USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 814 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0196 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -163:sc=-0.00305 (180deg=-0.12) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 MET CE :methyl -163:sc= 0 (180deg=-0.157) USER MOD Single : A 14 ASN : amide:sc= -3.19! C(o=-3.2!,f=-2.9!) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.753 K(o=-0.75,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 138:sc= -0.0338 (180deg=-0.854) USER MOD Single : A 20 SER OG : rot 95:sc= 1.26 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -4.89! C(o=-4.9!,f=-4.2!) USER MOD Single : A 30 ASN : amide:sc= -0.527 X(o=-0.53,f=-0.047) USER MOD Single : A 31 HIS : no HE2:sc= -4.15! C(o=-4.2!,f=-5!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 MET CE :methyl 160:sc= -0.379 (180deg=-1.54) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc=-0.00227 X(o=-0.0023,f=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -1.42 K(o=-1.4,f=-0.55) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -0.21 K(o=-0.21,f=-5.7!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 HIS : no HD1:sc= -2.96! C(o=-3!,f=-4.2!) USER MOD Single : A 56 TYR OH : rot 180:sc= -0.0364 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -0.044 X(o=-0.044,f=-0.23) USER MOD Single : A 64 GLN : amide:sc= -6.13! K(o=-6.1!,f=-2.6) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 TYR OH : rot 180:sc= -0.0231 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HD1:sc= -1.25 K(o=-1.2,f=-0.078) USER MOD Single : A 76 LYS NZ :NH3+ 164:sc= -0.024 (180deg=-0.276) USER MOD Single : A 77 SER OG : rot -30:sc= 0.166 USER MOD Single : A 79 SER OG : rot 180:sc= -0.358 USER MOD Single : A 81 GLN : amide:sc= -0.163 X(o=-0.16,f=0) USER MOD Single : A 86 TYR OH : rot 180:sc= -0.631! USER MOD Single : A 87 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0491) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -1.68 X(o=-1.7,f=-1.6) USER MOD Single : A 93 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.032) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 14:sc= 1.01 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.237 -8.255 2.655 1.00 0.00 N ATOM 2 CA GLY A 1 -20.702 -9.419 1.922 1.00 0.00 C ATOM 3 C GLY A 1 -21.396 -9.008 0.622 1.00 0.00 C ATOM 4 O GLY A 1 -22.573 -9.304 0.422 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.770 -8.561 3.532 1.00 0.00 H new ATOM 0 H2 GLY A 1 -19.561 -7.724 2.070 1.00 0.00 H new ATOM 0 H3 GLY A 1 -21.047 -7.645 2.888 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -19.859 -10.072 1.697 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -21.392 -9.991 2.542 1.00 0.00 H new ATOM 8 N SER A 2 -20.638 -8.330 -0.228 1.00 0.00 N ATOM 9 CA SER A 2 -21.166 -7.875 -1.503 1.00 0.00 C ATOM 10 C SER A 2 -20.018 -7.589 -2.472 1.00 0.00 C ATOM 11 O SER A 2 -18.964 -7.101 -2.066 1.00 0.00 O ATOM 12 CB SER A 2 -22.034 -6.628 -1.325 1.00 0.00 C ATOM 13 OG SER A 2 -21.375 -5.623 -0.559 1.00 0.00 O ATOM 0 H SER A 2 -19.663 -8.085 -0.058 1.00 0.00 H new ATOM 0 HA SER A 2 -21.793 -8.665 -1.916 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.295 -6.225 -2.304 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.968 -6.903 -0.835 1.00 0.00 H new ATOM 0 HG SER A 2 -21.961 -4.843 -0.470 1.00 0.00 H new ATOM 19 N SER A 3 -20.260 -7.905 -3.736 1.00 0.00 N ATOM 20 CA SER A 3 -19.260 -7.688 -4.767 1.00 0.00 C ATOM 21 C SER A 3 -19.847 -6.840 -5.897 1.00 0.00 C ATOM 22 O SER A 3 -21.064 -6.781 -6.065 1.00 0.00 O ATOM 23 CB SER A 3 -18.738 -9.017 -5.317 1.00 0.00 C ATOM 24 OG SER A 3 -17.449 -9.339 -4.802 1.00 0.00 O ATOM 0 H SER A 3 -21.135 -8.310 -4.069 1.00 0.00 H new ATOM 0 HA SER A 3 -18.420 -7.155 -4.321 1.00 0.00 H new ATOM 0 HB2 SER A 3 -19.438 -9.813 -5.065 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.691 -8.966 -6.405 1.00 0.00 H new ATOM 0 HG SER A 3 -17.152 -10.195 -5.176 1.00 0.00 H new ATOM 30 N GLY A 4 -18.955 -6.204 -6.642 1.00 0.00 N ATOM 31 CA GLY A 4 -19.370 -5.362 -7.751 1.00 0.00 C ATOM 32 C GLY A 4 -18.538 -4.079 -7.807 1.00 0.00 C ATOM 33 O GLY A 4 -18.033 -3.617 -6.784 1.00 0.00 O ATOM 0 H GLY A 4 -17.946 -6.255 -6.499 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.264 -5.910 -8.687 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -20.426 -5.111 -7.646 1.00 0.00 H new ATOM 37 N SER A 5 -18.421 -3.540 -9.011 1.00 0.00 N ATOM 38 CA SER A 5 -17.658 -2.320 -9.214 1.00 0.00 C ATOM 39 C SER A 5 -16.160 -2.624 -9.159 1.00 0.00 C ATOM 40 O SER A 5 -15.470 -2.548 -10.175 1.00 0.00 O ATOM 41 CB SER A 5 -18.024 -1.262 -8.171 1.00 0.00 C ATOM 42 OG SER A 5 -19.429 -1.200 -7.943 1.00 0.00 O ATOM 0 H SER A 5 -18.842 -3.926 -9.856 1.00 0.00 H new ATOM 0 HA SER A 5 -17.905 -1.922 -10.198 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.514 -1.485 -7.234 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.667 -0.287 -8.503 1.00 0.00 H new ATOM 0 HG SER A 5 -19.621 -0.514 -7.270 1.00 0.00 H new ATOM 48 N SER A 6 -15.700 -2.962 -7.963 1.00 0.00 N ATOM 49 CA SER A 6 -14.296 -3.277 -7.762 1.00 0.00 C ATOM 50 C SER A 6 -14.151 -4.351 -6.682 1.00 0.00 C ATOM 51 O SER A 6 -14.670 -4.200 -5.577 1.00 0.00 O ATOM 52 CB SER A 6 -13.500 -2.028 -7.380 1.00 0.00 C ATOM 53 OG SER A 6 -13.555 -1.029 -8.394 1.00 0.00 O ATOM 0 H SER A 6 -16.275 -3.025 -7.123 1.00 0.00 H new ATOM 0 HA SER A 6 -13.893 -3.658 -8.700 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.891 -1.620 -6.448 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.461 -2.302 -7.197 1.00 0.00 H new ATOM 0 HG SER A 6 -13.036 -0.247 -8.111 1.00 0.00 H new ATOM 59 N GLY A 7 -13.442 -5.412 -7.039 1.00 0.00 N ATOM 60 CA GLY A 7 -13.221 -6.511 -6.114 1.00 0.00 C ATOM 61 C GLY A 7 -11.966 -6.275 -5.273 1.00 0.00 C ATOM 62 O GLY A 7 -12.059 -5.935 -4.094 1.00 0.00 O ATOM 0 H GLY A 7 -13.013 -5.534 -7.956 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.086 -6.620 -5.460 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -13.121 -7.444 -6.669 1.00 0.00 H new ATOM 66 N PRO A 8 -10.790 -6.471 -5.927 1.00 0.00 N ATOM 67 CA PRO A 8 -9.517 -6.283 -5.252 1.00 0.00 C ATOM 68 C PRO A 8 -9.207 -4.796 -5.069 1.00 0.00 C ATOM 69 O PRO A 8 -9.844 -3.945 -5.688 1.00 0.00 O ATOM 70 CB PRO A 8 -8.499 -6.999 -6.125 1.00 0.00 C ATOM 71 CG PRO A 8 -9.157 -7.160 -7.486 1.00 0.00 C ATOM 72 CD PRO A 8 -10.641 -6.874 -7.322 1.00 0.00 C ATOM 0 HA PRO A 8 -9.513 -6.692 -4.241 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -7.577 -6.423 -6.203 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -8.235 -7.968 -5.702 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -8.713 -6.474 -8.208 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -9.002 -8.169 -7.868 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -10.969 -6.085 -7.999 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -11.241 -7.756 -7.545 1.00 0.00 H new ATOM 80 N LYS A 9 -8.230 -4.529 -4.215 1.00 0.00 N ATOM 81 CA LYS A 9 -7.828 -3.159 -3.943 1.00 0.00 C ATOM 82 C LYS A 9 -6.327 -3.012 -4.202 1.00 0.00 C ATOM 83 O LYS A 9 -5.580 -3.985 -4.117 1.00 0.00 O ATOM 84 CB LYS A 9 -8.252 -2.747 -2.532 1.00 0.00 C ATOM 85 CG LYS A 9 -7.381 -3.431 -1.476 1.00 0.00 C ATOM 86 CD LYS A 9 -8.018 -4.739 -1.002 1.00 0.00 C ATOM 87 CE LYS A 9 -8.137 -4.770 0.523 1.00 0.00 C ATOM 88 NZ LYS A 9 -6.797 -4.725 1.148 1.00 0.00 N ATOM 0 H LYS A 9 -7.705 -5.238 -3.702 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.337 -2.471 -4.618 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -8.175 -1.665 -2.427 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.298 -3.009 -2.371 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -6.393 -3.633 -1.890 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.241 -2.762 -0.627 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -9.006 -4.850 -1.450 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.418 -5.584 -1.341 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.733 -3.923 0.864 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -8.660 -5.674 0.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.866 -5.032 2.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.152 -5.359 0.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.429 -3.753 1.111 1.00 0.00 H new ATOM 102 N LYS A 10 -5.931 -1.786 -4.513 1.00 0.00 N ATOM 103 CA LYS A 10 -4.533 -1.499 -4.785 1.00 0.00 C ATOM 104 C LYS A 10 -3.734 -1.598 -3.484 1.00 0.00 C ATOM 105 O LYS A 10 -3.944 -0.814 -2.560 1.00 0.00 O ATOM 106 CB LYS A 10 -4.391 -0.149 -5.492 1.00 0.00 C ATOM 107 CG LYS A 10 -3.101 -0.093 -6.313 1.00 0.00 C ATOM 108 CD LYS A 10 -3.355 0.520 -7.692 1.00 0.00 C ATOM 109 CE LYS A 10 -2.827 -0.391 -8.802 1.00 0.00 C ATOM 110 NZ LYS A 10 -2.816 0.325 -10.098 1.00 0.00 N ATOM 0 H LYS A 10 -6.554 -0.981 -4.583 1.00 0.00 H new ATOM 0 HA LYS A 10 -4.119 -2.238 -5.471 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -5.249 0.016 -6.144 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -4.392 0.654 -4.755 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -2.353 0.495 -5.782 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -2.694 -1.098 -6.427 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -4.424 0.685 -7.829 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -2.871 1.495 -7.755 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -1.819 -0.727 -8.557 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -3.451 -1.282 -8.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -2.455 -0.307 -10.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -3.783 0.624 -10.