USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 1035 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 5 GLN : amide:sc= -1.94 K(o=-1.9,f=-5.8!) USER MOD Set 1.2: A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 152:sc= -0.177 (180deg=-0.787) USER MOD Single : A 1 MET N :NH3+ -177:sc= -0.109 (180deg=-0.116) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= 0.787 K(o=0.79,f=-2.3!) USER MOD Single : A 15 ASN : amide:sc= -0.221 K(o=-0.22,f=-1.9!) USER MOD Single : A 16 ASN : amide:sc= -0.827 K(o=-0.83,f=-3.7!) USER MOD Single : A 21 THR OG1 : rot -56:sc= -6.15! USER MOD Single : A 28 HIS : no HD1:sc= -0.221 K(o=-0.22,f=-2) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.364 X(o=-0.36,f=-0.38) USER MOD Single : A 32 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.288) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0.0357 K(o=0.036,f=-1.7) USER MOD Single : A 55 GLN : amide:sc= -0.0366 X(o=-0.037,f=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 HIS : no HD1:sc= -0.607 X(o=-0.61,f=-0.29) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -177:sc= 0.13 (180deg=0.128) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= -3.57! K(o=-3.6!,f=-1.1) USER MOD Single : A 97 LYS NZ :NH3+ -172:sc= 1.17 (180deg=1.1) USER MOD Single : A 100 GLN : amide:sc= -3.29! C(o=-3.3!,f=-5.1!) USER MOD Single : A 105 MET CE :methyl 180:sc= -0.645 (180deg=-0.645) USER MOD Single : A 106 SER OG : rot -52:sc= 1.02 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 119 ASN : amide:sc= -9.18! C(o=-9.2!,f=-13!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 16.366 12.823 9.304 1.00 0.00 N ATOM 2 CA MET A 1 16.046 14.198 8.824 1.00 0.00 C ATOM 3 C MET A 1 15.992 14.210 7.295 1.00 0.00 C ATOM 4 O MET A 1 15.834 15.247 6.679 1.00 0.00 O ATOM 5 CB MET A 1 17.128 15.167 9.302 1.00 0.00 C ATOM 6 CG MET A 1 16.620 16.604 9.175 1.00 0.00 C ATOM 7 SD MET A 1 17.704 17.531 8.060 1.00 0.00 S ATOM 8 CE MET A 1 16.403 18.315 7.079 1.00 0.00 C ATOM 0 H1 MET A 1 16.352 12.806 10.344 1.00 0.00 H new ATOM 0 H2 MET A 1 15.659 12.154 8.937 1.00 0.00 H new ATOM 0 H3 MET A 1 17.310 12.548 8.966 1.00 0.00 H new ATOM 0 HA MET A 1 15.079 14.504 9.222 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.390 14.953 10.338 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.034 15.037 8.711 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.599 16.608 8.793 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.596 17.080 10.155 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.766 19.265 6.686 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.127 17.661 6.251 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.530 18.492 7.707 1.00 0.00 H new ATOM 20 N LYS A 2 16.123 13.071 6.673 1.00 0.00 N ATOM 21 CA LYS A 2 16.079 13.031 5.184 1.00 0.00 C ATOM 22 C LYS A 2 16.147 11.579 4.701 1.00 0.00 C ATOM 23 O LYS A 2 16.700 11.290 3.658 1.00 0.00 O ATOM 24 CB LYS A 2 17.269 13.813 4.619 1.00 0.00 C ATOM 25 CG LYS A 2 18.574 13.101 4.984 1.00 0.00 C ATOM 26 CD LYS A 2 19.175 13.741 6.239 1.00 0.00 C ATOM 27 CE LYS A 2 20.678 13.948 6.039 1.00 0.00 C ATOM 28 NZ LYS A 2 21.370 13.874 7.357 1.00 0.00 N ATOM 0 H LYS A 2 16.258 12.169 7.129 1.00 0.00 H new ATOM 0 HA LYS A 2 15.148 13.480 4.839 1.00 0.00 H new ATOM 0 HB2 LYS A 2 17.180 13.897 3.536 1.00 0.00 H new ATOM 0 HB3 LYS A 2 17.273 14.827 5.018 1.00 0.00 H new ATOM 0 HG2 LYS A 2 18.386 12.042 5.158 1.00 0.00 H new ATOM 0 HG3 LYS A 2 19.280 13.167 4.156 1.00 0.00 H new ATOM 0 HD2 LYS A 2 18.690 14.696 6.441 1.00 0.00 H new ATOM 0 HD3 LYS A 2 18.997 13.104 7.105 1.00 0.00 H new ATOM 0 HE2 LYS A 2 21.074 13.188 5.365 1.00 0.00 H new ATOM 0 HE3 LYS A 2 20.864 14.916 5.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 22.391 14.015 7.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 20.999 14.615 7.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 21.203 12.941 7.785 1.00 0.00 H new ATOM 42 N LYS A 3 15.591 10.664 5.447 1.00 0.00 N ATOM 43 CA LYS A 3 15.631 9.238 5.018 1.00 0.00 C ATOM 44 C LYS A 3 14.513 8.456 5.707 1.00 0.00 C ATOM 45 O LYS A 3 14.745 7.684 6.616 1.00 0.00 O ATOM 46 CB LYS A 3 16.975 8.627 5.393 1.00 0.00 C ATOM 47 CG LYS A 3 17.297 7.483 4.431 1.00 0.00 C ATOM 48 CD LYS A 3 18.095 6.405 5.167 1.00 0.00 C ATOM 49 CE LYS A 3 17.167 5.242 5.525 1.00 0.00 C ATOM 50 NZ LYS A 3 17.245 4.201 4.463 1.00 0.00 N ATOM 0 H LYS A 3 15.113 10.841 6.331 1.00 0.00 H new ATOM 0 HA LYS A 3 15.495 9.189 3.938 1.00 0.00 H new ATOM 0 HB2 LYS A 3 17.757 9.385 5.349 1.00 0.00 H new ATOM 0 HB3 LYS A 3 16.946 8.258 6.418 1.00 0.00 H new ATOM 0 HG2 LYS A 3 16.375 7.059 4.032 1.00 0.00 H new ATOM 0 HG3 LYS A 3 17.869 7.858 3.582 1.00 0.00 H new ATOM 0 HD2 LYS A 3 18.914 6.052 4.541 1.00 0.00 H new ATOM 0 HD3 LYS A 3 18.541 6.820 6.071 1.00 0.00 H new ATOM 0 HE2 LYS A 3 17.453 4.817 6.487 1.00 0.00 H new ATOM 0 HE3 LYS A 3 16.142 5.598 5.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 16.615 3.410 4.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 16.952 4.611 3.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 18.223 3.854 4.388 1.00 0.00 H new ATOM 64 N LEU A 4 13.305 8.653 5.274 1.00 0.00 N ATOM 65 CA LEU A 4 12.158 7.932 5.882 1.00 0.00 C ATOM 66 C LEU A 4 11.290 7.334 4.771 1.00 0.00 C ATOM 67 O LEU A 4 10.537 8.031 4.120 1.00 0.00 O ATOM 68 CB LEU A 4 11.326 8.918 6.700 1.00 0.00 C ATOM 69 CG LEU A 4 10.292 8.153 7.517 1.00 0.00 C ATOM 70 CD1 LEU A 4 11.008 7.151 8.423 1.00 0.00 C ATOM 71 CD2 LEU A 4 9.496 9.141 8.370 1.00 0.00 C ATOM 0 H LEU A 4 13.059 9.290 4.516 1.00 0.00 H new ATOM 0 HA LEU A 4 12.523 7.134 6.528 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.973 9.496 7.361 1.00 0.00 H new ATOM 0 HB3 LEU A 4 10.830 9.628 6.039 1.00 0.00 H new ATOM 0 HG LEU A 4 9.614 7.619 6.852 1.00 0.00 H new ATOM 0 HD11 LEU A 4 10.272 6.601 9.010 1.00 0.00 H new ATOM 0 HD12 LEU A 4 11.581 6.453 7.812 1.00 0.00 H new ATOM 0 HD13 LEU A 4 11.682 7.684 9.094 1.00 0.00 H new ATOM 0 HD21 LEU A 4 8.754 8.600 8.957 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.173 9.671 9.040 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.992 9.858 7.722 1.00 0.00 H new ATOM 83 N GLN A 5 11.385 6.051 4.546 1.00 0.00 N ATOM 84 CA GLN A 5 10.558 5.424 3.473 1.00 0.00 C ATOM 85 C GLN A 5 9.750 4.267 4.060 1.00 0.00 C ATOM 86 O GLN A 5 10.176 3.605 4.984 1.00 0.00 O ATOM 87 CB GLN A 5 11.458 4.888 2.351 1.00 0.00 C ATOM 88 CG GLN A 5 12.824 5.577 2.394 1.00 0.00 C ATOM 89 CD GLN A 5 13.628 5.198 1.147 1.00 0.00 C ATOM 90 OE1 GLN A 5 14.183 4.119 1.074 1.00 0.00 O ATOM 91 NE2 GLN A 5 13.714 6.044 0.158 1.00 0.00 N ATOM 0 H GLN A 5 11.996 5.412 5.055 1.00 0.00 H new ATOM 0 HA GLN A 5 9.886 6.178 3.064 1.00 0.00 H new ATOM 0 HB2 GLN A 5 11.583 3.810 2.458 1.00 0.00 H new ATOM 0 HB3 GLN A 5 10.986 5.060 1.383 1.00 0.00 H new ATOM 0 HG2 GLN A 5 12.696 6.658 2.442 1.00 0.00 H new ATOM 0 HG3 GLN A 5 13.365 5.280 3.292 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.248 6.949 0.219 1.00 0.00 H new ATOM 0 HE22 GLN A 5 14.247 5.800 -0.677 1.00 0.00 H new ATOM 100 N ILE A 6 8.584 4.018 3.530 1.00 0.00 N ATOM 101 CA ILE A 6 7.748 2.911 4.049 1.00 0.00 C ATOM 102 C ILE A 6 7.755 1.755 3.046 1.00 0.00 C ATOM 103 O ILE A 6 8.358 1.839 1.995 1.00 0.00 O ATOM 104 CB ILE A 6 6.323 3.417 4.239 1.00 0.00 C ATOM 105 CG1 ILE A 6 6.356 4.856 4.762 1.00 0.00 C ATOM 106 CG2 ILE A 6 5.611 2.529 5.247 1.00 0.00 C ATOM 107 CD1 ILE A 6 7.233 4.924 6.012 1.00 0.00 C ATOM 0 H ILE A 6 8.176 4.540 2.755 1.00 0.00 H new ATOM 0 HA ILE A 6 8.144 2.560 5.002 1.00 0.00 H new ATOM 0 HB ILE A 6 5.794 3.391 3.286 1.00 0.00 H new ATOM 0 HG12 ILE A 6 6.746 5.524 3.994 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.346 5.193 4.995 1.00 0.00 H new ATOM 0 HG21 ILE A 6 4.590 2.885 5.388 1.00 0.00 H new ATOM 0 HG22 ILE A 6 5.590 1.504 4.878 1.00 0.00 H new ATOM 0 HG23 ILE A 6 6.141 2.561 6.199 1.00 0.00 H new ATOM 0 HD11 ILE A 6 7.257 5.948 6.385 1.00 0.00 H new ATOM 0 HD12 ILE A 6 6.823 4.268 6.780 1.00 0.00 H new ATOM 0 HD13 ILE A 6 8.245 4.605 5.764 1.00 0.00 H new ATOM 119 N ALA A 7 7.090 0.677 3.362 1.00 0.00 N ATOM 120 CA ALA A 7 7.061 -0.482 2.423 1.00 0.00 C ATOM 121 C ALA A 7 5.652 -1.081 2.389 1.00 0.00 C ATOM 122 O ALA A 7 5.288 -1.877 3.231 1.00 0.00 O ATOM 123 CB ALA A 7 8.054 -1.544 2.899 1.00 0.00 C ATOM 0 H ALA A 7 6.566 0.548 4.228 1.00 0.00 H new ATOM 0 HA ALA A 7 7.335 -0.146 1.423 1.00 0.00 H new ATOM 0 HB1 ALA A 7 8.035 -2.392 2.215 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.058 -1.119 2.923 1.00 0.00 H new ATOM 0 HB3 ALA A 7 7.778 -1.878 3.899 1.00 0.00 H new ATOM 129 N VAL A 8 4.856 -0.704 1.425 1.00 0.00 N ATOM 130 CA VAL A 8 3.472 -1.253 1.346 1.00 0.00 C ATOM 131 C VAL A 8 3.262 -1.964 0.016 1.00 0.00 C ATOM 132 O VAL A 8 3.607 -1.463 -1.036 1.00 0.00 O ATOM 133 CB VAL A 8 2.457 -0.116 1.442 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.572 0.778 0.206 1.00 0.00 C ATOM 135 CG2 VAL A 8 1.049 -0.709 1.500 1.00 0.00 C ATOM 0 H VAL A 8 5.104 -0.041 0.690 1.00 0.00 H new ATOM 0 HA VAL A 8 3.335 -1.955 2.169 1.00 0.00 H new ATOM 0 HB VAL A 8 2.652 0.473 2.338 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.847 1.589 0.275 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.578 1.194 0.150 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.373 0.189 -0.689 1.00 0.00 H new ATOM 0 HG21 VAL A 8 0.318 0.096 1.569 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.863 -1.293 0.598 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.962 -1.354 2.374 1.00 0.00 H new ATOM 145 N GLY A 9 2.665 -3.116 0.058 1.00 0.00 N ATOM 146 CA GLY A 9 2.385 -3.860 -1.194 1.00 0.00 C ATOM 147 C GLY A 9 0.886 -4.122 -1.247 1.00 0.00 C ATOM 148 O GLY A 9 0.343 -4.827 -0.419 1.00 0.00 O ATOM 0 H GLY A 9 2.356 -3.578 0.913 1.00 0.00 H new ATOM 0 HA2 GLY A 9 2.704 -3.283 -2.062 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.939 -4.799 -1.214 1.00 0.00 H new ATOM 152 N ILE A 10 0.204 -3.571 -2.207 1.00 0.00 N ATOM 153 CA ILE A 10 -1.250 -3.815 -2.282 1.00 0.00 C ATOM 154 C ILE A 10 -1.448 -5.129 -3.019 1.00 0.00 C ATOM 155 O ILE A 10 -0.575 -5.586 -3.730 1.00 0.00 O ATOM 156 CB ILE A 10 -1.963 -2.676 -3.018 1.00 0.00 C ATOM 157 CG1 ILE A 10 -1.244 -1.338 -2.792 1.00 0.00 C ATOM 158 CG2 ILE A 10 -3.385 -2.556 -2.481 1.00 0.00 C ATOM 159 CD1 ILE A 10 -1.671 -0.352 -3.880 1.00 0.00 C ATOM 0 H ILE A 10 0.590 -2.969 -2.934 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.676 -3.863 -1.280 1.00 0.00 H new ATOM 0 HB ILE A 10 -1.964 -2.901 -4.085 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -1.489 -0.941 -1.807 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -0.164 -1.482 -2.818 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -3.902 -1.748 -2.998 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -3.917 -3.493 -2.648 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.354 -2.342 -1.413 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -1.165 0.601 -3.726 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -1.404 -0.751 -4.858 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -2.750 -0.202 -3.832 1.00 0.00 H new ATOM 171 N ILE A 11 -2.558 -5.767 -2.837 1.00 0.00 N ATOM 172 CA ILE A 11 -2.755 -7.079 -3.516 1.00 0.00 C ATOM 173 C ILE A 11 -4.064 -7.075 -4.295 1.00 0.00 C ATOM 174 O ILE A 11 -5.013 -6.425 -3.924 1.00 0.00 O ATOM 175 CB ILE A 11 -2.769 -8.200 -2.470 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.395 -7.625 -1.099 1.00 0.00 C ATOM 177 CG2 ILE A 11 -1.751 -9.272 -2.864 1.00 0.00 C ATOM 178 CD1 ILE A 11 -2.167 -8.757 -0.104 1.00 0.00 C ATOM 0 H ILE A 11 -3.334 -5.448 -2.256 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.935 -7.248 -4.214 1.00 0.00 H new ATOM 0 HB ILE A 11 -3.765 -8.640 -2.421 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -1.494 -7.017 -1.184 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.189 -6.970 -0.741 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -1.758 -10.071 -2.122 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.012 -9.681 -3.840 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.756 -8.829 -2.911 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -1.902 -8.340 0.867 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -3.079 -9.347 -0.009 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.357 -9.395 -0.458 1.00 0.00 H new ATOM 190 N ARG A 12 -4.110 -7.796 -5.378 1.00 0.00 N ATOM 191 CA ARG A 12 -5.349 -7.840 -6.204 1.00 0.00 C ATOM 192 C ARG A 12 -5.405 -9.169 -6.963 1.00 0.00 C ATOM 193 O ARG A 12 -4.570 -9.453 -7.799 1.00 0.00 O ATOM 194 CB ARG A 12 -5.327 -6.680 -7.204 1.00 0.00 C ATOM 195 CG ARG A 12 -6.660 -6.615 -7.952 1.00 0.00 C ATOM 196 CD ARG A 12 -6.846 -5.214 -8.542 1.00 0.00 C ATOM 197 NE ARG A 12 -5.767 -4.943 -9.536 1.00 0.00 N ATOM 198 CZ ARG A 12 -5.886 -3.950 -10.377 1.00 0.00 C ATOM 199 NH1 ARG A 12 -6.844 -3.076 -10.224 1.00 0.00 N ATOM 200 NH2 ARG A 12 -5.048 -3.830 -11.369 1.00 0.00 N ATOM 0 H ARG A 12 -3.337 -8.361 -5.730 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.225 -7.752 -5.561 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.147 -5.741 -6.681 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -4.509 -6.813 -7.912 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -6.680 -7.361 -8.746 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -7.481 -6.848 -7.274 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.823 -5.136 -9.020 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.819 -4.467 -7.748 1.00 0.00 H new ATOM 0 HE ARG A 12 -4.936 -5.533 -9.559 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -7.499 -3.168 -9.448 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -6.937 -2.301 -10.880 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -4.299 -4.512 -11.489 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -5.142 -3.055 -12.025 1.00 0.00 H new ATOM 214 N ASN A 13 -6.379 -9.989 -6.678 1.00 0.00 N ATOM 215 CA ASN A 13 -6.480 -11.299 -7.384 1.00 0.00 C ATOM 216 C ASN A 13 -7.322 -11.140 -8.650 1.00 0.00 C ATOM 217 O ASN A 13 -7.407 -10.074 -9.225 1.00 0.00 O ATOM 218 CB ASN A 13 -7.142 -12.332 -6.472 1.00 0.00 C ATOM 219 CG ASN A 13 -6.346 -13.637 -6.514 1.00 0.00 C ATOM 220 OD1 ASN A 13 -6.446 -14.391 -7.462 1.00 0.00 O ATOM 221 ND2 ASN A 13 -5.553 -13.938 -5.522 1.00 0.00 N ATOM 0 H ASN A 13 -7.109 -9.810 -5.988 1.00 0.00 H new ATOM 0 HA ASN A 13 -5.477 -11.635 -7.649 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -7.187 -11.954 -5.450 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -8.169 -12.510 -6.792 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -5.017 -14.806 -5.542 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -5.469 -13.305 -4.726 1.00 0.00 H new ATOM 228 N GLU A 14 -7.943 -12.201 -9.086 1.00 0.00 N ATOM 229 CA GLU A 14 -8.782 -12.126 -10.317 1.00 0.00 C ATOM 230 C GLU A 14 -10.212 -11.737 -9.948 1.00 0.00 C ATOM 231 O GLU A 14 -11.047 -11.518 -10.803 1.00 0.00 O ATOM 232 CB GLU A 14 -8.798 -13.487 -11.009 1.00 0.00 C ATOM 233 CG GLU A 14 -7.371 -13.895 -11.372 1.00 0.00 C ATOM 234 CD GLU A 14 -7.391 -15.268 -12.047 1.00 0.00 C ATOM 235 OE1 GLU A 14 -7.757 -16.226 -11.387 1.00 0.00 O ATOM 236 OE2 GLU A 14 -7.042 -15.336 -13.215 1.00 0.00 O ATOM 0 H GLU A 14 -7.906 -13.119 -8.643 1.00 0.00 H new ATOM 0 HA GLU A 14 -8.362 -11.376 -10.987 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.245 -14.234 -10.353 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -9.414 -13.442 -11.907 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -6.928 -13.156 -12.040 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.751 -13.927 -10.476 1.00 0.00 H new ATOM 243 N ASN A 15 -10.498 -11.640 -8.682 1.00 0.00 N ATOM 244 CA ASN A 15 -11.869 -11.255 -8.256 1.00 0.00 C ATOM 245 C ASN A 15 -11.889 -9.751 -8.026 1.00 0.00 C ATOM 246 O ASN