H new ATOM 0 HE ARG A 31 151.278 5.986 -19.037 1.00 0.00 H new ATOM 0 HH11 ARG A 31 148.740 8.374 -19.646 1.00 0.00 H new ATOM 0 HH12 ARG A 31 149.446 8.900 -21.177 1.00 0.00 H new ATOM 0 HH21 ARG A 31 152.173 6.673 -21.004 1.00 0.00 H new ATOM 0 HH22 ARG A 31 151.378 7.942 -21.942 1.00 0.00 H new ATOM 489 N LEU A 32 146.991 7.284 -15.015 1.00 0.00 N ATOM 490 CA LEU A 32 145.724 6.681 -14.617 1.00 0.00 C ATOM 491 C LEU A 32 145.917 5.219 -14.223 1.00 0.00 C ATOM 492 O LEU A 32 146.388 4.408 -15.019 1.00 0.00 O ATOM 493 CB LEU A 32 144.703 6.790 -15.754 1.00 0.00 C ATOM 494 CG LEU A 32 143.306 7.241 -15.324 1.00 0.00 C ATOM 495 CD1 LEU A 32 142.468 7.607 -16.539 1.00 0.00 C ATOM 496 CD2 LEU A 32 142.623 6.156 -14.508 1.00 0.00 C ATOM 0 H LEU A 32 147.136 7.336 -16.023 1.00 0.00 H new ATOM 0 HA LEU A 32 145.347 7.223 -13.750 1.00 0.00 H new ATOM 0 HB2 LEU A 32 145.082 7.491 -16.498 1.00 0.00 H new ATOM 0 HB3 LEU A 32 144.621 5.820 -16.243 1.00 0.00 H new ATOM 0 HG LEU A 32 143.407 8.127 -14.697 1.00 0.00 H new ATOM 0 HD11 LEU A 32 141.477 7.926 -16.215 1.00 0.00 H new ATOM 0 HD12 LEU A 32 142.951 8.419 -17.083 1.00 0.00 H new ATOM 0 HD13 LEU A 32 142.375 6.739 -17.191 1.00 0.00 H new ATOM 0 HD21 LEU A 32 141.630 6.495 -14.211 1.00 0.00 H new ATOM 0 HD22 LEU A 32 142.533 5.251 -15.109 1.00 0.00 H new ATOM 0 HD23 LEU A 32 143.215 5.943 -13.618 1.00 0.00 H new ATOM 508 N THR A 33 145.552 4.894 -12.988 1.00 0.00 N ATOM 509 CA THR A 33 145.689 3.533 -12.484 1.00 0.00 C ATOM 510 C THR A 33 144.455 3.120 -11.686 1.00 0.00 C ATOM 511 O THR A 33 144.549 2.338 -10.740 1.00 0.00 O ATOM 512 CB THR A 33 146.935 3.425 -11.605 1.00 0.00 C ATOM 513 OG1 THR A 33 147.014 2.146 -11.002 1.00 0.00 O ATOM 514 CG2 THR A 33 146.977 4.458 -10.500 1.00 0.00 C ATOM 0 H THR A 33 145.159 5.555 -12.317 1.00 0.00 H new ATOM 0 HA THR A 33 145.788 2.861 -13.337 1.00 0.00 H new ATOM 0 HB THR A 33 147.778 3.598 -12.274 1.00 0.00 H new ATOM 0 HG1 THR A 33 146.245 2.016 -10.408 1.00 0.00 H new ATOM 0 HG21 THR A 33 147.886 4.326 -9.913 1.00 0.00 H new ATOM 0 HG22 THR A 33 146.968 5.457 -10.935 1.00 0.00 H new ATOM 0 HG23 THR A 33 146.108 4.335 -9.854 1.00 0.00 H new ATOM 522 N PHE A 34 143.300 3.651 -12.072 1.00 0.00 N ATOM 523 CA PHE A 34 142.050 3.338 -11.388 1.00 0.00 C ATOM 524 C PHE A 34 141.190 2.383 -12.215 1.00 0.00 C ATOM 525 O PHE A 34 140.028 2.668 -12.505 1.00 0.00 O ATOM 526 CB PHE A 34 141.279 4.627 -11.086 1.00 0.00 C ATOM 527 CG PHE A 34 141.200 4.947 -9.621 1.00 0.00 C ATOM 528 CD1 PHE A 34 140.583 4.074 -8.739 1.00 0.00 C ATOM 529 CD2 PHE A 34 141.743 6.121 -9.123 1.00 0.00 C ATOM 530 CE1 PHE A 34 140.508 4.364 -7.391 1.00 0.00 C ATOM 531 CE2 PHE A 34 141.673 6.417 -7.776 1.00 0.00 C ATOM 532 CZ PHE A 34 141.054 5.538 -6.908 1.00 0.00 C ATOM 0 H PHE A 34 143.203 4.299 -12.854 1.00 0.00 H new ATOM 0 HA PHE A 34 142.292 2.840 -10.449 1.00 0.00 H new ATOM 0 HB2 PHE A 34 141.757 5.457 -11.606 1.00 0.00 H new ATOM 0 HB3 PHE A 34 140.269 4.539 -11.486 1.00 0.00 H new ATOM 0 HD1 PHE A 34 140.155 3.155 -9.111 1.00 0.00 H new ATOM 0 HD2 PHE A 34 142.227 6.813 -9.797 1.00 0.00 H new ATOM 0 HE1 PHE A 34 140.024 3.675 -6.715 1.00 0.00 H new ATOM 0 HE2 PHE A 34 142.102 7.335 -7.401 1.00 0.00 H new ATOM 0 HZ PHE A 34 140.997 5.768 -5.854 1.00 0.00 H new ATOM 542 N ASN A 35 141.768 1.246 -12.592 1.00 0.00 N ATOM 543 CA ASN A 35 141.049 0.251 -13.380 1.00 0.00 C ATOM 544 C ASN A 35 140.337 -0.752 -12.477 1.00 0.00 C ATOM 545 O ASN A 35 139.128 -0.954 -12.589 1.00 0.00 O ATOM 546 CB ASN A 35 142.010 -0.482 -14.318 1.00 0.00 C ATOM 547 CG ASN A 35 141.305 -1.078 -15.519 1.00 0.00 C ATOM 548 OD1 ASN A 35 141.426 -2.272 -15.796 1.00 0.00 O ATOM 549 ND2 ASN A 35 140.562 -0.248 -16.241 1.00 0.00 N ATOM 0 H ASN A 35 142.729 0.992 -12.365 1.00 0.00 H new ATOM 0 HA ASN A 35 140.299 0.772 -13.975 1.00 0.00 H new ATOM 0 HB2 ASN A 35 142.779 0.211 -14.659 1.00 0.00 H new ATOM 0 HB3 ASN A 35 142.516 -1.275 -13.767 1.00 0.00 H new ATOM 0 HD21 ASN A 35 140.063 -0.592 -17.061 1.00 0.00 H new ATOM 0 HD22 ASN A 35 140.490 0.734 -15.975 1.00 0.00 H new ATOM 556 N LYS A 36 141.095 -1.378 -11.581 1.00 0.00 N ATOM 557 CA LYS A 36 140.534 -2.359 -10.657 1.00 0.00 C ATOM 558 C LYS A 36 141.442 -2.552 -9.445 1.00 0.00 C ATOM 559 O LYS A 36 142.086 -3.589 -9.296 1.00 0.00 O ATOM 560 CB LYS A 36 140.318 -3.696 -11.373 1.00 0.00 C ATOM 561 CG LYS A 36 139.032 -4.397 -10.972 1.00 0.00 C ATOM 562 CD LYS A 36 139.185 -5.909 -11.013 1.00 0.00 C ATOM 563 CE LYS A 36 137.906 -6.608 -10.587 1.00 0.00 C ATOM 564 NZ LYS A 36 138.175 -7.952 -10.003 1.00 0.00 N ATOM 0 H LYS A 36 142.098 -1.224 -11.475 1.00 0.00 H new ATOM 0 HA LYS A 36 139.573 -1.984 -10.306 1.00 0.00 H new ATOM 0 HB2 LYS A 36 140.309 -3.525 -12.450 1.00 0.00 H new ATOM 0 HB3 LYS A 36 141.162 -4.353 -11.161 1.00 0.00 H new ATOM 0 HG2 LYS A 36 138.745 -4.086 -9.967 1.00 0.00 H new ATOM 0 HG3 LYS A 36 138.227 -4.093 -11.641 1.00 0.00 H new ATOM 0 HD2 LYS A 36 139.453 -6.222 -12.022 1.00 0.00 H new ATOM 0 HD3 LYS A 36 140.002 -6.211 -10.358 1.00 0.00 H new ATOM 0 HE2 LYS A 36 137.382 -5.993 -9.855 1.00 0.00 H new ATOM 0 HE3 LYS A 36 137.245 -6.712 -11.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 137.277 -8.396 -9.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 138.652 -8.548 -10.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 138.785 -7.851 -9.167 1.00 0.00 H new ATOM 578 N VAL A 37 141.490 -1.542 -8.584 1.00 0.00 N ATOM 579 CA VAL A 37 142.321 -1.595 -7.386 1.00 0.00 C ATOM 580 C VAL A 37 141.655 -2.414 -6.284 1.00 0.00 C ATOM 581 O VAL A 37 140.608 -2.025 -5.764 1.00 0.00 O ATOM 582 CB VAL A 37 142.607 -0.180 -6.843 1.00 0.00 C ATOM 583 CG1 VAL A 37 143.700 -0.223 -5.785 1.00 0.00 C ATOM 584 CG2 VAL A 37 142.979 0.768 -7.976 1.00 0.00 C ATOM 0 H VAL A 37 140.963 -0.676 -8.693 1.00 0.00 H new ATOM 0 HA VAL A 37 143.258 -2.071 -7.675 1.00 0.00 H new ATOM 0 HB VAL A 37 141.698 0.198 -6.375 1.00 0.00 H new ATOM 0 HG11 VAL A 37 143.887 0.785 -5.414 1.00 0.00 H new ATOM 0 HG12 VAL A 37 143.383 -0.860 -4.960 1.00 0.00 H new ATOM 0 HG13 VAL A 37 144.614 -0.624 -6.222 1.00 0.00 H new ATOM 0 HG21 VAL A 37 143.176 1.760 -7.570 1.00 0.00 H new ATOM 0 HG22 VAL A 37 143.871 0.398 -8.481 1.00 0.00 H new ATOM 0 HG23 VAL A 37 142.156 0.825 -8.688 1.00 0.00 H new ATOM 594 N ILE A 38 142.264 -3.542 -5.924 1.00 0.00 N ATOM 595 CA ILE A 38 141.711 -4.393 -4.876 1.00 0.00 C ATOM 596 C ILE A 38 142.606 -5.603 -4.588 1.00 