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -2.202 1.162 -10.027 1.00 0.00 H new ATOM 124 N PRO A 11 -2.809 -2.595 -3.452 1.00 0.00 N ATOM 125 CA PRO A 11 -1.977 -2.807 -2.280 1.00 0.00 C ATOM 126 C PRO A 11 -0.883 -1.742 -2.183 1.00 0.00 C ATOM 127 O PRO A 11 -0.717 -0.934 -3.095 1.00 0.00 O ATOM 128 CB PRO A 11 -1.424 -4.214 -2.439 1.00 0.00 C ATOM 129 CG PRO A 11 -1.589 -4.563 -3.909 1.00 0.00 C ATOM 130 CD PRO A 11 -2.532 -3.543 -4.527 1.00 0.00 C ATOM 0 HA PRO A 11 -2.534 -2.715 -1.347 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -0.376 -4.258 -2.143 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -1.964 -4.919 -1.807 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -0.624 -4.547 -4.416 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -1.991 -5.570 -4.020 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -2.074 -3.048 -5.383 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.447 -4.015 -4.884 1.00 0.00 H new ATOM 138 N PRO A 12 -0.146 -1.777 -1.041 1.00 0.00 N ATOM 139 CA PRO A 12 0.928 -0.824 -0.814 1.00 0.00 C ATOM 140 C PRO A 12 2.156 -1.171 -1.657 1.00 0.00 C ATOM 141 O PRO A 12 2.093 -2.043 -2.522 1.00 0.00 O ATOM 142 CB PRO A 12 1.197 -0.885 0.681 1.00 0.00 C ATOM 143 CG PRO A 12 0.593 -2.194 1.161 1.00 0.00 C ATOM 144 CD PRO A 12 -0.315 -2.720 0.061 1.00 0.00 C ATOM 0 HA PRO A 12 0.663 0.189 -1.117 1.00 0.00 H new ATOM 0 HB2 PRO A 12 2.267 -0.850 0.887 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.746 -0.036 1.194 1.00 0.00 H new ATOM 0 HG2 PRO A 12 1.378 -2.916 1.386 1.00 0.00 H new ATOM 0 HG3 PRO A 12 0.028 -2.039 2.081 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -0.033 -3.730 -0.236 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -1.353 -2.762 0.391 1.00 0.00 H new ATOM 152 N MET A 13 3.244 -0.470 -1.376 1.00 0.00 N ATOM 153 CA MET A 13 4.485 -0.692 -2.099 1.00 0.00 C ATOM 154 C MET A 13 5.683 -0.169 -1.304 1.00 0.00 C ATOM 155 O MET A 13 5.574 0.831 -0.596 1.00 0.00 O ATOM 156 CB MET A 13 4.422 0.016 -3.454 1.00 0.00 C ATOM 157 CG MET A 13 3.758 -0.874 -4.507 1.00 0.00 C ATOM 158 SD MET A 13 4.769 -0.939 -5.976 1.00 0.00 S ATOM 159 CE MET A 13 4.690 0.770 -6.483 1.00 0.00 C ATOM 0 H MET A 13 3.292 0.252 -0.657 1.00 0.00 H new ATOM 0 HA MET A 13 4.611 -1.765 -2.246 1.00 0.00 H new ATOM 0 HB2 MET A 13 3.865 0.948 -3.356 1.00 0.00 H new ATOM 0 HB3 MET A 13 5.429 0.280 -3.778 1.00 0.00 H new ATOM 0 HG2 MET A 13 3.616 -1.879 -4.109 1.00 0.00 H new ATOM 0 HG3 MET A 13 2.770 -0.486 -4.753 1.00 0.00 H new ATOM 0 HE1 MET A 13 5.003 0.856 -7.524 1.00 0.00 H new ATOM 0 HE2 MET A 13 3.667 1.133 -6.381 1.00 0.00 H new ATOM 0 HE3 MET A 13 5.351 1.367 -5.855 1.00 0.00 H new ATOM 169 N ASN A 14 6.800 -0.868 -1.449 1.00 0.00 N ATOM 170 CA ASN A 14 8.017 -0.486 -0.754 1.00 0.00 C ATOM 171 C ASN A 14 7.966 -1.013 0.682 1.00 0.00 C ATOM 172 O ASN A 14 8.761 -1.872 1.060 1.00 0.00 O ATOM 173 CB ASN A 14 8.163 1.036 -0.694 1.00 0.00 C ATOM 174 CG ASN A 14 7.689 1.684 -1.996 1.00 0.00 C ATOM 175 OD1 ASN A 14 8.042 1.272 -3.089 1.00 0.00 O ATOM 176 ND2 ASN A 14 6.871 2.717 -1.820 1.00 0.00 N ATOM 0 H ASN A 14 6.887 -1.696 -2.038 1.00 0.00 H new ATOM 0 HA ASN A 14 8.862 -0.908 -1.298 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.585 1.428 0.143 1.00 0.00 H new ATOM 0 HB3 ASN A 14 9.205 1.298 -0.512 1.00 0.00 H new ATOM 0 HD21 ASN A 14 6.499 3.216 -2.628 1.00 0.00 H new ATOM 0 HD22 ASN A 14 6.615 3.010 -0.877 1.00 0.00 H new ATOM 183 N GLY A 15 7.023 -0.476 1.442 1.00 0.00 N ATOM 184 CA GLY A 15 6.858 -0.881 2.828 1.00 0.00 C ATOM 185 C GLY A 15 6.299 0.266 3.671 1.00 0.00 C ATOM 186 O GLY A 15 5.522 0.038 4.598 1.00 0.00 O ATOM 0 H GLY A 15 6.365 0.236 1.124 1.00 0.00 H new ATOM 0 HA2 GLY A 15 6.187 -1.738 2.883 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.818 -1.201 3.234 1.00 0.00 H new ATOM 190 N TYR A 16 6.715 1.474 3.321 1.00 0.00 N ATOM 191 CA TYR A 16 6.265 2.657 4.034 1.00 0.00 C ATOM 192 C TYR A 16 4.745 2.808 3.942 1.00 0.00 C ATOM 193 O TYR A 16 4.085 3.098 4.938 1.00 0.00 O ATOM 194 CB TYR A 16 6.927 3.847 3.337 1.00 0.00 C ATOM 195 CG TYR A 16 6.370 5.207 3.764 1.00 0.00 C ATOM 196 CD1 TYR A 16 6.195 5.491 5.103 1.00 0.00 C ATOM 197 CD2 TYR A 16 6.044 6.149 2.810 1.00 0.00 C ATOM 198 CE1 TYR A 16 5.671 6.771 5.505 1.00 0.00 C ATOM 199 CE2 TYR A 16 5.520 7.428 3.212 1.00 0.00 C ATOM 200 CZ TYR A 16 5.359 7.676 4.540 1.00 0.00 C ATOM 201 OH TYR A 16 4.865 8.885 4.919 1.00 0.00 O ATOM 0 H TYR A 16 7.359 1.659 2.552 1.00 0.00 H new ATOM 0 HA TYR A 16 6.528 2.592 5.090 1.00 0.00 H new ATOM 0 HB2 TYR A 16 7.998 3.824 3.540 1.00 0.00 H new ATOM 0 HB3 TYR A 16 6.805 3.738 2.259 1.00 0.00 H new ATOM 0 HD1 TYR A 16 6.451 4.754 5.849 1.00 0.00 H new ATOM 0 HD2 TYR A 16 6.182 5.927 1.762 1.00 0.00 H new ATOM 0 HE1 TYR A 16 5.529 7.006 6.549 1.00 0.00 H new ATOM 0 HE2 TYR A 16 5.260 8.174 2.476 1.00 0.00 H new ATOM 0 HH TYR A 16 4.688 9.430 4.124 1.00 0.00 H new ATOM 211 N GLN A 17 4.234 2.604 2.736 1.00 0.00 N ATOM 212 CA GLN A 17 2.805 2.713 2.501 1.00 0.00 C ATOM 213 C GLN A 17 2.057 1.611 3.253 1.00 0.00 C ATOM 214 O GLN A 17 0.886 1.772 3.593 1.00 0.00 O ATOM 215 CB GLN A 17 2.491 2.666 1.004 1.00 0.00 C ATOM 216 CG GLN A 17 3.029 3.908 0.291 1.00 0.00 C ATOM 217 CD GLN A 17 2.628 3.910 -1.185 1.00 0.00 C ATOM 218 OE1 GLN A 17 2.105 4.879 -1.711 1.00 0.00 O ATOM 219 NE2 GLN A 17 2.900 2.775 -1.821 1.00 0.00 N ATOM 0 H GLN A 17 4.785 2.364 1.912 1.00 0.00 H new ATOM 0 HA GLN A 17 2.467 3.677 2.880 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.931 1.771 0.565 1.00 0.00 H new ATOM 0 HB3 GLN A 17 1.413 2.596 0.857 1.00 0.00 H new ATOM 0 HG2 GLN A 17 2.646 4.805 0.777 1.00 0.00 H new ATOM 0 HG3 GLN A 17 4.115 3.939 0.376 1.00 0.00 H new ATOM 0 HE21 GLN A 17 3.339 2.002 -1.320 1.00 0.00 H new ATOM 0 HE22 GLN A 17 2.670 2.677 -2.810 1.00 0.00 H new ATOM 228 N LYS A 18 2.764 0.516 3.492 1.00 0.00 N ATOM 229 CA LYS A 18 2.182 -0.612 4.197 1.00 0.00 C ATOM 230 C LYS A 18 1.903 -0.212 5.648 1.00 0.00 C ATOM 231 O LYS A 18 0.769 -0.307 6.115 1.00 0.00 O ATOM 232 CB LYS A 18 3.073 -1.848 4.060 1.00 0.00 C ATOM 233 CG LYS A 18 2.520 -3.017 4.878 1.00 0.00 C ATOM 234 CD LYS A 18 1.837 -4.044 3.974 1.00 0.00 C ATOM 235 CE LYS A 18 1.033 -5.052 4.798 1.00 0.00 C ATOM 236 NZ LYS A 18 -0.405 -4.701 4.787 1.00 0.00 N ATOM 0 H LYS A 18 3.735 0.387 3.209 1.00 0.00 H new ATOM 0 HA LYS A 18 1.226 -0.887 3.752 1.00 0.00 H new ATOM 0 HB2 LYS A 18 3.144 -2.135 3.011 1.00 0.00 H new ATOM 0 HB3 LYS A 18 4.083 -1.611 4.394 1.00 0.00 H new ATOM 0 HG2 LYS A 18 3.330 -3.494 5.430 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.808 -2.645 5.615 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.177 -3.534 3.272 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.587 -4.569 3.382 1.00 0.00 H new ATOM 0 HE2 LYS A 18 1.172 -6.055 4.393 1.00 0.00 H new ATOM 0 HE3 LYS A 18 1.402 -5.068 5.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -0.972 -5.565 4.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -0.657 -4.240 5.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -0.598 -4.051 3.999 1.00 0.00 H new ATOM 250 N PHE A 19 2.958 0.226 6.320 1.00 0.00 N ATOM 251 CA PHE A 19 2.841 0.641 7.708 1.00 0.00 C ATOM 252 C PHE A 19 1.853 1.800 7.852 1.00 0.00 C ATOM 253 O PHE A 19 1.065 1.834 8.796 1.00 0.00 O ATOM 254 CB PHE A 19 4.228 1.110 8.152 1.00 0.00 C ATOM 255 CG PHE A 19 4.208 2.059 9.352 1.00 0.00 C ATOM 256 CD1 PHE A 19 3.856 1.594 10.581 1.00 0.00 C ATOM 257 CD2 PHE A 19 4.543 3.367 9.191 1.00 0.00 C ATOM 258 CE1 PHE A 19 3.838 2.474 11.695 1.00 0.00 C ATOM 259 CE2 PHE A 19 4.525 4.247 10.305 1.00 0.00 C ATOM 260 CZ PHE A 19 4.173 3.782 11.534 1.00 0.00 C ATOM 0 H PHE A 19 3.897 0.302 5.929 1.00 0.00 H new ATOM 0 HA PHE A 19 2.478 -0.188 8.316 1.00 0.00 H new ATOM 0 HB2 PHE A 19 4.833 0.238 8.401 1.00 0.00 H new ATOM 0 HB3 PHE A 19 4.717 1.609 7.315 1.00 0.00 H new ATOM 0 HD1 PHE A 19 3.590 0.555 10.709 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.823 3.737 8.216 1.00 0.00 H new ATOM 0 HE1 PHE A 19 3.558 2.104 12.670 1.00 0.00 H new ATOM 0 HE2 PHE A 19 4.791 5.286 10.177 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.160 4.451 12.381 1.00 0.00 H new ATOM 270 N SER A 20 1.926 2.721 6.903 1.00 0.00 N ATOM 271 CA SER A 20 1.048 3.878 6.913 1.00 0.00 C ATOM 272 C SER A 20 -0.413 3.426 6.968 1.00 0.00 C ATOM 273 O SER A 20 -1.139 3.773 7.898 1.00 0.00 O ATOM 274 CB SER A 20 1.285 4.760 5.685 1.00 0.00 C ATOM 275 OG SER A 20 2.646 5.166 5.574 1.00 0.00 O ATOM 0 H SER A 20 2.580 2.689 6.121 1.00 0.00 H new ATOM 0 HA SER A 20 1.272 4.470 7.801 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.995 4.216 4.786 1.00 0.00 H new ATOM 0 HB3 SER A 20 0.647 5.642 5.744 1.00 0.00 H new ATOM 0 HG SER A 20 3.123 4.552 4.977 1.00 0.00 H new ATOM 281 N GLN A 21 -0.800 2.659 5.960 1.00 0.00 N ATOM 282 CA GLN A 21 -2.161 2.155 5.882 1.00 0.00 C ATOM 283 C GLN A 21 -2.628 1.673 7.257 1.00 0.00 C ATOM 284 O GLN A 21 -3.798 1.821 7.605 1.00 0.00 O ATOM 285 CB GLN A 21 -2.274 1.039 4.842 1.00 0.00 C ATOM 286 CG GLN A 21 -2.912 1.555 3.551 1.00 0.00 C ATOM 287 CD GLN A 21 -3.399 0.396 2.679 1.00 0.00 C ATOM 288 OE1 GLN A 21 -2.713 -0.075 1.787 1.00 0.00 O ATOM 289 NE2 GLN A 21 -4.619 -0.036 2.985 1.00 0.00 N ATOM 0 H GLN A 21 -0.195 2.374 5.190 1.00 0.00 H new ATOM 0 HA GLN A 21 -2.812 2.970 5.564 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -1.284 0.636 4.627 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -2.871 0.221 5.245 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -3.749 2.211 3.791 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -2.188 2.153 2.997 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -5.140 0.403 3.744 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -5.034 -0.806 2.460 1.00 0.00 H new ATOM 298 N GLU A 22 -1.689 1.108 8.001 1.00 0.00 N ATOM 299 CA GLU A 22 -1.990 0.603 9.330 1.00 0.00 C ATOM 300 C GLU A 22 -2.440 1.746 10.242 1.00 0.00 C ATOM 301 O GLU A 22 -3.401 1.602 10.995 1.00 0.00 O ATOM 302 CB GLU A 22 -0.786 -0.131 9.923 1.00 0.00 C ATOM 303 CG GLU A 22 -1.230 -1.359 10.720 1.00 0.00 C ATOM 304 CD GLU A 22 -0.512 -2.618 10.232 1.00 0.00 C ATOM 305 OE1 GLU A 22 -1.054 -3.258 9.305 1.00 0.00 O ATOM 306 OE2 GLU A 22 0.564 -2.913 10.796 1.00 0.00 O ATOM 0 H GLU A 22 -0.719 0.989 7.709 1.00 0.00 H new ATOM 0 HA GLU A 22 -2.807 -0.114 9.249 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.112 -0.437 9.123 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.227 0.544 10.570 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -1.022 -1.205 11.779 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.308 -1.490 10.623 1.00 0.00 H new ATOM 313 N LEU A 23 -1.723 2.856 10.144 1.00 0.00 N ATOM 314 CA LEU A 23 -2.037 4.023 10.951 1.00 0.00 C ATOM 315 C LEU A 23 -3.358 4.629 10.472 1.00 0.00 C ATOM 316 O LEU A 23 -4.063 5.278 11.243 1.00 0.00 O ATOM 317 CB LEU A 23 -0.868 5.011 10.941 1.00 0.00 C ATOM 318 CG LEU A 23 0.425 4.526 11.600 1.00 0.00 C ATOM 319 CD1 LEU A 23 1.650 4.984 10.806 1.00 0.00 C ATOM 320 CD2 LEU A 23 0.493 4.967 13.063 1.00 0.00 C ATOM 0 H LEU A 23 -0.926 2.972 9.518 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.176 3.739 11.994 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.649 5.274 9.906 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -1.187 5.926 11.441 1.00 0.00 H new ATOM 0 HG LEU A 23 0.425 3.436 11.592 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.556 4.626 11.296 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.600 4.580 9.795 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.668 6.073 10.761 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.422 4.609 13.508 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.460 6.055 13.117 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.354 4.551 13.608 1.00 0.00 H new ATOM 332 N LEU A 24 -3.653 4.395 9.202 1.00 0.00 N ATOM 333 CA LEU A 24 -4.877 4.909 8.611 1.00 0.00 C ATOM 334 C LEU A 24 -6.053 4.028 9.037 1.00 0.00 C ATOM 335 O LEU A 24 -7.188 4.498 9.118 1.00 0.00 O ATOM 336 CB LEU A 24 -4.726 5.042 7.095 1.00 0.00 C ATOM 337 CG LEU A 24 -3.709 6.078 6.610 1.00 0.00 C ATOM 338 CD1 LEU A 24 -3.933 6.418 5.135 1.00 0.00 C ATOM 339 CD2 LEU A 24 -3.731 7.324 7.496 1.00 0.00 C