A 15 -12.597 -9.250 -7.179 1.00 0.00 O ATOM 247 CB ASN A 15 -12.232 -11.983 -6.960 1.00 0.00 C ATOM 248 CG ASN A 15 -13.754 -12.009 -6.800 1.00 0.00 C ATOM 249 OD1 ASN A 15 -14.476 -12.072 -7.773 1.00 0.00 O ATOM 250 ND2 ASN A 15 -14.273 -11.963 -5.603 1.00 0.00 N ATOM 0 H ASN A 15 -9.840 -11.811 -7.922 1.00 0.00 H new ATOM 0 HA ASN A 15 -12.593 -11.528 -9.023 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -11.840 -13.000 -6.979 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -11.774 -11.481 -6.108 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -15.286 -11.980 -5.485 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -13.665 -11.910 -4.785 1.00 0.00 H new ATOM 257 N ASN A 16 -11.123 -9.034 -8.802 1.00 0.00 N ATOM 258 CA ASN A 16 -11.062 -7.571 -8.690 1.00 0.00 C ATOM 259 C ASN A 16 -11.237 -7.130 -7.238 1.00 0.00 C ATOM 260 O ASN A 16 -11.905 -6.159 -6.944 1.00 0.00 O ATOM 261 CB ASN A 16 -12.153 -7.000 -9.562 1.00 0.00 C ATOM 262 CG ASN A 16 -12.229 -7.791 -10.869 1.00 0.00 C ATOM 263 OD1 ASN A 16 -12.614 -8.943 -10.874 1.00 0.00 O ATOM 264 ND2 ASN A 16 -11.871 -7.215 -11.983 1.00 0.00 N ATOM 0 H ASN A 16 -10.523 -9.426 -9.528 1.00 0.00 H new ATOM 0 HA ASN A 16 -10.089 -7.207 -9.018 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -13.110 -7.045 -9.042 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -11.953 -5.949 -9.772 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -11.914 -7.732 -12.861 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -11.548 -6.247 -11.976 1.00 0.00 H new ATOM 271 N GLU A 17 -10.620 -7.832 -6.332 1.00 0.00 N ATOM 272 CA GLU A 17 -10.720 -7.456 -4.897 1.00 0.00 C ATOM 273 C GLU A 17 -9.313 -7.160 -4.381 1.00 0.00 C ATOM 274 O GLU A 17 -8.402 -7.946 -4.556 1.00 0.00 O ATOM 275 CB GLU A 17 -11.322 -8.608 -4.091 1.00 0.00 C ATOM 276 CG GLU A 17 -12.707 -8.958 -4.640 1.00 0.00 C ATOM 277 CD GLU A 17 -13.693 -9.131 -3.481 1.00 0.00 C ATOM 278 OE1 GLU A 17 -13.294 -9.685 -2.470 1.00 0.00 O ATOM 279 OE2 GLU A 17 -14.828 -8.709 -3.625 1.00 0.00 O ATOM 0 H GLU A 17 -10.048 -8.654 -6.525 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.361 -6.581 -4.789 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -10.670 -9.480 -4.143 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -11.398 -8.328 -3.040 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.053 -8.171 -5.310 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.655 -9.875 -5.226 1.00 0.00 H new ATOM 286 N ILE A 18 -9.121 -6.036 -3.756 1.00 0.00 N ATOM 287 CA ILE A 18 -7.762 -5.704 -3.244 1.00 0.00 C ATOM 288 C ILE A 18 -7.731 -5.868 -1.734 1.00 0.00 C ATOM 289 O ILE A 18 -8.710 -5.655 -1.055 1.00 0.00 O ATOM 290 CB ILE A 18 -7.389 -4.254 -3.571 1.00 0.00 C ATOM 291 CG1 ILE A 18 -8.539 -3.557 -4.284 1.00 0.00 C ATOM 292 CG2 ILE A 18 -6.152 -4.219 -4.468 1.00 0.00 C ATOM 293 CD1 ILE A 18 -8.759 -4.198 -5.656 1.00 0.00 C ATOM 0 H ILE A 18 -9.840 -5.335 -3.577 1.00 0.00 H new ATOM 0 HA ILE A 18 -7.052 -6.378 -3.723 1.00 0.00 H new ATOM 0 HB ILE A 18 -7.178 -3.737 -2.635 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -9.448 -3.631 -3.687 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.319 -2.496 -4.399 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.896 -3.184 -4.694 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.317 -4.696 -3.955 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.360 -4.752 -5.396 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -9.583 -3.697 -6.164 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -7.852 -4.101 -6.253 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -8.999 -5.254 -5.530 1.00 0.00 H new ATOM 305 N PHE A 19 -6.596 -6.204 -1.205 1.00 0.00 N ATOM 306 CA PHE A 19 -6.478 -6.348 0.274 1.00 0.00 C ATOM 307 C PHE A 19 -5.879 -5.055 0.817 1.00 0.00 C ATOM 308 O PHE A 19 -4.688 -4.953 1.042 1.00 0.00 O ATOM 309 CB PHE A 19 -5.570 -7.541 0.626 1.00 0.00 C ATOM 310 CG PHE A 19 -5.020 -7.367 2.027 1.00 0.00 C ATOM 311 CD1 PHE A 19 -5.857 -7.557 3.135 1.00 0.00 C ATOM 312 CD2 PHE A 19 -3.682 -6.999 2.218 1.00 0.00 C ATOM 313 CE1 PHE A 19 -5.356 -7.382 4.430 1.00 0.00 C ATOM 314 CE2 PHE A 19 -3.183 -6.823 3.514 1.00 0.00 C ATOM 315 CZ PHE A 19 -4.018 -7.014 4.618 1.00 0.00 C ATOM 0 H PHE A 19 -5.740 -6.387 -1.729 1.00 0.00 H new ATOM 0 HA PHE A 19 -7.457 -6.532 0.716 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -6.133 -8.472 0.559 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.752 -7.612 -0.090 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.889 -7.839 2.989 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -3.036 -6.851 1.366 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.001 -7.531 5.284 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.151 -6.539 3.661 1.00 0.00 H new ATOM 0 HZ PHE A 19 -3.631 -6.878 5.617 1.00 0.00 H new ATOM 325 N ILE A 20 -6.688 -4.053 1.001 1.00 0.00 N ATOM 326 CA ILE A 20 -6.163 -2.767 1.494 1.00 0.00 C ATOM 327 C ILE A 20 -6.268 -2.704 3.014 1.00 0.00 C ATOM 328 O ILE A 20 -6.355 -3.709 3.690 1.00 0.00 O ATOM 329 CB ILE A 20 -6.997 -1.643 0.856 1.00 0.00 C ATOM 330 CG1 ILE A 20 -6.223 -0.319 0.777 1.00 0.00 C ATOM 331 CG2 ILE A 20 -8.279 -1.418 1.662 1.00 0.00 C ATOM 332 CD1 ILE A 20 -4.751 -0.504 1.162 1.00 0.00 C ATOM 0 H ILE A 20 -7.693 -4.076 0.829 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.112 -2.658 1.225 1.00 0.00 H new ATOM 0 HB ILE A 20 -7.235 -1.961 -0.159 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -6.288 0.082 -0.235 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -6.684 0.413 1.440 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -8.863 -0.620 1.202 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -8.866 -2.336 1.675 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -8.022 -1.137 2.683 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -4.234 0.453 1.095 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -4.686 -0.880 2.183 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.284 -1.217 0.482 1.00 0.00 H new ATOM 344 N THR A 21 -6.271 -1.520 3.550 1.00 0.00 N ATOM 345 CA THR A 21 -6.388 -1.371 5.021 1.00 0.00 C ATOM 346 C THR A 21 -7.573 -0.454 5.322 1.00 0.00 C ATOM 347 O THR A 21 -8.123 0.156 4.432 1.00 0.00 O ATOM 348 CB THR A 21 -5.102 -0.771 5.577 1.00 0.00 C ATOM 349 OG1 THR A 21 -4.045 -1.007 4.660 1.00 0.00 O ATOM 350 CG2 THR A 21 -4.772 -1.423 6.919 1.00 0.00 C ATOM 0 H THR A 21 -6.197 -0.646 3.030 1.00 0.00 H new ATOM 0 HA THR A 21 -6.548 -2.342 5.489 1.00 0.00 H new ATOM 0 HB THR A 21 -5.229 0.302 5.721 1.00 0.00 H new ATOM 0 HG1 THR A 21 -3.971 -1.969 4.486 1.00 0.00 H new ATOM 0 HG21 THR A 21 -3.852 -0.993 7.316 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.587 -1.245 7.620 1.00 0.00 H new ATOM 0 HG23 THR A 21 -4.641 -2.496 6.780 1.00 0.00 H new ATOM 358 N ARG A 22 -7.989 -0.357 6.556 1.00 0.00 N ATOM 359 CA ARG A 22 -9.138 0.514 6.875 1.00 0.00 C ATOM 360 C ARG A 22 -9.152 0.855 8.363 1.00 0.00 C ATOM 361 O ARG A 22 -8.134 0.856 9.025 1.00 0.00 O ATOM 362 CB ARG A 22 -10.426 -0.202 6.502 1.00 0.00 C ATOM 363 CG ARG A 22 -11.355 0.813 5.861 1.00 0.00 C ATOM 364 CD ARG A 22 -12.353 0.103 4.944 1.00 0.00 C ATOM 365 NE ARG A 22 -13.561 -0.285 5.726 1.00 0.00 N ATOM 366 CZ ARG A 22 -14.655 -0.632 5.104 1.00 0.00 C ATOM 367 NH1 ARG A 22 -14.590 -1.371 4.032 1.00 0.00 N ATOM 368 NH2 ARG A 22 -15.815 -0.240 5.557 1.00 0.00 N ATOM 0 H ARG A 22 -7.578 -0.846 7.351 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.051 1.440 6.307 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.221 -1.021 5.812 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -10.890 -0.639 7.387 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -11.889 1.368 6.633 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -10.776 1.538 5.290 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.636 0.759 4.120 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.893 -0.782 4.504 1.00 0.00 H new ATOM 0 HE ARG A 22 -13.533 -0.279 6.746 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.684 -1.679 3.679 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -15.445 -1.642 3.547 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -15.866 0.337 6.396 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -16.670 -0.511 5.071 1.00 0.00 H new ATOM 382 N ARG A 23 -10.308 1.152 8.886 1.00 0.00 N ATOM 383 CA ARG A 23 -10.423 1.504 10.317 1.00 0.00 C ATOM 384 C ARG A 23 -9.594 0.536 11.161 1.00 0.00 C ATOM 385 O ARG A 23 -9.986 -0.589 11.400 1.00 0.00 O ATOM 386 CB ARG A 23 -11.890 1.412 10.717 1.00 0.00 C ATOM 387 CG ARG A 23 -12.520 0.165 10.098 1.00 0.00 C ATOM 388 CD ARG A 23 -13.726 -0.265 10.938 1.00 0.00 C ATOM 389 NE ARG A 23 -13.859 -1.749 10.908 1.00 0.00 N ATOM 390 CZ ARG A 23 -13.559 -2.413 9.825 1.00 0.00 C ATOM 391 NH1 ARG A 23 -14.465 -2.600 8.904 1.00 0.00 N ATOM 392 NH2 ARG A 23 -12.352 -2.880 9.660 1.00 0.00 N ATOM 0 H ARG A 23 -11.188 1.164 8.370 1.00 0.00 H new ATOM 0 HA ARG A 23 -10.051 2.515 10.483 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -11.978 1.374 11.803 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -12.423 2.303 10.385 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -12.831 0.371 9.074 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -11.788 -0.641 10.053 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -13.606 0.078 11.966 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -14.634 0.198 10.552 1.00 0.00 H new ATOM 0 HE ARG A 23 -14.185 -2.247 11.736 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -15.406 -2.227 9.031 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -14.232 -3.119 8.057 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -11.643 -2.726 10.377 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -12.117 -3.399 8.814 1.00 0.00 H new ATOM 406 N ALA A 24 -8.454 0.970 11.618 1.00 0.00 N ATOM 407 CA ALA A 24 -7.598 0.084 12.452 1.00 0.00 C ATOM 408 C ALA A 24 -7.010 0.894 13.608 1.00 0.00 C ATOM 409 O ALA A 24 -5.992 0.544 14.172 1.00 0.00 O ATOM 410 CB ALA A 24 -6.464 -0.481 11.596 1.00 0.00 C ATOM 0 H ALA A 24 -8.077 1.903 11.449 1.00 0.00 H new ATOM 0 HA ALA A 24 -8.196 -0.737 12.848 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.836 -1.130 12.206 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -6.883 -1.054 10.769 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -5.863 0.338 11.202 1.00 0.00 H new ATOM 416 N ALA A 25 -7.643 1.978 13.964 1.00 0.00 N ATOM 417 CA ALA A 25 -7.124 2.815 15.081 1.00 0.00 C ATOM 418 C ALA A 25 -8.037 4.026 15.276 1.00 0.00 C ATOM 419 O ALA A 25 -7.870 5.050 14.643 1.00 0.00 O ATOM 420 CB ALA A 25 -5.710 3.294 14.745 1.00 0.00 C ATOM 0 H ALA A 25 -8.499 2.320 13.528 1.00 0.00 H new ATOM 0 HA ALA A 25 -7.101 2.225 15.997 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.330 3.907 15.562 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -5.058 2.432 14.604 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.734 3.885 13.829 1.00 0.00 H new ATOM 426 N ASP A 26 -9.003 3.919 16.144 1.00 0.00 N ATOM 427 CA ASP A 26 -9.928 5.066 16.376 1.00 0.00 C ATOM 428 C ASP A 26 -10.352 5.655 15.028 1.00 0.00 C ATOM 429 O ASP A 26 -9.870 6.692 14.616 1.00 0.00 O ATOM 430 CB ASP A 26 -9.222 6.149 17.199 1.00 0.00 C ATOM 431 CG ASP A 26 -8.093 5.528 18.025 1.00 0.00 C ATOM 432 OD1 ASP A 26 -8.314 4.470 18.593 1.00 0.00 O ATOM 433 OD2 ASP A 26 -7.027 6.120 18.076 1.00 0.00 O ATOM 0 H ASP A 26 -9.193 3.088 16.704 1.00 0.00 H new ATOM 0 HA ASP A 26 -10.805 4.714 16.920 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -8.820 6.916 16.537 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -9.938 6.641 17.858 1.00 0.00 H new ATOM 438 N ALA A 27 -11.252 5.007 14.339 1.00 0.00 N ATOM 439 CA ALA A 27 -11.701 5.538 13.021 1.00 0.00 C ATOM 440 C ALA A 27 -12.906 4.736 12.529 1.00 0.00 C ATOM 441 O ALA A 27 -12.768 3.779 11.795 1.00 0.00 O ATOM 442 CB ALA A 27 -10.559 5.419 12.008 1.00 0.00 C ATOM 0 H ALA A 27 -11.694 4.136 14.631 1.00 0.00 H new ATOM 0 HA ALA A 27 -11.984 6.585 13.129 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -10.886 5.807 11.043 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -9.701 5.993 12.358 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -10.276 4.372 11.901 1.00 0.00 H new ATOM 448 N HIS A 28 -14.091 5.116 12.926 1.00 0.00 N ATOM 449 CA HIS A 28 -15.301 4.369 12.477 1.00 0.00 C ATOM 450 C HIS A 28 -16.185 5.285 11.630 1.00 0.00 C ATOM 451 O HIS A 28 -17.086 4.836 10.950 1.00 0.00 O ATOM 452 CB HIS A 28 -16.086 3.891 13.697 1.00 0.00 C ATOM 453 CG HIS A 28 -15.255 2.905 14.471 1.00 0.00 C ATOM 454 ND1 HIS A 28 -14.178 2.242 13.903 1.00 0.00 N ATOM 455 CD2 HIS A 28 -15.330 2.460 15.767 1.00 0.00 C ATOM 456 CE1 HIS A 28 -13.654 1.441 14.848 1.00 0.00 C ATOM 457 NE2 HIS A 28 -14.317 1.536 16.003 1.00 0.00 N ATOM 0 H HIS A 28 -14.273 5.910 13.540 1.00 0.00 H new ATOM 0 HA HIS A 28 -14.995 3.509 11.881 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -16.347 4.739 14.330 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -17.021 3.428 13.383 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -16.063 2.778 16.493 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -12.800 0.799 14.691 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -14.123 1.038 16.872 1.00 0.00 H new ATOM 465 N MET A 29 -15.941 6.566 11.666 1.00 0.00 N ATOM 466 CA MET A 29 -16.772 7.506 10.864 1.00 0.00 C ATOM 467 C MET A 29 -15.960 8.021 9.675 1.00 0.00 C ATOM 468 O MET A 29 -14.811 8.393 9.815 1.00 0.00 O ATOM 469 CB MET A 29 -17.193 8.684 11.744 1.00 0.00 C ATOM 470 CG MET A 29 -18.582 9.168 11.322 1.00 0.00 C ATOM 471 SD MET A 29 -19.145 10.456 12.461 1.00 0.00 S ATOM 472 CE MET A 29 -20.503 9.521 13.205 1.00 0.00 C ATOM 0 H MET A 29 -15.201 7.002 12.217 1.00 0.00 H new ATOM 0 HA MET A 29 -17.658 6.988 10.498 1.00 0.00 H new ATOM 0 HB2 MET A 29 -17.204 8.383 12.792 1.00 0.00 H new ATOM 0 HB3 MET A 29 -16.471 9.495 11.653 1.00 0.00 H new ATOM 0 HG2 MET A 29 -18.549 9.557 10.304 1.00 0.00 H new ATOM 0 HG3 MET A 29 -19.285 8.335 11.323 1.00 0.00 H new ATOM 0 HE1 MET A 29 -21.002 10.137 13.954 1.00 0.00 H new ATOM 0 HE2 MET A 29 -21.218 9.240 12.432 1.00 0.00 H new ATOM 0 HE3 MET A 29 -20.109 8.622 13.679 1.00 0.00 H new ATOM 482 N ALA A 30 -16.552 8.040 8.507 1.00 0.00 N ATOM 483 CA ALA A 30 -15.833 8.527 7.289 1.00 0.00 C ATOM 484 C ALA A 30 -14.992 7.395 6.686 1.00 0.00 C ATOM 485 O ALA A 30 -14.654 7.418 5.520 1.00 0.00 O ATOM 486 CB ALA A 30 -14.921 9.700 7.652 1.00 0.00 C ATOM 0 H ALA A 30 -17.512 7.736 8.344 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.571 8.857 6.557 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.402 10.047 6.759 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -15.520 10.513 8.063 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -14.190 9.377 8.393 1.00 0.00 H new ATOM 492 N ASN A 31 -14.650 6.406 7.466 1.00 0.00 N ATOM 493 CA ASN A 31 -13.833 5.284 6.926 1.00 0.00 C ATOM 494 C ASN A 31 -12.506 5.828 6.398 1.00 0.00 C ATOM 495 O ASN A 31 -12.469 6.602 5.462 1.00 0.00 O ATOM 496 CB ASN A 31 -14.594 4.600 5.790 1.00 0.00 C ATOM 497 CG ASN A 31 -16.091 4.611 6.100 1.00 0.00 C ATOM 498 OD1 ASN A 31 -16.512 4.130 7.133 1.00 0.00 O ATOM 499 ND2 ASN A 31 -16.918 5.148 5.246 1.00 0.00 N ATOM 0 H ASN A 31 -14.901 6.327 8.452 1.00 0.00 H new ATOM 0 HA ASN A 31 -13.639 4.561 7.719 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -14.403 5.115 4.848 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -14.244 3.575 5.669 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -17.918 5.164 5.446 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -16.564 5.552 4.379 1.00 0.00 H new ATOM 506 N LYS A 32 -11.416 5.430 6.990 1.00 0.00 N ATOM 507 CA LYS A 32 -10.091 5.926 6.525 1.00 0.00 C ATOM 508 C LYS A 32 -9.141 4.741 6.344 1.00 0.00 C ATOM 509 O LYS A 32 -9.075 3.853 7.172 1.00 0.00 O ATOM 510 CB LYS A 32 -9.518 6.890 7.566 1.00 0.00 C ATOM 511 CG LYS A 32 -10.272 8.220 7.500 1.00 0.00 C ATOM 512 CD LYS A 32 -10.250 8.748 6.065 1.00 0.00 C ATOM 513 CE LYS A 32 -10.098 10.271 6.084 1.00 0.00 C ATOM 514 NZ LYS A 32 -11.195 10.868 6.895 1.00 0.00 N ATOM 0 H LYS A 32 -11.385 4.782 7.777 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.206 6.446 5.574 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.606 6.459 8.563 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.456 7.052 7.381 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.301 8.084 7.833 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -9.813 8.944 8.172 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.426 8.296 5.513 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -11.169 8.470 5.550 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.130 10.546 6.503 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.128 10.663 5.