0.00 C ATOM 597 O ILE A 38 143.776 -5.461 -4.215 1.00 0.00 O ATOM 598 CB ILE A 38 140.278 -4.865 -5.246 1.00 0.00 C ATOM 599 CG1 ILE A 38 139.593 -5.555 -4.050 1.00 0.00 C ATOM 600 CG2 ILE A 38 140.280 -5.738 -6.501 1.00 0.00 C ATOM 601 CD1 ILE A 38 138.310 -6.275 -4.410 1.00 0.00 C ATOM 0 H ILE A 38 143.131 -3.884 -6.338 1.00 0.00 H new ATOM 0 HA ILE A 38 141.663 -3.791 -3.969 1.00 0.00 H new ATOM 0 HB ILE A 38 139.686 -3.982 -5.485 1.00 0.00 H new ATOM 0 HG12 ILE A 38 140.288 -6.270 -3.609 1.00 0.00 H new ATOM 0 HG13 ILE A 38 139.377 -4.807 -3.287 1.00 0.00 H new ATOM 0 HG21 ILE A 38 139.261 -6.049 -6.729 1.00 0.00 H new ATOM 0 HG22 ILE A 38 140.682 -5.169 -7.339 1.00 0.00 H new ATOM 0 HG23 ILE A 38 140.899 -6.619 -6.330 1.00 0.00 H new ATOM 0 HD11 ILE A 38 137.888 -6.735 -3.516 1.00 0.00 H new ATOM 0 HD12 ILE A 38 137.596 -5.562 -4.823 1.00 0.00 H new ATOM 0 HD13 ILE A 38 138.521 -7.047 -5.150 1.00 0.00 H new ATOM 613 N LYS A 39 142.034 -6.785 -4.761 1.00 0.00 N ATOM 614 CA LYS A 39 142.732 -8.048 -4.534 1.00 0.00 C ATOM 615 C LYS A 39 143.025 -8.277 -3.052 1.00 0.00 C ATOM 616 O LYS A 39 142.950 -7.353 -2.242 1.00 0.00 O ATOM 617 CB LYS A 39 144.033 -8.095 -5.337 1.00 0.00 C ATOM 618 CG LYS A 39 143.958 -8.976 -6.576 1.00 0.00 C ATOM 619 CD LYS A 39 142.687 -8.725 -7.373 1.00 0.00 C ATOM 620 CE LYS A 39 142.987 -8.473 -8.841 1.00 0.00 C ATOM 621 NZ LYS A 39 142.068 -7.460 -9.428 1.00 0.00 N ATOM 0 H LYS A 39 141.067 -6.899 -5.065 1.00 0.00 H new ATOM 0 HA LYS A 39 142.072 -8.847 -4.872 1.00 0.00 H new ATOM 0 HB2 LYS A 39 144.300 -7.082 -5.638 1.00 0.00 H new ATOM 0 HB3 LYS A 39 144.834 -8.457 -4.693 1.00 0.00 H new ATOM 0 HG2 LYS A 39 144.826 -8.789 -7.208 1.00 0.00 H new ATOM 0 HG3 LYS A 39 144.000 -10.024 -6.280 1.00 0.00 H new ATOM 0 HD2 LYS A 39 142.023 -9.584 -7.279 1.00 0.00 H new ATOM 0 HD3 LYS A 39 142.159 -7.867 -6.957 1.00 0.00 H new ATOM 0 HE2 LYS A 39 144.017 -8.134 -8.948 1.00 0.00 H new ATOM 0 HE3 LYS A 39 142.899 -9.407 -9.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 142.378 -7.228 -10.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 141.102 -7.843 -9.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 142.082 -6.599 -8.844 1.00 0.00 H new ATOM 635 N PRO A 40 143.362 -9.529 -2.684 1.00 0.00 N ATOM 636 CA PRO A 40 143.668 -9.899 -1.296 1.00 0.00 C ATOM 637 C PRO A 40 144.762 -9.029 -0.690 1.00 0.00 C ATOM 638 O PRO A 40 145.939 -9.386 -0.710 1.00 0.00 O ATOM 639 CB PRO A 40 144.142 -11.351 -1.407 1.00 0.00 C ATOM 640 CG PRO A 40 143.525 -11.858 -2.661 1.00 0.00 C ATOM 641 CD PRO A 40 143.468 -10.684 -3.596 1.00 0.00 C ATOM 0 HA PRO A 40 142.805 -9.767 -0.643 1.00 0.00 H new ATOM 0 HB2 PRO A 40 145.230 -11.410 -1.450 1.00 0.00 H new ATOM 0 HB3 PRO A 40 143.825 -11.938 -0.545 1.00 0.00 H new ATOM 0 HG2 PRO A 40 144.116 -12.668 -3.087 1.00 0.00 H new ATOM 0 HG3 PRO A 40 142.528 -12.256 -2.473 1.00 0.00 H new ATOM 0 HD2 PRO A 40 144.359 -10.623 -4.220 1.00 0.00 H new ATOM 0 HD3 PRO A 40 142.612 -10.746 -4.268 1.00 0.00 H new ATOM 649 N CYS A 41 144.361 -7.884 -0.154 1.00 0.00 N ATOM 650 CA CYS A 41 145.299 -6.952 0.460 1.00 0.00 C ATOM 651 C CYS A 41 145.573 -7.328 1.915 1.00 0.00 C ATOM 652 O CYS A 41 145.180 -8.399 2.376 1.00 0.00 O ATOM 653 CB CYS A 41 144.744 -5.532 0.378 1.00 0.00 C ATOM 654 SG CYS A 41 143.103 -5.344 1.108 1.00 0.00 S ATOM 0 H CYS A 41 143.389 -7.577 -0.132 1.00 0.00 H new ATOM 0 HA CYS A 41 146.242 -7.003 -0.084 1.00 0.00 H new ATOM 0 HB2 CYS A 41 145.434 -4.853 0.880 1.00 0.00 H new ATOM 0 HB3 CYS A 41 144.702 -5.229 -0.668 1.00 0.00 H new ATOM 0 HG CYS A 41 143.205 -4.740 2.255 1.00 0.00 H new ATOM 660 N MET A 42 146.254 -6.438 2.635 1.00 0.00 N ATOM 661 CA MET A 42 146.584 -6.673 4.034 1.00 0.00 C ATOM 662 C MET A 42 147.224 -5.433 4.653 1.00 0.00 C ATOM 663 O MET A 42 148.244 -4.942 4.168 1.00 0.00 O ATOM 664 CB MET A 42 147.531 -7.869 4.163 1.00 0.00 C ATOM 665 CG MET A 42 147.315 -8.685 5.428 1.00 0.00 C ATOM 666 SD MET A 42 148.253 -10.224 5.429 1.00 0.00 S ATOM 667 CE MET A 42 147.289 -11.212 4.289 1.00 0.00 C ATOM 0 H MET A 42 146.587 -5.546 2.269 1.00 0.00 H new ATOM 0 HA MET A 42 145.660 -6.892 4.570 1.00 0.00 H new ATOM 0 HB2 MET A 42 147.403 -8.518 3.296 1.00 0.00 H new ATOM 0 HB3 MET A 42 148.560 -7.510 4.144 1.00 0.00 H new ATOM 0 HG2 MET A 42 147.602 -8.089 6.294 1.00 0.00 H new ATOM 0 HG3 MET A 42 146.254 -8.911 5.534 1.00 0.00 H new ATOM 0 HE1 MET A 42 147.600 -12.254 4.358 1.00 0.00 H new ATOM 0 HE2 MET A 42 146.232 -11.132 4.542 1.00 0.00 H new ATOM 0 HE3 MET A 42 147.447 -10.852 3.272 1.00 0.00 H new ATOM 677 N LYS A 43 146.616 -4.930 5.722 1.00 0.00 N ATOM 678 CA LYS A 43 147.124 -3.744 6.403 1.00 0.00 C ATOM 679 C LYS A 43 147.883 -4.121 7.672 1.00 0.00 C ATOM 680 O LYS A 43 147.501 -5.050 8.385 1.00 0.00 O ATOM 681 CB LYS A 43 145.971 -2.799 6.748 1.00 0.00 C ATOM 682 CG LYS A 43 146.417 -1.521 7.442 1.00 0.00 C ATOM 683 CD LYS A 43 145.730 -1.347 8.788 1.00 0.00 C ATOM 684 CE LYS A 43 145.953 0.048 9.350 1.00 0.00 C ATOM 685 NZ LYS A 43 147.091 0.085 10.310 1.00 0.00 N ATOM 0 H LYS A 43 145.771 -5.325 6.136 1.00 0.00 H new ATOM 0 HA LYS A 43 147.815 -3.238 5.728 1.00 0.00 H new ATOM 0 HB2 LYS A 43 145.439 -2.539 5.833 1.00 0.00 H new ATOM 0 HB3 LYS A 43 145.263 -3.323 7.390 1.00 0.00 H new ATOM 0 HG2 LYS A 43 147.498 -1.541 7.584 1.00 0.00 H new ATOM 0 HG3 LYS A 43 146.195 -0.664 6.806 1.00 0.00 H new ATOM 0 HD2 LYS A 43 144.661 -1.530 8.679 1.00 0.00 H new ATOM 0 HD3 LYS A 43 146.110 -2.089 9.491 1.00 0.00 H new ATOM 0 HE2 LYS A 43 146.145 0.742 8.532 1.00 0.00 H new ATOM 0 HE3 LYS A 43 145.046 0.387 9.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 147.115 1.010 10.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 146.970 -0.665 11.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 147.983 -0.065 9.797 1.00 0.00 H new ATOM 699 N LYS A 44 148.956 -3.390 7.951 1.00 0.00 N ATOM 700 CA LYS A 44 149.768 -3.641 9.135 1.00 0.00 C ATOM 701 C LYS A 44 149.797 -2.412 10.035 1.00 0.00 C ATOM 702 O LYS A 44 149.198 -1.384 9.719 1.00 0.00 O ATOM 703 CB LYS A 44 151.192 -4.030 8.732 1.00 0.00 C ATOM 704 CG LYS A 44 151.444 -5.529 8.759 1.00 0.00 C ATOM 705 CD LYS A 44 151.756 -6.070 7.371 1.00 0.00 C ATOM 706 CE LYS A 44 151.244 -7.491 7.200 1.00 0.00 C ATOM 707 NZ LYS A 44 150.773 -7.748 5.811 1.00 0.00 N ATOM 0 H LYS A 44 149.284 -2.617 7.372 1.00 0.00 H new ATOM 0 HA LYS A 44 149.321 -4.467 9.688 1.00 0.00 H new ATOM 0 HB2 LYS A 44 151.392 -3.654 7.729 1.00 0.00 H new ATOM 0 HB3 LYS A 44 151.897 -3.539 9.403 1.00 0.00 H new ATOM 0 HG2 LYS A 44 152.275 -5.747 9.430 1.00 0.00 H new ATOM 0 HG3 LYS A 44 150.568 -6.039 9.160 1.00 0.00 H new ATOM 0 HD2 LYS A 44 151.303 -5.426 6.618 1.00 0.00 H new ATOM 0 HD3 LYS A 44 152.833 -6.047 7.204 1.00 0.00 H new ATOM 0 HE2 LYS A 44 152.037 -8.195 7.451 1.00 0.00 H new ATOM 0 HE3 LYS A 44 150.427 -7.669 7.