ATOM 0 H LEU A 24 -3.066 3.856 8.566 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.083 5.915 8.977 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.445 4.069 6.691 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.699 5.293 6.674 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.713 5.643 6.692 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.197 7.156 4.816 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -3.826 5.515 4.533 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.936 6.825 5.004 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.999 8.044 7.130 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.725 7.771 7.470 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.485 7.046 8.521 1.00 0.00 H new ATOM 351 N SER A 25 -5.742 2.767 9.298 1.00 0.00 N ATOM 352 CA SER A 25 -6.760 1.817 9.714 1.00 0.00 C ATOM 353 C SER A 25 -6.791 1.718 11.240 1.00 0.00 C ATOM 354 O SER A 25 -7.788 1.286 11.818 1.00 0.00 O ATOM 355 CB SER A 25 -6.510 0.438 9.098 1.00 0.00 C ATOM 356 OG SER A 25 -7.159 0.291 7.838 1.00 0.00 O ATOM 0 H SER A 25 -4.800 2.381 9.230 1.00 0.00 H new ATOM 0 HA SER A 25 -7.727 2.174 9.360 1.00 0.00 H new ATOM 0 HB2 SER A 25 -5.438 0.285 8.974 1.00 0.00 H new ATOM 0 HB3 SER A 25 -6.865 -0.334 9.781 1.00 0.00 H new ATOM 0 HG SER A 25 -6.974 -0.601 7.477 1.00 0.00 H new ATOM 362 N ASN A 26 -5.688 2.125 11.851 1.00 0.00 N ATOM 363 CA ASN A 26 -5.577 2.088 13.299 1.00 0.00 C ATOM 364 C ASN A 26 -6.364 3.256 13.897 1.00 0.00 C ATOM 365 O ASN A 26 -7.303 3.049 14.664 1.00 0.00 O ATOM 366 CB ASN A 26 -4.120 2.224 13.744 1.00 0.00 C ATOM 367 CG ASN A 26 -3.346 0.929 13.489 1.00 0.00 C ATOM 368 OD1 ASN A 26 -3.852 -0.169 13.650 1.00 0.00 O ATOM 369 ND2 ASN A 26 -2.093 1.118 13.083 1.00 0.00 N ATOM 0 H ASN A 26 -4.863 2.482 11.369 1.00 0.00 H new ATOM 0 HA ASN A 26 -5.971 1.132 13.642 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -3.647 3.046 13.207 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.082 2.472 14.805 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -1.494 0.316 12.886 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -1.731 2.065 12.968 1.00 0.00 H new ATOM 376 N GLY A 27 -5.953 4.459 13.523 1.00 0.00 N ATOM 377 CA GLY A 27 -6.608 5.660 14.012 1.00 0.00 C ATOM 378 C GLY A 27 -5.797 6.306 15.138 1.00 0.00 C ATOM 379 O GLY A 27 -6.358 6.972 16.007 1.00 0.00 O ATOM 0 H GLY A 27 -5.174 4.627 12.887 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -6.732 6.370 13.194 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -7.606 5.413 14.373 1.00 0.00 H new ATOM 383 N GLU A 28 -4.492 6.088 15.084 1.00 0.00 N ATOM 384 CA GLU A 28 -3.599 6.641 16.089 1.00 0.00 C ATOM 385 C GLU A 28 -3.388 8.136 15.846 1.00 0.00 C ATOM 386 O GLU A 28 -2.943 8.857 16.738 1.00 0.00 O ATOM 387 CB GLU A 28 -2.263 5.894 16.105 1.00 0.00 C ATOM 388 CG GLU A 28 -2.433 4.456 15.611 1.00 0.00 C ATOM 389 CD GLU A 28 -1.329 3.553 16.165 1.00 0.00 C ATOM 390 OE1 GLU A 28 -0.175 4.032 16.215 1.00 0.00 O ATOM 391 OE2 GLU A 28 -1.664 2.404 16.527 1.00 0.00 O ATOM 0 H GLU A 28 -4.031 5.536 14.361 1.00 0.00 H new ATOM 0 HA GLU A 28 -4.061 6.514 17.068 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -1.543 6.416 15.475 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -1.857 5.889 17.117 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -3.407 4.075 15.917 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.411 4.437 14.521 1.00 0.00 H new ATOM 398 N LEU A 29 -3.718 8.559 14.634 1.00 0.00 N ATOM 399 CA LEU A 29 -3.570 9.956 14.262 1.00 0.00 C ATOM 400 C LEU A 29 -4.885 10.462 13.665 1.00 0.00 C ATOM 401 O LEU A 29 -4.880 11.206 12.686 1.00 0.00 O ATOM 402 CB LEU A 29 -2.364 10.140 13.339 1.00 0.00 C ATOM 403 CG LEU A 29 -1.358 8.988 13.312 1.00 0.00 C ATOM 404 CD1 LEU A 29 -0.543 9.002 12.017 1.00 0.00 C ATOM 405 CD2 LEU A 29 -0.463 9.012 14.553 1.00 0.00 C ATOM 0 H LEU A 29 -4.087 7.958 13.897 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.364 10.565 15.142 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.729 10.301 12.325 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.839 11.048 13.637 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.913 8.050 13.333 1.00 0.00 H new ATOM 0 HD11 LEU A 29 0.165 8.173 12.023 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.214 8.900 11.164 1.00 0.00 H new ATOM 0 HD13 LEU A 29 0.002 9.943 11.940 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.243 8.183 14.509 1.00 0.00 H new ATOM 0 HD22 LEU A 29 0.085 9.953 14.588 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.079 8.917 15.447 1.00 0.00 H new ATOM 417 N ASN A 30 -5.979 10.037 14.280 1.00 0.00 N ATOM 418 CA ASN A 30 -7.298 10.438 13.821 1.00 0.00 C ATOM 419 C ASN A 30 -7.737 11.693 14.578 1.00 0.00 C ATOM 420 O ASN A 30 -8.847 12.185 14.380 1.00 0.00 O ATOM 421 CB ASN A 30 -8.331 9.341 14.086 1.00 0.00 C ATOM 422 CG ASN A 30 -8.760 8.665 12.782 1.00 0.00 C ATOM 423 OD1 ASN A 30 -9.928 8.402 12.545 1.00 0.00 O ATOM 424 ND2 ASN A 30 -7.754 8.400 11.954 1.00 0.00 N ATOM 0 H ASN A 30 -5.979 9.419 15.092 1.00 0.00 H new ATOM 0 HA ASN A 30 -7.239 10.626 12.749 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -7.912 8.598 14.764 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -9.202 9.769 14.582 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -7.937 7.950 11.057 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -6.800 8.647 12.216 1.00 0.00 H new ATOM 431 N HIS A 31 -6.843 12.175 15.429 1.00 0.00 N ATOM 432 CA HIS A 31 -7.124 13.363 16.216 1.00 0.00 C ATOM 433 C HIS A 31 -6.818 14.613 15.388 1.00 0.00 C ATOM 434 O HIS A 31 -7.372 15.681 15.641 1.00 0.00 O ATOM 435 CB HIS A 31 -6.361 13.330 17.542 1.00 0.00 C ATOM 436 CG HIS A 31 -4.879 13.084 17.392 1.00 0.00 C ATOM 437 ND1 HIS A 31 -4.345 11.823 17.190 1.00 0.00 N ATOM 438 CD2 HIS A 31 -3.825 13.950 17.415 1.00 0.00 C ATOM 439 CE1 HIS A 31 -3.028 11.937 17.098 1.00 0.00 C ATOM 440 NE2 HIS A 31 -2.708 13.256 17.238 1.00 0.00 N ATOM 0 H HIS A 31 -5.924 11.764 15.590 1.00 0.00 H new ATOM 0 HA HIS A 31 -8.183 13.390 16.473 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -6.511 14.278 18.059 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -6.786 12.551 18.175 1.00 0.00 H new ATOM 0 HD1 HIS A 31 -4.875 10.954 17.123 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -3.889 15.019 17.554 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -2.330 11.128 16.940 1.00 0.00 H new ATOM 448 N LEU A 32 -5.936 14.437 14.415 1.00 0.00 N ATOM 449 CA LEU A 32 -5.549 15.536 13.547 1.00 0.00 C ATOM 450 C LEU A 32 -6.153 15.321 12.158 1.00 0.00 C ATOM 451 O LEU A 32 -6.726 14.268 11.882 1.00 0.00 O ATOM 452 CB LEU A 32 -4.028 15.702 13.538 1.00 0.00 C ATOM 453 CG LEU A 32 -3.228 14.584 14.210 1.00 0.00 C ATOM 454 CD1 LEU A 32 -3.062 13.388 13.271 1.00 0.00 C ATOM 455 CD2 LEU A 32 -1.882 15.104 14.719 1.00 0.00 C ATOM 0 H LEU A 32 -5.478 13.549 14.209 1.00 0.00 H new ATOM 0 HA LEU A 32 -5.947 16.478 13.925 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.698 15.787 12.503 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -3.782 16.644 14.029 1.00 0.00 H new ATOM 0 HG LEU A 32 -3.789 14.236 15.078 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.490 12.608 13.773 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.044 13.000 12.999 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -2.534 13.703 12.371 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.333 14.290 15.192 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.303 15.494 13.882 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.050 15.899 15.446 1.00 0.00 H new ATOM 467 N PRO A 33 -6.001 16.363 11.298 1.00 0.00 N ATOM 468 CA PRO A 33 -6.525 16.299 9.944 1.00 0.00 C ATOM 469 C PRO A 33 -5.657 15.399 9.062 1.00 0.00 C ATOM 470 O PRO A 33 -4.464 15.238 9.318 1.00 0.00 O ATOM 471 CB PRO A 33 -6.561 17.741 9.467 1.00 0.00 C ATOM 472 CG PRO A 33 -5.628 18.509 10.389 1.00 0.00 C ATOM 473 CD PRO A 33 -5.329 17.626 11.590 1.00 0.00 C ATOM 0 HA PRO A 33 -7.519 15.854 9.899 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -6.235 17.817 8.430 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.573 18.142 9.513 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -4.707 18.770 9.868 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -6.090 19.443 10.708 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -4.256 17.483 11.719 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -5.705 18.071 12.512 1.00 0.00 H new ATOM 481 N LEU A 34 -6.288 14.837 8.042 1.00 0.00 N ATOM 482 CA LEU A 34 -5.588 13.957 7.121 1.00 0.00 C ATOM 483 C LEU A 34 -4.225 14.564 6.781 1.00 0.00 C ATOM 484 O LEU A 34 -3.192 13.924 6.972 1.00 0.00 O ATOM 485 CB LEU A 34 -6.455 13.666 5.895 1.00 0.00 C ATOM 486 CG LEU A 34 -5.977 12.528 4.991 1.00 0.00 C ATOM 487 CD1 LEU A 34 -4.449 12.489 4.920 1.00 0.00 C ATOM 488 CD2 LEU A 34 -6.564 11.188 5.438 1.00 0.00 C ATOM 0 H LEU A 34 -7.277 14.974 7.833 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.400 12.989 7.586 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -7.464 13.434 6.235 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.521 14.575 5.297 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.342 12.718 3.982 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.136 11.671 4.271 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.079 13.433 4.519 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -4.042 12.335 5.919 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -6.208 10.397 4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -6.251 10.976 6.460 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -7.652 11.235 5.394 1.00 0.00 H new ATOM 500 N LYS A 35 -4.267 15.791 6.282 1.00 0.00 N ATOM 501 CA LYS A 35 -3.049 16.490 5.912 1.00 0.00 C ATOM 502 C LYS A 35 -1.967 16.209 6.958 1.00 0.00 C ATOM 503 O LYS A 35 -0.801 16.022 6.614 1.00 0.00 O ATOM 504 CB LYS A 35 -3.329 17.980 5.703 1.00 0.00 C ATOM 505 CG LYS A 35 -2.032 18.751 5.450 1.00 0.00 C ATOM 506 CD LYS A 35 -1.722 18.826 3.953 1.00 0.00 C ATOM 507 CE LYS A 35 -0.935 20.095 3.619 1.00 0.00 C ATOM 508 NZ LYS A 35 -0.479 20.066 2.211 1.00 0.00 N ATOM 0 H LYS A 35 -5.126 16.319 6.126 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.674 16.122 4.957 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -4.005 18.112 4.858 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.832 18.386 6.581 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -2.118 19.758 5.858 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.208 18.265 5.972 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -1.149 17.949 3.652 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -2.652 18.810 3.384 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.560 20.972 3.787 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -0.076 20.183 4.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 0.053 20.934 2.