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.272 11.883 6.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -12.093 10.397 6.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.987 10.742 7.906 1.00 0.00 H new ATOM 528 N LEU A 33 -8.400 4.719 5.270 1.00 0.00 N ATOM 529 CA LEU A 33 -7.452 3.594 5.047 1.00 0.00 C ATOM 530 C LEU A 33 -6.124 4.142 4.574 1.00 0.00 C ATOM 531 O LEU A 33 -5.942 5.333 4.437 1.00 0.00 O ATOM 532 CB LEU A 33 -7.996 2.643 3.996 1.00 0.00 C ATOM 533 CG LEU A 33 -8.430 3.421 2.762 1.00 0.00 C ATOM 534 CD1 LEU A 33 -7.664 2.897 1.549 1.00 0.00 C ATOM 535 CD2 LEU A 33 -9.930 3.225 2.547 1.00 0.00 C ATOM 0 H LEU A 33 -8.411 5.431 4.539 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.323 3.054 5.985 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.233 1.913 3.726 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.841 2.086 4.401 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.219 4.482 2.896 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -7.969 3.449 0.660 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.594 3.030 1.709 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -7.882 1.838 1.411 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -10.247 3.780 1.664 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.142 2.165 2.404 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.473 3.589 3.419 1.00 0.00 H new ATOM 547 N GLU A 34 -5.189 3.284 4.325 1.00 0.00 N ATOM 548 CA GLU A 34 -3.866 3.773 3.864 1.00 0.00 C ATOM 549 C GLU A 34 -3.053 2.634 3.273 1.00 0.00 C ATOM 550 O GLU A 34 -3.574 1.637 2.820 1.00 0.00 O ATOM 551 CB GLU A 34 -3.106 4.371 5.047 1.00 0.00 C ATOM 552 CG GLU A 34 -2.272 5.565 4.576 1.00 0.00 C ATOM 553 CD GLU A 34 -1.033 5.705 5.462 1.00 0.00 C ATOM 554 OE1 GLU A 34 -0.527 4.685 5.903 1.00 0.00 O ATOM 555 OE2 GLU A 34 -0.611 6.827 5.685 1.00 0.00 O ATOM 0 H GLU A 34 -5.278 2.272 4.418 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.021 4.532 3.097 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -3.807 4.687 5.819 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -2.458 3.617 5.494 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -1.975 5.427 3.536 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -2.867 6.477 4.619 1.00 0.00 H new ATOM 562 N PHE A 35 -1.763 2.784 3.302 1.00 0.00 N ATOM 563 CA PHE A 35 -0.861 1.729 2.775 1.00 0.00 C ATOM 564 C PHE A 35 0.095 1.310 3.898 1.00 0.00 C ATOM 565 O PHE A 35 1.126 1.923 4.093 1.00 0.00 O ATOM 566 CB PHE A 35 -0.060 2.284 1.594 1.00 0.00 C ATOM 567 CG PHE A 35 -0.908 3.281 0.837 1.00 0.00 C ATOM 568 CD1 PHE A 35 -1.027 4.595 1.302 1.00 0.00 C ATOM 569 CD2 PHE A 35 -1.576 2.889 -0.330 1.00 0.00 C ATOM 570 CE1 PHE A 35 -1.813 5.519 0.603 1.00 0.00 C ATOM 571 CE2 PHE A 35 -2.363 3.811 -1.030 1.00 0.00 C ATOM 572 CZ PHE A 35 -2.482 5.126 -0.563 1.00 0.00 C ATOM 0 H PHE A 35 -1.288 3.606 3.674 1.00 0.00 H new ATOM 0 HA PHE A 35 -1.440 0.870 2.436 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.852 2.763 1.951 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.244 1.472 0.933 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.512 4.897 2.202 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.484 1.875 -0.690 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.903 6.533 0.962 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.878 3.508 -1.930 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.090 5.837 -1.102 1.00 0.00 H new ATOM 582 N PRO A 36 -0.288 0.283 4.613 1.00 0.00 N ATOM 583 CA PRO A 36 0.505 -0.236 5.742 1.00 0.00 C ATOM 584 C PRO A 36 1.914 -0.616 5.285 1.00 0.00 C ATOM 585 O PRO A 36 2.433 -0.083 4.326 1.00 0.00 O ATOM 586 CB PRO A 36 -0.262 -1.475 6.222 1.00 0.00 C ATOM 587 CG PRO A 36 -1.554 -1.587 5.374 1.00 0.00 C ATOM 588 CD PRO A 36 -1.541 -0.444 4.350 1.00 0.00 C ATOM 0 HA PRO A 36 0.628 0.504 6.533 1.00 0.00 H new ATOM 0 HB2 PRO A 36 0.349 -2.371 6.109 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -0.506 -1.387 7.281 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.598 -2.552 4.869 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.436 -1.520 6.011 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -1.570 -0.827 3.330 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -2.408 0.205 4.471 1.00 0.00 H new ATOM 596 N GLY A 37 2.541 -1.531 5.971 1.00 0.00 N ATOM 597 CA GLY A 37 3.917 -1.940 5.578 1.00 0.00 C ATOM 598 C GLY A 37 4.765 -2.146 6.834 1.00 0.00 C ATOM 599 O GLY A 37 4.257 -2.443 7.896 1.00 0.00 O ATOM 0 H GLY A 37 2.160 -2.012 6.786 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.882 -2.860 4.995 1.00 0.00 H new ATOM 0 HA3 GLY A 37 4.367 -1.177 4.943 1.00 0.00 H new ATOM 603 N GLY A 38 6.055 -1.990 6.720 1.00 0.00 N ATOM 604 CA GLY A 38 6.934 -2.176 7.908 1.00 0.00 C ATOM 605 C GLY A 38 8.153 -1.260 7.792 1.00 0.00 C ATOM 606 O GLY A 38 9.188 -1.513 8.373 1.00 0.00 O ATOM 0 H GLY A 38 6.538 -1.742 5.856 1.00 0.00 H new ATOM 0 HA2 GLY A 38 6.382 -1.950 8.820 1.00 0.00 H new ATOM 0 HA3 GLY A 38 7.253 -3.216 7.978 1.00 0.00 H new ATOM 610 N LYS A 39 8.039 -0.198 7.043 1.00 0.00 N ATOM 611 CA LYS A 39 9.194 0.730 6.889 1.00 0.00 C ATOM 612 C LYS A 39 10.244 0.081 5.988 1.00 0.00 C ATOM 613 O LYS A 39 10.258 -1.120 5.799 1.00 0.00 O ATOM 614 CB LYS A 39 9.806 1.020 8.261 1.00 0.00 C ATOM 615 CG LYS A 39 9.887 2.533 8.470 1.00 0.00 C ATOM 616 CD LYS A 39 9.497 2.872 9.910 1.00 0.00 C ATOM 617 CE LYS A 39 10.757 3.211 10.709 1.00 0.00 C ATOM 618 NZ LYS A 39 10.418 3.298 12.157 1.00 0.00 N ATOM 0 H LYS A 39 7.197 0.067 6.532 1.00 0.00 H new ATOM 0 HA LYS A 39 8.855 1.664 6.442 1.00 0.00 H new ATOM 0 HB2 LYS A 39 9.201 0.565 9.045 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.800 0.578 8.329 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.897 2.886 8.263 1.00 0.00 H new ATOM 0 HG3 LYS A 39 9.223 3.043 7.773 1.00 0.00 H new ATOM 0 HD2 LYS A 39 8.807 3.715 9.923 1.00 0.00 H new ATOM 0 HD3 LYS A 39 8.979 2.029 10.367 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.519 2.448 10.548 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.175 4.157 10.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 11.274 3.528 12.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 9.705 4.041 12.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 10.038 2.385 12.480 1.00 0.00 H new ATOM 632 N ILE A 40 11.125 0.863 5.429 1.00 0.00 N ATOM 633 CA ILE A 40 12.171 0.287 4.541 1.00 0.00 C ATOM 634 C ILE A 40 13.493 0.201 5.305 1.00 0.00 C ATOM 635 O ILE A 40 13.940 1.156 5.908 1.00 0.00 O ATOM 636 CB ILE A 40 12.335 1.179 3.306 1.00 0.00 C ATOM 637 CG1 ILE A 40 13.128 0.430 2.235 1.00 0.00 C ATOM 638 CG2 ILE A 40 13.077 2.461 3.684 1.00 0.00 C ATOM 639 CD1 ILE A 40 12.554 0.760 0.856 1.00 0.00 C ATOM 0 H ILE A 40 11.165 1.875 5.549 1.00 0.00 H new ATOM 0 HA ILE A 40 11.877 -0.713 4.223 1.00 0.00 H new ATOM 0 HB ILE A 40 11.349 1.436 2.918 1.00 0.00 H new ATOM 0 HG12 ILE A 40 14.180 0.713 2.281 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.079 -0.644 2.414 1.00 0.00 H new ATOM 0 HG21 ILE A 40 13.190 3.090 2.801 1.00 0.00 H new ATOM 0 HG22 ILE A 40 12.510 3.000 4.443 1.00 0.00 H new ATOM 0 HG23 ILE A 40 14.062 2.209 4.078 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.118 0.227 0.090 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.508 0.455 0.815 1.00 0.00 H new ATOM 0 HD13 ILE A 40 12.626 1.833 0.679 1.00 0.00 H new ATOM 651 N GLU A 41 14.119 -0.944 5.293 1.00 0.00 N ATOM 652 CA GLU A 41 15.408 -1.096 6.023 1.00 0.00 C ATOM 653 C GLU A 41 16.470 -1.640 5.075 1.00 0.00 C ATOM 654 O GLU A 41 17.394 -0.952 4.688 1.00 0.00 O ATOM 655 CB GLU A 41 15.223 -2.066 7.193 1.00 0.00 C ATOM 656 CG GLU A 41 13.912 -1.753 7.917 1.00 0.00 C ATOM 657 CD GLU A 41 14.002 -2.234 9.366 1.00 0.00 C ATOM 658 OE1 GLU A 41 13.899 -3.431 9.580 1.00 0.00 O ATOM 659 OE2 GLU A 41 14.172 -1.397 10.238 1.00 0.00 O ATOM 0 H GLU A 41 13.793 -1.781 4.809 1.00 0.00 H new ATOM 0 HA GLU A 41 15.725 -0.125 6.403 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.213 -3.093 6.829 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.061 -1.982 7.885 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.716 -0.681 7.890 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.079 -2.242 7.411 1.00 0.00 H new ATOM 666 N MET A 42 16.338 -2.873 4.705 1.00 0.00 N ATOM 667 CA MET A 42 17.328 -3.491 3.781 1.00 0.00 C ATOM 668 C MET A 42 16.717 -3.602 2.383 1.00 0.00 C ATOM 669 O MET A 42 15.832 -4.399 2.140 1.00 0.00 O ATOM 670 CB MET A 42 17.697 -4.885 4.293 1.00 0.00 C ATOM 671 CG MET A 42 19.018 -4.811 5.060 1.00 0.00 C ATOM 672 SD MET A 42 18.840 -3.689 6.470 1.00 0.00 S ATOM 673 CE MET A 42 20.228 -4.328 7.437 1.00 0.00 C ATOM 0 H MET A 42 15.582 -3.490 5.003 1.00 0.00 H new ATOM 0 HA MET A 42 18.224 -2.872 3.736 1.00 0.00 H new ATOM 0 HB2 MET A 42 16.908 -5.267 4.941 1.00 0.00 H new ATOM 0 HB3 MET A 42 17.787 -5.579 3.458 1.00 0.00 H new ATOM 0 HG2 MET A 42 19.305 -5.804 5.406 1.00 0.00 H new ATOM 0 HG3 MET A 42 19.813 -4.461 4.402 1.00 0.00 H new ATOM 0 HE1 MET A 42 20.309 -3.770 8.370 1.00 0.00 H new ATOM 0 HE2 MET A 42 20.063 -5.383 7.657 1.00 0.00 H new ATOM 0 HE3 MET A 42 21.150 -4.217 6.867 1.00 0.00 H new ATOM 683 N GLY A 43 17.179 -2.803 1.461 1.00 0.00 N ATOM 684 CA GLY A 43 16.626 -2.855 0.078 1.00 0.00 C ATOM 685 C GLY A 43 17.216 -1.710 -0.747 1.00 0.00 C ATOM 686 O GLY A 43 17.404 -0.614 -0.257 1.00 0.00 O ATOM 0 H GLY A 43 17.918 -2.115 1.606 1.00 0.00 H new ATOM 0 HA2 GLY A 43 16.864 -3.812 -0.385 1.00 0.00 H new ATOM 0 HA3 GLY A 43 15.539 -2.776 0.106 1.00 0.00 H new ATOM 690 N GLU A 44 17.519 -1.956 -1.992 1.00 0.00 N ATOM 691 CA GLU A 44 18.106 -0.879 -2.839 1.00 0.00 C ATOM 692 C GLU A 44 17.075 -0.399 -3.864 1.00 0.00 C ATOM 693 O GLU A 44 17.272 0.601 -4.526 1.00 0.00 O ATOM 694 CB GLU A 44 19.337 -1.421 -3.567 1.00 0.00 C ATOM 695 CG GLU A 44 20.560 -0.590 -3.179 1.00 0.00 C ATOM 696 CD GLU A 44 21.810 -1.472 -3.205 1.00 0.00 C ATOM 697 OE1 GLU A 44 21.969 -2.212 -4.161 1.00 0.00 O ATOM 698 OE2 GLU A 44 22.587 -1.392 -2.267 1.00 0.00 O ATOM 0 H GLU A 44 17.386 -2.853 -2.458 1.00 0.00 H new ATOM 0 HA GLU A 44 18.394 -0.041 -2.205 1.00 0.00 H new ATOM 0 HB2 GLU A 44 19.496 -2.467 -3.306 1.00 0.00 H new ATOM 0 HB3 GLU A 44 19.183 -1.381 -4.645 1.00 0.00 H new ATOM 0 HG2 GLU A 44 20.678 0.246 -3.869 1.00 0.00 H new ATOM 0 HG3 GLU A 44 20.423 -0.165 -2.184 1.00 0.00 H new ATOM 705 N THR A 45 15.977 -1.093 -4.005 1.00 0.00 N ATOM 706 CA THR A 45 14.954 -0.653 -4.989 1.00 0.00 C ATOM 707 C THR A 45 13.553 -0.987 -4.468 1.00 0.00 C ATOM 708 O THR A 45 13.403 -1.565 -3.410 1.00 0.00 O ATOM 709 CB THR A 45 15.179 -1.358 -6.325 1.00 0.00 C ATOM 710 OG1 THR A 45 16.292 -2.233 -6.213 1.00 0.00 O ATOM 711 CG2 THR A 45 15.443 -0.310 -7.408 1.00 0.00 C ATOM 0 H THR A 45 15.748 -1.939 -3.484 1.00 0.00 H new ATOM 0 HA THR A 45 15.041 0.424 -5.130 1.00 0.00 H new ATOM 0 HB THR A 45 14.296 -1.937 -6.593 1.00 0.00 H new ATOM 0 HG1 THR A 45 16.438 -2.688 -7.069 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.604 -0.808 -8.364 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.584 0.357 -7.486 1.00 0.00 H new ATOM 0 HG23 THR A 45 16.329 0.269 -7.146 1.00 0.00 H new ATOM 719 N PRO A 46 12.571 -0.591 -5.232 1.00 0.00 N ATOM 720 CA PRO A 46 11.159 -0.809 -4.880 1.00 0.00 C ATOM 721 C PRO A 46 10.773 -2.279 -5.088 1.00 0.00 C ATOM 722 O PRO A 46 9.675 -2.692 -4.777 1.00 0.00 O ATOM 723 CB PRO A 46 10.384 0.087 -5.858 1.00 0.00 C ATOM 724 CG PRO A 46 11.399 0.628 -6.900 1.00 0.00 C ATOM 725 CD PRO A 46 12.786 0.116 -6.504 1.00 0.00 C ATOM 0 HA PRO A 46 10.949 -0.575 -3.836 1.00 0.00 H new ATOM 0 HB2 PRO A 46 9.593 -0.478 -6.351 1.00 0.00 H new ATOM 0 HB3 PRO A 46 9.905 0.909 -5.327 1.00 0.00 H new ATOM 0 HG2 PRO A 46 11.137 0.288 -7.902 1.00 0.00 H new ATOM 0 HG3 PRO A 46 11.384 1.718 -6.919 1.00 0.00 H new ATOM 0 HD2 PRO A 46 13.194 -0.550 -7.264 1.00 0.00 H new ATOM 0 HD3 PRO A 46 13.493 0.937 -6.387 1.00 0.00 H new ATOM 733 N GLU A 47 11.668 -3.069 -5.617 1.00 0.00 N ATOM 734 CA GLU A 47 11.359 -4.502 -5.854 1.00 0.00 C ATOM 735 C GLU A 47 12.082 -5.343 -4.806 1.00 0.00 C ATOM 736 O GLU A 47 11.572 -6.330 -4.319 1.00 0.00 O ATOM 737 CB GLU A 47 11.866 -4.883 -7.239 1.00 0.00 C ATOM 738 CG GLU A 47 10.702 -4.880 -8.235 1.00 0.00 C ATOM 739 CD GLU A 47 10.961 -5.921 -9.326 1.00 0.00 C ATOM 740 OE1 GLU A 47 10.709 -7.087 -9.076 1.00 0.00 O ATOM 741 OE2 GLU A 47 11.409 -5.533 -10.393 1.00 0.00 O ATOM 0 H GLU A 47 12.605 -2.778 -5.896 1.00 0.00 H new ATOM 0 HA GLU A 47 10.285 -4.675 -5.788 1.00 0.00 H new ATOM 0 HB2 GLU A 47 12.635 -4.180 -7.561 1.00 0.00 H new ATOM 0 HB3 GLU A 47 12.329 -5.870 -7.209 1.00 0.00 H new ATOM 0 HG2 GLU A 47 9.768 -5.103 -7.719 1.00 0.00 H new ATOM 0 HG3 GLU A 47 10.593 -3.891 -8.680 1.00 0.00 H new ATOM 748 N GLN A 48 13.271 -4.942 -4.460 1.00 0.00 N ATOM 749 CA GLN A 48 14.065 -5.669 -3.450 1.00 0.00 C ATOM 750 C GLN A 48 13.470 -5.413 -2.083 1.00 0.00 C ATOM 751 O GLN A 48 13.100 -6.311 -1.358 1.00 0.00 O ATOM 752 CB GLN A 48 15.488 -5.123 -3.479 1.00 0.00 C ATOM 753 CG GLN A 48 16.446 -6.244 -3.838 1.00 0.00 C ATOM 754 CD GLN A 48 17.860 -5.680 -3.993 1.00 0.00 C ATOM 755 OE1 GLN A 48 18.270 -4.824 -3.235 1.00 0.00 O ATOM 756 NE2 GLN A 48 18.631 -6.126 -4.949 1.00 0.00 N ATOM 0 H GLN A 48 13.732 -4.119 -4.848 1.00 0.00 H new ATOM 0 HA GLN A 48 14.063 -6.739 -3.660 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.565 -4.315 -4.207 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.749 -4.703 -2.508 1.00 0.00 H new ATOM 0 HG2 GLN A 48 16.432 -7.010 -3.063 1.00 0.00 H new ATOM 0 HG3 GLN A 48 16.131 -6.723 -4.765 1.00 0.00 H new ATOM 0 HE21 GLN A 48 18.289 -6.845 -5.587 1.00 0.00 H new ATOM 0 HE22 GLN A 48 19.575 -5.755 -5.058 1.00 0.00 H new ATOM 765 N ALA A 49 13.396 -4.176 -1.738 1.00 0.00 N ATOM 766 CA ALA A 49 12.838 -3.797 -0.417 1.00 0.00 C ATOM 767 C ALA A 49 11.541 -4.572 -0.168 1.00 0.00 C ATOM 768 O ALA A 49 11.302 -5.073 0.912 1.00 0.00 O ATOM 769 CB ALA A 49 12.553 -2.294 -0.384 1.00 0.00 C ATOM 0 H ALA A 49 13.701 -3.394 -2.318 1.00 0.00 H new ATOM 0 HA ALA A 49 13.562 -4.040 0.361 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.143 -2.023 0.589 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.479 -1.744 -0.554 1.00 0.00 H new ATOM 0 HB3 ALA A 49 11.834 -2.043 -1.163 1.00 0.00 H new ATOM 775 N VAL A 50 10.704 -4.673 -1.164 1.00 0.00 N ATOM 776 CA VAL A 50 9.425 -5.414 -1.003 1.00 0.00 C ATOM 777 C VAL A 50 9.693 -6.902 -1.122 1.00 0.00 C ATOM 778 O VAL A 50 8.996 -7.723 -0.567 1.00 0.00 O ATOM 779 CB VAL A 50 8.480 -4.988 -2.104 1.00 0.00 C ATOM 780 CG1 VAL A 50 9.056 -5.409 -3.456 1.00 0.00 C ATOM 781 CG2 VAL A 50 7.119 -5.646 -1.900 1.00 0.00 C ATOM 0 H VAL A 50 10.854 -4.270 -2.089 1.00 0.00 H new ATOM 0 HA VAL A 50 8.986 -5.200 -0.029 1.00 0.00 H new ATOM 0 HB