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 150.085 -8.528 5.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 150.321 -6.891 5.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 151.583 -8.005 5.212 1.00 0.00 H new ATOM 721 N THR A 45 150.503 -2.521 11.154 1.00 0.00 N ATOM 722 CA THR A 45 150.616 -1.422 12.094 1.00 0.00 C ATOM 723 C THR A 45 151.755 -1.664 13.076 1.00 0.00 C ATOM 724 O THR A 45 152.081 -2.807 13.395 1.00 0.00 O ATOM 725 CB THR A 45 149.302 -1.220 12.854 1.00 0.00 C ATOM 726 OG1 THR A 45 148.196 -1.627 12.066 1.00 0.00 O ATOM 727 CG2 THR A 45 149.067 0.216 13.267 1.00 0.00 C ATOM 0 H THR A 45 151.006 -3.364 11.430 1.00 0.00 H new ATOM 0 HA THR A 45 150.833 -0.518 11.526 1.00 0.00 H new ATOM 0 HB THR A 45 149.391 -1.831 13.752 1.00 0.00 H new ATOM 0 HG1 THR A 45 147.388 -1.643 12.620 1.00 0.00 H new ATOM 0 HG21 THR A 45 148.120 0.291 13.801 1.00 0.00 H new ATOM 0 HG22 THR A 45 149.877 0.545 13.918 1.00 0.00 H new ATOM 0 HG23 THR A 45 149.035 0.849 12.380 1.00 0.00 H new ATOM 735 N ILE A 46 152.358 -0.579 13.551 1.00 0.00 N ATOM 736 CA ILE A 46 153.460 -0.678 14.498 1.00 0.00 C ATOM 737 C ILE A 46 153.268 0.279 15.664 1.00 0.00 C ATOM 738 O ILE A 46 153.808 1.384 15.675 1.00 0.00 O ATOM 739 CB ILE A 46 154.820 -0.380 13.833 1.00 0.00 C ATOM 740 CG1 ILE A 46 154.897 -1.023 12.448 1.00 0.00 C ATOM 741 CG2 ILE A 46 155.953 -0.879 14.715 1.00 0.00 C ATOM 742 CD1 ILE A 46 154.150 -0.253 11.382 1.00 0.00 C ATOM 0 H ILE A 46 152.103 0.375 13.296 1.00 0.00 H new ATOM 0 HA ILE A 46 153.462 -1.706 14.861 1.00 0.00 H new ATOM 0 HB ILE A 46 154.918 0.699 13.712 1.00 0.00 H new ATOM 0 HG12 ILE A 46 155.943 -1.111 12.155 1.00 0.00 H new ATOM 0 HG13 ILE A 46 154.495 -2.035 12.503 1.00 0.00 H new ATOM 0 HG21 ILE A 46 156.908 -0.664 14.237 1.00 0.00 H new ATOM 0 HG22 ILE A 46 155.910 -0.377 15.681 1.00 0.00 H new ATOM 0 HG23 ILE A 46 155.854 -1.955 14.860 1.00 0.00 H new ATOM 0 HD11 ILE A 46 154.248 -0.767 10.426 1.00 0.00 H new ATOM 0 HD12 ILE A 46 153.096 -0.187 11.652 1.00 0.00 H new ATOM 0 HD13 ILE A 46 154.567 0.751 11.299 1.00 0.00 H new ATOM 754 N TYR A 47 152.499 -0.150 16.652 1.00 0.00 N ATOM 755 CA TYR A 47 152.253 0.677 17.820 1.00 0.00 C ATOM 756 C TYR A 47 152.972 0.104 19.034 1.00 0.00 C ATOM 757 O TYR A 47 152.617 -0.967 19.526 1.00 0.00 O ATOM 758 CB TYR A 47 150.750 0.786 18.096 1.00 0.00 C ATOM 759 CG TYR A 47 150.103 -0.530 18.468 1.00 0.00 C ATOM 760 CD1 TYR A 47 149.732 -1.445 17.490 1.00 0.00 C ATOM 761 CD2 TYR A 47 149.861 -0.856 19.796 1.00 0.00 C ATOM 762 CE1 TYR A 47 149.138 -2.646 17.825 1.00 0.00 C ATOM 763 CE2 TYR A 47 149.269 -2.055 20.141 1.00 0.00 C ATOM 764 CZ TYR A 47 148.908 -2.947 19.152 1.00 0.00 C ATOM 765 OH TYR A 47 148.317 -4.142 19.489 1.00 0.00 O ATOM 0 H TYR A 47 152.038 -1.060 16.668 1.00 0.00 H new ATOM 0 HA TYR A 47 152.641 1.676 17.622 1.00 0.00 H new ATOM 0 HB2 TYR A 47 150.589 1.501 18.903 1.00 0.00 H new ATOM 0 HB3 TYR A 47 150.255 1.187 17.211 1.00 0.00 H new ATOM 0 HD1 TYR A 47 149.911 -1.213 16.451 1.00 0.00 H new ATOM 0 HD2 TYR A 47 150.141 -0.160 20.573 1.00 0.00 H new ATOM 0 HE1 TYR A 47 148.855 -3.346 17.053 1.00 0.00 H new ATOM 0 HE2 TYR A 47 149.090 -2.293 21.179 1.00 0.00 H new ATOM 0 HH TYR A 47 148.227 -4.199 20.463 1.00 0.00 H new ATOM 775 N GLU A 48 153.992 0.816 19.510 1.00 0.00 N ATOM 776 CA GLU A 48 154.765 0.361 20.663 1.00 0.00 C ATOM 777 C GLU A 48 153.860 -0.114 21.788 1.00 0.00 C ATOM 778 O GLU A 48 153.730 -1.311 22.043 1.00 0.00 O ATOM 779 CB GLU A 48 155.684 1.477 21.163 1.00 0.00 C ATOM 780 CG GLU A 48 156.556 1.065 22.339 1.00 0.00 C ATOM 781 CD GLU A 48 157.820 0.349 21.906 1.00 0.00 C ATOM 782 OE1 GLU A 48 157.739 -0.497 20.991 1.00 0.00 O ATOM 783 OE2 GLU A 48 158.890 0.636 22.482 1.00 0.00 O ATOM 0 H GLU A 48 154.301 1.705 19.117 1.00 0.00 H new ATOM 0 HA GLU A 48 155.373 -0.484 20.341 1.00 0.00 H new ATOM 0 HB2 GLU A 48 156.324 1.804 20.344 1.00 0.00 H new ATOM 0 HB3 GLU A 48 155.076 2.334 21.454 1.00 0.00 H new ATOM 0 HG2 GLU A 48 156.824 1.950 22.915 1.00 0.00 H new ATOM 0 HG3 GLU A 48 155.983 0.415 23.001 1.00 0.00 H new ATOM 790 N ASN A 49 153.241 0.839 22.450 1.00 0.00 N ATOM 791 CA ASN A 49 152.336 0.551 23.557 1.00 0.00 C ATOM 792 C ASN A 49 151.628 1.822 24.007 1.00 0.00 C ATOM 793 O ASN A 49 150.401 1.904 23.992 1.00 0.00 O ATOM 794 CB ASN A 49 153.104 -0.066 24.728 1.00 0.00 C ATOM 795 CG ASN A 49 152.376 -1.247 25.338 1.00 0.00 C ATOM 796 OD1 ASN A 49 152.081 -1.259 26.532 1.00 0.00 O ATOM 797 ND2 ASN A 49 152.083 -2.250 24.518 1.00 0.00 N ATOM 0 H ASN A 49 153.345 1.832 22.243 1.00 0.00 H new ATOM 0 HA ASN A 49 151.588 -0.164 23.214 1.00 0.00 H new ATOM 0 HB2 ASN A 49 154.088 -0.387 24.385 1.00 0.00 H new ATOM 0 HB3 ASN A 49 153.265 0.693 25.494 1.00 0.00 H new ATOM 0 HD21 ASN A 49 151.594 -3.072 24.872 1.00 0.00 H new ATOM 0 HD22 ASN A 49 152.347 -2.198 23.534 1.00 0.00 H new ATOM 804 N GLU A 50 152.418 2.818 24.391 1.00 0.00 N ATOM 805 CA GLU A 50 151.876 4.096 24.831 1.00 0.00 C ATOM 806 C GLU A 50 151.934 5.107 23.692 1.00 0.00 C ATOM 807 O GLU A 50 152.195 6.291 23.909 1.00 0.00 O ATOM 808 CB GLU A 50 152.658 4.619 26.036 1.00 0.00 C ATOM 809 CG GLU A 50 151.808 5.410 27.018 1.00 0.00 C ATOM 810 CD GLU A 50 151.494 4.632 28.279 1.00 0.00 C ATOM 811 OE1 GLU A 50 152.317 3.775 28.668 1.00 0.00 O ATOM 812 OE2 GLU A 50 150.427 4.877 28.879 1.00 0.00 O ATOM 0 H GLU A 50 153.436 2.764 24.406 1.00 0.00 H new ATOM 0 HA GLU A 50 150.837 3.952 25.126 1.00 0.00 H new ATOM 0 HB2 GLU A 50 153.111 3.776 26.558 1.00 0.00 H new ATOM 0 HB3 GLU A 50 153.473 5.251 25.683 1.00 0.00 H new ATOM 0 HG2 GLU A 50 152.329 6.330 27.284 1.00 0.00 H new ATOM 0 HG3 GLU A 50 150.876 5.700 26.533 1.00 0.00 H new ATOM 819 N ARG A 51 151.695 4.627 22.475 1.00 0.00 N ATOM 820 CA ARG A 51 151.724 5.478 21.292 1.00 0.00 C ATOM 821 C ARG A 51 153.119 6.056 21.081 1.00 0.00 C ATOM 822 O ARG A 51 153.288 7.269 20.961 1.00 0.00 O ATOM 823 CB ARG A 51 150.699 6.610 21.421 1.00 0.00 C ATOM 824 CG ARG A 51 149.257 6.139 21.337 1.00 0.00 