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 0.134 19.239 2.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -1.304 20.004 1.580 1.00 0.00 H new ATOM 522 N GLU A 36 -2.393 16.188 8.212 1.00 0.00 N ATOM 523 CA GLU A 36 -1.476 15.932 9.309 1.00 0.00 C ATOM 524 C GLU A 36 -1.165 14.437 9.405 1.00 0.00 C ATOM 525 O GLU A 36 -0.005 14.046 9.518 1.00 0.00 O ATOM 526 CB GLU A 36 -2.040 16.460 10.630 1.00 0.00 C ATOM 527 CG GLU A 36 -1.781 17.961 10.775 1.00 0.00 C ATOM 528 CD GLU A 36 -1.375 18.311 12.209 1.00 0.00 C ATOM 529 OE1 GLU A 36 -2.271 18.264 13.080 1.00 0.00 O ATOM 530 OE2 GLU A 36 -0.179 18.617 12.401 1.00 0.00 O ATOM 0 H GLU A 36 -3.361 16.344 8.493 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.546 16.464 9.110 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.112 16.266 10.676 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -1.584 15.926 11.464 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -0.994 18.266 10.086 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.678 18.517 10.501 1.00 0.00 H new ATOM 537 N ARG A 37 -2.223 13.641 9.355 1.00 0.00 N ATOM 538 CA ARG A 37 -2.079 12.197 9.434 1.00 0.00 C ATOM 539 C ARG A 37 -0.853 11.743 8.638 1.00 0.00 C ATOM 540 O ARG A 37 0.094 11.201 9.207 1.00 0.00 O ATOM 541 CB ARG A 37 -3.321 11.489 8.892 1.00 0.00 C ATOM 542 CG ARG A 37 -4.358 11.278 9.997 1.00 0.00 C ATOM 543 CD ARG A 37 -5.633 10.641 9.440 1.00 0.00 C ATOM 544 NE ARG A 37 -6.804 11.486 9.761 1.00 0.00 N ATOM 545 CZ ARG A 37 -8.076 11.086 9.633 1.00 0.00 C ATOM 546 NH1 ARG A 37 -8.350 9.852 9.191 1.00 0.00 N ATOM 547 NH2 ARG A 37 -9.076 11.922 9.948 1.00 0.00 N ATOM 0 H ARG A 37 -3.184 13.969 9.261 1.00 0.00 H new ATOM 0 HA ARG A 37 -1.954 11.933 10.484 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -3.758 12.079 8.086 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -3.038 10.527 8.465 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -3.940 10.641 10.776 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -4.598 12.234 10.462 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -5.547 10.520 8.360 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -5.766 9.645 9.863 1.00 0.00 H new ATOM 0 HE ARG A 37 -6.632 12.432 10.101 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -7.590 9.216 8.951 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -9.319 9.548 9.094 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -8.868 12.862 10.285 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -10.045 11.618 9.851 1.00 0.00 H new ATOM 561 N MET A 38 -0.911 11.980 7.336 1.00 0.00 N ATOM 562 CA MET A 38 0.182 11.601 6.457 1.00 0.00 C ATOM 563 C MET A 38 1.529 12.033 7.040 1.00 0.00 C ATOM 564 O MET A 38 2.331 11.194 7.448 1.00 0.00 O ATOM 565 CB MET A 38 -0.014 12.254 5.088 1.00 0.00 C ATOM 566 CG MET A 38 -1.252 11.692 4.385 1.00 0.00 C ATOM 567 SD MET A 38 -0.783 10.353 3.302 1.00 0.00 S ATOM 568 CE MET A 38 -1.222 8.958 4.327 1.00 0.00 C ATOM 0 H MET A 38 -1.698 12.430 6.868 1.00 0.00 H new ATOM 0 HA MET A 38 0.182 10.516 6.355 1.00 0.00 H new ATOM 0 HB2 MET A 38 -0.117 13.333 5.207 1.00 0.00 H new ATOM 0 HB3 MET A 38 0.868 12.084 4.470 1.00 0.00 H new ATOM 0 HG2 MET A 38 -1.971 11.338 5.124 1.00 0.00 H new ATOM 0 HG3 MET A 38 -1.744 12.478 3.813 1.00 0.00 H new ATOM 0 HE1 MET A 38 -1.335 8.070 3.705 1.00 0.00 H new ATOM 0 HE2 MET A 38 -0.437 8.787 5.064 1.00 0.00 H new ATOM 0 HE3 MET A 38 -2.162 9.164 4.839 1.00 0.00 H new ATOM 578 N VAL A 39 1.737 13.341 7.062 1.00 0.00 N ATOM 579 CA VAL A 39 2.973 13.895 7.589 1.00 0.00 C ATOM 580 C VAL A 39 3.304 13.217 8.919 1.00 0.00 C ATOM 581 O VAL A 39 4.429 12.766 9.127 1.00 0.00 O ATOM 582 CB VAL A 39 2.857 15.416 7.705 1.00 0.00 C ATOM 583 CG1 VAL A 39 1.602 15.812 8.485 1.00 0.00 C ATOM 584 CG2 VAL A 39 4.112 16.014 8.345 1.00 0.00 C ATOM 0 H VAL A 39 1.070 14.034 6.723 1.00 0.00 H new ATOM 0 HA VAL A 39 3.801 13.697 6.909 1.00 0.00 H new ATOM 0 HB VAL A 39 2.768 15.823 6.698 1.00 0.00 H new ATOM 0 HG11 VAL A 39 1.544 16.898 8.553 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.719 15.433 7.971 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.648 15.388 9.488 1.00 0.00 H new ATOM 0 HG21 VAL A 39 4.004 17.096 8.416 1.00 0.00 H new ATOM 0 HG22 VAL A 39 4.246 15.597 9.343 1.00 0.00 H new ATOM 0 HG23 VAL A 39 4.982 15.776 7.733 1.00 0.00 H new ATOM 594 N GLU A 40 2.303 13.166 9.786 1.00 0.00 N ATOM 595 CA GLU A 40 2.474 12.550 11.091 1.00 0.00 C ATOM 596 C GLU A 40 3.035 11.135 10.941 1.00 0.00 C ATOM 597 O GLU A 40 3.892 10.718 11.718 1.00 0.00 O ATOM 598 CB GLU A 40 1.156 12.539 11.869 1.00 0.00 C ATOM 599 CG GLU A 40 1.403 12.699 13.370 1.00 0.00 C ATOM 600 CD GLU A 40 2.221 13.959 13.659 1.00 0.00 C ATOM 601 OE1 GLU A 40 1.748 15.046 13.263 1.00 0.00 O ATOM 602 OE2 GLU A 40 3.301 13.807 14.270 1.00 0.00 O ATOM 0 H GLU A 40 1.371 13.541 9.610 1.00 0.00 H new ATOM 0 HA GLU A 40 3.189 13.144 11.661 1.00 0.00 H new ATOM 0 HB2 GLU A 40 0.514 13.345 11.515 1.00 0.00 H new ATOM 0 HB3 GLU A 40 0.627 11.605 11.682 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.450 12.751 13.896 1.00 0.00 H new ATOM 0 HG3 GLU A 40 1.929 11.824 13.751 1.00 0.00 H new ATOM 609 N ILE A 41 2.527 10.435 9.937 1.00 0.00 N ATOM 610 CA ILE A 41 2.967 9.075 9.675 1.00 0.00 C ATOM 611 C ILE A 41 4.449 9.087 9.294 1.00 0.00 C ATOM 612 O ILE A 41 5.272 8.472 9.970 1.00 0.00 O ATOM 613 CB ILE A 41 2.068 8.414 8.628 1.00 0.00 C ATOM 614 CG1 ILE A 41 0.619 8.347 9.113 1.00 0.00 C ATOM 615 CG2 ILE A 41 2.606 7.036 8.237 1.00 0.00 C ATOM 616 CD1 ILE A 41 -0.358 8.489 7.944 1.00 0.00 C ATOM 0 H ILE A 41 1.815 10.784 9.295 1.00 0.00 H new ATOM 0 HA ILE A 41 2.874 8.465 10.573 1.00 0.00 H new ATOM 0 HB ILE A 41 2.078 9.031 7.730 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.446 7.399 9.623 1.00 0.00 H new ATOM 0 HG13 ILE A 41 0.438 9.138 9.841 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.949 6.587 7.492 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.608 7.141 7.821 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.644 6.397 9.119 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -1.381 8.438 8.317 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.199 9.448 7.451 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -0.191 7.682 7.230 1.00 0.00 H new ATOM 628 N GLY A 42 4.743 9.794 8.213 1.00 0.00 N ATOM 629 CA GLY A 42 6.112 9.895 7.735 1.00 0.00 C ATOM 630 C GLY A 42 7.096 9.980 8.902 1.00 0.00 C ATOM 631 O GLY A 42 8.229 9.512 8.799 1.00 0.00 O ATOM 0 H GLY A 42 4.057 10.302 7.655 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.350 9.029 7.117 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.216 10.777 7.102 1.00 0.00 H new ATOM 635 N SER A 43 6.628 10.581 9.986 1.00 0.00 N ATOM 636 CA SER A 43 7.454 10.734 11.172 1.00 0.00 C ATOM 637 C SER A 43 7.602 9.388 11.884 1.00 0.00 C ATOM 638 O SER A 43 8.717 8.938 12.143 1.00 0.00 O ATOM 639 CB SER A 43 6.862 11.775 12.125 1.00 0.00 C ATOM 640 OG SER A 43 7.798 12.801 12.442 1.00 0.00 O ATOM 0 H SER A 43 5.688 10.968 10.068 1.00 0.00 H new ATOM 0 HA SER A 43 8.438 11.084 10.860 1.00 0.00 H new ATOM 0 HB2 SER A 43 5.976 12.220 11.671 1.00 0.00 H new ATOM 0 HB3 SER A 43 6.538 11.284 13.042 1.00 0.00 H new ATOM 0 HG SER A 43 7.382 13.447 13.051 1.00 0.00 H new ATOM 646 N ARG A 44 6.461 8.782 12.180 1.00 0.00 N ATOM 647 CA ARG A 44 6.450 7.497 12.857 1.00 0.00 C ATOM 648 C ARG A 44 7.273 6.475 12.069 1.00 0.00 C ATOM 649 O ARG A 44 8.005 5.678 12.655 1.00 0.00 O ATOM 650 CB ARG A 44 5.022 6.973 13.020 1.00 0.00 C ATOM 651 CG ARG A 44 4.234 7.829 14.014 1.00 0.00 C ATOM 652 CD ARG A 44 3.159 7.001 14.720 1.00 0.00 C ATOM 653 NE ARG A 44 3.631 6.597 16.063 1.00 0.00 N ATOM 654 CZ ARG A 44 3.904 7.457 17.053 1.00 0.00 C ATOM 655 NH1 ARG A 44 3.753 8.774 16.857 1.00 0.00 N ATOM 656 NH2 ARG A 44 4.328 7.000 18.239 1.00 0.00 N ATOM 0 H ARG A 44 5.538 9.158 11.963 1.00 0.00 H new ATOM 0 HA ARG A 44 6.889 7.639 13.845 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.518 6.974 12.054 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.047 5.939 13.365 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.914 8.254 14.752 1.00 0.00 H new ATOM 0 HG3 ARG A 44 3.769 8.665 13.491 1.00 0.00 H new ATOM 0 HD2 ARG A 44 2.241 7.582 14.808 1.00 0.00 H new ATOM 0 HD3 ARG A 44 2.922 6.117 14.128 1.00 0.00 H new ATOM 0 HE ARG A 44 3.756 5.601 16.246 1.00 0.00 H new ATOM 0 HH11 ARG A 44 3.430 9.122 15.954 1.00 0.00 H new ATOM 0 HH12 ARG A 44 3.961 9.429 17.611 1.00 0.00 H new ATOM 0 HH21 ARG A 44 4.443 5.997 18.388 1.00 0.00 H new ATOM 0 HH22 ARG A 44 4.536 7.655 18.993 1.00 0.00 H new ATOM 670 N TRP A 45 7.127 6.533 10.754 1.00 0.00 N ATOM 671 CA TRP A 45 7.848 5.623 9.880 1.00 0.00 C ATOM 672 C TRP A 45 9.345 5.878 10.064 1.00 0.00 C ATOM 673 O TRP A 45 10.155 4.960 9.937 1.00 0.00 O ATOM 674 CB TRP A 45 7.389 5.777 8.429 1.00 0.00 C ATOM 675 CG TRP A 45 8.288 5.070 7.413 1.00 0.00 C ATOM 676 CD1 TRP A 45 9.283 5.596 6.685 1.00 0.00 C ATOM 677 CD2 TRP A 45 8.235 3.677 7.040 1.00 0.00 C ATOM 678 NE1 TRP A 45 9.872 4.648 5.873 1.00 0.00 N ATOM 679 CE2 TRP A 45 9.214 3.444 6.096 1.00 0.00 C ATOM 680 CE3 TRP A 45 7.387 2.648 7.485 1.00 0.00 C ATOM 681 CZ2 TRP A 45 9.438 2.189 5.518 1.00 0.00 C ATOM 682 CZ3 TRP A 45 7.623 1.399 6.897 1.00 0.00 C ATOM 683 CH2 TRP A 45 8.605 1.148 5.946 1.00 0.00 C ATOM 0 H TRP A 45 6.520 7.196 10.272 1.00 0.00 H new ATOM 0 HA TRP A 45 7.636 4.587 10.143 1.00 0.00 H new ATOM 0 HB2 TRP A 45 6.376 5.386 8.336 1.00 0.00 H new ATOM 0 HB3 TRP A 45 7.345 6.838 8.183 1.00 0.00 H new ATOM 0 HD1 TRP A 45 9.586 6.632 6.728 1.00 0.00 H new ATOM 0 HE1 TRP A 45 10.647 4.802 5.228 1.00 0.00 H new ATOM 0 HE3 TRP A 45 6.614 2.808 8.222 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 10.212 2.032 4.781 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 6.998 0.573 7.204 1.00 0.00 H new ATOM 0 HH2 TRP A 45 8.725 0.155 5.539 1.00 0.00 H new ATOM 694 N GLN A 46 9.668 7.128 10.359 1.00 0.00 N ATOM 695 CA GLN A 46 11.054 7.515 10.561 1.00 0.00 C ATOM 696 C GLN A 46 11.506 7.149 11.976 1.00 0.00 C ATOM 697 O GLN A 46 12.685 7.270 12.306 1.00 0.00 O ATOM 698 CB GLN A 46 11.251 9.008 10.292 1.00 0.00 C ATOM 699 CG GLN A 46 11.738 9.248 8.862 1.00 0.00 C ATOM 700 CD GLN A 46 12.924 10.214 8.841 1.00 0.00 C ATOM 701 OE1 GLN A 46 12.821 11.372 9.213 1.00 0.00 O ATOM 702 NE2 GLN A 46 14.052 9.676 8.386 1.00 0.00 N ATOM 0 H GLN A 46 8.994 7.886 10.463 1.00 0.00 H new ATOM 0 HA GLN A 46 11.671 6.967 9.850 1.00 0.00 H new ATOM 0 HB2 GLN A 46 10.312 9.537 10.454 1.00 0.00 H new ATOM 0 HB3 GLN A 46 11.973 9.416 10.999 1.00 0.00 H new ATOM 0 HG2 GLN A 46 12.029 8.300 8.409 1.00 0.00 H new ATOM 0 HG3 GLN A 46 10.924 9.653 8.260 1.00 0.00 H new ATOM 0 HE21 GLN A 46 14.069 8.700 8.091 1.00 0.00 H new ATOM 0 HE22 GLN A 46 14.900 10.240 8.332 1.00 0.00 H new ATOM 711 N ARG A 47 10.545 6.709 12.775 1.00 0.00 N ATOM 712 CA ARG A 47 10.830 6.324 14.147 