VAL A 50 8.360 -3.905 -2.079 1.00 0.00 H new ATOM 0 HG11 VAL A 50 8.377 -5.103 -4.252 1.00 0.00 H new ATOM 0 HG12 VAL A 50 10.025 -4.932 -3.603 1.00 0.00 H new ATOM 0 HG13 VAL A 50 9.177 -6.492 -3.479 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.442 -5.336 -2.696 1.00 0.00 H new ATOM 0 HG22 VAL A 50 7.232 -6.730 -1.922 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.709 -5.343 -0.936 1.00 0.00 H new ATOM 791 N VAL A 51 10.707 -7.251 -1.841 1.00 0.00 N ATOM 792 CA VAL A 51 11.044 -8.680 -1.994 1.00 0.00 C ATOM 793 C VAL A 51 11.193 -9.277 -0.596 1.00 0.00 C ATOM 794 O VAL A 51 10.545 -10.235 -0.225 1.00 0.00 O ATOM 795 CB VAL A 51 12.363 -8.769 -2.801 1.00 0.00 C ATOM 796 CG1 VAL A 51 13.563 -9.198 -1.945 1.00 0.00 C ATOM 797 CG2 VAL A 51 12.184 -9.776 -3.913 1.00 0.00 C ATOM 0 H VAL A 51 11.322 -6.604 -2.334 1.00 0.00 H new ATOM 0 HA VAL A 51 10.273 -9.236 -2.527 1.00 0.00 H new ATOM 0 HB VAL A 51 12.575 -7.771 -3.186 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.457 -9.242 -2.567 1.00 0.00 H new ATOM 0 HG12 VAL A 51 13.714 -8.476 -1.143 1.00 0.00 H new ATOM 0 HG13 VAL A 51 13.371 -10.182 -1.516 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.106 -9.849 -4.490 1.00 0.00 H new ATOM 0 HG22 VAL A 51 11.945 -10.750 -3.487 1.00 0.00 H new ATOM 0 HG23 VAL A 51 11.372 -9.456 -4.566 1.00 0.00 H new ATOM 807 N ARG A 52 12.081 -8.710 0.150 1.00 0.00 N ATOM 808 CA ARG A 52 12.385 -9.171 1.509 1.00 0.00 C ATOM 809 C ARG A 52 11.369 -8.645 2.552 1.00 0.00 C ATOM 810 O ARG A 52 11.221 -9.231 3.605 1.00 0.00 O ATOM 811 CB ARG A 52 13.796 -8.645 1.790 1.00 0.00 C ATOM 812 CG ARG A 52 13.880 -7.960 3.151 1.00 0.00 C ATOM 813 CD ARG A 52 15.228 -7.250 3.284 1.00 0.00 C ATOM 814 NE ARG A 52 16.334 -8.249 3.206 1.00 0.00 N ATOM 815 CZ ARG A 52 16.193 -9.430 3.747 1.00 0.00 C ATOM 816 NH1 ARG A 52 15.783 -9.540 4.982 1.00 0.00 N ATOM 817 NH2 ARG A 52 16.465 -10.501 3.050 1.00 0.00 N ATOM 0 H ARG A 52 12.633 -7.906 -0.147 1.00 0.00 H new ATOM 0 HA ARG A 52 12.322 -10.257 1.584 1.00 0.00 H new ATOM 0 HB2 ARG A 52 14.507 -9.471 1.753 1.00 0.00 H new ATOM 0 HB3 ARG A 52 14.085 -7.941 1.009 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.067 -7.242 3.259 1.00 0.00 H new ATOM 0 HG3 ARG A 52 13.764 -8.695 3.947 1.00 0.00 H new ATOM 0 HD2 ARG A 52 15.339 -6.508 2.493 1.00 0.00 H new ATOM 0 HD3 ARG A 52 15.275 -6.714 4.232 1.00 0.00 H new ATOM 0 HE ARG A 52 17.203 -8.009 2.729 1.00 0.00 H new ATOM 0 HH11 ARG A 52 15.572 -8.703 5.526 1.00 0.00 H new ATOM 0 HH12 ARG A 52 15.673 -10.463 5.403 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.787 -10.414 2.086 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.356 -11.424 3.470 1.00 0.00 H new ATOM 831 N GLU A 53 10.702 -7.537 2.317 1.00 0.00 N ATOM 832 CA GLU A 53 9.769 -7.032 3.376 1.00 0.00 C ATOM 833 C GLU A 53 8.423 -7.767 3.335 1.00 0.00 C ATOM 834 O GLU A 53 7.775 -7.940 4.349 1.00 0.00 O ATOM 835 CB GLU A 53 9.559 -5.524 3.198 1.00 0.00 C ATOM 836 CG GLU A 53 8.451 -5.264 2.179 1.00 0.00 C ATOM 837 CD GLU A 53 7.128 -5.029 2.908 1.00 0.00 C ATOM 838 OE1 GLU A 53 7.056 -5.358 4.080 1.00 0.00 O ATOM 839 OE2 GLU A 53 6.209 -4.528 2.282 1.00 0.00 O ATOM 0 H GLU A 53 10.759 -6.977 1.467 1.00 0.00 H new ATOM 0 HA GLU A 53 10.219 -7.224 4.350 1.00 0.00 H new ATOM 0 HB2 GLU A 53 9.298 -5.070 4.154 1.00 0.00 H new ATOM 0 HB3 GLU A 53 10.486 -5.057 2.866 1.00 0.00 H new ATOM 0 HG2 GLU A 53 8.701 -4.396 1.569 1.00 0.00 H new ATOM 0 HG3 GLU A 53 8.359 -6.113 1.502 1.00 0.00 H new ATOM 846 N LEU A 54 7.990 -8.187 2.184 1.00 0.00 N ATOM 847 CA LEU A 54 6.680 -8.892 2.099 1.00 0.00 C ATOM 848 C LEU A 54 6.843 -10.351 2.525 1.00 0.00 C ATOM 849 O LEU A 54 6.019 -10.894 3.233 1.00 0.00 O ATOM 850 CB LEU A 54 6.160 -8.839 0.662 1.00 0.00 C ATOM 851 CG LEU A 54 4.791 -8.155 0.644 1.00 0.00 C ATOM 852 CD1 LEU A 54 3.805 -8.961 1.491 1.00 0.00 C ATOM 853 CD2 LEU A 54 4.921 -6.743 1.219 1.00 0.00 C ATOM 0 H LEU A 54 8.483 -8.075 1.298 1.00 0.00 H new ATOM 0 HA LEU A 54 5.970 -8.401 2.764 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.860 -8.293 0.030 1.00 0.00 H new ATOM 0 HB3 LEU A 54 6.081 -9.847 0.254 1.00 0.00 H new ATOM 0 HG LEU A 54 4.426 -8.099 -0.382 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.830 -8.473 1.478 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.713 -9.967 1.083 1.00 0.00 H new ATOM 0 HD13 LEU A 54 4.168 -9.018 2.517 1.00 0.00 H new ATOM 0 HD21 LEU A 54 3.947 -6.254 1.207 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.286 -6.800 2.245 1.00 0.00 H new ATOM 0 HD23 LEU A 54 5.623 -6.168 0.616 1.00 0.00 H new ATOM 865 N GLN A 55 7.892 -10.997 2.098 1.00 0.00 N ATOM 866 CA GLN A 55 8.087 -12.422 2.481 1.00 0.00 C ATOM 867 C GLN A 55 8.373 -12.524 3.983 1.00 0.00 C ATOM 868 O GLN A 55 7.982 -13.472 4.633 1.00 0.00 O ATOM 869 CB GLN A 55 9.263 -13.010 1.695 1.00 0.00 C ATOM 870 CG GLN A 55 8.810 -13.349 0.273 1.00 0.00 C ATOM 871 CD GLN A 55 9.419 -14.687 -0.150 1.00 0.00 C ATOM 872 OE1 GLN A 55 10.216 -14.743 -1.065 1.00 0.00 O ATOM 873 NE2 GLN A 55 9.074 -15.776 0.481 1.00 0.00 N ATOM 0 H GLN A 55 8.620 -10.601 1.503 1.00 0.00 H new ATOM 0 HA GLN A 55 7.180 -12.981 2.250 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.087 -12.297 1.665 1.00 0.00 H new ATOM 0 HB3 GLN A 55 9.635 -13.906 2.193 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.722 -13.402 0.229 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.119 -12.563 -0.416 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.405 -15.730 1.249 1.00 0.00 H new ATOM 0 HE22 GLN A 55 9.474 -16.673 0.206 1.00 0.00 H new ATOM 882 N GLU A 56 9.058 -11.563 4.540 1.00 0.00 N ATOM 883 CA GLU A 56 9.369 -11.623 5.997 1.00 0.00 C ATOM 884 C GLU A 56 8.128 -11.253 6.817 1.00 0.00 C ATOM 885 O GLU A 56 8.106 -11.405 8.022 1.00 0.00 O ATOM 886 CB GLU A 56 10.501 -10.647 6.319 1.00 0.00 C ATOM 887 CG GLU A 56 11.755 -11.048 5.538 1.00 0.00 C ATOM 888 CD GLU A 56 12.607 -11.992 6.389 1.00 0.00 C ATOM 889 OE1 GLU A 56 12.076 -12.991 6.843 1.00 0.00 O ATOM 890 OE2 GLU A 56 13.777 -11.698 6.571 1.00 0.00 O ATOM 0 H GLU A 56 9.415 -10.742 4.052 1.00 0.00 H new ATOM 0 HA GLU A 56 9.675 -12.637 6.252 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.206 -9.631 6.057 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.708 -10.653 7.389 1.00 0.00 H new ATOM 0 HG2 GLU A 56 11.474 -11.536 4.605 1.00 0.00 H new ATOM 0 HG3 GLU A 56 12.330 -10.161 5.273 1.00 0.00 H new ATOM 897 N GLU A 57 7.097 -10.770 6.180 1.00 0.00 N ATOM 898 CA GLU A 57 5.866 -10.395 6.934 1.00 0.00 C ATOM 899 C GLU A 57 4.812 -11.496 6.781 1.00 0.00 C ATOM 900 O GLU A 57 4.430 -12.141 7.738 1.00 0.00 O ATOM 901 CB GLU A 57 5.312 -9.082 6.382 1.00 0.00 C ATOM 902 CG GLU A 57 5.688 -7.932 7.317 1.00 0.00 C ATOM 903 CD GLU A 57 7.209 -7.879 7.480 1.00 0.00 C ATOM 904 OE1 GLU A 57 7.782 -8.892 7.846 1.00 0.00 O ATOM 905 OE2 GLU A 57 7.773 -6.825 7.238 1.00 0.00 O ATOM 0 H GLU A 57 7.053 -10.619 5.172 1.00 0.00 H new ATOM 0 HA GLU A 57 6.112 -10.274 7.989 1.00 0.00 H new ATOM 0 HB2 GLU A 57 5.711 -8.898 5.385 1.00 0.00 H new ATOM 0 HB3 GLU A 57 4.228 -9.145 6.285 1.00 0.00 H new ATOM 0 HG2 GLU A 57 5.322 -6.988 6.914 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.213 -8.069 8.288 1.00 0.00 H new ATOM 912 N VAL A 58 4.346 -11.715 5.583 1.00 0.00 N ATOM 913 CA VAL A 58 3.317 -12.773 5.359 1.00 0.00 C ATOM 914 C VAL A 58 3.993 -14.015 4.768 1.00 0.00 C ATOM 915 O VAL A 58 3.552 -15.129 4.967 1.00 0.00 O ATOM 916 CB VAL A 58 2.252 -12.265 4.379 1.00 0.00 C ATOM 917 CG1 VAL A 58 1.131 -11.545 5.134 1.00 0.00 C ATOM 918 CG2 VAL A 58 2.890 -11.292 3.389 1.00 0.00 C ATOM 0 H VAL A 58 4.633 -11.207 4.747 1.00 0.00 H new ATOM 0 HA VAL A 58 2.843 -13.022 6.309 1.00 0.00 H new ATOM 0 HB VAL A 58 1.834 -13.119 3.846 1.00 0.00 H new ATOM 0 HG11 VAL A 58 0.383 -11.191 4.424 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.665 -12.235 5.838 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.546 -10.696 5.678 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.132 -10.932 2.693 1.00 0.00 H new ATOM 0 HG22 VAL A 58 3.315 -10.448 3.931 1.00 0.00 H new ATOM 0 HG23 VAL A 58 3.678 -11.801 2.835 1.00 0.00 H new ATOM 928 N GLY A 59 5.061 -13.825 4.041 1.00 0.00 N ATOM 929 CA GLY A 59 5.773 -14.984 3.428 1.00 0.00 C ATOM 930 C GLY A 59 4.825 -15.737 2.501 1.00 0.00 C ATOM 931 O GLY A 59 4.645 -16.934 2.601 1.00 0.00 O ATOM 0 H GLY A 59 5.473 -12.913 3.844 1.00 0.00 H new ATOM 0 HA2 GLY A 59 6.642 -14.636 2.870 1.00 0.00 H new ATOM 0 HA3 GLY A 59 6.141 -15.651 4.208 1.00 0.00 H new ATOM 935 N ILE A 60 4.231 -15.029 1.590 1.00 0.00 N ATOM 936 CA ILE A 60 3.297 -15.650 0.615 1.00 0.00 C ATOM 937 C ILE A 60 4.114 -16.026 -0.623 1.00 0.00 C ATOM 938 O ILE A 60 5.328 -16.032 -0.583 1.00 0.00 O ATOM 939 CB ILE A 60 2.222 -14.617 0.258 1.00 0.00 C ATOM 940 CG1 ILE A 60 2.058 -13.640 1.429 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.893 -15.325 0.002 1.00 0.00 C ATOM 942 CD1 ILE A 60 0.815 -12.791 1.218 1.00 0.00 C ATOM 0 H ILE A 60 4.355 -14.023 1.476 1.00 0.00 H new ATOM 0 HA ILE A 60 2.813 -16.538 1.020 1.00 0.00 H new ATOM 0 HB ILE A 60 2.521 -14.075 -0.639 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.979 -14.191 2.366 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.937 -13.001 1.508 1.00 0.00 H new ATOM 0 HG21 ILE A 60 0.131 -14.588 -0.251 1.00 0.00 H new ATOM 0 HG22 ILE A 60 1.008 -16.027 -0.824 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.590 -15.866 0.899 1.00 0.00 H new ATOM 0 HD11 ILE A 60 0.702 -12.098 2.052 1.00 0.00 H new ATOM 0 HD12 ILE A 60 0.912 -12.228 0.289 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -0.061 -13.437 1.161 1.00 0.00 H new ATOM 954 N THR A 61 3.486 -16.325 -1.723 1.00 0.00 N ATOM 955 CA THR A 61 4.280 -16.674 -2.935 1.00 0.00 C ATOM 956 C THR A 61 3.664 -15.997 -4.158 1.00 0.00 C ATOM 957 O THR A 61 2.791 -16.549 -4.798 1.00 0.00 O ATOM 958 CB THR A 61 4.299 -18.185 -3.148 1.00 0.00 C ATOM 959 OG1 THR A 61 4.908 -18.817 -2.030 1.00 0.00 O ATOM 960 CG2 THR A 61 5.102 -18.486 -4.412 1.00 0.00 C ATOM 0 H THR A 61 2.473 -16.344 -1.838 1.00 0.00 H new ATOM 0 HA THR A 61 5.304 -16.327 -2.794 1.00 0.00 H new ATOM 0 HB THR A 61 3.282 -18.561 -3.255 1.00 0.00 H new ATOM 0 HG1 THR A 61 4.918 -19.787 -2.168 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.126 -19.563 -4.580 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.634 -17.996 -5.266 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.120 -18.114 -4.294 1.00 0.00 H new ATOM 968 N PRO A 62 4.138 -14.814 -4.442 1.00 0.00 N ATOM 969 CA PRO A 62 3.645 -14.021 -5.579 1.00 0.00 C ATOM 970 C PRO A 62 3.946 -14.725 -6.904 1.00 0.00 C ATOM 971 O PRO A 62 4.835 -15.549 -6.995 1.00 0.00 O ATOM 972 CB PRO A 62 4.400 -12.693 -5.485 1.00 0.00 C ATOM 973 CG PRO A 62 5.427 -12.817 -4.330 1.00 0.00 C ATOM 974 CD PRO A 62 5.203 -14.171 -3.652 1.00 0.00 C ATOM 0 HA PRO A 62 2.564 -13.883 -5.546 1.00 0.00 H new ATOM 0 HB2 PRO A 62 4.906 -12.473 -6.425 1.00 0.00 H new ATOM 0 HB3 PRO A 62 3.708 -11.872 -5.296 1.00 0.00 H new ATOM 0 HG2 PRO A 62 6.445 -12.745 -4.714 1.00 0.00 H new ATOM 0 HG3 PRO A 62 5.298 -12.005 -3.615 1.00 0.00 H new ATOM 0 HD2 PRO A 62 6.114 -14.770 -3.654 1.00 0.00 H new ATOM 0 HD3 PRO A 62 4.904 -14.048 -2.611 1.00 0.00 H new ATOM 982 N GLN A 63 3.205 -14.409 -7.932 1.00 0.00 N ATOM 983 CA GLN A 63 3.440 -15.060 -9.250 1.00 0.00 C ATOM 984 C GLN A 63 3.772 -14.001 -10.307 1.00 0.00 C ATOM 985 O GLN A 63 4.687 -14.165 -11.089 1.00 0.00 O ATOM 986 CB GLN A 63 2.180 -15.821 -9.675 1.00 0.00 C ATOM 987 CG GLN A 63 1.483 -16.394 -8.437 1.00 0.00 C ATOM 988 CD GLN A 63 0.679 -17.636 -8.832 1.00 0.00 C ATOM 989 OE1 GLN A 63 1.175 -18.743 -8.760 1.00 0.00 O ATOM 990 NE2 GLN A 63 -0.551 -17.498 -9.246 1.00 0.00 N ATOM 0 H GLN A 63 2.447 -13.727 -7.914 1.00 0.00 H new ATOM 0 HA GLN A 63 4.277 -15.752 -9.160 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.503 -15.154 -10.210 1.00 0.00 H new ATOM 0 HB3 GLN A 63 2.443 -16.626 -10.362 1.00 0.00 H new ATOM 0 HG2 GLN A 63 2.221 -16.652 -7.678 1.00 0.00 H new ATOM 0 HG3 GLN A 63 0.823 -15.645 -7.999 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -0.968 -16.569 -9.306 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -1.096 -18.319 -9.509 1.00 0.00 H new ATOM 999 N HIS A 64 3.034 -12.921 -10.350 1.00 0.00 N ATOM 1000 CA HIS A 64 3.320 -11.876 -11.373 1.00 0.00 C ATOM 1001 C HIS A 64 2.905 -10.503 -10.840 1.00 0.00 C ATOM 1002 O HIS A 64 1.736 -10.176 -10.790 1.00 0.00 O ATOM 1003 CB HIS A 64 2.524 -12.190 -12.643 1.00 0.00 C ATOM 1004 CG HIS A 64 3.406 -12.022 -13.850 1.00 0.00 C ATOM 1005 ND1 HIS A 64 2.896 -11.713 -15.102 1.00 0.00 N ATOM 1006 CD2 HIS A 64 4.765 -12.117 -14.012 1.00 0.00 C ATOM 1007 CE1 HIS A 64 3.933 -11.634 -15.954 1.00 0.00 C ATOM 1008 NE2 HIS A 64 5.096 -11.873 -15.343 1.00 0.00 N ATOM 0 H HIS A 64 2.253 -12.720 -9.726 1.00 0.00 H new ATOM 0 HA HIS A 64 4.387 -11.866 -11.596 1.00 0.00 H new ATOM 0 HB2 HIS A 64 2.140 -13.209 -12.600 1.00 0.00 H new ATOM 0 HB3 HIS A 64 1.662 -11.528 -12.716 1.00 0.00 H new ATOM 0 HD2 HIS A 64 5.471 -12.346 -13.227 1.00 0.00 H new ATOM 0 HE1 HIS A 64 3.837 -11.405 -17.005 1.00 0.00 H new ATOM 0 HE2 HIS A 64 6.026 -11.876 -15.761 1.00 0.00 H new ATOM 1016 N PHE A 65 3.851 -9.696 -10.440 1.00 0.00 N ATOM 1017 CA PHE A 65 3.497 -8.351 -9.912 1.00 0.00 C ATOM 1018 C PHE A 65 4.415 -7.290 -10.508 1.00 0.00 C ATOM 1019 O PHE A 65 5.384 -7.584 -11.181 1.00 0.00 O ATOM 1020 CB PHE A 65 3.655 -8.331 -8.394 1.00 0.00 C ATOM 1021 CG PHE A 65 4.912 -9.069 -8.001 1.00 0.00 C ATOM 1022 CD1 PHE A 65 5.000 -10.456 -8.176 1.00 0.00 C ATOM 1023 CD2 PHE A 65 5.996 -8.363 -7.461 1.00 0.00 C ATOM 1024 CE1 PHE A 65 6.169 -11.135 -7.814 1.00 0.00 C ATOM 1025 CE2 PHE A 65 7.163 -9.043 -7.099 1.00 0.00 C ATOM 1026 CZ PHE A 65 7.251 -10.429 -7.276 1.00 0.00 C ATOM 0 H PHE A 65 4.848 -9.910 -10.457 1.00 0.00 H new ATOM 0 HA PHE A 65 2.463 -8.137 -10.184 1.00 0.00 H new ATOM 0 HB2 PHE A 65 3.700 -7.302 -8.037 1.00 0.00 H new ATOM 0 HB3 PHE A 65 2.788 -8.794 -7.923 1.00 0.00 H new ATOM 0 HD1 PHE A 65 4.165 -11.002 -8.591 1.00 0.00 H new ATOM 0 HD2 PHE A 65 5.930 -7.294 -7.325 1.00 0.00 H new ATOM 0 HE1 PHE A 65 6.236 -12.204 -7.950 1.00 0.00 H new ATOM 0 HE2 PHE A 65 7.997 -8.498 -6.682 1.00 0.00 H new ATOM 0 HZ PHE A 65 8.153 -10.953 -6.998 1.00 0.00 H new ATOM 1036 N SER A 66 4.109 -6.056 -10.246 1.00 0.00 N ATOM 1037 CA SER A 66 4.946 -4.940 -10.766 1.00 0.00 C ATOM 1038 C SER A 66 4.647 -3.680 -9.955 1.00 0.00 C ATOM 1039 O SER A 66 3.563 -3.516 -9.431 1.00 0.00 O ATOM 1040 CB SER A 66 4.619 -4.694 -12.240 1.00 0.00 C ATOM 1041 OG SER A 66 5.828 -4.625 -12.984 1.00 0.00 O ATOM 0 H SER A 66 3.306 -5.766 -9.688 1.00 0.00 H new ATOM 0 HA SER A 66 6.002 -5.196 -10.675 1.00 0.00 H new ATOM 0 HB2 SER A 66 3.988 -5.496 -12.623 1.00 0.00 H new ATOM 0 HB3 SER A 66 4.057 -3.766 -12.350 1.00 0.00 H new ATOM 0 HG SER A 66 5.622 -4.469 -13.929 1.00 0.00 H new ATOM 1047 N LEU A 67 5.590 -2.785 -9.839 1.00 0.00 N ATOM 1048 CA LEU A 67 5.327 -1.548 -9.052 1.00 0.00 C ATOM 1049 C LEU A 67 4.339 -0.662 -9.806 1.00 0.00 C ATOM 1050 O LEU A 67 4.702 0.054 -10.718 1.00 0.00 O ATOM 1051 CB LEU A 67 6.629 -0.773 -8.828 1.00 0.00 C ATOM 1052 CG LEU A 67 6.302 0.637 -8.316 1.00 0.00 C ATOM 1053 CD1 LEU A 67 5.663 0.554 -6.927 1.00 0.00 C ATOM 1054 CD2 LEU A 67 7.591 1.460 -8.235 1.00 0.00 C ATOM 0 H LEU A 67 6.521 -2.855 -10.250 1.00 0.00 H new ATOM 0 HA LEU A 67 4.909 -1.830 -8.086 1.00 0.00 H new ATOM 0 HB2 LEU A 67 7.257 -1.297 -8.108 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.193 -0.712 -9.758 1.00 0.00 H new ATOM 0 HG LEU A 67 5.603 1.114 -9.003 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.434 1.559 -6.571 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.744 -0.029 -6.984 