C ATOM 825 CD ARG A 51 148.396 6.781 22.415 1.00 0.00 C ATOM 826 NE ARG A 51 147.937 8.115 22.028 1.00 0.00 N ATOM 827 CZ ARG A 51 147.025 8.340 21.085 1.00 0.00 C ATOM 828 NH1 ARG A 51 146.474 7.328 20.427 1.00 0.00 N ATOM 829 NH2 ARG A 51 146.662 9.584 20.800 1.00 0.00 N ATOM 0 H ARG A 51 151.478 3.649 22.283 1.00 0.00 H new ATOM 0 HA ARG A 51 151.465 4.868 20.427 1.00 0.00 H new ATOM 0 HB2 ARG A 51 150.851 7.119 22.373 1.00 0.00 H new ATOM 0 HB3 ARG A 51 150.879 7.343 20.635 1.00 0.00 H new ATOM 0 HG2 ARG A 51 148.851 6.380 20.354 1.00 0.00 H new ATOM 0 HG3 ARG A 51 149.221 5.054 21.439 1.00 0.00 H new ATOM 0 HD2 ARG A 51 147.534 6.145 22.617 1.00 0.00 H new ATOM 0 HD3 ARG A 51 148.966 6.848 23.342 1.00 0.00 H new ATOM 0 HE ARG A 51 148.339 8.920 22.509 1.00 0.00 H new ATOM 0 HH11 ARG A 51 146.749 6.370 20.643 1.00 0.00 H new ATOM 0 HH12 ARG A 51 145.776 7.508 19.706 1.00 0.00 H new ATOM 0 HH21 ARG A 51 147.082 10.366 21.303 1.00 0.00 H new ATOM 0 HH22 ARG A 51 145.963 9.759 20.078 1.00 0.00 H new ATOM 843 N GLU A 52 154.122 5.181 21.038 1.00 0.00 N ATOM 844 CA GLU A 52 155.498 5.621 20.845 1.00 0.00 C ATOM 845 C GLU A 52 155.831 5.758 19.369 1.00 0.00 C ATOM 846 O GLU A 52 156.632 6.607 18.977 1.00 0.00 O ATOM 847 CB GLU A 52 156.479 4.661 21.520 1.00 0.00 C ATOM 848 CG GLU A 52 156.144 4.370 22.973 1.00 0.00 C ATOM 849 CD GLU A 52 157.381 4.186 23.830 1.00 0.00 C ATOM 850 OE1 GLU A 52 158.378 3.631 23.323 1.00 0.00 O ATOM 851 OE2 GLU A 52 157.353 4.597 25.009 1.00 0.00 O ATOM 0 H GLU A 52 154.007 4.172 21.134 1.00 0.00 H new ATOM 0 HA GLU A 52 155.596 6.602 21.310 1.00 0.00 H new ATOM 0 HB2 GLU A 52 156.496 3.723 20.965 1.00 0.00 H new ATOM 0 HB3 GLU A 52 157.483 5.082 21.465 1.00 0.00 H new ATOM 0 HG2 GLU A 52 155.546 5.188 23.375 1.00 0.00 H new ATOM 0 HG3 GLU A 52 155.531 3.470 23.028 1.00 0.00 H new ATOM 858 N ILE A 53 155.203 4.929 18.553 1.00 0.00 N ATOM 859 CA ILE A 53 155.429 4.975 17.113 1.00 0.00 C ATOM 860 C ILE A 53 154.131 4.833 16.329 1.00 0.00 C ATOM 861 O ILE A 53 153.849 5.621 15.427 1.00 0.00 O ATOM 862 CB ILE A 53 156.461 3.920 16.649 1.00 0.00 C ATOM 863 CG1 ILE A 53 156.071 2.513 17.095 1.00 0.00 C ATOM 864 CG2 ILE A 53 157.841 4.262 17.180 1.00 0.00 C ATOM 865 CD1 ILE A 53 156.822 1.436 16.352 1.00 0.00 C ATOM 0 H ILE A 53 154.536 4.219 18.857 1.00 0.00 H new ATOM 0 HA ILE A 53 155.844 5.960 16.902 1.00 0.00 H new ATOM 0 HB ILE A 53 156.476 3.937 15.559 1.00 0.00 H new ATOM 0 HG12 ILE A 53 156.259 2.410 18.164 1.00 0.00 H new ATOM 0 HG13 ILE A 53 155.000 2.373 16.945 1.00 0.00 H new ATOM 0 HG21 ILE A 53 158.556 3.511 16.845 1.00 0.00 H new ATOM 0 HG22 ILE A 53 158.142 5.241 16.807 1.00 0.00 H new ATOM 0 HG23 ILE A 53 157.817 4.280 18.270 1.00 0.00 H new ATOM 0 HD11 ILE A 53 156.504 0.457 16.711 1.00 0.00 H new ATOM 0 HD12 ILE A 53 156.614 1.517 15.285 1.00 0.00 H new ATOM 0 HD13 ILE A 53 157.892 1.555 16.523 1.00 0.00 H new ATOM 877 N LYS A 54 153.344 3.840 16.695 1.00 0.00 N ATOM 878 CA LYS A 54 152.052 3.582 16.052 1.00 0.00 C ATOM 879 C LYS A 54 152.120 3.759 14.537 1.00 0.00 C ATOM 880 O LYS A 54 151.373 4.548 13.957 1.00 0.00 O ATOM 881 CB LYS A 54 150.985 4.507 16.629 1.00 0.00 C ATOM 882 CG LYS A 54 149.573 3.954 16.521 1.00 0.00 C ATOM 883 CD LYS A 54 148.713 4.384 17.700 1.00 0.00 C ATOM 884 CE LYS A 54 147.981 3.202 18.318 1.00 0.00 C ATOM 885 NZ LYS A 54 146.674 3.606 18.906 1.00 0.00 N ATOM 0 H LYS A 54 153.573 3.186 17.443 1.00 0.00 H new ATOM 0 HA LYS A 54 151.790 2.543 16.255 1.00 0.00 H new ATOM 0 HB2 LYS A 54 151.211 4.698 17.678 1.00 0.00 H new ATOM 0 HB3 LYS A 54 151.031 5.466 16.113 1.00 0.00 H new ATOM 0 HG2 LYS A 54 149.117 4.297 15.592 1.00 0.00 H new ATOM 0 HG3 LYS A 54 149.610 2.866 16.474 1.00 0.00 H new ATOM 0 HD2 LYS A 54 149.340 4.860 18.454 1.00 0.00 H new ATOM 0 HD3 LYS A 54 147.989 5.130 17.371 1.00 0.00 H new ATOM 0 HE2 LYS A 54 147.817 2.438 17.558 1.00 0.00 H new ATOM 0 HE3 LYS A 54 148.604 2.753 19.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 146.206 2.773 19.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 146.832 4.316 19.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 146.070 4.011 18.163 1.00 0.00 H new ATOM 899 N GLY A 55 153.008 3.010 13.902 1.00 0.00 N ATOM 900 CA GLY A 55 153.141 3.089 12.457 1.00 0.00 C ATOM 901 C GLY A 55 152.072 2.283 11.755 1.00 0.00 C ATOM 902 O GLY A 55 151.403 1.461 12.379 1.00 0.00 O ATOM 0 H GLY A 55 153.639 2.350 14.357 1.00 0.00 H new ATOM 0 HA2 GLY A 55 153.078 4.130 12.142 1.00 0.00 H new ATOM 0 HA3 GLY A 55 154.125 2.725 12.161 1.00 0.00 H new ATOM 906 N TYR A 56 151.899 2.509 10.460 1.00 0.00 N ATOM 907 CA TYR A 56 150.895 1.774 9.707 1.00 0.00 C ATOM 908 C TYR A 56 151.397 1.437 8.308 1.00 0.00 C ATOM 909 O TYR A 56 151.639 2.327 7.493 1.00 0.00 O ATOM 910 CB TYR A 56 149.585 2.566 9.618 1.00 0.00 C ATOM 911 CG TYR A 56 149.755 4.065 9.731 1.00 0.00 C ATOM 912 CD1 TYR A 56 149.868 4.678 10.973 1.00 0.00 C ATOM 913 CD2 TYR A 56 149.795 4.868 8.599 1.00 0.00 C ATOM 914 CE1 TYR A 56 150.017 6.047 11.084 1.00 0.00 C ATOM 915 CE2 TYR A 56 149.945 6.239 8.700 1.00 0.00 C ATOM 916 CZ TYR A 56 150.055 6.823 9.944 1.00 0.00 C ATOM 917 OH TYR A 56 150.202 8.186 10.051 1.00 0.00 O ATOM 0 H TYR A 56 152.433 3.186 9.916 1.00 0.00 H new ATOM 0 HA TYR A 56 150.703 0.843 10.240 1.00 0.00 H new ATOM 0 HB2 TYR A 56 149.100 2.338 8.669 1.00 0.00 H new ATOM 0 HB3 TYR A 56 148.915 2.227 10.408 1.00 0.00 H new ATOM 0 HD1 TYR A 56 149.839 4.073 11.867 1.00 0.00 H new ATOM 0 HD2 TYR A 56 149.707 4.414 7.623 1.00 0.00 H new ATOM 0 HE1 TYR A 56 150.103 6.507 12.057 1.00 0.00 H new ATOM 0 HE2 TYR A 56 149.976 6.849 7.809 1.00 0.00 H new ATOM 0 HH TYR A 56 150.131 8.593 9.163 1.00 0.00 H new ATOM 927 N GLU A 57 151.543 0.145 8.037 1.00 0.00 N ATOM 928 CA GLU A 57 152.009 -0.308 6.734 1.00 0.00 C ATOM 929 C GLU A 57 150.849 -0.900 5.939 1.00 0.00 C ATOM 930 O GLU A 57 150.324 -1.959 6.286 1.00 0.00 O ATOM 931 CB GLU A 57 153.126 -1.343 6.887 1.00 0.00 C ATOM 932 CG GLU A 57 154.100 -1.029 8.010 1.00 0.00 C ATOM 933 CD GLU A 57 155.336 -1.907 7.972 1.00 0.00 C ATOM 934 OE1 GLU A 57 156.124 -1.781 7.013 1.00 0.00 O ATOM 935 OE2 GLU A 57 155.515 -2.720 8.904 1.00 0.00 O ATOM 0 H GLU A 57 151.346 -0.604 8.700 1.00 0.00 H new ATOM 0 HA GLU A 57 152.408 0.550 6.194 1.00 0.00 H new ATOM 0 HB2 GLU A 57 152.681 -2.321 7.067 1.00 0.00 H new ATOM 0 HB3 GLU A 57 153.677 -1.412 5.949 1.00 0.00 H new ATOM 0 HG2 GLU A 57 154.400 