1.00 0.00 C ATOM 713 C ARG A 47 11.109 4.822 14.230 1.00 0.00 C ATOM 714 O ARG A 47 12.043 4.397 14.907 1.00 0.00 O ATOM 715 CB ARG A 47 9.660 6.670 15.070 1.00 0.00 C ATOM 716 CG ARG A 47 9.487 8.185 15.191 1.00 0.00 C ATOM 717 CD ARG A 47 8.218 8.531 15.974 1.00 0.00 C ATOM 718 NE ARG A 47 8.576 9.071 17.305 1.00 0.00 N ATOM 719 CZ ARG A 47 9.193 10.244 17.498 1.00 0.00 C ATOM 720 NH1 ARG A 47 9.525 11.008 16.449 1.00 0.00 N ATOM 721 NH2 ARG A 47 9.478 10.654 18.742 1.00 0.00 N ATOM 0 H ARG A 47 9.568 6.611 12.499 1.00 0.00 H new ATOM 0 HA ARG A 47 11.710 6.879 14.471 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.743 6.225 14.683 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.831 6.240 16.057 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.355 8.615 15.690 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.438 8.630 14.197 1.00 0.00 H new ATOM 0 HD2 ARG A 47 7.628 9.263 15.422 1.00 0.00 H new ATOM 0 HD3 ARG A 47 7.597 7.642 16.088 1.00 0.00 H new ATOM 0 HE ARG A 47 8.338 8.515 18.126 1.00 0.00 H new ATOM 0 HH11 ARG A 47 9.308 10.697 15.502 1.00 0.00 H new ATOM 0 HH12 ARG A 47 9.995 11.901 16.597 1.00 0.00 H new ATOM 0 HH21 ARG A 47 9.225 10.073 19.541 1.00 0.00 H new ATOM 0 HH22 ARG A 47 9.948 11.547 18.889 1.00 0.00 H new ATOM 735 N ILE A 48 10.281 4.059 13.531 1.00 0.00 N ATOM 736 CA ILE A 48 10.427 2.613 13.517 1.00 0.00 C ATOM 737 C ILE A 48 11.878 2.255 13.188 1.00 0.00 C ATOM 738 O ILE A 48 12.709 3.139 12.987 1.00 0.00 O ATOM 739 CB ILE A 48 9.407 1.981 12.568 1.00 0.00 C ATOM 740 CG1 ILE A 48 9.436 2.662 11.198 1.00 0.00 C ATOM 741 CG2 ILE A 48 8.006 1.990 13.183 1.00 0.00 C ATOM 742 CD1 ILE A 48 8.674 1.837 10.159 1.00 0.00 C ATOM 0 H ILE A 48 9.507 4.415 12.970 1.00 0.00 H new ATOM 0 HA ILE A 48 10.211 2.198 14.502 1.00 0.00 H new ATOM 0 HB ILE A 48 9.685 0.938 12.415 1.00 0.00 H new ATOM 0 HG12 ILE A 48 8.995 3.656 11.273 1.00 0.00 H new ATOM 0 HG13 ILE A 48 10.469 2.795 10.876 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.300 1.535 12.488 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.014 1.424 14.114 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.704 3.018 13.386 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.710 2.343 9.195 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.132 0.852 10.069 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.636 1.727 10.472 1.00 0.00 H new ATOM 754 N SER A 49 12.137 0.956 13.144 1.00 0.00 N ATOM 755 CA SER A 49 13.473 0.470 12.843 1.00 0.00 C ATOM 756 C SER A 49 13.450 -0.362 11.560 1.00 0.00 C ATOM 757 O SER A 49 12.397 -0.540 10.949 1.00 0.00 O ATOM 758 CB SER A 49 14.032 -0.357 14.003 1.00 0.00 C ATOM 759 OG SER A 49 14.265 0.437 15.162 1.00 0.00 O ATOM 0 H SER A 49 11.445 0.226 13.312 1.00 0.00 H new ATOM 0 HA SER A 49 14.126 1.331 12.698 1.00 0.00 H new ATOM 0 HB2 SER A 49 13.334 -1.158 14.247 1.00 0.00 H new ATOM 0 HB3 SER A 49 14.964 -0.830 13.694 1.00 0.00 H new ATOM 0 HG SER A 49 14.620 -0.128 15.880 1.00 0.00 H new ATOM 765 N GLN A 50 14.624 -0.851 11.188 1.00 0.00 N ATOM 766 CA GLN A 50 14.752 -1.661 9.988 1.00 0.00 C ATOM 767 C GLN A 50 13.746 -2.812 10.015 1.00 0.00 C ATOM 768 O GLN A 50 12.974 -2.990 9.074 1.00 0.00 O ATOM 769 CB GLN A 50 16.181 -2.185 9.830 1.00 0.00 C ATOM 770 CG GLN A 50 16.344 -2.942 8.511 1.00 0.00 C ATOM 771 CD GLN A 50 15.972 -2.056 7.320 1.00 0.00 C ATOM 772 OE1 GLN A 50 16.796 -1.360 6.750 1.00 0.00 O ATOM 773 NE2 GLN A 50 14.688 -2.121 6.978 1.00 0.00 N ATOM 0 H GLN A 50 15.495 -0.702 11.697 1.00 0.00 H new ATOM 0 HA GLN A 50 14.533 -1.033 9.124 1.00 0.00 H new ATOM 0 HB2 GLN A 50 16.884 -1.352 9.865 1.00 0.00 H new ATOM 0 HB3 GLN A 50 16.425 -2.843 10.664 1.00 0.00 H new ATOM 0 HG2 GLN A 50 17.374 -3.282 8.408 1.00 0.00 H new ATOM 0 HG3 GLN A 50 15.714 -3.831 8.518 1.00 0.00 H new ATOM 0 HE21 GLN A 50 14.052 -2.725 7.498 1.00 0.00 H new ATOM 0 HE22 GLN A 50 14.340 -1.567 6.195 1.00 0.00 H new ATOM 782 N SER A 51 13.786 -3.566 11.105 1.00 0.00 N ATOM 783 CA SER A 51 12.886 -4.696 11.266 1.00 0.00 C ATOM 784 C SER A 51 11.500 -4.343 10.723 1.00 0.00 C ATOM 785 O SER A 51 10.898 -5.128 9.993 1.00 0.00 O ATOM 786 CB SER A 51 12.790 -5.117 12.734 1.00 0.00 C ATOM 787 OG SER A 51 12.210 -6.410 12.881 1.00 0.00 O ATOM 0 H SER A 51 14.427 -3.416 11.884 1.00 0.00 H new ATOM 0 HA SER A 51 13.287 -5.537 10.700 1.00 0.00 H new ATOM 0 HB2 SER A 51 13.785 -5.113 13.178 1.00 0.00 H new ATOM 0 HB3 SER A 51 12.194 -4.388 13.282 1.00 0.00 H new ATOM 0 HG SER A 51 12.168 -6.643 13.832 1.00 0.00 H new ATOM 793 N GLN A 52 11.034 -3.162 11.101 1.00 0.00 N ATOM 794 CA GLN A 52 9.730 -2.696 10.661 1.00 0.00 C ATOM 795 C GLN A 52 9.738 -2.443 9.152 1.00 0.00 C ATOM 796 O GLN A 52 9.011 -3.097 8.406 1.00 0.00 O ATOM 797 CB GLN A 52 9.311 -1.438 11.425 1.00 0.00 C ATOM 798 CG GLN A 52 9.227 -1.712 12.928 1.00 0.00 C ATOM 799 CD GLN A 52 7.771 -1.814 13.386 1.00 0.00 C ATOM 800 OE1 GLN A 52 7.028 -0.846 13.400 1.00 0.00 O ATOM 801 NE2 GLN A 52 7.405 -3.037 13.760 1.00 0.00 N ATOM 0 H GLN A 52 11.536 -2.514 11.707 1.00 0.00 H new ATOM 0 HA GLN A 52 8.997 -3.473 10.876 1.00 0.00 H new ATOM 0 HB2 GLN A 52 10.028 -0.638 11.237 1.00 0.00 H new ATOM 0 HB3 GLN A 52 8.344 -1.092 11.060 1.00 0.00 H new ATOM 0 HG2 GLN A 52 9.751 -2.638 13.162 1.00 0.00 H new ATOM 0 HG3 GLN A 52 9.729 -0.914 13.475 1.00 0.00 H new ATOM 0 HE21 GLN A 52 8.077 -3.804 13.724 1.00 0.00 H new ATOM 0 HE22 GLN A 52 6.453 -3.208 14.083 1.00 0.00 H new ATOM 810 N LYS A 53 10.569 -1.493 8.748 1.00 0.00 N ATOM 811 CA LYS A 53 10.681 -1.146 7.341 1.00 0.00 C ATOM 812 C LYS A 53 10.801 -2.427 6.513 1.00 0.00 C ATOM 813 O LYS A 53 10.145 -2.567 5.482 1.00 0.00 O ATOM 814 CB LYS A 53 11.832 -0.162 7.122 1.00 0.00 C ATOM 815 CG LYS A 53 11.556 1.169 7.826 1.00 0.00 C ATOM 816 CD LYS A 53 12.526 2.252 7.350 1.00 0.00 C ATOM 817 CE LYS A 53 12.209 3.598 8.005 1.00 0.00 C ATOM 818 NZ LYS A 53 13.032 4.672 7.406 1.00 0.00 N ATOM 0 H LYS A 53 11.171 -0.953 9.370 1.00 0.00 H new ATOM 0 HA LYS A 53 9.782 -0.630 7.003 1.00 0.00 H new ATOM 0 HB2 LYS A 53 12.760 -0.592 7.500 1.00 0.00 H new ATOM 0 HB3 LYS A 53 11.971 0.009 6.055 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.531 1.482 7.630 1.00 0.00 H new ATOM 0 HG3 LYS A 53 11.649 1.040 8.904 1.00 0.00 H new ATOM 0 HD2 LYS A 53 13.549 1.959 7.588 1.00 0.00 H new ATOM 0 HD3 LYS A 53 12.466 2.348 6.266 1.00 0.00 H new ATOM 0 HE2 LYS A 53 11.151 3.830 7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.399 3.541 9.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 12.805 5.579 7.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 14.040 4.457 7.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.831 4.736 6.388 1.00 0.00 H new ATOM 832 N GLU A 54 11.644 -3.328 6.994 1.00 0.00 N ATOM 833 CA GLU A 54 11.859 -4.593 6.311 1.00 0.00 C ATOM 834 C GLU A 54 10.567 -5.411 6.291 1.00 0.00 C ATOM 835 O GLU A 54 10.047 -5.731 5.223 1.00 0.00 O ATOM 836 CB GLU A 54 12.998 -5.381 6.961 1.00 0.00 C ATOM 837 CG GLU A 54 14.321 -5.134 6.234 1.00 0.00 C ATOM 838 CD GLU A 54 14.612 -6.251 5.230 1.00 0.00 C ATOM 839 OE1 GLU A 54 14.524 -7.426 5.648 1.00 0.00 O ATOM 840 OE2 GLU A 54 14.917 -5.905 4.068 1.00 0.00 O ATOM 0 H GLU A 54 12.187 -3.208 7.849 1.00 0.00 H new ATOM 0 HA GLU A 54 12.149 -4.383 5.281 1.00 0.00 H new ATOM 0 HB2 GLU A 54 13.094 -5.091 8.007 1.00 0.00 H new ATOM 0 HB3 GLU A 54 12.764 -6.445 6.945 1.00 0.00 H new ATOM 0 HG2 GLU A 54 14.282 -4.176 5.716 1.00 0.00 H new ATOM 0 HG3 GLU A 54 15.132 -5.072 6.959 1.00 0.00 H new ATOM 847 N HIS A 55 10.086 -5.727 7.484 1.00 0.00 N ATOM 848 CA HIS A 55 8.864 -6.503 7.617 1.00 0.00 C ATOM 849 C HIS A 55 7.772 -5.896 6.734 1.00 0.00 C ATOM 850 O HIS A 55 7.302 -6.535 5.794 1.00 0.00 O ATOM 851 CB HIS A 55 8.447 -6.612 9.085 1.00 0.00 C ATOM 852 CG HIS A 55 7.252 -7.505 9.319 1.00 0.00 C ATOM 853 ND1 HIS A 55 7.239 -8.845 8.975 1.00 0.00 N ATOM 854 CD2 HIS A 55 6.032 -7.237 9.867 1.00 0.00 C ATOM 855 CE1 HIS A 55 6.060 -9.351 9.304 1.00 0.00 C ATOM 856 NE2 HIS A 55 5.313 -8.352 9.857 1.00 0.00 N ATOM 0 H HIS A 55 10.520 -5.460 8.368 1.00 0.00 H new ATOM 0 HA HIS A 55 9.037 -7.522 7.272 1.00 0.00 H new ATOM 0 HB2 HIS A 55 9.289 -6.990 9.664 1.00 0.00 H new ATOM 0 HB3 HIS A 55 8.222 -5.615 9.463 1.00 0.00 H new ATOM 0 HD2 HIS A 55 5.706 -6.279 10.245 1.00 0.00 H new ATOM 0 HE1 HIS A 55 5.745 -10.374 9.160 1.00 0.00 H new ATOM 0 HE2 HIS A 55 4.359 -8.447 10.205 1.00 0.00 H new ATOM 864 N TYR A 56 7.401 -4.668 7.067 1.00 0.00 N ATOM 865 CA TYR A 56 6.373 -3.968 6.316 1.00 0.00 C ATOM 866 C TYR A 56 6.657 -4.024 4.814 1.00 0.00 C ATOM 867 O TYR A 56 5.747 -4.237 4.014 1.00 0.00 O ATOM 868 CB TYR A 56 6.431 -2.511 6.779 1.00 0.00 C ATOM 869 CG TYR A 56 5.712 -2.250 8.104 1.00 0.00 C ATOM 870 CD1 TYR A 56 4.374 -2.564 8.236 1.00 0.00 C ATOM 871 CD2 TYR A 56 6.400 -1.701 9.167 1.00 0.00 C ATOM 872 CE1 TYR A 56 3.697 -2.318 9.483 1.00 0.00 C ATOM 873 CE2 TYR A 56 5.723 -1.456 10.414 1.00 0.00 C ATOM 874 CZ TYR A 56 4.405 -1.776 10.511 1.00 0.00 C ATOM 875 OH TYR A 56 3.765 -1.544 11.688 1.00 0.00 O ATOM 0 H TYR A 56 7.794 -4.140 7.846 1.00 0.00 H new ATOM 0 HA TYR A 56 5.397 -4.423 6.486 1.00 0.00 H new ATOM 0 HB2 TYR A 56 7.475 -2.214 6.879 1.00 0.00 H new ATOM 0 HB3 TYR A 56 5.992 -1.878 6.008 1.00 0.00 H new ATOM 0 HD1 TYR A 56 3.835 -2.994 7.404 1.00 0.00 H new ATOM 0 HD2 TYR A 56 7.447 -1.455 9.064 1.00 0.00 H new ATOM 0 HE1 TYR A 56 2.651 -2.558 9.600 1.00 0.00 H new ATOM 0 HE2 TYR A 56 6.250 -1.028 11.254 1.00 0.00 H new ATOM 0 HH TYR A 56 4.394 -1.156 12.331 1.00 0.00 H new ATOM 885 N LYS A 57 7.923 -3.830 4.476 1.00 0.00 N ATOM 886 CA LYS A 57 8.339 -3.856 3.084 1.00 0.00 C ATOM 887 C LYS A 57 8.039 -5.235 2.492 1.00 0.00 C ATOM 888 O LYS A 57 7.503 -5.339 1.390 1.00 0.00 O ATOM 889 CB LYS A 57 9.805 -3.437 2.954 1.00 0.00 C ATOM 890 CG LYS A 57 10.373 -3.844 1.593 1.00 0.00 C ATOM 891 CD LYS A 57 11.395 -2.820 1.097 1.00 0.00 C ATOM 892 CE LYS A 57 12.728 -2.973 1.834 1.00 0.00 C ATOM 893 NZ LYS A 57 13.785 -3.428 0.903 1.00 0.00 N ATOM 0 H LYS A 57 8.675 -3.654 5.142 1.00 0.00 H new ATOM 0 HA LYS A 57 7.771 -3.129 2.504 1.00 0.00 H new ATOM 0 HB2 LYS A 57 9.891 -2.358 3.080 1.00 0.00 H new ATOM 0 HB3 LYS A 57 10.391 -3.898 3.749 1.00 0.00 H new ATOM 0 HG2 LYS A 57 10.843 -4.824 1.670 1.00 0.00 H new ATOM 0 HG3 LYS A 57 9.563 -3.935 0.869 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.551 -2.947 0.026 1.00 0.00 H new ATOM 0 HD3 LYS A 57 11.007 -1.812 1.246 1.00 0.00 H new ATOM 0 HE2 LYS A 57 13.014 -2.021 2.282 1.00 0.00 H new ATOM 0 HE3 LYS A 57 12.620 -3.689 2.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 14.683 -3.527 1.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 13.517 -4.347 0.