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.356 0.073 -6.236 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.361 2.462 -7.872 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.289 0.977 -7.551 1.00 0.00 H new ATOM 0 HD23 LEU A 67 8.042 1.528 -9.225 1.00 0.00 H new ATOM 1066 N PHE A 68 3.098 -0.691 -9.417 1.00 0.00 N ATOM 1067 CA PHE A 68 2.083 0.165 -10.084 1.00 0.00 C ATOM 1068 C PHE A 68 2.683 1.556 -10.290 1.00 0.00 C ATOM 1069 O PHE A 68 3.097 1.921 -11.372 1.00 0.00 O ATOM 1070 CB PHE A 68 0.848 0.243 -9.168 1.00 0.00 C ATOM 1071 CG PHE A 68 0.178 1.594 -9.258 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -0.362 2.030 -10.472 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.103 2.408 -8.124 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -0.980 3.283 -10.550 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.513 3.658 -8.201 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.053 4.096 -9.414 1.00 0.00 C ATOM 0 H PHE A 68 2.741 -1.275 -8.661 1.00 0.00 H new ATOM 0 HA PHE A 68 1.792 -0.244 -11.052 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.138 -0.536 -9.445 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.145 0.051 -8.137 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.302 1.401 -11.348 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.522 2.069 -7.188 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -1.400 3.622 -11.486 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.572 4.286 -7.325 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.528 5.064 -9.474 1.00 0.00 H new ATOM 1086 N GLU A 69 2.729 2.325 -9.246 1.00 0.00 N ATOM 1087 CA GLU A 69 3.299 3.700 -9.347 1.00 0.00 C ATOM 1088 C GLU A 69 3.482 4.283 -7.945 1.00 0.00 C ATOM 1089 O GLU A 69 2.528 4.506 -7.227 1.00 0.00 O ATOM 1090 CB GLU A 69 2.348 4.588 -10.151 1.00 0.00 C ATOM 1091 CG GLU A 69 3.132 5.330 -11.237 1.00 0.00 C ATOM 1092 CD GLU A 69 2.189 5.703 -12.383 1.00 0.00 C ATOM 1093 OE1 GLU A 69 1.180 6.331 -12.113 1.00 0.00 O ATOM 1094 OE2 GLU A 69 2.494 5.353 -13.512 1.00 0.00 O ATOM 0 H GLU A 69 2.395 2.063 -8.318 1.00 0.00 H new ATOM 0 HA GLU A 69 4.266 3.656 -9.849 1.00 0.00 H new ATOM 0 HB2 GLU A 69 1.564 3.981 -10.605 1.00 0.00 H new ATOM 0 HB3 GLU A 69 1.856 5.303 -9.491 1.00 0.00 H new ATOM 0 HG2 GLU A 69 3.589 6.228 -10.821 1.00 0.00 H new ATOM 0 HG3 GLU A 69 3.942 4.703 -11.608 1.00 0.00 H new ATOM 1101 N LYS A 70 4.702 4.523 -7.548 1.00 0.00 N ATOM 1102 CA LYS A 70 4.961 5.079 -6.202 1.00 0.00 C ATOM 1103 C LYS A 70 4.875 6.608 -6.238 1.00 0.00 C ATOM 1104 O LYS A 70 4.932 7.219 -7.287 1.00 0.00 O ATOM 1105 CB LYS A 70 6.368 4.671 -5.788 1.00 0.00 C ATOM 1106 CG LYS A 70 7.366 5.141 -6.849 1.00 0.00 C ATOM 1107 CD LYS A 70 8.233 6.261 -6.271 1.00 0.00 C ATOM 1108 CE LYS A 70 9.274 5.663 -5.324 1.00 0.00 C ATOM 1109 NZ LYS A 70 10.091 6.757 -4.728 1.00 0.00 N ATOM 0 H LYS A 70 5.536 4.353 -8.110 1.00 0.00 H new ATOM 0 HA LYS A 70 4.221 4.701 -5.496 1.00 0.00 H new ATOM 0 HB2 LYS A 70 6.616 5.108 -4.821 1.00 0.00 H new ATOM 0 HB3 LYS A 70 6.426 3.589 -5.673 1.00 0.00 H new ATOM 0 HG2 LYS A 70 7.993 4.309 -7.168 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.835 5.496 -7.732 1.00 0.00 H new ATOM 0 HD2 LYS A 70 8.728 6.805 -7.076 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.610 6.979 -5.737 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.780 5.093 -4.537 1.00 0.00 H new ATOM 0 HE3 LYS A 70 9.917 4.968 -5.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 10.832 6.347 -4.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 10.532 7.314 -5.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.480 7.375 -4.156 1.00 0.00 H new ATOM 1123 N LEU A 71 4.753 7.227 -5.096 1.00 0.00 N ATOM 1124 CA LEU A 71 4.680 8.715 -5.050 1.00 0.00 C ATOM 1125 C LEU A 71 5.754 9.228 -4.088 1.00 0.00 C ATOM 1126 O LEU A 71 6.651 8.502 -3.710 1.00 0.00 O ATOM 1127 CB LEU A 71 3.297 9.147 -4.556 1.00 0.00 C ATOM 1128 CG LEU A 71 2.828 8.193 -3.460 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.706 8.371 -2.220 1.00 0.00 C ATOM 1130 CD2 LEU A 71 1.374 8.504 -3.102 1.00 0.00 C ATOM 0 H LEU A 71 4.700 6.764 -4.189 1.00 0.00 H new ATOM 0 HA LEU A 71 4.845 9.127 -6.046 1.00 0.00 H new ATOM 0 HB2 LEU A 71 3.338 10.167 -4.173 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.587 9.146 -5.383 1.00 0.00 H new ATOM 0 HG LEU A 71 2.904 7.165 -3.816 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.372 7.690 -1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.743 8.151 -2.474 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.630 9.399 -1.864 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.038 7.823 -2.320 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.299 9.531 -2.746 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.747 8.379 -3.985 1.00 0.00 H new ATOM 1142 N GLU A 72 5.678 10.467 -3.687 1.00 0.00 N ATOM 1143 CA GLU A 72 6.711 10.997 -2.752 1.00 0.00 C ATOM 1144 C GLU A 72 6.134 12.144 -1.919 1.00 0.00 C ATOM 1145 O GLU A 72 5.321 12.919 -2.384 1.00 0.00 O ATOM 1146 CB GLU A 72 7.909 11.511 -3.554 1.00 0.00 C ATOM 1147 CG GLU A 72 9.201 10.972 -2.939 1.00 0.00 C ATOM 1148 CD GLU A 72 10.373 11.268 -3.877 1.00 0.00 C ATOM 1149 OE1 GLU A 72 10.586 10.488 -4.791 1.00 0.00 O ATOM 1150 OE2 GLU A 72 11.038 12.269 -3.665 1.00 0.00 O ATOM 0 H GLU A 72 4.953 11.130 -3.963 1.00 0.00 H new ATOM 0 HA GLU A 72 7.027 10.195 -2.085 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.828 11.193 -4.594 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.920 12.601 -3.554 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.374 11.433 -1.967 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.117 9.898 -2.772 1.00 0.00 H new ATOM 1157 N TYR A 73 6.564 12.261 -0.691 1.00 0.00 N ATOM 1158 CA TYR A 73 6.063 13.359 0.180 1.00 0.00 C ATOM 1159 C TYR A 73 7.230 13.920 0.999 1.00 0.00 C ATOM 1160 O TYR A 73 8.331 13.409 0.953 1.00 0.00 O ATOM 1161 CB TYR A 73 4.989 12.816 1.126 1.00 0.00 C ATOM 1162 CG TYR A 73 3.782 13.727 1.097 1.00 0.00 C ATOM 1163 CD1 TYR A 73 3.130 13.990 -0.115 1.00 0.00 C ATOM 1164 CD2 TYR A 73 3.314 14.307 2.282 1.00 0.00 C ATOM 1165 CE1 TYR A 73 2.010 14.831 -0.141 1.00 0.00 C ATOM 1166 CE2 TYR A 73 2.195 15.148 2.256 1.00 0.00 C ATOM 1167 CZ TYR A 73 1.543 15.410 1.045 1.00 0.00 C ATOM 1168 OH TYR A 73 0.439 16.238 1.021 1.00 0.00 O ATOM 0 H TYR A 73 7.244 11.639 -0.253 1.00 0.00 H new ATOM 0 HA TYR A 73 5.632 14.148 -0.436 1.00 0.00 H new ATOM 0 HB2 TYR A 73 4.703 11.807 0.828 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.383 12.749 2.140 1.00 0.00 H new ATOM 0 HD1 TYR A 73 3.491 13.544 -1.030 1.00 0.00 H new ATOM 0 HD2 TYR A 73 3.816 14.106 3.217 1.00 0.00 H new ATOM 0 HE1 TYR A 73 1.507 15.033 -1.075 1.00 0.00 H new ATOM 0 HE2 TYR A 73 1.834 15.595 3.171 1.00 0.00 H new ATOM 0 HH TYR A 73 0.248 16.554 1.929 1.00 0.00 H new ATOM 1178 N GLU A 74 7.003 14.968 1.742 1.00 0.00 N ATOM 1179 CA GLU A 74 8.103 15.561 2.555 1.00 0.00 C ATOM 1180 C GLU A 74 7.512 16.326 3.737 1.00 0.00 C ATOM 1181 O GLU A 74 6.852 17.332 3.573 1.00 0.00 O ATOM 1182 CB GLU A 74 8.920 16.517 1.682 1.00 0.00 C ATOM 1183 CG GLU A 74 10.272 16.791 2.344 1.00 0.00 C ATOM 1184 CD GLU A 74 10.817 18.133 1.851 1.00 0.00 C ATOM 1185 OE1 GLU A 74 10.650 18.423 0.677 1.00 0.00 O ATOM 1186 OE2 GLU A 74 11.392 18.848 2.655 1.00 0.00 O ATOM 0 H GLU A 74 6.102 15.440 1.822 1.00 0.00 H new ATOM 0 HA GLU A 74 8.749 14.766 2.928 1.00 0.00 H new ATOM 0 HB2 GLU A 74 9.070 16.084 0.693 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.377 17.451 1.542 1.00 0.00 H new ATOM 0 HG2 GLU A 74 10.162 16.807 3.428 1.00 0.00 H new ATOM 0 HG3 GLU A 74 10.974 15.992 2.107 1.00 0.00 H new ATOM 1193 N PHE A 75 7.752 15.853 4.926 1.00 0.00 N ATOM 1194 CA PHE A 75 7.218 16.542 6.131 1.00 0.00 C ATOM 1195 C PHE A 75 8.120 17.737 6.444 1.00 0.00 C ATOM 1196 O PHE A 75 9.069 17.990 5.729 1.00 0.00 O ATOM 1197 CB PHE A 75 7.233 15.564 7.306 1.00 0.00 C ATOM 1198 CG PHE A 75 5.817 15.281 7.753 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.826 14.998 6.802 1.00 0.00 C ATOM 1200 CD2 PHE A 75 5.493 15.299 9.115 1.00 0.00 C ATOM 1201 CE1 PHE A 75 3.513 14.734 7.216 1.00 0.00 C ATOM 1202 CE2 PHE A 75 4.182 15.035 9.528 1.00 0.00 C ATOM 1203 CZ PHE A 75 3.192 14.753 8.579 1.00 0.00 C ATOM 0 H PHE A 75 8.299 15.013 5.116 1.00 0.00 H new ATOM 0 HA PHE A 75 6.198 16.884 5.958 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.724 14.636 7.013 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.808 15.982 8.132 1.00 0.00 H new ATOM 0 HD1 PHE A 75 5.074 14.983 5.751 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.256 15.517 9.848 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.749 14.516 6.484 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.934 15.049 10.579 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.180 14.550 8.898 1.00 0.00 H new ATOM 1213 N PRO A 76 7.806 18.438 7.505 1.00 0.00 N ATOM 1214 CA PRO A 76 8.596 19.608 7.934 1.00 0.00 C ATOM 1215 C PRO A 76 9.944 19.184 8.550 1.00 0.00 C ATOM 1216 O PRO A 76 10.466 19.859 9.416 1.00 0.00 O ATOM 1217 CB PRO A 76 7.729 20.285 9.003 1.00 0.00 C ATOM 1218 CG PRO A 76 6.521 19.354 9.290 1.00 0.00 C ATOM 1219 CD PRO A 76 6.628 18.148 8.343 1.00 0.00 C ATOM 0 HA PRO A 76 8.832 20.261 7.094 1.00 0.00 H new ATOM 0 HB2 PRO A 76 8.306 20.454 9.912 1.00 0.00 H new ATOM 0 HB3 PRO A 76 7.387 21.260 8.656 1.00 0.00 H new ATOM 0 HG2 PRO A 76 6.529 19.026 10.330 1.00 0.00 H new ATOM 0 HG3 PRO A 76 5.582 19.884 9.130 1.00 0.00 H new ATOM 0 HD2 PRO A 76 6.755 17.218 8.898 1.00 0.00 H new ATOM 0 HD3 PRO A 76 5.728 18.038 7.738 1.00 0.00 H new ATOM 1227 N ASP A 77 10.523 18.084 8.126 1.00 0.00 N ATOM 1228 CA ASP A 77 11.825 17.668 8.711 1.00 0.00 C ATOM 1229 C ASP A 77 12.515 16.646 7.809 1.00 0.00 C ATOM 1230 O ASP A 77 13.704 16.719 7.572 1.00 0.00 O ATOM 1231 CB ASP A 77 11.610 17.058 10.103 1.00 0.00 C ATOM 1232 CG ASP A 77 10.179 16.528 10.230 1.00 0.00 C ATOM 1233 OD1 ASP A 77 9.297 17.323 10.510 1.00 0.00 O ATOM 1234 OD2 ASP A 77 9.991 15.336 10.046 1.00 0.00 O ATOM 0 H ASP A 77 10.149 17.466 7.406 1.00 0.00 H new ATOM 0 HA ASP A 77 12.458 18.551 8.797 1.00 0.00 H new ATOM 0 HB2 ASP A 77 12.322 16.249 10.268 1.00 0.00 H new ATOM 0 HB3 ASP A 77 11.797 17.809 10.871 1.00 0.00 H new ATOM 1239 N ARG A 78 11.792 15.683 7.326 1.00 0.00 N ATOM 1240 CA ARG A 78 12.405 14.650 6.474 1.00 0.00 C ATOM 1241 C ARG A 78 11.547 14.419 5.230 1.00 0.00 C ATOM 1242 O ARG A 78 10.532 15.054 5.033 1.00 0.00 O ATOM 1243 CB ARG A 78 12.486 13.357 7.274 1.00 0.00 C ATOM 1244 CG ARG A 78 11.359 13.293 8.311 1.00 0.00 C ATOM 1245 CD ARG A 78 11.600 12.111 9.253 1.00 0.00 C ATOM 1246 NE ARG A 78 12.324 12.583 10.468 1.00 0.00 N ATOM 1247 CZ ARG A 78 12.378 11.828 11.531 1.00 0.00 C ATOM 1248 NH1 ARG A 78 11.386 11.822 12.377 1.00 0.00 N ATOM 1249 NH2 ARG A 78 13.426 11.081 11.749 1.00 0.00 N ATOM 0 H ARG A 78 10.792 15.570 7.490 1.00 0.00 H new ATOM 0 HA ARG A 78 13.399 14.971 6.162 1.00 0.00 H new ATOM 0 HB2 ARG A 78 12.418 12.502 6.601 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.452 13.293 7.774 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.320 14.222 8.879 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.396 13.184 7.812 1.00 0.00 H new ATOM 0 HD2 ARG A 78 10.650 11.658 9.536 1.00 0.00 H new ATOM 0 HD3 ARG A 78 12.182 11.341 8.746 1.00 0.00 H new ATOM 0 HE ARG A 78 12.777 13.497 10.468 1.00 0.00 H new ATOM 0 HH11 ARG A 78 10.568 12.407 12.208 1.00 0.00 H new ATOM 0 HH12 ARG A 78 11.428 11.232 13.208 1.00 0.00 H new ATOM 0 HH21 ARG A 78 14.203 11.087 11.088 1.00 0.00 H new ATOM 0 HH22 ARG A 78 13.468 10.491 12.580 1.00 0.00 H new ATOM 1263 N HIS A 79 11.948 13.500 4.395 1.00 0.00 N ATOM 1264 CA HIS A 79 11.157 13.207 3.167 1.00 0.00 C ATOM 1265 C HIS A 79 10.475 11.850 3.333 1.00 0.00 C ATOM 1266 O HIS A 79 11.120 10.842 3.540 1.00 0.00 O ATOM 1267 CB HIS A 79 12.084 13.164 1.951 1.00 0.00 C ATOM 1268 CG HIS A 79 13.210 14.144 2.138 1.00 0.00 C ATOM 1269 ND1 HIS A 79 14.486 13.903 1.654 1.00 0.00 N ATOM 1270 CD2 HIS A 79 13.267 15.372 2.749 1.00 0.00 C ATOM 1271 CE1 HIS A 79 15.250 14.962 1.977 1.00 0.00 C ATOM 1272 NE2 HIS A 79 14.556 15.888 2.647 1.00 0.00 N ATOM 0 H HIS A 79 12.791 12.938 4.511 1.00 0.00 H new ATOM 0 HA HIS A 79 10.409 13.986 3.018 1.00 0.00 H new ATOM 0 HB2 HIS A 79 12.482 12.158 1.821 1.00 0.00 H new ATOM 0 HB3 HIS A 79 11.525 13.405 1.047 1.00 0.00 H new ATOM 0 HD2 HIS A 79 12.437 15.863 3.235 1.00 0.00 H new ATOM 0 HE1 HIS A 79 16.296 15.053 1.726 1.00 0.00 H new ATOM 0 HE2 HIS A 79 14.897 16.780 3.006 1.00 0.00 H new ATOM 1280 N ILE A 80 9.174 11.811 3.250 1.00 0.00 N ATOM 1281 CA ILE A 80 8.460 10.513 3.411 1.00 0.00 C ATOM 1282 C ILE A 80 8.305 9.839 2.047 1.00 0.00 C ATOM 1283 O ILE A 80 7.317 10.017 1.363 1.00 0.00 O ATOM 1284 CB ILE A 80 7.080 10.765 4.021 1.00 0.00 C ATOM 1285 CG1 ILE A 80 7.212 11.761 5.175 1.00 0.00 C ATOM 1286 CG2 ILE A 80 6.506 9.447 4.547 1.00 0.00 C ATOM 1287 CD1 ILE A 80 5.908 11.798 5.972 1.00 0.00 C ATOM 0 H ILE A 80 8.576 12.619 3.078 1.00 0.00 H new ATOM 0 HA ILE A 80 9.034 9.861 4.069 1.00 0.00 H new ATOM 0 HB ILE A 80 6.413 11.172 3.261 1.00 0.00 H new ATOM 0 HG12 ILE A 80 8.039 11.473 5.824 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.442 12.754 4.788 1.00 0.00 H new ATOM 0 HG21 ILE A 80 5.523 9.626 4.982 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.416 8.736 3.726 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.171 9.039 5.309 1.00 0.00 H new ATOM 0 HD11 ILE A 80 6.004 12.508 6.794 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.091 12.106 5.319 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.698 10.806 6.372 1.00 0.00 H new ATOM 1299 N THR A 81 9.276 9.062 1.648 1.00 0.00 N ATOM 1300 CA THR A 81 9.189 8.371 0.331 1.00 0.00 C ATOM 1301 C THR A 81 8.414 7.063 0.497 1.00 0.00 C ATOM 1302 O THR A 81 8.795 6.197 1.259 1.00 0.00 O ATOM 1303 CB THR A 81 10.601 8.066 -0.177 1.00 0.00 C ATOM 1304 OG1 THR A 81 11.480 9.108 0.222 1.00 0.00 O ATOM 1305 CG2 THR A 81 10.590 7.962 -1.703 1.00 0.00 C ATOM 0 H THR A 81 10.127 8.876 2.179 1.00 0.00 H new ATOM 0 HA THR A 81 8.675 9.012 -0.386 1.00 0.00 H new ATOM 0 HB THR A 81 10.941 7.120 0.244 1.00 0.00 H new ATOM 0 HG1 THR A 81 12.385 8.914 -0.101 1.00 0.00 H new ATOM 0 HG21 THR A 81 11.597 7.745 -2.060 1.00 0.00 H new ATOM 0 HG22 THR A 81 9.916 7.161 -2.008 1.00 0.00 H new ATOM 0 HG23 THR A 81 10.249 8.905 -2.130 1.00 0.00 H new ATOM 1313 N LEU A 82 7.326 6.913 -0.207 1.00 0.00 N ATOM 1314 CA LEU A 82 6.527 5.661 -0.083 1.00 0.00 C ATOM 1315 C LEU A 82 6.432 4.977 -1.448 1.00 0.00 C ATOM 1316 O LEU A 82 6.235 5.616 -2.463 1.00 0.00 O ATOM 1317 CB LEU A 82 5.122 6.000 0.416 1.00 0.00 C ATOM 1318 CG LEU A 82 4.805 5.154 1.649 1.00 0.00 C ATOM 1319 CD1 LEU A 82 4.091 6.015 2.692 1.00 0.00 C ATOM 1320 CD2 LEU A 82 3.900 3.988 1.245 1.00 0.00 C ATOM 0 H LEU A 82 6.956 7.602 -0.862 1.00 0.00 H new ATOM 0 HA LEU A 82 7.013 4.990 0.626 1.00 0.00 H new ATOM 0 HB2 LEU A 82 5.057 7.060 0.662 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.389 5.809 -0.368 1.00 0.00 H new ATOM 0 HG LEU A 82 5.732 4.768 2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 82 3.866 5.410 3.570 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.734 6.847 2.979 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.163 6.402 2.271 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.672 3.383 2.123 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.974 4.376 0.822 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.408 3.373 0.502 1.00 0.00 H new ATOM 1332 N TRP A 83 6.567 3.679 -1.480 1.00 0.00 N ATOM 1333 CA TRP A 83 6.484 2.950 -2.777 1.00 0.00 C ATOM 1334 C TRP A 83 5.064 2.410 -2.966 1.00 0.00 C ATOM 1335 O TRP A 83 4.280 2.358 -2.039 1.00 0.00 O ATOM 1336 CB