0.017 7.944 1.00 0.00 H new ATOM 0 HG3 GLU A 57 153.597 -1.157 8.969 1.00 0.00 H new ATOM 942 N TYR A 58 150.447 -0.205 4.885 1.00 0.00 N ATOM 943 CA TYR A 58 149.339 -0.651 4.051 1.00 0.00 C ATOM 944 C TYR A 58 149.837 -1.326 2.775 1.00 0.00 C ATOM 945 O TYR A 58 150.577 -0.730 1.994 1.00 0.00 O ATOM 946 CB TYR A 58 148.443 0.538 3.698 1.00 0.00 C ATOM 947 CG TYR A 58 146.980 0.322 4.012 1.00 0.00 C ATOM 948 CD1 TYR A 58 146.330 -0.845 3.633 1.00 0.00 C ATOM 949 CD2 TYR A 58 146.247 1.294 4.681 1.00 0.00 C ATOM 950 CE1 TYR A 58 144.990 -1.039 3.911 1.00 0.00 C ATOM 951 CE2 TYR A 58 144.908 1.107 4.966 1.00 0.00 C ATOM 952 CZ TYR A 58 144.284 -0.059 4.579 1.00 0.00 C ATOM 953 OH TYR A 58 142.949 -0.246 4.858 1.00 0.00 O ATOM 0 H TYR A 58 150.872 0.672 4.586 1.00 0.00 H new ATOM 0 HA TYR A 58 148.765 -1.385 4.616 1.00 0.00 H new ATOM 0 HB2 TYR A 58 148.794 1.417 4.239 1.00 0.00 H new ATOM 0 HB3 TYR A 58 148.547 0.755 2.635 1.00 0.00 H new ATOM 0 HD1 TYR A 58 146.881 -1.614 3.112 1.00 0.00 H new ATOM 0 HD2 TYR A 58 146.732 2.211 4.983 1.00 0.00 H new ATOM 0 HE1 TYR A 58 144.499 -1.952 3.607 1.00 0.00 H new ATOM 0 HE2 TYR A 58 144.353 1.871 5.490 1.00 0.00 H new ATOM 0 HH TYR A 58 142.733 -1.200 4.800 1.00 0.00 H new ATOM 963 N GLN A 59 149.412 -2.567 2.568 1.00 0.00 N ATOM 964 CA GLN A 59 149.797 -3.325 1.382 1.00 0.00 C ATOM 965 C GLN A 59 148.556 -3.740 0.600 1.00 0.00 C ATOM 966 O GLN A 59 147.733 -4.511 1.092 1.00 0.00 O ATOM 967 CB GLN A 59 150.607 -4.562 1.778 1.00 0.00 C ATOM 968 CG GLN A 59 151.359 -5.191 0.616 1.00 0.00 C ATOM 969 CD GLN A 59 150.750 -6.507 0.170 1.00 0.00 C ATOM 970 OE1 GLN A 59 149.800 -7.003 0.773 1.00 0.00 O ATOM 971 NE2 GLN A 59 151.299 -7.079 -0.896 1.00 0.00 N ATOM 0 H GLN A 59 148.799 -3.072 3.208 1.00 0.00 H new ATOM 0 HA GLN A 59 150.418 -2.690 0.750 1.00 0.00 H new ATOM 0 HB2 GLN A 59 151.320 -4.286 2.555 1.00 0.00 H new ATOM 0 HB3 GLN A 59 149.935 -5.304 2.210 1.00 0.00 H new ATOM 0 HG2 GLN A 59 151.369 -4.496 -0.224 1.00 0.00 H new ATOM 0 HG3 GLN A 59 152.397 -5.355 0.906 1.00 0.00 H new ATOM 0 HE21 GLN A 59 152.086 -6.632 -1.366 1.00 0.00 H new ATOM 0 HE22 GLN A 59 150.933 -7.965 -1.245 1.00 0.00 H new ATOM 980 N LEU A 60 148.418 -3.215 -0.614 1.00 0.00 N ATOM 981 CA LEU A 60 147.268 -3.523 -1.443 1.00 0.00 C ATOM 982 C LEU A 60 147.678 -4.042 -2.819 1.00 0.00 C ATOM 983 O LEU A 60 148.730 -3.680 -3.343 1.00 0.00 O ATOM 984 CB LEU A 60 146.379 -2.289 -1.599 1.00 0.00 C ATOM 985 CG LEU A 60 144.878 -2.556 -1.480 1.00 0.00 C ATOM 986 CD1 LEU A 60 144.354 -2.100 -0.123 1.00 0.00 C ATOM 987 CD2 LEU A 60 144.119 -1.873 -2.610 1.00 0.00 C ATOM 0 H LEU A 60 149.089 -2.576 -1.041 1.00 0.00 H new ATOM 0 HA LEU A 60 146.710 -4.313 -0.941 1.00 0.00 H new ATOM 0 HB2 LEU A 60 146.664 -1.557 -0.844 1.00 0.00 H new ATOM 0 HB3 LEU A 60 146.577 -1.838 -2.571 1.00 0.00 H new ATOM 0 HG LEU A 60 144.715 -3.631 -1.562 1.00 0.00 H new ATOM 0 HD11 LEU A 60 143.284 -2.299 -0.060 1.00 0.00 H new ATOM 0 HD12 LEU A 60 144.871 -2.643 0.668 1.00 0.00 H new ATOM 0 HD13 LEU A 60 144.531 -1.031 -0.005 1.00 0.00 H new ATOM 0 HD21 LEU A 60 143.053 -2.076 -2.507 1.00 0.00 H new ATOM 0 HD22 LEU A 60 144.290 -0.797 -2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 60 144.470 -2.257 -3.568 1.00 0.00 H new ATOM 999 N TYR A 61 146.820 -4.875 -3.408 1.00 0.00 N ATOM 1000 CA TYR A 61 147.075 -5.427 -4.731 1.00 0.00 C ATOM 1001 C TYR A 61 146.230 -4.685 -5.755 1.00 0.00 C ATOM 1002 O TYR A 61 145.192 -5.173 -6.200 1.00 0.00 O ATOM 1003 CB TYR A 61 146.755 -6.921 -4.757 1.00 0.00 C ATOM 1004 CG TYR A 61 147.928 -7.798 -4.385 1.00 0.00 C ATOM 1005 CD1 TYR A 61 148.834 -8.226 -5.347 1.00 0.00 C ATOM 1006 CD2 TYR A 61 148.130 -8.199 -3.071 1.00 0.00 C ATOM 1007 CE1 TYR A 61 149.909 -9.028 -5.010 1.00 0.00 C ATOM 1008 CE2 TYR A 61 149.203 -8.999 -2.724 1.00 0.00 C ATOM 1009 CZ TYR A 61 150.088 -9.412 -3.698 1.00 0.00 C ATOM 1010 OH TYR A 61 151.158 -10.208 -3.357 1.00 0.00 O ATOM 0 H TYR A 61 145.943 -5.180 -2.986 1.00 0.00 H new ATOM 0 HA TYR A 61 148.130 -5.303 -4.976 1.00 0.00 H new ATOM 0 HB2 TYR A 61 145.932 -7.120 -4.071 1.00 0.00 H new ATOM 0 HB3 TYR A 61 146.411 -7.193 -5.755 1.00 0.00 H new ATOM 0 HD1 TYR A 61 148.697 -7.927 -6.376 1.00 0.00 H new ATOM 0 HD2 TYR A 61 147.437 -7.880 -2.307 1.00 0.00 H new ATOM 0 HE1 TYR A 61 150.604 -9.352 -5.770 1.00 0.00 H new ATOM 0 HE2 TYR A 61 149.347 -9.299 -1.696 1.00 0.00 H new ATOM 0 HH TYR A 61 151.139 -10.386 -2.394 1.00 0.00 H new ATOM 1020 N VAL A 62 146.670 -3.484 -6.097 1.00 0.00 N ATOM 1021 CA VAL A 62 145.948 -2.646 -7.036 1.00 0.00 C ATOM 1022 C VAL A 62 146.061 -3.159 -8.468 1.00 0.00 C ATOM 1023 O VAL A 62 147.050 -2.910 -9.159 1.00 0.00 O ATOM 1024 CB VAL A 62 146.434 -1.180 -6.961 1.00 0.00 C ATOM 1025 CG1 VAL A 62 147.951 -1.109 -7.006 1.00 0.00 C ATOM 1026 CG2 VAL A 62 145.818 -0.343 -8.074 1.00 0.00 C ATOM 0 H VAL A 62 147.528 -3.068 -5.735 1.00 0.00 H new ATOM 0 HA VAL A 62 144.898 -2.687 -6.748 1.00 0.00 H new ATOM 0 HB VAL A 62 146.105 -0.766 -6.008 1.00 0.00 H new ATOM 0 HG11 VAL A 62 148.268 -0.068 -6.952 1.00 0.00 H new ATOM 0 HG12 VAL A 62 148.366 -1.659 -6.162 1.00 0.00 H new ATOM 0 HG13 VAL A 62 148.308 -1.549 -7.937 1.00 0.00 H new ATOM 0 HG21 VAL A 62 146.176 0.684 -7.998 1.00 0.00 H new ATOM 0 HG22 VAL A 62 146.104 -0.757 -9.041 1.00 0.00 H new ATOM 0 HG23 VAL A 62 144.732 -0.356 -7.981 1.00 0.00 H new ATOM 1036 N TYR A 63 145.026 -3.856 -8.917 1.00 0.00 N ATOM 1037 CA TYR A 63 144.997 -4.377 -10.278 1.00 0.00 C ATOM 1038 C TYR A 63 144.501 -3.289 -11.220 1.00 0.00 C ATOM 1039 O TYR A 63 143.296 -3.126 -11.408 1.00 0.00 O ATOM 1040 CB TYR A 63 144.083 -5.603 -10.364 1.00 0.00 C ATOM 1041 CG TYR A 63 144.208 -6.375 -11.661 1.00 0.00 C ATOM 1042 CD1 TYR A 63 143.898 -5.784 -12.882 1.00 0.00 C ATOM 1043 CD2 TYR A 63 144.633 -7.696 -11.663 1.00 0.00 C ATOM 1044 CE1 TYR A 63 144.009 -6.490 -14.064 1.00 0.00 C ATOM 1045 CE2 TYR A 63 144.746 -8.408 -12.841 1.00 0.00 C ATOM 1046 CZ TYR A 63 144.434 -7.801 -14.038 1.00 0.00 C ATOM 1047 OH TYR A 63 144.545 -8.507 -15.214 1.00 0.00 O ATOM 0 H TYR A 63 144.198 -4.073 -8.362 1.00 0.00 H new ATOM 0 HA TYR A 63 146.004 -4.680 -10.566 1.00 0.00 H new ATOM 0 HB2 TYR A 63 144.309 -6.271 -9.533 1.00 0.00 H new ATOM 0 HB3 TYR A 63 143.049 -5.281 -10.243 1.00 0.00 H new ATOM 0 HD1 TYR A 63 143.565 -4.757 -12.906 1.00 0.00 H new ATOM 0 HD2 TYR A 63 144.880 -8.176 -10.727 1.00 0.00 H new ATOM 0 HE1 TYR A 63 143.764 -6.017 -15.004 1.00 0.00 H new ATOM 0 HE2 TYR A 63 145.077 -9.436 -12.824 1.00 0.00 H new ATOM 0 HH TYR A 63 144.761 -7.892 -15.946 1.00 0.00 H new ATOM 1057 N ALA A 64 145.426 -2.525 -11.797 1.00 0.00 N ATOM 1058 CA ALA A 64 145.037 -1.439 -12.697 1.00 0.00 C ATOM 1059 C ALA A 64 145.180 -1.833 -14.157 1.00 0.00 C ATOM 1060 O ALA A 64 145.481 -2.985 -14.475 1.00 0.00 O ATOM 1061 CB ALA A 64 145.848 -0.190 -12.408 1.00 0.00 C ATOM 0 H ALA A 64 146.431 -2.633 -11.662 1.00 0.00 H new ATOM 0 HA ALA A 64 143.983 -1.229 -12.514 1.00 0.00 H new ATOM 0 HB1 ALA A 64 145.544 0.606 -13.087 1.00 0.00 H new ATOM 0 HB2 ALA A 64 145.676 0.126 -11.379 1.00 0.00 H new ATOM 0 HB3 ALA A 64 146.908 -0.403 -12.550 1.00 0.00 H new ATOM 1067 N SER A 65 144.966 -0.862 -15.048 1.00 0.00 N ATOM 1068 CA SER A 65 145.075 -1.096 -16.485 1.00 0.00 C ATOM 1069 C SER A 65 146.301 -1.945 -16.791 1.00 0.00 C ATOM 1070 O SER A 65 146.286 -2.778 -17.696 1.00 0.00 O ATOM 1071 CB SER A 65 145.156 0.233 -17.239 1.00 0.00 C ATOM 1072 OG SER A 65 144.564 0.127 -18.524 1.00 0.00 O ATOM 0 H SER A 65 144.716 0.094 -14.796 1.00 0.00 H new ATOM 0 HA SER A 65 144.185 -1.631 -16.815 1.00 0.00 H new ATOM 0 HB2 SER A 65 144.652 1.011 -16.666 1.00 0.00 H new ATOM 0 HB3 SER A 65 146.198 0.535 -17.339 1.00 0.00 H new ATOM 0 HG SER A 65 144.627 0.989 -18.985 1.00 0.00 H new ATOM 1078 N ASP A 66 147.354 -1.737 -16.009 1.00 0.00 N ATOM 1079 CA ASP A 66 148.578 -2.492 -16.171 1.00 0.00 C ATOM 1080 C ASP A 66 148.307 -3.968 -15.957 1.00 0.00 C ATOM 1081 O ASP A 66 148.404 -4.776 -16.879 1.00 0.00 O ATOM 1082 CB ASP A 66 149.648 -2.001 -15.193 1.00 0.00 C ATOM 1083 CG ASP A 66 151.018 -2.571 -15.500 1.00 0.00 C ATOM 1084 OD1 ASP A 66 151.253 -3.757 -15.181 1.00 0.00 O ATOM 1085 OD2 ASP A 66 151.857 -1.835 -16.060 1.00 0.00 O ATOM 0 H ASP A 66 147.379 -1.049 -15.257 1.00 0.00 H new ATOM 0 HA ASP A 66 148.948 -2.343 -17.185 1.00 0.00 H new ATOM 0 HB2 ASP A 66 149.695 -0.913 -15.227 1.00 0.00 H new ATOM 0 HB3 ASP A 66 149.362 -2.277 -14.178 1.00 0.00 H new ATOM 1090 N LYS A 67 147.955 -4.297 -14.727 1.00 0.00 N ATOM 1091 CA LYS A 67 147.644 -5.673 -14.339 1.00 0.00 C ATOM 1092 C LYS A 67 147.619 -5.806 -12.825 1.00 0.00 C ATOM 1093 O LYS A 67 147.668 -4.805 -12.109 1.00 0.00 O ATOM 1094 CB LYS A 67 148.676 -6.643 -14.930 1.00 0.00 C ATOM 1095 CG LYS A 67 148.165 -7.395 -16.145 1.00 0.00 C ATOM 1096 CD LYS A 67 148.607 -8.851 -16.132 1.00 0.00 C ATOM 1097 CE LYS A 67 147.462 -9.784 -15.770 1.00 0.00 C ATOM 1098 NZ LYS A 67 146.943 -10.512 -16.961 1.00 0.00 N ATOM 0 H LYS A 67 147.875 -3.623 -13.965 1.00 0.00 H new ATOM 0 HA LYS A 67 146.658 -5.924 -14.731 1.00 0.00 H new ATOM 0 HB2 LYS A 67 149.572 -6.086 -15.206 1.00 0.00 H new ATOM 0 HB3 LYS A 67 148.970 -7.361 -14.164 1.00 0.00 H new ATOM 0 HG2 LYS A 67 147.076 -7.345 -16.173 1.00 0.00 H new ATOM 0 HG3 LYS A 67 148.529 -6.912 -17.052 1.00 0.00 H new ATOM 0 HD2 LYS A 67 149.000 -9.121 -17.112 1.00 0.00 H new ATOM 0 HD3 LYS A 67 149.420 -8.978 -15.417 1.00 0.00 H new ATOM 0 HE2 LYS A 67 147.801 -10.503 -15.024 1.00 0.00 H new ATOM 0 HE3 LYS A 67 146.655 -9.209 -15.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 146.164 -11.138 -16.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 146.596 -9.827 -17.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 147.706 -11.080 -17.380 1.00 0.00 H new ATOM 1112 N LEU A 68 147.561 -7.046 -12.340 1.00 0.00 N ATOM 1113 CA LEU A 68 147.560 -7.303 -10.904 1.00 0.00 C ATOM 1114 C LEU A 68 148.841 -6.747 -10.303 1.00 0.00 C ATOM 1115 O LEU A 68 149.795 -7.483 -10.052 1.00 0.00 O ATOM 1116 CB LEU A 68 147.455 -8.805 -10.625 1.00 0.00 C ATOM 1117 CG LEU A 68 148.563 -9.659 -11.249 1.00 0.00 C ATOM 1118 CD1 LEU A 68 149.173 -10.592 -10.214 1.00 0.00 C ATOM 1119 CD2 LEU A 68 148.024 -10.454 -12.431 1.00 0.00 C ATOM 0 H LEU A 68 147.514 -7.884 -12.920 1.00 0.00 H new ATOM 0 HA LEU A 68 146.697 -6.814 -10.451 1.00 0.00 H new ATOM 0 HB2 LEU A 68 147.462 -8.960 -9.546 1.00 0.00 H new ATOM 0 HB3 LEU A 68 146.492 -9.161 -10.992 1.00 0.00 H new ATOM 0 HG LEU A 68 149.345 -8.991 -11.609 1.00 0.00 H new ATOM 0 HD11 LEU A 68 149.957 -11.189 -10.679 1.00 0.00 H new ATOM 0 HD12 LEU A 68 149.598 -10.004 -9.400 1.00 0.00 H new ATOM 0 HD13 LEU A 68 148.401 -11.252 -9.819 1.00 0.00 H new ATOM 0 HD21 LEU A 68 148.825 -11.055 -12.861 1.00 0.00 H new ATOM 0 HD22 LEU A 68 147.221 -11.109 -12.093 1.00 0.00 H new ATOM 0 HD23 LEU A 68 147.639 -9.768 -13.186 1.00 0.00 H new ATOM 1131 N PHE A 69 148.867 -5.436 -10.111 1.00 0.00 N ATOM 1132 CA PHE A 69 150.041 -4.765 -9.586 1.00 0.00 C ATOM 1133 C PHE A 69 149.820 -4.335 -8.135 1.00 0.00 C ATOM 1134 O PHE A 69 148.726 -3.917 -7.757 1.00 0.00 O ATOM 1135 CB PHE A 69 150.393 -3.605 -10.531 1.00 0.00 C ATOM 1136 CG PHE A 69 149.932 -2.248 -10.109 1.00 0.00 C ATOM 1137 CD1 PHE A 69 150.588 -1.553 -9.112 1.00 0.00 C ATOM 1138 CD2 PHE A 69 148.856 -1.657 -10.742 1.00 0.00 C ATOM 1139 CE1 PHE A 69 150.171 -0.290 -8.750 1.00 0.00 C ATOM 1140 CE2 PHE A 69 148.438 -0.397 -10.388 1.00 0.00 C ATOM 1141 CZ PHE A 69 149.095 0.292 -9.390 1.00 0.00 C ATOM 0 H PHE A 69 148.083 -4.816 -10.313 1.00 0.00 H new ATOM 0 HA PHE A 69 150.896 -5.441 -9.553 1.00 0.00 H new ATOM 0 HB2 PHE A 69 151.476 -3.577 -10.651 1.00 0.00 H new ATOM 0 HB3 PHE A 69 149.969 -3.821 -11.512 1.00 0.00 H new ATOM 0 HD1 PHE A 69 151.434 -2.002 -8.612 1.00 0.00 H new ATOM 0 HD2 PHE A 69 148.337 -2.191 -11.524 1.00 0.00 H new ATOM 0 HE1 PHE A 69 150.686 0.244 -7.966 1.00 0.00 H new ATOM 0 HE2 PHE A 69 147.595 0.054 -10.891 1.00 0.00 H new ATOM 0 HZ PHE A 69 148.769 1.283 -9.110 1.00 0.00 H new ATOM 1151 N ARG A 70 150.853 -4.502 -7.312 1.00 0.00 N ATOM 1152 CA ARG A 70 150.761 -4.198 -5.898 1.00 0.00 C ATOM 1153 C ARG A 70 151.432 -2.882 -5.525 1.00 0.00 C ATOM 1154 O ARG A 70 152.458 -2.503 -6.089 1.00 0.00 O ATOM 1155 CB ARG A 70 151.377 -5.343 -5.086 1.00 0.00 C ATOM 1156 CG ARG A 70 151.441 -5.079 -3.588 1.00 0.00 C ATOM 1157 CD ARG A 70 152.861 -4.789 -3.126 1.00 0.00 C ATOM 1158 NE ARG A 70 153.772 -5.893 -3.428 1.00 0.00 N ATOM 1159 CZ ARG A 70 154.632 -5.898 -4.445 1.00 0.00 C ATOM 1160 NH1 ARG A 70 154.700 -4.869 -5.282 1.00 0.00 N ATOM 1161 NH2 ARG A 70 155.427 -6.944 -4.632 1.00 0.00 N ATOM 0 H ARG A 70 151.765 -4.848 -7.609 1.00 0.00 H new ATOM 0 HA ARG A 70 149.702 -4.089 -5.663 1.00 0.00 H new ATOM 0 HB2 ARG A 70 150.798 -6.250 -5.260 1.00 0.00 H new ATOM 0 HB3 ARG A 70 152.385 -5.533 -5.454 