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 13.899 -2.731 0.140 1.00 0.00 H new ATOM 907 N LYS A 58 8.399 -6.260 3.251 1.00 0.00 N ATOM 908 CA LYS A 58 8.175 -7.628 2.816 1.00 0.00 C ATOM 909 C LYS A 58 6.677 -7.854 2.608 1.00 0.00 C ATOM 910 O LYS A 58 6.256 -8.322 1.551 1.00 0.00 O ATOM 911 CB LYS A 58 8.816 -8.613 3.796 1.00 0.00 C ATOM 912 CG LYS A 58 8.286 -10.031 3.573 1.00 0.00 C ATOM 913 CD LYS A 58 7.127 -10.339 4.523 1.00 0.00 C ATOM 914 CE LYS A 58 7.579 -10.260 5.983 1.00 0.00 C ATOM 915 NZ LYS A 58 7.500 -11.592 6.622 1.00 0.00 N ATOM 0 H LYS A 58 8.844 -6.170 4.164 1.00 0.00 H new ATOM 0 HA LYS A 58 8.660 -7.807 1.857 1.00 0.00 H new ATOM 0 HB2 LYS A 58 9.899 -8.602 3.672 1.00 0.00 H new ATOM 0 HB3 LYS A 58 8.609 -8.300 4.819 1.00 0.00 H new ATOM 0 HG2 LYS A 58 7.954 -10.141 2.541 1.00 0.00 H new ATOM 0 HG3 LYS A 58 9.089 -10.752 3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 58 6.314 -9.633 4.352 1.00 0.00 H new ATOM 0 HD3 LYS A 58 6.735 -11.334 4.313 1.00 0.00 H new ATOM 0 HE2 LYS A 58 8.601 -9.886 6.034 1.00 0.00 H new ATOM 0 HE3 LYS A 58 6.953 -9.552 6.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 7.810 -11.521 7.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 6.519 -11.935 6.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 8.116 -12.258 6.113 1.00 0.00 H new ATOM 929 N LEU A 59 5.911 -7.511 3.634 1.00 0.00 N ATOM 930 CA LEU A 59 4.468 -7.671 3.578 1.00 0.00 C ATOM 931 C LEU A 59 3.943 -7.067 2.274 1.00 0.00 C ATOM 932 O LEU A 59 3.237 -7.732 1.517 1.00 0.00 O ATOM 933 CB LEU A 59 3.815 -7.088 4.832 1.00 0.00 C ATOM 934 CG LEU A 59 4.298 -7.660 6.167 1.00 0.00 C ATOM 935 CD1 LEU A 59 3.768 -6.834 7.341 1.00 0.00 C ATOM 936 CD2 LEU A 59 3.930 -9.139 6.295 1.00 0.00 C ATOM 0 H LEU A 59 6.263 -7.123 4.509 1.00 0.00 H new ATOM 0 HA LEU A 59 4.202 -8.728 3.571 1.00 0.00 H new ATOM 0 HB2 LEU A 59 3.984 -6.011 4.838 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.738 -7.242 4.762 1.00 0.00 H new ATOM 0 HG LEU A 59 5.386 -7.596 6.193 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.126 -7.262 8.278 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.122 -5.807 7.252 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.678 -6.844 7.330 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.285 -9.521 7.252 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.847 -9.251 6.238 1.00 0.00 H new ATOM 0 HD23 LEU A 59 4.395 -9.701 5.485 1.00 0.00 H new ATOM 948 N ALA A 60 4.308 -5.813 2.051 1.00 0.00 N ATOM 949 CA ALA A 60 3.883 -5.111 0.852 1.00 0.00 C ATOM 950 C ALA A 60 4.026 -6.040 -0.355 1.00 0.00 C ATOM 951 O ALA A 60 3.161 -6.065 -1.230 1.00 0.00 O ATOM 952 CB ALA A 60 4.697 -3.825 0.697 1.00 0.00 C ATOM 0 H ALA A 60 4.894 -5.265 2.681 1.00 0.00 H new ATOM 0 HA ALA A 60 2.834 -4.825 0.926 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.378 -3.299 -0.203 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.538 -3.187 1.566 1.00 0.00 H new ATOM 0 HB3 ALA A 60 5.756 -4.072 0.617 1.00 0.00 H new ATOM 958 N GLU A 61 5.124 -6.782 -0.364 1.00 0.00 N ATOM 959 CA GLU A 61 5.391 -7.710 -1.449 1.00 0.00 C ATOM 960 C GLU A 61 4.316 -8.798 -1.495 1.00 0.00 C ATOM 961 O GLU A 61 3.849 -9.169 -2.570 1.00 0.00 O ATOM 962 CB GLU A 61 6.786 -8.324 -1.315 1.00 0.00 C ATOM 963 CG GLU A 61 7.814 -7.266 -0.909 1.00 0.00 C ATOM 964 CD GLU A 61 7.515 -5.924 -1.582 1.00 0.00 C ATOM 965 OE1 GLU A 61 7.929 -5.771 -2.751 1.00 0.00 O ATOM 966 OE2 GLU A 61 6.879 -5.083 -0.911 1.00 0.00 O ATOM 0 H GLU A 61 5.839 -6.759 0.363 1.00 0.00 H new ATOM 0 HA GLU A 61 5.361 -7.157 -2.388 1.00 0.00 H new ATOM 0 HB2 GLU A 61 6.766 -9.121 -0.572 1.00 0.00 H new ATOM 0 HB3 GLU A 61 7.080 -8.778 -2.262 1.00 0.00 H new ATOM 0 HG2 GLU A 61 7.807 -7.143 0.174 1.00 0.00 H new ATOM 0 HG3 GLU A 61 8.814 -7.601 -1.185 1.00 0.00 H new ATOM 973 N GLU A 62 3.955 -9.277 -0.314 1.00 0.00 N ATOM 974 CA GLU A 62 2.943 -10.315 -0.205 1.00 0.00 C ATOM 975 C GLU A 62 1.560 -9.743 -0.524 1.00 0.00 C ATOM 976 O GLU A 62 0.772 -10.372 -1.227 1.00 0.00 O ATOM 977 CB GLU A 62 2.964 -10.958 1.183 1.00 0.00 C ATOM 978 CG GLU A 62 1.696 -11.779 1.426 1.00 0.00 C ATOM 979 CD GLU A 62 2.041 -13.183 1.928 1.00 0.00 C ATOM 980 OE1 GLU A 62 3.026 -13.747 1.405 1.00 0.00 O ATOM 981 OE2 GLU A 62 1.311 -13.660 2.824 1.00 0.00 O ATOM 0 H GLU A 62 4.345 -8.966 0.576 1.00 0.00 H new ATOM 0 HA GLU A 62 3.169 -11.094 -0.933 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.840 -11.599 1.277 1.00 0.00 H new ATOM 0 HB3 GLU A 62 3.052 -10.184 1.945 1.00 0.00 H new ATOM 0 HG2 GLU A 62 1.065 -11.273 2.156 1.00 0.00 H new ATOM 0 HG3 GLU A 62 1.121 -11.850 0.502 1.00 0.00 H new ATOM 988 N GLN A 63 1.308 -8.557 0.009 1.00 0.00 N ATOM 989 CA GLN A 63 0.034 -7.893 -0.210 1.00 0.00 C ATOM 990 C GLN A 63 -0.226 -7.724 -1.708 1.00 0.00 C ATOM 991 O GLN A 63 -1.332 -7.978 -2.182 1.00 0.00 O ATOM 992 CB GLN A 63 -0.012 -6.544 0.510 1.00 0.00 C ATOM 993 CG GLN A 63 -1.066 -6.550 1.619 1.00 0.00 C ATOM 994 CD GLN A 63 -2.479 -6.507 1.032 1.00 0.00 C ATOM 995 OE1 GLN A 63 -3.099 -7.523 0.765 1.00 0.00 O ATOM 996 NE2 GLN A 63 -2.951 -5.277 0.848 1.00 0.00 N ATOM 0 H GLN A 63 1.964 -8.038 0.592 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.756 -8.518 0.208 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.967 -6.321 0.935 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.237 -5.753 -0.206 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.950 -7.444 2.231 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.914 -5.693 2.275 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -2.379 -4.469 1.093 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -3.885 -5.142 0.462 1.00 0.00 H new ATOM 1005 N GLN A 64 0.812 -7.296 -2.411 1.00 0.00 N ATOM 1006 CA GLN A 64 0.710 -7.091 -3.846 1.00 0.00 C ATOM 1007 C GLN A 64 0.579 -8.434 -4.567 1.00 0.00 C ATOM 1008 O GLN A 64 -0.204 -8.564 -5.507 1.00 0.00 O ATOM 1009 CB GLN A 64 1.909 -6.300 -4.374 1.00 0.00 C ATOM 1010 CG GLN A 64 2.069 -4.978 -3.620 1.00 0.00 C ATOM 1011 CD GLN A 64 3.531 -4.529 -3.605 1.00 0.00 C ATOM 1012 OE1 GLN A 64 4.251 -4.637 -4.584 1.00 0.00 O ATOM 1013 NE2 GLN A 64 3.929 -4.020 -2.443 1.00 0.00 N ATOM 0 H GLN A 64 1.728 -7.086 -2.014 1.00 0.00 H new ATOM 0 HA GLN A 64 -0.187 -6.505 -4.046 1.00 0.00 H new ATOM 0 HB2 GLN A 64 2.816 -6.895 -4.269 1.00 0.00 H new ATOM 0 HB3 GLN A 64 1.779 -6.102 -5.438 1.00 0.00 H new ATOM 0 HG2 GLN A 64 1.454 -4.211 -4.090 1.00 0.00 H new ATOM 0 HG3 GLN A 64 1.710 -5.093 -2.597 1.00 0.00 H new ATOM 0 HE21 GLN A 64 3.275 -3.958 -1.663 1.00 0.00 H new ATOM 0 HE22 GLN A 64 4.888 -3.691 -2.332 1.00 0.00 H new ATOM 1022 N ARG A 65 1.356 -9.399 -4.099 1.00 0.00 N ATOM 1023 CA ARG A 65 1.336 -10.727 -4.687 1.00 0.00 C ATOM 1024 C ARG A 65 -0.102 -11.234 -4.805 1.00 0.00 C ATOM 1025 O ARG A 65 -0.496 -11.761 -5.845 1.00 0.00 O ATOM 1026 CB ARG A 65 2.150 -11.714 -3.847 1.00 0.00 C ATOM 1027 CG ARG A 65 1.397 -13.034 -3.669 1.00 0.00 C ATOM 1028 CD ARG A 65 2.292 -14.093 -3.022 1.00 0.00 C ATOM 1029 NE ARG A 65 2.203 -15.362 -3.778 1.00 0.00 N ATOM 1030 CZ ARG A 65 2.974 -16.432 -3.543 1.00 0.00 C ATOM 1031 NH1 ARG A 65 3.896 -16.393 -2.571 1.00 0.00 N ATOM 1032 NH2 ARG A 65 2.824 -17.541 -4.279 1.00 0.00 N ATOM 0 H ARG A 65 2.004 -9.288 -3.319 1.00 0.00 H new ATOM 0 HA ARG A 65 1.783 -10.657 -5.679 1.00 0.00 H new ATOM 0 HB2 ARG A 65 3.110 -11.901 -4.328 1.00 0.00 H new ATOM 0 HB3 ARG A 65 2.362 -11.278 -2.871 1.00 0.00 H new ATOM 0 HG2 ARG A 65 0.514 -12.872 -3.051 1.00 0.00 H new ATOM 0 HG3 ARG A 65 1.047 -13.391 -4.638 1.00 0.00 H new ATOM 0 HD2 ARG A 65 3.325 -13.745 -3.001 1.00 0.00 H new ATOM 0 HD3 ARG A 65 1.989 -14.254 -1.988 1.00 0.00 H new ATOM 0 HE ARG A 65 1.511 -15.426 -4.525 1.00 0.00 H new ATOM 0 HH11 ARG A 65 4.011 -15.549 -2.010 1.00 0.00 H new ATOM 0 HH12 ARG A 65 4.483 -17.208 -2.392 1.00 0.00 H new ATOM 0 HH21 ARG A 65 2.122 -17.571 -5.019 1.00 0.00 H new ATOM 0 HH22 ARG A 65 3.411 -18.355 -4.100 1.00 0.00 H new ATOM 1046 N GLN A 66 -0.849 -11.058 -3.725 1.00 0.00 N ATOM 1047 CA GLN A 66 -2.236 -11.491 -3.694 1.00 0.00 C ATOM 1048 C GLN A 66 -3.033 -10.796 -4.800 1.00 0.00 C ATOM 1049 O GLN A 66 -3.701 -11.454 -5.596 1.00 0.00 O ATOM 1050 CB GLN A 66 -2.861 -11.233 -2.322 1.00 0.00 C ATOM 1051 CG GLN A 66 -2.795 -12.485 -1.445 1.00 0.00 C ATOM 1052 CD GLN A 66 -3.739 -12.366 -0.247 1.00 0.00 C ATOM 1053 OE1 GLN A 66 -4.626 -13.177 -0.039 1.00 0.00 O ATOM 1054 NE2 GLN A 66 -3.498 -11.312 0.528 1.00 0.00 N ATOM 0 H GLN A 66 -0.520 -10.621 -2.864 1.00 0.00 H new ATOM 0 HA GLN A 66 -2.265 -12.566 -3.872 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -2.340 -10.412 -1.830 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -3.899 -10.924 -2.444 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -3.060 -13.362 -2.036 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -1.774 -12.634 -1.094 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -2.739 -10.672 0.296 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -4.073 -11.144 1.354 1.00 0.00 H new ATOM 1063 N TYR A 67 -2.937 -9.474 -4.813 1.00 0.00 N ATOM 1064 CA TYR A 67 -3.641 -8.683 -5.807 1.00 0.00 C ATOM 1065 C TYR A 67 -3.334 -9.180 -7.221 1.00 0.00 C ATOM 1066 O TYR A 67 -4.238 -9.588 -7.949 1.00 0.00 O ATOM 1067 CB TYR A 67 -3.116 -7.253 -5.657 1.00 0.00 C ATOM 1068 CG TYR A 67 -3.570 -6.304 -6.767 1.00 0.00 C ATOM 1069 CD1 TYR A 67 -4.872 -5.845 -6.794 1.00 0.00 C ATOM 1070 CD2 TYR A 67 -2.679 -5.906 -7.743 1.00 0.00 C ATOM 1071 CE1 TYR A 67 -5.299 -4.951 -7.839 1.00 0.00 C ATOM 1072 CE2 TYR A 67 -3.106 -5.013 -8.788 1.00 0.00 C ATOM 1073 CZ TYR A 67 -4.395 -4.579 -8.784 1.00 0.00 C ATOM 1074 OH TYR A 67 -4.799 -3.735 -9.771 1.00 0.00 O ATOM 0 H TYR A 67 -2.382 -8.932 -4.151 1.00 0.00 H new ATOM 0 HA TYR A 67 -4.719 -8.751 -5.658 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -3.444 -6.855 -4.697 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -2.026 -7.277 -5.637 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -5.570 -6.157 -6.031 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.661 -6.265 -7.723 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -6.314 -4.584 -7.871 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.419 -4.695 -9.558 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.048 -3.555 -10.375 1.00 0.00 H new ATOM 1084 N LYS A 68 -2.057 -9.129 -7.568 1.00 0.00 N ATOM 1085 CA LYS A 68 -1.620 -9.570 -8.882 1.00 0.00 C ATOM 1086 C LYS A 68 -2.383 -10.837 -9.270 1.00 0.00 C ATOM 1087 O LYS A 68 -2.615 -11.089 -10.452 1.00 0.00 O ATOM 1088 CB LYS A 68 -0.099 -9.734 -8.913 1.00 0.00 C ATOM 1089 CG LYS A 68 0.602 -8.411 -8.597 1.00 0.00 C ATOM 1090 CD LYS A 68 0.141 -7.304 -9.547 1.00 0.00 C ATOM 1091 CE LYS A 68 0.331 -7.721 -11.007 1.00 0.00 C ATOM 1092 NZ LYS A 68 0.054 -6.583 -11.911 1.00 0.00 N ATOM 0 H LYS A 68 -1.310 -8.789 -6.962 1.00 0.00 H new ATOM 0 HA LYS A 68 -1.852 -8.816 -9.634 1.00 0.00 H new ATOM 0 HB2 LYS A 68 0.203 -10.492 -8.190 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.212 -10.089 -9.896 1.00 0.00 H new ATOM 0 HG2 LYS A 68 0.393 -8.122 -7.567 1.00 0.00 H new ATOM 0 HG3 LYS A 68 1.681 -8.539 -8.679 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.909 -7.076 -9.364 1.00 0.00 H new ATOM 0 HD3 LYS A 68 0.704 -6.392 -9.349 1.00 0.00 H new ATOM 0 HE2 LYS A 68 1.350 -8.075 -11.160 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -0.334 -8.551 -11.