TRP A 83 7.475 1.781 -2.781 1.00 0.00 C ATOM 1337 CG TRP A 83 8.644 2.099 -1.899 1.00 0.00 C ATOM 1338 CD1 TRP A 83 8.743 1.766 -0.590 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.877 2.800 -2.236 1.00 0.00 C ATOM 1340 NE1 TRP A 83 9.956 2.220 -0.104 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.691 2.864 -1.080 1.00 0.00 C ATOM 1342 CE3 TRP A 83 10.363 3.381 -3.421 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.943 3.481 -1.099 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 11.622 4.004 -3.444 1.00 0.00 C ATOM 1345 CH2 TRP A 83 12.410 4.055 -2.285 1.00 0.00 C ATOM 0 H TRP A 83 6.731 3.091 -0.663 1.00 0.00 H new ATOM 0 HA TRP A 83 6.730 3.634 -3.590 1.00 0.00 H new ATOM 0 HB2 TRP A 83 6.982 0.874 -2.432 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.818 1.587 -3.797 1.00 0.00 H new ATOM 0 HD1 TRP A 83 7.997 1.233 -0.019 1.00 0.00 H new ATOM 0 HE1 TRP A 83 10.270 2.094 0.858 1.00 0.00 H new ATOM 0 HE3 TRP A 83 9.764 3.348 -4.319 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.546 3.515 -0.204 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 11.985 4.446 -4.360 1.00 0.00 H new ATOM 0 HH2 TRP A 83 13.376 4.537 -2.309 1.00 0.00 H new ATOM 1356 N PHE A 84 4.728 2.006 -4.159 1.00 0.00 N ATOM 1357 CA PHE A 84 3.362 1.468 -4.408 1.00 0.00 C ATOM 1358 C PHE A 84 3.472 0.138 -5.152 1.00 0.00 C ATOM 1359 O PHE A 84 3.219 0.055 -6.337 1.00 0.00 O ATOM 1360 CB PHE A 84 2.571 2.463 -5.258 1.00 0.00 C ATOM 1361 CG PHE A 84 1.655 3.261 -4.365 1.00 0.00 C ATOM 1362 CD1 PHE A 84 2.178 4.280 -3.559 1.00 0.00 C ATOM 1363 CD2 PHE A 84 0.285 2.978 -4.337 1.00 0.00 C ATOM 1364 CE1 PHE A 84 1.330 5.017 -2.726 1.00 0.00 C ATOM 1365 CE2 PHE A 84 -0.563 3.715 -3.504 1.00 0.00 C ATOM 1366 CZ PHE A 84 -0.042 4.735 -2.698 1.00 0.00 C ATOM 0 H PHE A 84 5.342 2.025 -4.974 1.00 0.00 H new ATOM 0 HA PHE A 84 2.850 1.314 -3.458 1.00 0.00 H new ATOM 0 HB2 PHE A 84 3.252 3.129 -5.788 1.00 0.00 H new ATOM 0 HB3 PHE A 84 1.991 1.933 -6.014 1.00 0.00 H new ATOM 0 HD1 PHE A 84 3.236 4.497 -3.581 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.117 2.191 -4.958 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.733 5.803 -2.105 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.621 3.497 -3.482 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.698 5.304 -2.055 1.00 0.00 H new ATOM 1376 N TRP A 85 3.857 -0.904 -4.469 1.00 0.00 N ATOM 1377 CA TRP A 85 3.995 -2.222 -5.144 1.00 0.00 C ATOM 1378 C TRP A 85 2.620 -2.871 -5.295 1.00 0.00 C ATOM 1379 O TRP A 85 2.193 -3.653 -4.469 1.00 0.00 O ATOM 1380 CB TRP A 85 4.903 -3.123 -4.306 1.00 0.00 C ATOM 1381 CG TRP A 85 6.074 -2.328 -3.824 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.787 -1.463 -4.579 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.676 -2.307 -2.498 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.793 -0.915 -3.802 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.765 -1.405 -2.512 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.385 -2.979 -1.297 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.539 -1.177 -1.373 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.162 -2.751 -0.150 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.236 -1.851 -0.188 1.00 0.00 C ATOM 0 H TRP A 85 4.081 -0.899 -3.474 1.00 0.00 H new ATOM 0 HA TRP A 85 4.432 -2.082 -6.133 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.351 -3.529 -3.459 1.00 0.00 H new ATOM 0 HB3 TRP A 85 5.244 -3.971 -4.901 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.602 -1.236 -5.619 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.471 -0.233 -4.141 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.559 -3.674 -1.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.367 -0.484 -1.408 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 6.931 -3.272 0.767 1.00 0.00 H new ATOM 0 HH2 TRP A 85 8.829 -1.679 0.698 1.00 0.00 H new ATOM 1400 N LEU A 86 1.929 -2.550 -6.352 1.00 0.00 N ATOM 1401 CA LEU A 86 0.581 -3.139 -6.576 1.00 0.00 C ATOM 1402 C LEU A 86 0.731 -4.456 -7.342 1.00 0.00 C ATOM 1403 O LEU A 86 1.021 -4.467 -8.521 1.00 0.00 O ATOM 1404 CB LEU A 86 -0.254 -2.156 -7.397 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.643 -2.733 -7.664 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.278 -3.180 -6.347 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -2.515 -1.649 -8.307 1.00 0.00 C ATOM 0 H LEU A 86 2.242 -1.901 -7.074 1.00 0.00 H new ATOM 0 HA LEU A 86 0.089 -3.331 -5.623 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.342 -1.210 -6.863 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.247 -1.944 -8.342 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.562 -3.591 -8.331 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.269 -3.591 -6.542 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.653 -3.943 -5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.365 -2.325 -5.677 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.509 -2.050 -8.502 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.594 -0.797 -7.632 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -2.063 -1.328 -9.245 1.00 0.00 H new ATOM 1419 N VAL A 87 0.549 -5.569 -6.683 1.00 0.00 N ATOM 1420 CA VAL A 87 0.699 -6.870 -7.373 1.00 0.00 C ATOM 1421 C VAL A 87 -0.626 -7.285 -8.013 1.00 0.00 C ATOM 1422 O VAL A 87 -1.631 -6.615 -7.881 1.00 0.00 O ATOM 1423 CB VAL A 87 1.119 -7.919 -6.354 1.00 0.00 C ATOM 1424 CG1 VAL A 87 2.376 -7.449 -5.623 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.011 -8.145 -5.348 1.00 0.00 C ATOM 0 H VAL A 87 0.303 -5.627 -5.695 1.00 0.00 H new ATOM 0 HA VAL A 87 1.453 -6.781 -8.155 1.00 0.00 H new ATOM 0 HB VAL A 87 1.331 -8.856 -6.869 1.00 0.00 H new ATOM 0 HG11 VAL A 87 2.675 -8.201 -4.893 1.00 0.00 H new ATOM 0 HG12 VAL A 87 3.181 -7.300 -6.342 1.00 0.00 H new ATOM 0 HG13 VAL A 87 2.169 -6.509 -5.111 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.295 -8.897 -4.620 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.232 -7.210 -4.833 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.902 -8.489 -5.873 1.00 0.00 H new ATOM 1435 N GLU A 88 -0.632 -8.390 -8.707 1.00 0.00 N ATOM 1436 CA GLU A 88 -1.886 -8.854 -9.360 1.00 0.00 C ATOM 1437 C GLU A 88 -2.112 -10.342 -9.070 1.00 0.00 C ATOM 1438 O GLU A 88 -3.224 -10.826 -9.135 1.00 0.00 O ATOM 1439 CB GLU A 88 -1.784 -8.644 -10.872 1.00 0.00 C ATOM 1440 CG GLU A 88 -1.592 -7.157 -11.170 1.00 0.00 C ATOM 1441 CD GLU A 88 -0.387 -6.971 -12.094 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -0.478 -7.370 -13.244 1.00 0.00 O ATOM 1443 OE2 GLU A 88 0.608 -6.436 -11.635 1.00 0.00 O ATOM 0 H GLU A 88 0.179 -8.992 -8.849 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.724 -8.280 -8.964 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.948 -9.217 -11.274 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -2.686 -9.010 -11.362 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -2.488 -6.751 -11.638 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -1.440 -6.606 -10.242 1.00 0.00 H new ATOM 1450 N ARG A 89 -1.076 -11.080 -8.762 1.00 0.00 N ATOM 1451 CA ARG A 89 -1.265 -12.523 -8.488 1.00 0.00 C ATOM 1452 C ARG A 89 -0.261 -13.017 -7.455 1.00 0.00 C ATOM 1453 O ARG A 89 0.858 -12.555 -7.376 1.00 0.00 O ATOM 1454 CB ARG A 89 -1.057 -13.320 -9.778 1.00 0.00 C ATOM 1455 CG ARG A 89 -2.397 -13.547 -10.468 1.00 0.00 C ATOM 1456 CD ARG A 89 -3.414 -14.051 -9.451 1.00 0.00 C ATOM 1457 NE ARG A 89 -4.231 -15.143 -10.056 1.00 0.00 N ATOM 1458 CZ ARG A 89 -4.559 -15.091 -11.319 1.00 0.00 C ATOM 1459 NH1 ARG A 89 -4.763 -13.936 -11.891 1.00 0.00 N ATOM 1460 NH2 ARG A 89 -4.679 -16.192 -12.010 1.00 0.00 N ATOM 0 H ARG A 89 -0.116 -10.742 -8.690 1.00 0.00 H new ATOM 0 HA ARG A 89 -2.276 -12.665 -8.105 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -0.382 -12.782 -10.443 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -0.587 -14.277 -9.553 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -2.748 -12.619 -10.919 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -2.284 -14.271 -11.275 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.902 -14.417 -8.561 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -4.061 -13.233 -9.133 1.00 0.00 H new ATOM 0 HE ARG A 89 -4.534 -15.931 -9.483 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -4.666 -13.076 -11.352 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -5.019 -13.894 -12.877 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -4.517 -17.095 -11.564 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -4.935 -16.150 -12.996 1.00 0.00 H new ATOM 1474 N TRP A 90 -0.663 -13.985 -6.688 1.00 0.00 N ATOM 1475 CA TRP A 90 0.252 -14.573 -5.674 1.00 0.00 C ATOM 1476 C TRP A 90 -0.330 -15.877 -5.159 1.00 0.00 C ATOM 1477 O TRP A 90 -1.306 -16.387 -5.673 1.00 0.00 O ATOM 1478 CB TRP A 90 0.520 -13.608 -4.504 1.00 0.00 C ATOM 1479 CG TRP A 90 -0.713 -13.325 -3.693 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -0.881 -13.706 -2.404 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -1.921 -12.588 -4.060 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -2.109 -13.261 -1.953 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -2.796 -12.573 -2.944 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -2.345 -11.945 -5.241 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -4.042 -11.939 -3.009 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -3.596 -11.311 -5.301 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -4.441 -11.310 -4.188 1.00 0.00 C ATOM 0 H TRP A 90 -1.595 -14.399 -6.719 1.00 0.00 H new ATOM 0 HA TRP A 90 1.210 -14.762 -6.158 1.00 0.00 H new ATOM 0 HB2 TRP A 90 1.287 -14.033 -3.856 1.00 0.00 H new ATOM 0 HB3 TRP A 90 0.916 -12.671 -4.895 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -0.167 -14.269 -1.821 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -2.466 -13.418 -1.010 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -1.701 -11.940 -6.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -4.693 -11.937 -2.148 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -3.907 -10.821 -6.212 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -5.403 -10.822 -4.241 1.00 0.00 H new ATOM 1498 N GLU A 91 0.276 -16.431 -4.158 1.00 0.00 N ATOM 1499 CA GLU A 91 -0.219 -17.726 -3.617 1.00 0.00 C ATOM 1500 C GLU A 91 -1.195 -17.470 -2.474 1.00 0.00 C ATOM 1501 O GLU A 91 -2.395 -17.461 -2.665 1.00 0.00 O ATOM 1502 CB GLU A 91 0.965 -18.542 -3.107 1.00 0.00 C ATOM 1503 CG GLU A 91 0.448 -19.805 -2.420 1.00 0.00 C ATOM 1504 CD GLU A 91 1.345 -20.991 -2.782 1.00 0.00 C ATOM 1505 OE1 GLU A 91 2.393 -20.759 -3.361 1.00 0.00 O ATOM 1506 OE2 GLU A 91 0.967 -22.109 -2.475 1.00 0.00 O ATOM 0 H GLU A 91 1.095 -16.047 -3.686 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.732 -18.277 -4.406 1.00 0.00 H new ATOM 0 HB2 GLU A 91 1.622 -18.807 -3.935 1.00 0.00 H new ATOM 0 HB3 GLU A 91 1.556 -17.950 -2.408 1.00 0.00 H new ATOM 0 HG2 GLU A 91 0.434 -19.663 -1.339 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.578 -20.005 -2.729 1.00 0.00 H new ATOM 1513 N GLY A 92 -0.686 -17.273 -1.290 1.00 0.00 N ATOM 1514 CA GLY A 92 -1.577 -17.016 -0.126 1.00 0.00 C ATOM 1515 C GLY A 92 -2.631 -15.970 -0.509 1.00 0.00 C ATOM 1516 O GLY A 92 -2.651 -15.473 -1.612 1.00 0.00 O ATOM 0 H GLY A 92 0.312 -17.279 -1.078 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -2.063 -17.941 0.184 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -0.991 -16.663 0.723 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.510 -15.645 0.393 1.00 0.00 N ATOM 1521 CA GLU A 93 -4.575 -14.629 0.092 1.00 0.00 C ATOM 1522 C GLU A 93 -4.143 -13.152 0.366 1.00 0.00 C ATOM 1523 O GLU A 93 -4.683 -12.247 -0.227 1.00 0.00 O ATOM 1524 CB GLU A 93 -5.826 -14.956 0.910 1.00 0.00 C ATOM 1525 CG GLU A 93 -7.004 -15.205 -0.035 1.00 0.00 C ATOM 1526 CD GLU A 93 -8.138 -15.892 0.729 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -7.885 -16.928 1.322 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -9.240 -15.370 0.708 1.00 0.00 O ATOM 0 H GLU A 93 -3.544 -16.037 1.334 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.772 -14.694 -0.978 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.649 -15.836 1.528 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.056 -14.133 1.586 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.353 -14.261 -0.454 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.687 -15.827 -0.872 1.00 0.00 H new ATOM 1535 N PRO A 94 -3.207 -12.956 1.248 1.00 0.00 N ATOM 1536 CA PRO A 94 -2.679 -11.627 1.622 1.00 0.00 C ATOM 1537 C PRO A 94 -1.423 -11.295 0.802 1.00 0.00 C ATOM 1538 O PRO A 94 -1.159 -11.903 -0.209 1.00 0.00 O ATOM 1539 CB PRO A 94 -2.244 -11.847 3.069 1.00 0.00 C ATOM 1540 CG PRO A 94 -1.962 -13.365 3.200 1.00 0.00 C ATOM 1541 CD PRO A 94 -2.623 -14.040 1.992 1.00 0.00 C ATOM 0 HA PRO A 94 -3.401 -10.826 1.466 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -1.354 -11.263 3.303 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -3.023 -11.533 3.763 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -0.890 -13.560 3.214 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -2.369 -13.756 4.133 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -1.893 -14.584 1.393 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -3.380 -14.760 2.304 1.00 0.00 H new ATOM 1549 N TRP A 95 -0.624 -10.372 1.307 1.00 0.00 N ATOM 1550 CA TRP A 95 0.690 -9.972 0.680 1.00 0.00 C ATOM 1551 C TRP A 95 1.019 -8.508 0.992 1.00 0.00 C ATOM 1552 O TRP A 95 1.605 -7.814 0.183 1.00 0.00 O ATOM 1553 CB TRP A 95 0.767 -10.172 -0.836 1.00 0.00 C ATOM 1554 CG TRP A 95 2.222 -10.296 -1.171 1.00 0.00 C ATOM 1555 CD1 TRP A 95 2.996 -11.359 -0.846 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.098 -9.343 -1.840 1.00 0.00 C ATOM 1557 NE1 TRP A 95 4.292 -11.122 -1.269 1.00 0.00 N ATOM 1558 CE2 TRP A 95 4.405 -9.891 -1.895 1.00 0.00 C ATOM 1559 CE3 TRP A 95 2.889 -8.071 -2.401 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 5.465 -9.196 -2.485 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 3.952 -7.371 -2.994 1.00 0.00 C ATOM 1562 CH2 TRP A 95 5.236 -7.932 -3.036 1.00 0.00 C ATOM 0 H TRP A 95 -0.839 -9.860 2.163 1.00 0.00 H new ATOM 0 HA TRP A 95 1.420 -10.647 1.128 1.00 0.00 H new ATOM 0 HB2 TRP A 95 0.221 -11.066 -1.138 1.00 0.00 H new ATOM 0 HB3 TRP A 95 0.317 -9.330 -1.362 1.00 0.00 H new ATOM 0 HD1 TRP A 95 2.656 -12.249 -0.338 1.00 0.00 H new ATOM 0 HE1 TRP A 95 5.067 -11.772 -1.137 1.00 0.00 H new ATOM 0 HE3 TRP A 95 1.904 -7.629 -2.376 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 6.453 -9.632 -2.515 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 3.779 -6.394 -3.421 1.00 0.00 H new ATOM 0 HH2 TRP A 95 6.048 -7.387 -3.494 1.00 0.00 H new ATOM 1573 N GLY A 96 0.685 -8.036 2.162 1.00 0.00 N ATOM 1574 CA GLY A 96 1.026 -6.625 2.522 1.00 0.00 C ATOM 1575 C GLY A 96 1.593 -6.607 3.938 1.00 0.00 C ATOM 1576 O GLY A 96 2.711 -7.019 4.175 1.00 0.00 O ATOM 0 H GLY A 96 0.192 -8.562 2.884 1.00 0.00 H new ATOM 0 HA2 GLY A 96 1.753 -6.220 1.818 1.00 0.00 H new ATOM 0 HA3 GLY A 96 0.139 -5.994 2.462 1.00 0.00 H new ATOM 1580 N LYS A 97 0.830 -6.145 4.880 1.00 0.00 N ATOM 1581 CA LYS A 97 1.318 -6.114 6.284 1.00 0.00 C ATOM 1582 C LYS A 97 0.859 -7.388 6.996 1.00 0.00 C ATOM 1583 O LYS A 97 -0.204 -7.910 6.728 1.00 0.00 O ATOM 1584 CB LYS A 97 0.744 -4.890 7.000 1.00 0.00 C ATOM 1585 CG LYS A 97 1.860 -4.176 7.767 1.00 0.00 C ATOM 1586 CD LYS A 97 2.261 -5.011 8.983 1.00 0.00 C ATOM 1587 CE LYS A 97 2.589 -4.082 10.156 1.00 0.00 C ATOM 1588 NZ LYS A 97 4.066 -3.907 10.254 1.00 0.00 N ATOM 0 H LYS A 97 -0.114 -5.786 4.741 1.00 0.00 H new ATOM 0 HA LYS A 97 2.406 -6.056 6.296 1.00 0.00 H new ATOM 0 HB2 LYS A 97 0.293 -4.211 6.277 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -0.046 -5.194 7.686 1.00 0.00 H new ATOM 0 HG2 LYS A 97 2.722 -4.024 7.117 1.00 0.00 H new ATOM 0 HG3 LYS A 97 1.523 -3.190 8.086 1.00 0.00 H new ATOM 0 HD2 LYS A 97 1.451 -5.687 9.256 1.00 0.00 H new ATOM 0 HD3 LYS A 97 3.125 -5.630 8.743 1.00 0.00 H new ATOM 0 HE2 LYS A 97 2.106 -3.115 10.014 1.00 0.00 H new ATOM 0 HE3 LYS A 97 2.199 -4.500 11.