1.00 0.00 H new ATOM 0 HG2 ARG A 70 150.798 -4.234 -3.340 1.00 0.00 H new ATOM 0 HG3 ARG A 70 151.053 -5.944 -3.050 1.00 0.00 H new ATOM 0 HD2 ARG A 70 153.221 -3.880 -3.608 1.00 0.00 H new ATOM 0 HD3 ARG A 70 152.862 -4.602 -2.052 1.00 0.00 H new ATOM 0 HE ARG A 70 153.747 -6.712 -2.820 1.00 0.00 H new ATOM 0 HH11 ARG A 70 154.089 -4.063 -5.150 1.00 0.00 H new ATOM 0 HH12 ARG A 70 155.363 -4.885 -6.057 1.00 0.00 H new ATOM 0 HH21 ARG A 70 155.378 -7.741 -3.998 1.00 0.00 H new ATOM 0 HH22 ARG A 70 156.087 -6.951 -5.410 1.00 0.00 H new ATOM 1175 N ALA A 71 150.850 -2.214 -4.534 1.00 0.00 N ATOM 1176 CA ALA A 71 151.378 -0.961 -4.020 1.00 0.00 C ATOM 1177 C ALA A 71 151.532 -1.072 -2.510 1.00 0.00 C ATOM 1178 O ALA A 71 150.779 -1.803 -1.867 1.00 0.00 O ATOM 1179 CB ALA A 71 150.467 0.199 -4.392 1.00 0.00 C ATOM 0 H ALA A 71 150.000 -2.528 -4.067 1.00 0.00 H new ATOM 0 HA ALA A 71 152.353 -0.766 -4.466 1.00 0.00 H new ATOM 0 HB1 ALA A 71 150.880 1.127 -3.998 1.00 0.00 H new ATOM 0 HB2 ALA A 71 150.390 0.268 -5.477 1.00 0.00 H new ATOM 0 HB3 ALA A 71 149.476 0.034 -3.968 1.00 0.00 H new ATOM 1185 N ASP A 72 152.510 -0.376 -1.932 1.00 0.00 N ATOM 1186 CA ASP A 72 152.716 -0.466 -0.494 1.00 0.00 C ATOM 1187 C ASP A 72 153.033 0.888 0.116 1.00 0.00 C ATOM 1188 O ASP A 72 153.702 1.721 -0.496 1.00 0.00 O ATOM 1189 CB ASP A 72 153.843 -1.453 -0.184 1.00 0.00 C ATOM 1190 CG ASP A 72 153.531 -2.334 1.011 1.00 0.00 C ATOM 1191 OD1 ASP A 72 152.989 -1.812 2.007 1.00 0.00 O ATOM 1192 OD2 ASP A 72 153.828 -3.545 0.947 1.00 0.00 O ATOM 0 H ASP A 72 153.156 0.241 -2.425 1.00 0.00 H new ATOM 0 HA ASP A 72 151.786 -0.823 -0.050 1.00 0.00 H new ATOM 0 HB2 ASP A 72 154.022 -2.081 -1.057 1.00 0.00 H new ATOM 0 HB3 ASP A 72 154.763 -0.901 0.006 1.00 0.00 H new ATOM 1197 N ILE A 73 152.554 1.090 1.334 1.00 0.00 N ATOM 1198 CA ILE A 73 152.787 2.331 2.052 1.00 0.00 C ATOM 1199 C ILE A 73 153.043 2.054 3.523 1.00 0.00 C ATOM 1200 O ILE A 73 152.245 1.403 4.191 1.00 0.00 O ATOM 1201 CB ILE A 73 151.601 3.300 1.924 1.00 0.00 C ATOM 1202 CG1 ILE A 73 150.274 2.542 2.024 1.00 0.00 C ATOM 1203 CG2 ILE A 73 151.698 4.075 0.618 1.00 0.00 C ATOM 1204 CD1 ILE A 73 149.846 1.877 0.731 1.00 0.00 C ATOM 0 H ILE A 73 151.999 0.405 1.847 1.00 0.00 H new ATOM 0 HA ILE A 73 153.664 2.798 1.603 1.00 0.00 H new ATOM 0 HB ILE A 73 151.637 4.014 2.747 1.00 0.00 H new ATOM 0 HG12 ILE A 73 150.359 1.782 2.801 1.00 0.00 H new ATOM 0 HG13 ILE A 73 149.494 3.235 2.340 1.00 0.00 H new ATOM 0 HG21 ILE A 73 150.853 4.759 0.537 1.00 0.00 H new ATOM 0 HG22 ILE A 73 152.628 4.644 0.601 1.00 0.00 H new ATOM 0 HG23 ILE A 73 151.683 3.379 -0.220 1.00 0.00 H new ATOM 0 HD11 ILE A 73 148.898 1.361 0.884 1.00 0.00 H new ATOM 0 HD12 ILE A 73 149.727 2.633 -0.045 1.00 0.00 H new ATOM 0 HD13 ILE A 73 150.605 1.158 0.423 1.00 0.00 H new ATOM 1216 N SER A 74 154.161 2.550 4.017 1.00 0.00 N ATOM 1217 CA SER A 74 154.533 2.355 5.413 1.00 0.00 C ATOM 1218 C SER A 74 154.838 3.680 6.076 1.00 0.00 C ATOM 1219 O SER A 74 155.389 4.590 5.456 1.00 0.00 O ATOM 1220 CB SER A 74 155.737 1.418 5.524 1.00 0.00 C ATOM 1221 OG SER A 74 156.914 2.042 5.039 1.00 0.00 O ATOM 0 H SER A 74 154.832 3.093 3.474 1.00 0.00 H new ATOM 0 HA SER A 74 153.688 1.898 5.928 1.00 0.00 H new ATOM 0 HB2 SER A 74 155.879 1.125 6.564 1.00 0.00 H new ATOM 0 HB3 SER A 74 155.546 0.506 4.959 1.00 0.00 H new ATOM 0 HG SER A 74 157.670 1.424 5.122 1.00 0.00 H new ATOM 1227 N GLU A 75 154.464 3.789 7.340 1.00 0.00 N ATOM 1228 CA GLU A 75 154.682 5.008 8.087 1.00 0.00 C ATOM 1229 C GLU A 75 154.950 4.682 9.556 1.00 0.00 C ATOM 1230 O GLU A 75 154.069 4.159 10.232 1.00 0.00 O ATOM 1231 CB GLU A 75 153.437 5.893 7.963 1.00 0.00 C ATOM 1232 CG GLU A 75 153.202 6.806 9.153 1.00 0.00 C ATOM 1233 CD GLU A 75 152.589 8.136 8.760 1.00 0.00 C ATOM 1234 OE1 GLU A 75 151.778 8.159 7.811 1.00 0.00 O ATOM 1235 OE2 GLU A 75 152.920 9.154 9.402 1.00 0.00 O ATOM 0 H GLU A 75 154.008 3.045 7.867 1.00 0.00 H new ATOM 0 HA GLU A 75 155.549 5.535 7.687 1.00 0.00 H new ATOM 0 HB2 GLU A 75 153.526 6.502 7.064 1.00 0.00 H new ATOM 0 HB3 GLU A 75 152.563 5.255 7.830 1.00 0.00 H new ATOM 0 HG2 GLU A 75 152.547 6.305 9.866 1.00 0.00 H new ATOM 0 HG3 GLU A 75 154.149 6.984 9.662 1.00 0.00 H new ATOM 1242 N ASP A 76 156.147 4.984 10.057 1.00 0.00 N ATOM 1243 CA ASP A 76 156.453 4.698 11.446 1.00 0.00 C ATOM 1244 C ASP A 76 157.231 5.830 12.095 1.00 0.00 C ATOM 1245 O ASP A 76 157.522 6.849 11.468 1.00 0.00 O ATOM 1246 CB ASP A 76 157.247 3.399 11.572 1.00 0.00 C ATOM 1247 CG ASP A 76 156.432 2.180 11.188 1.00 0.00 C ATOM 1248 OD1 ASP A 76 155.875 2.164 10.070 1.00 0.00 O ATOM 1249 OD2 ASP A 76 156.353 1.240 12.005 1.00 0.00 O ATOM 0 H ASP A 76 156.904 5.418 9.529 1.00 0.00 H new ATOM 0 HA ASP A 76 155.501 4.591 11.965 1.00 0.00 H new ATOM 0 HB2 ASP A 76 158.132 3.455 10.938 1.00 0.00 H new ATOM 0 HB3 ASP A 76 157.597 3.289 12.598 1.00 0.00 H new ATOM 1342 N ARG A 82 158.074 7.572 6.973 1.00 0.00 N ATOM 1343 CA ARG A 82 156.805 7.307 6.302 1.00 0.00 C ATOM 1344 C ARG A 82 156.928 7.640 4.825 1.00 0.00 C ATOM 1345 O ARG A 82 157.580 8.618 4.455 1.00 0.00 O ATOM 1346 CB ARG A 82 155.666 8.109 6.946 1.00 0.00 C ATOM 1347 CG ARG A 82 154.521 8.448 5.998 1.00 0.00 C ATOM 1348 CD ARG A 82 154.754 9.776 5.296 1.00 0.00 C ATOM 1349 NE ARG A 82 154.044 9.855 4.022 1.00 0.00 N ATOM 1350 CZ ARG A 82 152.742 10.114 3.912 1.00 0.00 C ATOM 1351 NH1 ARG A 82 152.004 10.316 4.996 1.00 0.00 N ATOM 1352 NH2 ARG A 82 152.177 10.171 2.713 1.00 0.00 N ATOM 0 HA ARG A 82 156.566 6.249 6.409 1.00 0.00 H new ATOM 0 HB2 ARG A 82 155.269 7.542 7.788 1.00 0.00 H new ATOM 0 HB3 ARG A 82 156.074 9.036 7.350 1.00 0.00 H new ATOM 0 HG2 ARG A 82 154.415 7.657 5.256 1.00 0.00 H new ATOM 0 HG3 ARG A 82 153.585 8.489 6.556 1.00 0.00 H new ATOM 0 HD2 ARG A 82 154.428 10.590 5.943 1.00 0.00 H new ATOM 0 HD3 ARG A 82 155.822 9.913 5.125 1.00 0.00 H new ATOM 0 HE ARG A 82 154.577 9.703 3.166 1.00 0.00 H new ATOM 0 HH11 ARG A 82 152.433 10.273 5.920 1.00 0.00 H new ATOM 0 HH12 ARG A 82 151.008 10.514 4.905 1.00 0.00 H new ATOM 0 HH21 ARG A 82 152.740 10.017 1.876 1.00 0.00 H new ATOM 0 HH22 ARG A 82 151.180 10.369 2.628 1.00 0.00 H new ATOM 1366 N LYS A 83 156.309 6.827 3.978 1.00 0.00 N ATOM 1367 CA LYS A 83 156.379 7.070 2.542 1.00 0.00 C ATOM 1368 C LYS A 83 155.568 6.075 1.716 1.00 0.00 C ATOM 1369 O LYS A 83 155.391 4.916 2.096 1.00 0.00 O ATOM 1370 CB LYS A 83 157.835 7.049 2.075 1.00 0.00 C ATOM 1371 CG LYS A 83 158.600 5.815 2.524 1.00 0.00 C ATOM 1372 CD LYS A 83 159.659 5.415 1.507 1.00 0.00 C ATOM 1373 CE LYS A 83 161.000 6.068 1.809 1.00 0.00 C ATOM 1374 NZ LYS A 83 161.993 5.083 2.316 1.00 0.00 N ATOM 0 H LYS A 83 155.763 6.010 4.252 1.00 0.00 H new ATOM 0 HA LYS A 83 155.938 8.053 2.379 1.00 0.00 H new ATOM 0 HB2 LYS A 83 157.860 7.106 0.987 1.00 0.00 H new ATOM 0 HB3 LYS A 83 158.342 7.937 2.452 1.00 0.00 H new ATOM 0 HG2 LYS A 83 159.073 6.009 3.486 1.00 0.00 H new ATOM 0 HG3 LYS A 83 157.905 4.988 2.672 1.00 0.00 H new ATOM 0 HD2 LYS A 83 159.773 4.331 1.507 1.00 0.00 H new ATOM 0 HD3 LYS A 83 159.331 5.701 0.508 1.00 0.00 H new ATOM 0 HE2 LYS A 83 161.386 6.541 0.906 1.00 0.00 H new ATOM 0 HE3 LYS A 83 160.862 6.858 2.