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 0.188 -6.883 -12.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -0.926 -6.263 -11.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 0.706 -5.802 -11.695 1.00 0.00 H new ATOM 1106 N VAL A 69 -2.753 -11.602 -8.253 1.00 0.00 N ATOM 1107 CA VAL A 69 -3.485 -12.837 -8.474 1.00 0.00 C ATOM 1108 C VAL A 69 -4.986 -12.540 -8.488 1.00 0.00 C ATOM 1109 O VAL A 69 -5.645 -12.704 -9.513 1.00 0.00 O ATOM 1110 CB VAL A 69 -3.092 -13.874 -7.420 1.00 0.00 C ATOM 1111 CG1 VAL A 69 -4.006 -15.099 -7.488 1.00 0.00 C ATOM 1112 CG2 VAL A 69 -1.623 -14.277 -7.569 1.00 0.00 C ATOM 0 H VAL A 69 -2.559 -11.390 -7.274 1.00 0.00 H new ATOM 0 HA VAL A 69 -3.228 -13.264 -9.443 1.00 0.00 H new ATOM 0 HB VAL A 69 -3.217 -13.418 -6.438 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.705 -15.820 -6.728 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -5.037 -14.794 -7.310 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.928 -15.557 -8.474 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.369 -15.015 -6.808 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.462 -14.706 -8.558 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.990 -13.398 -7.447 1.00 0.00 H new ATOM 1122 N HIS A 70 -5.482 -12.107 -7.338 1.00 0.00 N ATOM 1123 CA HIS A 70 -6.893 -11.785 -7.205 1.00 0.00 C ATOM 1124 C HIS A 70 -7.378 -11.074 -8.470 1.00 0.00 C ATOM 1125 O HIS A 70 -8.481 -11.333 -8.948 1.00 0.00 O ATOM 1126 CB HIS A 70 -7.148 -10.974 -5.934 1.00 0.00 C ATOM 1127 CG HIS A 70 -6.813 -11.710 -4.658 1.00 0.00 C ATOM 1128 ND1 HIS A 70 -7.348 -11.363 -3.430 1.00 0.00 N ATOM 1129 CD2 HIS A 70 -5.994 -12.777 -4.434 1.00 0.00 C ATOM 1130 CE1 HIS A 70 -6.865 -12.190 -2.515 1.00 0.00 C ATOM 1131 NE2 HIS A 70 -6.026 -13.066 -3.139 1.00 0.00 N ATOM 0 H HIS A 70 -4.932 -11.972 -6.490 1.00 0.00 H new ATOM 0 HA HIS A 70 -7.471 -12.703 -7.102 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -6.561 -10.056 -5.977 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -8.197 -10.680 -5.907 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -5.417 -13.299 -5.183 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -7.095 -12.174 -1.460 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -5.509 -13.819 -2.685 1.00 0.00 H new ATOM 1139 N LEU A 71 -6.530 -10.190 -8.975 1.00 0.00 N ATOM 1140 CA LEU A 71 -6.858 -9.439 -10.175 1.00 0.00 C ATOM 1141 C LEU A 71 -7.134 -10.413 -11.322 1.00 0.00 C ATOM 1142 O LEU A 71 -8.174 -10.332 -11.973 1.00 0.00 O ATOM 1143 CB LEU A 71 -5.761 -8.419 -10.485 1.00 0.00 C ATOM 1144 CG LEU A 71 -6.178 -7.227 -11.350 1.00 0.00 C ATOM 1145 CD1 LEU A 71 -7.311 -6.440 -10.690 1.00 0.00 C ATOM 1146 CD2 LEU A 71 -4.976 -6.338 -11.675 1.00 0.00 C ATOM 0 H LEU A 71 -5.616 -9.977 -8.575 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.768 -8.858 -10.024 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.369 -8.039 -9.542 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.942 -8.936 -10.985 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.561 -7.609 -12.296 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.588 -5.599 -11.325 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.174 -7.091 -10.553 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.979 -6.069 -9.720 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.300 -5.499 -12.290 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.541 -5.962 -10.749 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.230 -6.919 -12.217 1.00 0.00 H new ATOM 1158 N ASP A 72 -6.184 -11.312 -11.534 1.00 0.00 N ATOM 1159 CA ASP A 72 -6.312 -12.301 -12.591 1.00 0.00 C ATOM 1160 C ASP A 72 -7.563 -13.147 -12.343 1.00 0.00 C ATOM 1161 O ASP A 72 -8.307 -13.449 -13.275 1.00 0.00 O ATOM 1162 CB ASP A 72 -5.104 -13.239 -12.616 1.00 0.00 C ATOM 1163 CG ASP A 72 -4.275 -13.191 -13.902 1.00 0.00 C ATOM 1164 OD1 ASP A 72 -4.176 -12.083 -14.472 1.00 0.00 O ATOM 1165 OD2 ASP A 72 -3.761 -14.264 -14.285 1.00 0.00 O ATOM 0 H ASP A 72 -5.322 -11.376 -10.992 1.00 0.00 H new ATOM 0 HA ASP A 72 -6.378 -11.772 -13.542 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -4.456 -12.995 -11.774 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.453 -14.260 -12.464 1.00 0.00 H new ATOM 1170 N LEU A 73 -7.755 -13.506 -11.082 1.00 0.00 N ATOM 1171 CA LEU A 73 -8.903 -14.311 -10.700 1.00 0.00 C ATOM 1172 C LEU A 73 -10.188 -13.569 -11.072 1.00 0.00 C ATOM 1173 O LEU A 73 -11.157 -14.183 -11.516 1.00 0.00 O ATOM 1174 CB LEU A 73 -8.820 -14.694 -9.221 1.00 0.00 C ATOM 1175 CG LEU A 73 -7.484 -15.273 -8.752 1.00 0.00 C ATOM 1176 CD1 LEU A 73 -7.543 -15.659 -7.272 1.00 0.00 C ATOM 1177 CD2 LEU A 73 -7.055 -16.448 -9.634 1.00 0.00 C ATOM 0 H LEU A 73 -7.135 -13.254 -10.312 1.00 0.00 H new ATOM 0 HA LEU A 73 -8.908 -15.252 -11.250 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -9.039 -13.809 -8.624 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.603 -15.422 -9.010 1.00 0.00 H new ATOM 0 HG LEU A 73 -6.723 -14.500 -8.853 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -6.581 -16.068 -6.964 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -7.770 -14.776 -6.674 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -8.320 -16.408 -7.122 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -6.102 -16.841 -9.279 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -7.811 -17.232 -9.588 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -6.946 -16.109 -10.664 1.00 0.00 H new ATOM 1189 N TRP A 74 -10.154 -12.259 -10.878 1.00 0.00 N ATOM 1190 CA TRP A 74 -11.304 -11.427 -11.188 1.00 0.00 C ATOM 1191 C TRP A 74 -11.569 -11.527 -12.691 1.00 0.00 C ATOM 1192 O TRP A 74 -12.703 -11.362 -13.138 1.00 0.00 O ATOM 1193 CB TRP A 74 -11.084 -9.989 -10.714 1.00 0.00 C ATOM 1194 CG TRP A 74 -11.972 -8.959 -11.416 1.00 0.00 C ATOM 1195 CD1 TRP A 74 -13.198 -8.550 -11.063 1.00 0.00 C ATOM 1196 CD2 TRP A 74 -11.650 -8.220 -12.613 1.00 0.00 C ATOM 1197 NE1 TRP A 74 -13.688 -7.605 -11.942 1.00 0.00 N ATOM 1198 CE2 TRP A 74 -12.717 -7.399 -12.914 1.00 0.00 C ATOM 1199 CE3 TRP A 74 -10.495 -8.246 -13.415 1.00 0.00 C ATOM 1200 CZ2 TRP A 74 -12.735 -6.541 -14.021 1.00 0.00 C ATOM 1201 CZ3 TRP A 74 -10.529 -7.383 -14.517 1.00 0.00 C ATOM 1202 CH2 TRP A 74 -11.595 -6.549 -14.834 1.00 0.00 C ATOM 0 H TRP A 74 -9.348 -11.753 -10.510 1.00 0.00 H new ATOM 0 HA TRP A 74 -12.188 -11.777 -10.655 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -11.267 -9.939 -9.641 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -10.039 -9.721 -10.872 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -13.735 -8.914 -10.200 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -14.596 -7.143 -11.888 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -9.649 -8.881 -13.198 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -13.583 -5.907 -14.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -9.666 -7.364 -15.166 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -11.544 -5.910 -15.703 1.00 0.00 H new ATOM 1213 N VAL A 75 -10.503 -11.796 -13.431 1.00 0.00 N ATOM 1214 CA VAL A 75 -10.606 -11.920 -14.875 1.00 0.00 C ATOM 1215 C VAL A 75 -11.119 -13.317 -15.227 1.00 0.00 C ATOM 1216 O VAL A 75 -11.809 -13.495 -16.230 1.00 0.00 O ATOM 1217 CB VAL A 75 -9.260 -11.595 -15.525 1.00 0.00 C ATOM 1218 CG1 VAL A 75 -9.321 -11.794 -17.041 1.00 0.00 C ATOM 1219 CG2 VAL A 75 -8.810 -10.175 -15.176 1.00 0.00 C ATOM 0 H VAL A 75 -9.564 -11.932 -13.057 1.00 0.00 H new ATOM 0 HA VAL A 75 -11.324 -11.202 -15.270 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.520 -12.288 -15.125 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.351 -11.556 -17.478 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -9.574 -12.831 -17.262 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -10.081 -11.137 -17.464 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.851 -9.970 -15.651 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -9.551 -9.460 -15.533 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -8.707 -10.081 -14.095 1.00 0.00 H new ATOM 1229 N LYS A 76 -10.762 -14.274 -14.383 1.00 0.00 N ATOM 1230 CA LYS A 76 -11.178 -15.651 -14.592 1.00 0.00 C ATOM 1231 C LYS A 76 -12.678 -15.774 -14.316 1.00 0.00 C ATOM 1232 O LYS A 76 -13.263 -16.837 -14.513 1.00 0.00 O ATOM 1233 CB LYS A 76 -10.319 -16.603 -13.758 1.00 0.00 C ATOM 1234 CG LYS A 76 -8.902 -16.704 -14.326 1.00 0.00 C ATOM 1235 CD LYS A 76 -8.035 -17.635 -13.476 1.00 0.00 C ATOM 1236 CE LYS A 76 -8.477 -19.091 -13.633 1.00 0.00 C ATOM 1237 NZ LYS A 76 -8.159 -19.586 -14.991 1.00 0.00 N ATOM 0 H LYS A 76 -10.189 -14.123 -13.553 1.00 0.00 H new ATOM 0 HA LYS A 76 -11.020 -15.943 -15.630 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -10.277 -16.252 -12.727 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -10.778 -17.591 -13.740 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -8.943 -17.074 -15.350 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -8.450 -15.713 -14.363 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -6.990 -17.535 -13.771 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -8.100 -17.342 -12.428 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -7.979 -19.711 -12.888 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -9.549 -19.174 -13.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -8.209 -20.625 -15.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -8.844 -19.199 -15.