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.297 -3.390 11.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 4.526 -4.840 10.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 4.407 -3.369 9.432 1.00 0.00 H new ATOM 1602 N GLU A 98 1.651 -7.894 7.900 1.00 0.00 N ATOM 1603 CA GLU A 98 1.252 -9.133 8.623 1.00 0.00 C ATOM 1604 C GLU A 98 0.730 -8.764 10.011 1.00 0.00 C ATOM 1605 O GLU A 98 1.327 -7.982 10.722 1.00 0.00 O ATOM 1606 CB GLU A 98 2.462 -10.060 8.759 1.00 0.00 C ATOM 1607 CG GLU A 98 1.992 -11.443 9.214 1.00 0.00 C ATOM 1608 CD GLU A 98 2.289 -11.618 10.703 1.00 0.00 C ATOM 1609 OE1 GLU A 98 1.539 -11.086 11.503 1.00 0.00 O ATOM 1610 OE2 GLU A 98 3.265 -12.281 11.018 1.00 0.00 O ATOM 0 H GLU A 98 2.555 -7.504 8.169 1.00 0.00 H new ATOM 0 HA GLU A 98 0.468 -9.644 8.064 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.985 -10.137 7.806 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.170 -9.649 9.479 1.00 0.00 H new ATOM 0 HG2 GLU A 98 0.923 -11.554 9.030 1.00 0.00 H new ATOM 0 HG3 GLU A 98 2.497 -12.218 8.638 1.00 0.00 H new ATOM 1617 N GLY A 99 -0.384 -9.320 10.401 1.00 0.00 N ATOM 1618 CA GLY A 99 -0.947 -8.998 11.741 1.00 0.00 C ATOM 1619 C GLY A 99 -1.890 -7.801 11.621 1.00 0.00 C ATOM 1620 O GLY A 99 -2.624 -7.480 12.535 1.00 0.00 O ATOM 0 H GLY A 99 -0.928 -9.983 9.849 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.484 -9.859 12.139 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -0.143 -8.773 12.441 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.878 -7.144 10.497 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.770 -5.973 10.304 1.00 0.00 C ATOM 1626 C GLN A 100 -4.114 -6.459 9.750 1.00 0.00 C ATOM 1627 O GLN A 100 -4.149 -7.329 8.901 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.114 -5.013 9.310 1.00 0.00 C ATOM 1629 CG GLN A 100 -3.016 -3.802 9.094 1.00 0.00 C ATOM 1630 CD GLN A 100 -2.745 -2.765 10.186 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -2.240 -3.094 11.242 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -3.064 -1.516 9.979 1.00 0.00 N ATOM 0 H GLN A 100 -1.284 -7.371 9.699 1.00 0.00 H new ATOM 0 HA GLN A 100 -2.934 -5.459 11.251 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.142 -4.693 9.686 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -1.937 -5.521 8.362 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -2.832 -3.368 8.111 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -4.063 -4.106 9.117 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -3.488 -1.238 9.094 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -2.889 -0.818 10.702 1.00 0.00 H new ATOM 1641 N PRO A 101 -5.185 -5.892 10.248 1.00 0.00 N ATOM 1642 CA PRO A 101 -6.540 -6.268 9.813 1.00 0.00 C ATOM 1643 C PRO A 101 -6.700 -6.082 8.305 1.00 0.00 C ATOM 1644 O PRO A 101 -6.659 -7.025 7.543 1.00 0.00 O ATOM 1645 CB PRO A 101 -7.477 -5.328 10.586 1.00 0.00 C ATOM 1646 CG PRO A 101 -6.602 -4.454 11.520 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.134 -4.837 11.276 1.00 0.00 C ATOM 0 HA PRO A 101 -6.758 -7.317 10.013 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -8.044 -4.702 9.897 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -8.201 -5.901 11.166 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -6.761 -3.396 11.313 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -6.872 -4.619 12.563 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -4.553 -3.980 10.935 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -4.662 -5.198 12.190 1.00 0.00 H new ATOM 1655 N GLY A 102 -6.897 -4.874 7.879 1.00 0.00 N ATOM 1656 CA GLY A 102 -7.080 -4.608 6.423 1.00 0.00 C ATOM 1657 C GLY A 102 -8.169 -5.531 5.880 1.00 0.00 C ATOM 1658 O GLY A 102 -8.678 -6.374 6.592 1.00 0.00 O ATOM 0 H GLY A 102 -6.940 -4.049 8.477 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.356 -3.566 6.263 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.144 -4.776 5.889 1.00 0.00 H new ATOM 1662 N GLU A 103 -8.561 -5.381 4.639 1.00 0.00 N ATOM 1663 CA GLU A 103 -9.644 -6.275 4.129 1.00 0.00 C ATOM 1664 C GLU A 103 -9.654 -6.325 2.601 1.00 0.00 C ATOM 1665 O GLU A 103 -8.895 -5.650 1.936 1.00 0.00 O ATOM 1666 CB GLU A 103 -10.997 -5.762 4.627 1.00 0.00 C ATOM 1667 CG GLU A 103 -11.039 -4.235 4.536 1.00 0.00 C ATOM 1668 CD GLU A 103 -11.394 -3.652 5.905 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -11.061 -4.278 6.899 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -11.993 -2.591 5.937 1.00 0.00 O ATOM 0 H GLU A 103 -8.191 -4.700 3.975 1.00 0.00 H new ATOM 0 HA GLU A 103 -9.459 -7.283 4.501 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -11.801 -6.193 4.031 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -11.159 -6.078 5.657 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -10.073 -3.853 4.206 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -11.775 -3.924 3.795 1.00 0.00 H new ATOM 1677 N TRP A 104 -10.521 -7.135 2.048 1.00 0.00 N ATOM 1678 CA TRP A 104 -10.607 -7.260 0.567 1.00 0.00 C ATOM 1679 C TRP A 104 -11.712 -6.343 0.030 1.00 0.00 C ATOM 1680 O TRP A 104 -12.737 -6.159 0.656 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.937 -8.710 0.201 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.670 -9.476 -0.004 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -8.584 -9.410 0.800 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.338 -10.421 -1.063 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.607 -10.254 0.303 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.024 -10.898 -0.845 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.040 -10.905 -2.182 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -7.429 -11.824 -1.704 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -9.444 -11.837 -3.049 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -8.141 -12.295 -2.809 1.00 0.00 C ATOM 0 H TRP A 104 -11.177 -7.719 2.567 1.00 0.00 H new ATOM 0 HA TRP A 104 -9.652 -6.972 0.126 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.528 -9.170 0.993 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -11.542 -8.738 -0.705 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -8.494 -8.798 1.685 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.691 -10.385 0.732 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.044 -10.558 -2.376 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -6.425 -12.174 -1.515 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -9.993 -12.202 -3.905 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -7.688 -13.012 -3.478 1.00 0.00 H new ATOM 1701 N MET A 105 -11.516 -5.777 -1.131 1.00 0.00 N ATOM 1702 CA MET A 105 -12.559 -4.889 -1.717 1.00 0.00 C ATOM 1703 C MET A 105 -13.170 -5.594 -2.929 1.00 0.00 C ATOM 1704 O MET A 105 -12.843 -6.725 -3.220 1.00 0.00 O ATOM 1705 CB MET A 105 -11.924 -3.568 -2.157 1.00 0.00 C ATOM 1706 CG MET A 105 -12.645 -2.402 -1.476 1.00 0.00 C ATOM 1707 SD MET A 105 -11.894 -0.839 -1.996 1.00 0.00 S ATOM 1708 CE MET A 105 -10.746 -0.665 -0.607 1.00 0.00 C ATOM 0 H MET A 105 -10.677 -5.892 -1.699 1.00 0.00 H new ATOM 0 HA MET A 105 -13.331 -4.680 -0.976 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.866 -3.557 -1.897 1.00 0.00 H new ATOM 0 HB3 MET A 105 -11.987 -3.465 -3.240 1.00 0.00 H new ATOM 0 HG2 MET A 105 -13.703 -2.413 -1.737 1.00 0.00 H new ATOM 0 HG3 MET A 105 -12.582 -2.505 -0.393 1.00 0.00 H new ATOM 0 HE1 MET A 105 -10.168 0.252 -0.725 1.00 0.00 H new ATOM 0 HE2 MET A 105 -11.308 -0.622 0.326 1.00 0.00 H new ATOM 0 HE3 MET A 105 -10.070 -1.520 -0.584 1.00 0.00 H new ATOM 1718 N SER A 106 -14.056 -4.949 -3.640 1.00 0.00 N ATOM 1719 CA SER A 106 -14.667 -5.619 -4.823 1.00 0.00 C ATOM 1720 C SER A 106 -14.624 -4.695 -6.037 1.00 0.00 C ATOM 1721 O SER A 106 -15.495 -4.737 -6.883 1.00 0.00 O ATOM 1722 CB SER A 106 -16.119 -5.983 -4.510 1.00 0.00 C ATOM 1723 OG SER A 106 -16.748 -6.458 -5.691 1.00 0.00 O ATOM 0 H SER A 106 -14.380 -3.999 -3.456 1.00 0.00 H new ATOM 0 HA SER A 106 -14.101 -6.523 -5.048 1.00 0.00 H new ATOM 0 HB2 SER A 106 -16.155 -6.746 -3.733 1.00 0.00 H new ATOM 0 HB3 SER A 106 -16.650 -5.112 -4.126 1.00 0.00 H new ATOM 0 HG SER A 106 -16.610 -5.814 -6.417 1.00 0.00 H new ATOM 1729 N LEU A 107 -13.605 -3.879 -6.130 1.00 0.00 N ATOM 1730 CA LEU A 107 -13.473 -2.946 -7.293 1.00 0.00 C ATOM 1731 C LEU A 107 -14.859 -2.500 -7.766 1.00 0.00 C ATOM 1732 O LEU A 107 -15.240 -2.727 -8.897 1.00 0.00 O ATOM 1733 CB LEU A 107 -12.753 -3.664 -8.434 1.00 0.00 C ATOM 1734 CG LEU A 107 -12.145 -2.634 -9.385 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -10.652 -2.489 -9.091 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -12.338 -3.102 -10.828 1.00 0.00 C ATOM 0 H LEU A 107 -12.852 -3.818 -5.445 1.00 0.00 H new ATOM 0 HA LEU A 107 -12.902 -2.069 -6.988 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -11.972 -4.311 -8.035 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -13.452 -4.304 -8.973 1.00 0.00 H new ATOM 0 HG LEU A 107 -12.637 -1.672 -9.245 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -10.217 -1.754 -9.769 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -10.514 -2.159 -8.061 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -10.158 -3.450 -9.233 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -11.905 -2.369 -11.509 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.844 -4.063 -10.968 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -13.403 -3.207 -11.037 1.00 0.00 H new ATOM 1748 N VAL A 108 -15.621 -1.878 -6.909 1.00 0.00 N ATOM 1749 CA VAL A 108 -16.986 -1.438 -7.319 1.00 0.00 C ATOM 1750 C VAL A 108 -17.021 0.082 -7.450 1.00 0.00 C ATOM 1751 O VAL A 108 -17.622 0.621 -8.358 1.00 0.00 O ATOM 1752 CB VAL A 108 -18.004 -1.880 -6.266 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -19.366 -1.257 -6.580 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -18.126 -3.405 -6.287 1.00 0.00 C ATOM 0 H VAL A 108 -15.361 -1.656 -5.948 1.00 0.00 H new ATOM 0 HA VAL A 108 -17.234 -1.889 -8.280 1.00 0.00 H new ATOM 0 HB VAL A 108 -17.673 -1.553 -5.280 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -20.092 -1.572 -5.830 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -19.280 -0.170 -6.569 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -19.697 -1.585 -7.565 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -18.851 -3.722 -5.537 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -18.458 -3.730 -7.273 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -17.156 -3.851 -6.065 1.00 0.00 H new ATOM 1764 N GLY A 109 -16.386 0.780 -6.554 1.00 0.00 N ATOM 1765 CA GLY A 109 -16.390 2.264 -6.635 1.00 0.00 C ATOM 1766 C GLY A 109 -15.092 2.810 -6.045 1.00 0.00 C ATOM 1767 O GLY A 109 -15.077 3.850 -5.418 1.00 0.00 O ATOM 0 H GLY A 109 -15.865 0.388 -5.770 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -16.492 2.582 -7.673 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -17.246 2.666 -6.093 1.00 0.00 H new ATOM 1771 N LEU A 110 -14.000 2.119 -6.236 1.00 0.00 N ATOM 1772 CA LEU A 110 -12.716 2.608 -5.680 1.00 0.00 C ATOM 1773 C LEU A 110 -12.577 4.100 -5.974 1.00 0.00 C ATOM 1774 O LEU A 110 -12.895 4.562 -7.052 1.00 0.00 O ATOM 1775 CB LEU A 110 -11.559 1.858 -6.327 1.00 0.00 C ATOM 1776 CG LEU A 110 -10.793 1.088 -5.253 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -9.685 0.264 -5.908 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -10.173 2.079 -4.263 1.00 0.00 C ATOM 0 H LEU A 110 -13.946 1.241 -6.752 1.00 0.00 H new ATOM 0 HA LEU A 110 -12.699 2.440 -4.603 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -11.935 1.171 -7.085 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -10.894 2.558 -6.833 1.00 0.00 H new ATOM 0 HG LEU A 110 -11.476 0.423 -4.725 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -9.139 -0.285 -5.141 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -10.124 -0.440 -6.615 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -9.001 0.929 -6.435 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -9.626 1.532 -3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -9.490 2.743 -4.793 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -10.962 2.668 -3.796 1.00 0.00 H new ATOM 1790 N ASN A 111 -12.106 4.858 -5.027 1.00 0.00 N ATOM 1791 CA ASN A 111 -11.954 6.320 -5.259 1.00 0.00 C ATOM 1792 C ASN A 111 -10.975 6.910 -4.238 1.00 0.00 C ATOM 1793 O ASN A 111 -10.810 6.392 -3.151 1.00 0.00 O ATOM 1794 CB ASN A 111 -13.318 6.995 -5.106 1.00 0.00 C ATOM 1795 CG ASN A 111 -13.454 8.117 -6.134 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -13.028 9.230 -5.897 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -14.038 7.872 -7.276 1.00 0.00 N ATOM 0 H ASN A 111 -11.820 4.531 -4.104 1.00 0.00 H new ATOM 0 HA ASN A 111 -11.567 6.490 -6.264 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -14.114 6.264 -5.244 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -13.425 7.397 -4.098 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -14.136 8.615 -7.968 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -14.396 6.938 -7.476 1.00 0.00 H new ATOM 1804 N ALA A 112 -10.333 7.996 -4.576 1.00 0.00 N ATOM 1805 CA ALA A 112 -9.377 8.627 -3.622 1.00 0.00 C ATOM 1806 C ALA A 112 -10.132 9.028 -2.349 1.00 0.00 C ATOM 1807 O ALA A 112 -9.541 9.322 -1.328 1.00 0.00 O ATOM 1808 CB ALA A 112 -8.768 9.874 -4.265 1.00 0.00 C ATOM 0 H ALA A 112 -10.430 8.473 -5.472 1.00 0.00 H new ATOM 0 HA ALA A 112 -8.584 7.922 -3.374 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -8.068 10.337 -3.569 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -8.241 9.593 -5.176 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -9.560 10.582 -4.508 1.00 0.00 H new ATOM 1814 N ASP A 113 -11.440 9.046 -2.408 1.00 0.00 N ATOM 1815 CA ASP A 113 -12.247 9.429 -1.214 1.00 0.00 C ATOM 1816 C ASP A 113 -11.975 8.456 -0.069 1.00 0.00 C ATOM 1817 O ASP A 113 -11.830 8.849 1.070 1.00 0.00 O ATOM 1818 CB ASP A 113 -13.728 9.379 -1.573 1.00 0.00 C ATOM 1819 CG ASP A 113 -14.534 10.211 -0.571 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -14.904 9.667 0.457 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -14.768 11.375 -0.849 1.00 0.00 O ATOM 0 H ASP A 113 -11.985 8.810 -3.238 1.00 0.00 H new ATOM 0 HA ASP A 113 -11.973 10.437 -0.903 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.880 9.761 -2.582 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -14.078 8.347 -1.567 1.00 0.00 H new ATOM 1826 N ASP A 114 -11.893 7.188 -0.362 1.00 0.00 N ATOM 1827 CA ASP A 114 -11.617 6.205 0.717 1.00 0.00 C ATOM 1828 C ASP A 114 -10.128 6.262 1.038 1.00 0.00 C ATOM 1829 O ASP A 114 -9.666 5.714 2.018 1.00 0.00 O ATOM 1830 CB ASP A 114 -11.983 4.796 0.244 1.00 0.00 C ATOM 1831 CG ASP A 114 -12.760 4.073 1.345 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -12.794 4.585 2.452 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -13.305 3.019 1.065 1.00 0.00 O ATOM 0 H ASP A 114 -12.005 6.794 -1.296 1.00 0.00 H new ATOM 0 HA ASP A 114 -12.209 6.442 1.601 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.584 4.850 -0.664 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -11.080 4.238 -0.004 1.00 0.00 H new ATOM 1838 N PHE A 115 -9.374 6.943 0.221 1.00 0.00 N ATOM 1839 CA PHE A 115 -7.916 7.056 0.481 1.00 0.00 C ATOM 1840 C PHE A 115 -7.626 8.449 1.043 1.00 0.00 C ATOM 1841 O PHE A 115 -7.666 9.423 0.318 1.00 0.00 O ATOM 1842 CB PHE A 115 -7.149 6.862 -0.827 1.00 0.00 C ATOM 1843 CG PHE A 115 -6.803 5.401 -0.988 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -5.696 