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 162.893 5.566 2.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 161.637 4.650 3.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 162.144 4.343 1.601 1.00 0.00 H new ATOM 1388 N LEU A 84 155.110 6.554 0.561 1.00 0.00 N ATOM 1389 CA LEU A 84 154.340 5.750 -0.385 1.00 0.00 C ATOM 1390 C LEU A 84 155.234 5.413 -1.575 1.00 0.00 C ATOM 1391 O LEU A 84 155.940 6.286 -2.079 1.00 0.00 O ATOM 1392 CB LEU A 84 153.097 6.516 -0.861 1.00 0.00 C ATOM 1393 CG LEU A 84 152.649 7.685 0.029 1.00 0.00 C ATOM 1394 CD1 LEU A 84 151.311 8.231 -0.448 1.00 0.00 C ATOM 1395 CD2 LEU A 84 152.559 7.265 1.492 1.00 0.00 C ATOM 0 H LEU A 84 155.263 7.515 0.254 1.00 0.00 H new ATOM 0 HA LEU A 84 154.005 4.835 0.103 1.00 0.00 H new ATOM 0 HB2 LEU A 84 153.292 6.901 -1.862 1.00 0.00 H new ATOM 0 HB3 LEU A 84 152.270 5.811 -0.946 1.00 0.00 H new ATOM 0 HG LEU A 84 153.400 8.472 -0.048 1.00 0.00 H new ATOM 0 HD11 LEU A 84 151.007 9.059 0.192 1.00 0.00 H new ATOM 0 HD12 LEU A 84 151.407 8.583 -1.475 1.00 0.00 H new ATOM 0 HD13 LEU A 84 150.560 7.443 -0.404 1.00 0.00 H new ATOM 0 HD21 LEU A 84 152.240 8.115 2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 84 151.837 6.455 1.594 1.00 0.00 H new ATOM 0 HD23 LEU A 84 153.536 6.925 1.834 1.00 0.00 H new ATOM 1407 N LEU A 85 155.248 4.152 -2.007 1.00 0.00 N ATOM 1408 CA LEU A 85 156.125 3.775 -3.114 1.00 0.00 C ATOM 1409 C LEU A 85 155.591 2.618 -3.963 1.00 0.00 C ATOM 1410 O LEU A 85 155.021 2.848 -5.030 1.00 0.00 O ATOM 1411 CB LEU A 85 157.512 3.424 -2.571 1.00 0.00 C ATOM 1412 CG LEU A 85 157.530 2.878 -1.140 1.00 0.00 C ATOM 1413 CD1 LEU A 85 158.831 2.144 -0.872 1.00 0.00 C ATOM 1414 CD2 LEU A 85 157.339 4.004 -0.134 1.00 0.00 C ATOM 0 H LEU A 85 154.682 3.396 -1.622 1.00 0.00 H new ATOM 0 HA LEU A 85 156.175 4.639 -3.777 1.00 0.00 H new ATOM 0 HB2 LEU A 85 157.967 2.686 -3.231 1.00 0.00 H new ATOM 0 HB3 LEU A 85 158.137 4.316 -2.611 1.00 0.00 H new ATOM 0 HG LEU A 85 156.704 2.175 -1.029 1.00 0.00 H new ATOM 0 HD11 LEU A 85 158.829 1.762 0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 85 158.931 1.313 -1.571 1.00 0.00 H new ATOM 0 HD13 LEU A 85 159.669 2.829 -1.001 1.00 0.00 H new ATOM 0 HD21 LEU A 85 157.355 3.596 0.876 1.00 0.00 H new ATOM 0 HD22 LEU A 85 158.144 4.731 -0.244 1.00 0.00 H new ATOM 0 HD23 LEU A 85 156.381 4.493 -0.313 1.00 0.00 H new ATOM 1426 N ARG A 86 155.817 1.378 -3.507 1.00 0.00 N ATOM 1427 CA ARG A 86 155.403 0.176 -4.244 1.00 0.00 C ATOM 1428 C ARG A 86 154.254 0.459 -5.207 1.00 0.00 C ATOM 1429 O ARG A 86 153.264 1.094 -4.842 1.00 0.00 O ATOM 1430 CB ARG A 86 155.020 -0.950 -3.281 1.00 0.00 C ATOM 1431 CG ARG A 86 155.849 -2.211 -3.463 1.00 0.00 C ATOM 1432 CD ARG A 86 157.183 -2.116 -2.740 1.00 0.00 C ATOM 1433 NE ARG A 86 158.066 -3.230 -3.078 1.00 0.00 N ATOM 1434 CZ ARG A 86 159.094 -3.618 -2.326 1.00 0.00 C ATOM 1435 NH1 ARG A 86 159.383 -2.977 -1.202 1.00 0.00 N ATOM 1436 NH2 ARG A 86 159.835 -4.652 -2.702 1.00 0.00 N ATOM 0 H ARG A 86 156.288 1.181 -2.624 1.00 0.00 H new ATOM 0 HA ARG A 86 156.260 -0.142 -4.837 1.00 0.00 H new ATOM 0 HB2 ARG A 86 155.133 -0.595 -2.257 1.00 0.00 H new ATOM 0 HB3 ARG A 86 153.967 -1.194 -3.420 1.00 0.00 H new ATOM 0 HG2 ARG A 86 155.292 -3.070 -3.088 1.00 0.00 H new ATOM 0 HG3 ARG A 86 156.022 -2.382 -4.525 1.00 0.00 H new ATOM 0 HD2 ARG A 86 157.670 -1.176 -2.998 1.00 0.00 H new ATOM 0 HD3 ARG A 86 157.012 -2.102 -1.664 1.00 0.00 H new ATOM 0 HE ARG A 86 157.884 -3.741 -3.942 1.00 0.00 H new ATOM 0 HH11 ARG A 86 158.816 -2.181 -0.909 1.00 0.00 H new ATOM 0 HH12 ARG A 86 160.172 -3.280 -0.631 1.00 0.00 H new ATOM 0 HH21 ARG A 86 159.617 -5.148 -3.566 1.00 0.00 H new ATOM 0 HH22 ARG A 86 160.623 -4.951 -2.127 1.00 0.00 H new ATOM 1450 N PHE A 87 154.409 -0.012 -6.441 1.00 0.00 N ATOM 1451 CA PHE A 87 153.402 0.192 -7.475 1.00 0.00 C ATOM 1452 C PHE A 87 153.591 -0.806 -8.614 1.00 0.00 C ATOM 1453 O PHE A 87 153.553 -0.435 -9.787 1.00 0.00 O ATOM 1454 CB PHE A 87 153.493 1.623 -8.012 1.00 0.00 C ATOM 1455 CG PHE A 87 152.160 2.277 -8.235 1.00 0.00 C ATOM 1456 CD1 PHE A 87 151.417 2.746 -7.165 1.00 0.00 C ATOM 1457 CD2 PHE A 87 151.656 2.430 -9.515 1.00 0.00 C ATOM 1458 CE1 PHE A 87 150.195 3.354 -7.367 1.00 0.00 C ATOM 1459 CE2 PHE A 87 150.433 3.036 -9.725 1.00 0.00 C ATOM 1460 CZ PHE A 87 149.701 3.500 -8.649 1.00 0.00 C ATOM 0 H PHE A 87 155.226 -0.539 -6.749 1.00 0.00 H new ATOM 0 HA PHE A 87 152.416 0.033 -7.038 1.00 0.00 H new ATOM 0 HB2 PHE A 87 154.070 2.227 -7.312 1.00 0.00 H new ATOM 0 HB3 PHE A 87 154.043 1.613 -8.953 1.00 0.00 H new ATOM 0 HD1 PHE A 87 151.798 2.635 -6.161 1.00 0.00 H new ATOM 0 HD2 PHE A 87 152.226 2.071 -10.359 1.00 0.00 H new ATOM 0 HE1 PHE A 87 149.625 3.715 -6.524 1.00 0.00 H new ATOM 0 HE2 PHE A 87 150.049 3.147 -10.728 1.00 0.00 H new ATOM 0 HZ PHE A 87 148.745 3.976 -8.810 1.00 0.00 H new ATOM 1470 N ASN A 88 153.793 -2.074 -8.255 1.00 0.00 N ATOM 1471 CA ASN A 88 153.993 -3.143 -9.236 1.00 0.00 C ATOM 1472 C ASN A 88 154.511 -4.405 -8.550 1.00 0.00 C ATOM 1473 O ASN A 88 155.506 -4.366 -7.827 1.00 0.00 O ATOM 1474 CB ASN A 88 154.976 -2.707 -10.331 1.00 0.00 C ATOM 1475 CG ASN A 88 155.296 -3.824 -11.308 1.00 0.00 C ATOM 1476 OD1 ASN A 88 156.332 -4.481 -11.199 1.00 0.00 O ATOM 1477 ND2 ASN A 88 154.406 -4.043 -12.269 1.00 0.00 N ATOM 0 H ASN A 88 153.823 -2.388 -7.285 1.00 0.00 H new ATOM 0 HA ASN A 88 153.030 -3.357 -9.699 1.00 0.00 H new ATOM 0 HB2 ASN A 88 154.555 -1.862 -10.876 1.00 0.00 H new ATOM 0 HB3 ASN A 88 155.899 -2.359 -9.868 1.00 0.00 H new ATOM 0 HD21 ASN A 88 154.567 -4.780 -12.955 1.00 0.00 H new ATOM 0 HD22 ASN A 88 153.561 -3.474 -12.321 1.00 0.00 H new