4.862 -0.321 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -7.594 4.584 -1.804 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -5.379 3.508 -0.472 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -7.278 3.230 -1.955 1.00 0.00 C ATOM 1848 CZ PHE A 115 -6.170 2.691 -1.290 1.00 0.00 C ATOM 0 H PHE A 115 -9.706 7.425 -0.614 1.00 0.00 H new ATOM 0 HA PHE A 115 -7.603 6.294 1.195 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -7.752 7.200 -1.670 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -6.241 7.465 -0.823 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -5.087 5.492 0.310 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -8.449 4.999 -2.317 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -4.525 3.093 0.042 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -7.889 2.600 -2.585 1.00 0.00 H new ATOM 0 HZ PHE A 115 -5.925 1.646 -1.408 1.00 0.00 H new ATOM 1858 N PRO A 116 -7.348 8.509 2.321 1.00 0.00 N ATOM 1859 CA PRO A 116 -7.056 9.782 2.990 1.00 0.00 C ATOM 1860 C PRO A 116 -6.027 10.577 2.180 1.00 0.00 C ATOM 1861 O PRO A 116 -5.310 10.017 1.374 1.00 0.00 O ATOM 1862 CB PRO A 116 -6.511 9.377 4.367 1.00 0.00 C ATOM 1863 CG PRO A 116 -6.771 7.861 4.539 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.287 7.324 3.195 1.00 0.00 C ATOM 0 HA PRO A 116 -7.929 10.428 3.083 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -5.445 9.594 4.437 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.004 9.943 5.157 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.856 7.346 4.831 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.502 7.685 5.328 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -6.619 6.565 2.788 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -8.267 6.860 3.303 1.00 0.00 H new ATOM 1872 N PRO A 117 -6.005 11.865 2.405 1.00 0.00 N ATOM 1873 CA PRO A 117 -5.090 12.772 1.688 1.00 0.00 C ATOM 1874 C PRO A 117 -3.634 12.335 1.872 1.00 0.00 C ATOM 1875 O PRO A 117 -3.354 11.292 2.428 1.00 0.00 O ATOM 1876 CB PRO A 117 -5.335 14.150 2.318 1.00 0.00 C ATOM 1877 CG PRO A 117 -6.471 13.999 3.361 1.00 0.00 C ATOM 1878 CD PRO A 117 -6.881 12.518 3.394 1.00 0.00 C ATOM 0 HA PRO A 117 -5.270 12.775 0.613 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -4.426 14.520 2.794 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.612 14.876 1.553 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -6.133 14.324 4.345 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -7.322 14.626 3.093 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -6.744 12.091 4.388 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -7.932 12.392 3.136 1.00 0.00 H new ATOM 1886 N ALA A 118 -2.711 13.134 1.398 1.00 0.00 N ATOM 1887 CA ALA A 118 -1.261 12.796 1.525 1.00 0.00 C ATOM 1888 C ALA A 118 -0.833 11.870 0.380 1.00 0.00 C ATOM 1889 O ALA A 118 0.337 11.769 0.065 1.00 0.00 O ATOM 1890 CB ALA A 118 -0.998 12.109 2.868 1.00 0.00 C ATOM 0 H ALA A 118 -2.903 14.016 0.923 1.00 0.00 H new ATOM 0 HA ALA A 118 -0.681 13.718 1.474 1.00 0.00 H new ATOM 0 HB1 ALA A 118 0.061 11.866 2.951 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -1.282 12.778 3.681 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -1.586 11.193 2.929 1.00 0.00 H new ATOM 1896 N ASN A 119 -1.757 11.188 -0.242 1.00 0.00 N ATOM 1897 CA ASN A 119 -1.384 10.275 -1.352 1.00 0.00 C ATOM 1898 C ASN A 119 -2.168 10.645 -2.617 1.00 0.00 C ATOM 1899 O ASN A 119 -2.619 9.792 -3.352 1.00 0.00 O ATOM 1900 CB ASN A 119 -1.717 8.846 -0.938 1.00 0.00 C ATOM 1901 CG ASN A 119 -0.426 8.103 -0.595 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.067 7.147 -1.253 1.00 0.00 O ATOM 1903 ND2 ASN A 119 0.291 8.507 0.418 1.00 0.00 N ATOM 0 H ASN A 119 -2.753 11.226 -0.027 1.00 0.00 H new ATOM 0 HA ASN A 119 -0.318 10.363 -1.563 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -2.386 8.851 -0.078 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.241 8.334 -1.746 1.00 0.00 H new ATOM 0 HD21 ASN A 119 1.154 8.020 0.658 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.012 9.310 0.969 1.00 0.00 H new ATOM 1910 N GLU A 120 -2.334 11.911 -2.872 1.00 0.00 N ATOM 1911 CA GLU A 120 -3.088 12.351 -4.080 1.00 0.00 C ATOM 1912 C GLU A 120 -2.306 12.107 -5.395 1.00 0.00 C ATOM 1913 O GLU A 120 -2.918 11.852 -6.413 1.00 0.00 O ATOM 1914 CB GLU A 120 -3.391 13.844 -3.956 1.00 0.00 C ATOM 1915 CG GLU A 120 -4.256 14.092 -2.719 1.00 0.00 C ATOM 1916 CD GLU A 120 -5.590 14.705 -3.144 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -5.564 15.695 -3.857 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -6.615 14.175 -2.749 1.00 0.00 O ATOM 0 H GLU A 120 -1.976 12.669 -2.290 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.003 11.761 -4.128 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -2.462 14.409 -3.881 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.907 14.196 -4.849 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -4.427 13.156 -2.188 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -3.740 14.760 -2.029 1.00 0.00 H new ATOM 1925 N PRO A 121 -0.992 12.228 -5.369 1.00 0.00 N ATOM 1926 CA PRO A 121 -0.169 12.058 -6.585 1.00 0.00 C ATOM 1927 C PRO A 121 -0.295 10.648 -7.174 1.00 0.00 C ATOM 1928 O PRO A 121 -0.283 10.478 -8.378 1.00 0.00 O ATOM 1929 CB PRO A 121 1.272 12.321 -6.131 1.00 0.00 C ATOM 1930 CG PRO A 121 1.231 12.681 -4.627 1.00 0.00 C ATOM 1931 CD PRO A 121 -0.221 12.532 -4.153 1.00 0.00 C ATOM 0 HA PRO A 121 -0.492 12.738 -7.374 1.00 0.00 H new ATOM 0 HB2 PRO A 121 1.892 11.440 -6.297 1.00 0.00 H new ATOM 0 HB3 PRO A 121 1.713 13.134 -6.707 1.00 0.00 H new ATOM 0 HG2 PRO A 121 1.889 12.024 -4.058 1.00 0.00 H new ATOM 0 HG3 PRO A 121 1.583 13.700 -4.468 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -0.315 11.734 -3.417 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -0.577 13.447 -3.679 1.00 0.00 H new ATOM 1939 N VAL A 122 -0.411 9.630 -6.361 1.00 0.00 N ATOM 1940 CA VAL A 122 -0.526 8.264 -6.924 1.00 0.00 C ATOM 1941 C VAL A 122 -1.999 7.849 -6.888 1.00 0.00 C ATOM 1942 O VAL A 122 -2.520 7.313 -7.842 1.00 0.00 O ATOM 1943 CB VAL A 122 0.378 7.312 -6.110 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -0.384 6.075 -5.627 1.00 0.00 C ATOM 1945 CG2 VAL A 122 1.546 6.864 -6.990 1.00 0.00 C ATOM 0 H VAL A 122 -0.430 9.690 -5.343 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.192 8.226 -7.961 1.00 0.00 H new ATOM 0 HB VAL A 122 0.734 7.852 -5.233 1.00 0.00 H new ATOM 0 HG11 VAL A 122 0.288 5.432 -5.059 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.214 6.384 -4.991 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.770 5.527 -6.486 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.191 6.191 -6.424 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.162 6.345 -7.868 1.00 0.00 H new ATOM 0 HG23 VAL A 122 2.119 7.736 -7.305 1.00 0.00 H new ATOM 1955 N ILE A 123 -2.675 8.117 -5.802 1.00 0.00 N ATOM 1956 CA ILE A 123 -4.114 7.763 -5.705 1.00 0.00 C ATOM 1957 C ILE A 123 -4.868 8.377 -6.882 1.00 0.00 C ATOM 1958 O ILE A 123 -5.830 7.824 -7.376 1.00 0.00 O ATOM 1959 CB ILE A 123 -4.667 8.319 -4.403 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -3.953 7.637 -3.237 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -6.167 8.041 -4.333 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -4.430 6.190 -3.117 1.00 0.00 C ATOM 0 H ILE A 123 -2.286 8.569 -4.975 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.234 6.680 -5.727 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.503 9.395 -4.351 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -2.875 7.663 -3.393 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.154 8.174 -2.310 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.568 8.438 -3.400 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -6.666 8.520 -5.175 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -6.340 6.966 -4.373 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.919 5.706 -2.285 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.506 6.175 -2.941 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -4.206 5.655 -4.040 1.00 0.00 H new ATOM 1974 N ALA A 124 -4.437 9.521 -7.334 1.00 0.00 N ATOM 1975 CA ALA A 124 -5.129 10.176 -8.479 1.00 0.00 C ATOM 1976 C ALA A 124 -5.327 9.159 -9.608 1.00 0.00 C ATOM 1977 O ALA A 124 -6.346 9.142 -10.269 1.00 0.00 O ATOM 1978 CB ALA A 124 -4.278 11.342 -8.986 1.00 0.00 C ATOM 0 H ALA A 124 -3.636 10.031 -6.961 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.100 10.548 -8.153 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -4.782 11.823 -9.824 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.137 12.066 -8.183 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.307 10.969 -9.312 1.00 0.00 H new ATOM 1984 N LYS A 125 -4.353 8.324 -9.841 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.471 7.318 -10.935 1.00 0.00 C ATOM 1986 C LYS A 125 -5.302 6.112 -10.482 1.00 0.00 C ATOM 1987 O LYS A 125 -5.999 5.502 -11.269 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.075 6.842 -11.344 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.936 6.924 -12.864 1.00 0.00 C ATOM 1990 CD LYS A 125 -3.731 5.788 -13.511 1.00 0.00 C ATOM 1991 CE LYS A 125 -4.385 6.290 -14.800 1.00 0.00 C ATOM 1992 NZ LYS A 125 -3.417 6.173 -15.927 1.00 0.00 N ATOM 0 H LYS A 125 -3.477 8.294 -9.319 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.970 7.788 -11.782 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.314 7.457 -10.864 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.915 5.818 -11.008 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -3.300 7.887 -13.222 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.886 6.855 -13.148 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -3.072 4.947 -13.729 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -4.493 5.425 -12.822 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -5.282 5.709 -15.015 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -4.698 7.327 -14.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -3.861 6.514 -16.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.573 6.745 -15.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -3.140 5.178 -16.044 1.00 0.00 H new ATOM 2006 N LEU A 126 -5.230 5.750 -9.229 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.006 4.584 -8.749 1.00 0.00 C ATOM 2008 C LEU A 126 -7.448 4.687 -9.236 1.00 0.00 C ATOM 2009 O LEU A 126 -8.101 3.694 -9.482 1.00 0.00 O ATOM 2010 CB LEU A 126 -5.986 4.578 -7.232 1.00 0.00 C ATOM 2011 CG LEU A 126 -4.681 3.956 -6.722 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.624 2.478 -7.107 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -3.489 4.679 -7.345 1.00 0.00 C ATOM 0 H LEU A 126 -4.664 6.216 -8.520 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.565 3.664 -9.134 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -6.083 5.596 -6.856 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.839 4.015 -6.852 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.645 4.052 -5.637 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.694 2.042 -6.741 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -5.470 1.953 -6.663 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.667 2.383 -8.192 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.563 4.235 -6.981 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -3.534 4.586 -8.430 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -3.518 5.733 -7.070 1.00 0.00 H new ATOM 2025 N LYS A 127 -7.955 5.881 -9.384 1.00 0.00 N ATOM 2026 CA LYS A 127 -9.339 6.041 -9.866 1.00 0.00 C ATOM 2027 C LYS A 127 -9.434 5.419 -11.257 1.00 0.00 C ATOM 2028 O LYS A 127 -10.274 4.582 -11.523 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.649 7.531 -9.929 1.00 0.00 C ATOM 2030 CG LYS A 127 -9.678 8.099 -8.509 1.00 0.00 C ATOM 2031 CD LYS A 127 -10.095 9.571 -8.552 1.00 0.00 C ATOM 2032 CE LYS A 127 -8.950 10.439 -8.023 1.00 0.00 C ATOM 2033 NZ LYS A 127 -8.595 11.468 -9.042 1.00 0.00 N ATOM 0 H LYS A 127 -7.460 6.751 -9.188 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.052 5.551 -9.203 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.896 8.047 -10.524 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.609 7.695 -10.419 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -10.376 7.531 -7.894 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -8.695 8.003 -8.048 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.344 9.860 -9.573 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.991 9.725 -7.950 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.245 10.921 -7.091 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -8.082 9.818 -7.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -7.817 12.058 -8.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -8.296 10.998 -9.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -9.423 12.067 -9.234 1.00 0.00 H new ATOM 2047 N ARG A 128 -8.557 5.810 -12.142 1.00 0.00 N ATOM 2048 CA ARG A 128 -8.563 5.240 -13.505 1.00 0.00 C ATOM 2049 C ARG A 128 -7.824 3.896 -13.495 1.00 0.00 C ATOM 2050 O ARG A 128 -7.546 3.337 -14.536 1.00 0.00 O ATOM 2051 CB ARG A 128 -7.849 6.205 -14.447 1.00 0.00 C ATOM 2052 CG ARG A 128 -8.881 7.071 -15.168 1.00 0.00 C ATOM 2053 CD ARG A 128 -8.497 7.206 -16.643 1.00 0.00 C ATOM 2054 NE ARG A 128 -9.399 8.190 -17.307 1.00 0.00 N ATOM 2055 CZ ARG A 128 -9.090 8.672 -18.482 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -9.464 8.044 -19.564 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -8.404 9.778 -18.575 1.00 0.00 N ATOM 0 H ARG A 128 -7.833 6.507 -11.970 1.00 0.00 H new ATOM 0 HA ARG A 128 -9.589 5.087 -13.840 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -7.159 6.835 -13.885 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -7.255 5.649 -15.172 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -9.871 6.624 -15.079 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -8.933 8.056 -14.704 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -7.460 7.531 -16.731 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -8.571 6.238 -17.138 1.00 0.00 H new ATOM 0 HE ARG A 128 -10.258 8.487 -16.844 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -9.997 7.177 -19.492 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -9.223 8.420 -20.481 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -8.108 10.267 -17.730 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -8.163 10.153 -19.492 1.00 0.00 H new ATOM 2071 N LEU A 129 -7.509 3.386 -12.319 1.00 0.00 N ATOM 2072 CA LEU A 129 -6.793 2.082 -12.190 1.00 0.00 C ATOM 2073 C LEU A 129 -7.017 1.207 -13.428 1.00 0.00 C ATOM 2074 O LEU A 129 -8.068 0.592 -13.511 1.00 0.00 O ATOM 2075 CB LEU A 129 -7.348 1.362 -10.964 1.00 0.00 C ATOM 2076 CG LEU A 129 -6.274 1.255 -9.879 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -6.919 1.469 -8.507 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -5.638 -0.136 -9.917 1.00 0.00 C ATOM 2079 OXT LEU A 129 -6.135 1.167 -14.269 1.00 0.00 O ATOM 0 H LEU A 129 -7.726 3.835 -11.429 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.723 2.265 -12.092 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.213 1.902 -10.577 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.693 0.366 -11.244 1.00 0.00 H new ATOM 0 HG LEU A 129 -5.509 2.011 -10.055 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.157 1.394 -7.731 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -7.377 2.457 -8.471 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -7.682 0.709 -8.341 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -4.874 -0.208 -9.143 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.404 -0.891 -9.742 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -5.182 -0.301 -10.893 1.00 0.00 H new TER 2091 LEU A 129