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -7.200 -19.283 -15.255 1.00 0.00 H new ATOM 1251 N SER A 77 -13.256 -14.671 -13.865 1.00 0.00 N ATOM 1252 CA SER A 77 -14.677 -14.642 -13.560 1.00 0.00 C ATOM 1253 C SER A 77 -15.398 -13.689 -14.516 1.00 0.00 C ATOM 1254 O SER A 77 -16.627 -13.642 -14.541 1.00 0.00 O ATOM 1255 CB SER A 77 -14.920 -14.223 -12.109 1.00 0.00 C ATOM 1256 OG SER A 77 -16.284 -14.384 -11.729 1.00 0.00 O ATOM 0 H SER A 77 -12.767 -13.791 -13.703 1.00 0.00 H new ATOM 0 HA SER A 77 -15.076 -15.648 -13.691 1.00 0.00 H new ATOM 0 HB2 SER A 77 -14.287 -14.817 -11.449 1.00 0.00 H new ATOM 0 HB3 SER A 77 -14.628 -13.181 -11.979 1.00 0.00 H new ATOM 0 HG SER A 77 -16.859 -14.263 -12.514 1.00 0.00 H new ATOM 1262 N LEU A 78 -14.603 -12.954 -15.280 1.00 0.00 N ATOM 1263 CA LEU A 78 -15.150 -12.005 -16.234 1.00 0.00 C ATOM 1264 C LEU A 78 -15.729 -12.767 -17.429 1.00 0.00 C ATOM 1265 O LEU A 78 -15.057 -13.615 -18.013 1.00 0.00 O ATOM 1266 CB LEU A 78 -14.096 -10.965 -16.620 1.00 0.00 C ATOM 1267 CG LEU A 78 -13.966 -9.763 -15.683 1.00 0.00 C ATOM 1268 CD1 LEU A 78 -12.927 -8.770 -16.207 1.00 0.00 C ATOM 1269 CD2 LEU A 78 -15.325 -9.101 -15.449 1.00 0.00 C ATOM 0 H LEU A 78 -13.584 -12.997 -15.257 1.00 0.00 H new ATOM 0 HA LEU A 78 -15.969 -11.443 -15.786 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.128 -11.462 -16.678 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.326 -10.598 -17.620 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.611 -10.120 -14.716 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -12.854 -7.925 -15.523 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.957 -9.263 -16.280 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.228 -8.414 -17.192 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -15.204 -8.249 -14.779 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.732 -8.760 -16.401 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -16.008 -9.822 -15.000 1.00 0.00 H new ATOM 1281 N SER A 79 -16.970 -12.436 -17.755 1.00 0.00 N ATOM 1282 CA SER A 79 -17.647 -13.078 -18.869 1.00 0.00 C ATOM 1283 C SER A 79 -16.730 -13.103 -20.094 1.00 0.00 C ATOM 1284 O SER A 79 -15.636 -12.543 -20.066 1.00 0.00 O ATOM 1285 CB SER A 79 -18.958 -12.365 -19.202 1.00 0.00 C ATOM 1286 OG SER A 79 -20.088 -13.218 -19.035 1.00 0.00 O ATOM 0 H SER A 79 -17.524 -11.732 -17.267 1.00 0.00 H new ATOM 0 HA SER A 79 -17.885 -14.102 -18.580 1.00 0.00 H new ATOM 0 HB2 SER A 79 -19.067 -11.490 -18.562 1.00 0.00 H new ATOM 0 HB3 SER A 79 -18.924 -12.006 -20.231 1.00 0.00 H new ATOM 0 HG SER A 79 -20.906 -12.725 -19.256 1.00 0.00 H new ATOM 1292 N PRO A 80 -17.225 -13.776 -21.168 1.00 0.00 N ATOM 1293 CA PRO A 80 -16.463 -13.881 -22.400 1.00 0.00 C ATOM 1294 C PRO A 80 -16.485 -12.561 -23.173 1.00 0.00 C ATOM 1295 O PRO A 80 -15.761 -12.400 -24.154 1.00 0.00 O ATOM 1296 CB PRO A 80 -17.106 -15.028 -23.164 1.00 0.00 C ATOM 1297 CG PRO A 80 -18.483 -15.217 -22.549 1.00 0.00 C ATOM 1298 CD PRO A 80 -18.517 -14.452 -21.236 1.00 0.00 C ATOM 0 HA PRO A 80 -15.406 -14.080 -22.225 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -17.181 -14.796 -24.226 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -16.511 -15.937 -23.077 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -19.256 -14.850 -23.224 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -18.683 -16.275 -22.380 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -19.340 -13.737 -21.215 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -18.657 -15.124 -20.389 1.00 0.00 H new ATOM 1306 N GLN A 81 -17.324 -11.651 -22.702 1.00 0.00 N ATOM 1307 CA GLN A 81 -17.450 -10.350 -23.337 1.00 0.00 C ATOM 1308 C GLN A 81 -16.533 -9.334 -22.653 1.00 0.00 C ATOM 1309 O GLN A 81 -15.688 -8.720 -23.302 1.00 0.00 O ATOM 1310 CB GLN A 81 -18.904 -9.872 -23.324 1.00 0.00 C ATOM 1311 CG GLN A 81 -19.842 -10.956 -23.859 1.00 0.00 C ATOM 1312 CD GLN A 81 -21.217 -10.868 -23.194 1.00 0.00 C ATOM 1313 OE1 GLN A 81 -22.049 -10.044 -23.535 1.00 0.00 O ATOM 1314 NE2 GLN A 81 -21.408 -11.761 -22.227 1.00 0.00 N ATOM 0 H GLN A 81 -17.923 -11.788 -21.888 1.00 0.00 H new ATOM 0 HA GLN A 81 -17.142 -10.445 -24.378 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -19.194 -9.605 -22.308 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -19.000 -8.971 -23.930 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -19.949 -10.849 -24.939 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -19.408 -11.939 -23.677 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -20.669 -12.423 -21.991 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -22.293 -11.783 -21.721 1.00 0.00 H new ATOM 1323 N ASP A 82 -16.732 -9.188 -21.351 1.00 0.00 N ATOM 1324 CA ASP A 82 -15.933 -8.258 -20.572 1.00 0.00 C ATOM 1325 C ASP A 82 -14.452 -8.606 -20.730 1.00 0.00 C ATOM 1326 O ASP A 82 -13.662 -7.782 -21.188 1.00 0.00 O ATOM 1327 CB ASP A 82 -16.282 -8.343 -19.084 1.00 0.00 C ATOM 1328 CG ASP A 82 -17.541 -7.579 -18.671 1.00 0.00 C ATOM 1329 OD1 ASP A 82 -18.634 -8.168 -18.813 1.00 0.00 O ATOM 1330 OD2 ASP A 82 -17.382 -6.424 -18.221 1.00 0.00 O ATOM 0 H ASP A 82 -17.435 -9.698 -20.816 1.00 0.00 H new ATOM 0 HA ASP A 82 -16.140 -7.251 -20.935 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -16.407 -9.392 -18.815 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -15.439 -7.964 -18.506 1.00 0.00 H new ATOM 1335 N ARG A 83 -14.120 -9.829 -20.343 1.00 0.00 N ATOM 1336 CA ARG A 83 -12.747 -10.297 -20.437 1.00 0.00 C ATOM 1337 C ARG A 83 -12.177 -9.995 -21.825 1.00 0.00 C ATOM 1338 O ARG A 83 -11.096 -9.420 -21.944 1.00 0.00 O ATOM 1339 CB ARG A 83 -12.659 -11.802 -20.173 1.00 0.00 C ATOM 1340 CG ARG A 83 -11.541 -12.119 -19.178 1.00 0.00 C ATOM 1341 CD ARG A 83 -11.089 -13.575 -19.308 1.00 0.00 C ATOM 1342 NE ARG A 83 -11.969 -14.452 -18.504 1.00 0.00 N ATOM 1343 CZ ARG A 83 -13.099 -15.007 -18.963 1.00 0.00 C ATOM 1344 NH1 ARG A 83 -13.492 -14.780 -20.224 1.00 0.00 N ATOM 1345 NH2 ARG A 83 -13.835 -15.789 -18.162 1.00 0.00 N ATOM 0 H ARG A 83 -14.778 -10.510 -19.964 1.00 0.00 H new ATOM 0 HA ARG A 83 -12.165 -9.772 -19.680 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.611 -12.163 -19.783 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -12.478 -12.329 -21.110 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -10.695 -11.455 -19.352 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -11.889 -11.932 -18.162 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -11.115 -13.880 -20.354 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -10.057 -13.675 -18.972 1.00 0.00 H new ATOM 0 HE ARG A 83 -11.698 -14.646 -17.540 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -12.931 -14.185 -20.834 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -14.352 -15.202 -20.574 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -13.535 -15.962 -17.203 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -14.695 -16.211 -18.512 1.00 0.00 H new ATOM 1359 N ALA A 84 -12.929 -10.397 -22.839 1.00 0.00 N ATOM 1360 CA ALA A 84 -12.512 -10.177 -24.213 1.00 0.00 C ATOM 1361 C ALA A 84 -11.978 -8.751 -24.357 1.00 0.00 C ATOM 1362 O ALA A 84 -10.962 -8.528 -25.013 1.00 0.00 O ATOM 1363 CB ALA A 84 -13.686 -10.458 -25.154 1.00 0.00 C ATOM 0 H ALA A 84 -13.825 -10.874 -22.736 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.706 -10.860 -24.484 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -13.373 -10.293 -26.185 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -14.009 -11.492 -25.034 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -14.513 -9.789 -24.914 1.00 0.00 H new ATOM 1369 N ALA A 85 -12.687 -7.822 -23.733 1.00 0.00 N ATOM 1370 CA ALA A 85 -12.296 -6.423 -23.783 1.00 0.00 C ATOM 1371 C ALA A 85 -11.037 -6.219 -22.939 1.00 0.00 C ATOM 1372 O ALA A 85 -9.981 -5.870 -23.467 1.00 0.00 O ATOM 1373 CB ALA A 85 -13.461 -5.550 -23.312 1.00 0.00 C ATOM 0 H ALA A 85 -13.530 -8.010 -23.190 1.00 0.00 H new ATOM 0 HA ALA A 85 -12.059 -6.127 -24.805 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -13.168 -4.501 -23.349 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -14.321 -5.710 -23.962 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -13.725 -5.817 -22.289 1.00 0.00 H new ATOM 1379 N TYR A 86 -11.189 -6.445 -21.643 1.00 0.00 N ATOM 1380 CA TYR A 86 -10.076 -6.290 -20.720 1.00 0.00 C ATOM 1381 C TYR A 86 -8.769 -6.772 -21.352 1.00 0.00 C ATOM 1382 O TYR A 86 -7.756 -6.077 -21.299 1.00 0.00 O ATOM 1383 CB TYR A 86 -10.403 -7.173 -19.514 1.00 0.00 C ATOM 1384 CG TYR A 86 -9.223 -7.389 -18.564 1.00 0.00 C ATOM 1385 CD1 TYR A 86 -8.936 -6.450 -17.595 1.00 0.00 C ATOM 1386 CD2 TYR A 86 -8.445 -8.524 -18.677 1.00 0.00 C ATOM 1387 CE1 TYR A 86 -7.826 -6.653 -16.701 1.00 0.00 C ATOM 1388 CE2 TYR A 86 -7.335 -8.727 -17.783 1.00 0.00 C ATOM 1389 CZ TYR A 86 -7.080 -7.782 -16.839 1.00 0.00 C ATOM 1390 OH TYR A 86 -6.032 -7.974 -15.994 1.00 0.00 O ATOM 0 H TYR A 86 -12.066 -6.734 -21.209 1.00 0.00 H new ATOM 0 HA TYR A 86 -9.945 -5.243 -20.448 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -11.226 -6.722 -18.959 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -10.752 -8.142 -19.870 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -9.544 -5.562 -17.507 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.669 -9.259 -19.436 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -7.591 -5.925 -15.938 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -6.718 -9.610 -17.860 1.00 0.00 H new ATOM 0 HH TYR A 86 -5.590 -8.822 -16.208 1.00 0.00 H new ATOM 1400 N LYS A 87 -8.834 -7.960 -21.936 1.00 0.00 N ATOM 1401 CA LYS A 87 -7.668 -8.544 -22.577 1.00 0.00 C ATOM 1402 C LYS A 87 -7.124 -7.567 -23.621 1.00 0.00 C ATOM 1403 O LYS A 87 -5.924 -7.300 -23.660 1.00 0.00 O ATOM 1404 CB LYS A 87 -8.003 -9.926 -23.142 1.00 0.00 C ATOM 1405 CG LYS A 87 -7.410 -11.034 -22.269 1.00 0.00 C ATOM 1406 CD LYS A 87 -6.236 -11.717 -22.973 1.00 0.00 C ATOM 1407 CE LYS A 87 -6.533 -13.196 -23.225 1.00 0.00 C ATOM 1408 NZ LYS A 87 -7.651 -13.344 -24.184 1.00 0.00 N ATOM 0 H LYS A 87 -9.676 -8.534 -21.979 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.874 -8.708 -21.849 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.085 -10.046 -23.203 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -7.616 -10.011 -24.157 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.076 -10.615 -21.320 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -8.179 -11.771 -22.038 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -6.034 -11.216 -23.920 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.337 -11.622 -22.364 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -5.643 -13.690 -23.615 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.785 -13.688 -22.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -7.719 -14.336 -24.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -8.541 -13.060 -23.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.480 -12.740 -25.013 1.00 0.00 H new ATOM 1422 N GLU A 88 -8.032 -7.062 -24.443 1.00 0.00 N ATOM 1423 CA GLU A 88 -7.658 -6.121 -25.485 1.00 0.00 C ATOM 1424 C GLU A 88 -6.587 -5.158 -24.970 1.00 0.00 C ATOM 1425 O GLU A 88 -5.657 -4.812 -25.698 1.00 0.00 O ATOM 1426 CB GLU A 88 -8.880 -5.358 -25.999 1.00 0.00 C ATOM 1427 CG GLU A 88 -9.009 -3.999 -25.308 1.00 0.00 C ATOM 1428 CD GLU A 88 -10.348 -3.339 -25.641 1.00 0.00 C ATOM 1429 OE1 GLU A 88 -10.631 -3.208 -26.852 1.00 0.00 O ATOM 1430 OE2 GLU A 88 -11.060 -2.980 -24.678 1.00 0.00 O ATOM 0 H GLU A 88 -9.026 -7.287 -24.408 1.00 0.00 H new ATOM 0 HA GLU A 88 -7.243 -6.682 -26.322 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -8.797 -5.216 -27.076 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -9.781 -5.946 -25.823 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -8.921 -4.126 -24.229 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -8.192 -3.349 -25.621 1.00 0.00 H new ATOM 1437 N TYR A 89 -6.753 -4.752 -23.720 1.00 0.00 N ATOM 1438 CA TYR A 89 -5.811 -3.835 -23.100 1.00 0.00 C ATOM 1439 C TYR A 89 -4.583 -4.582 -22.576 1.00 0.00 C ATOM 1440 O TYR A 89 -3.462 -4.084 -22.673 1.00 0.00 O ATOM 1441 CB TYR A 89 -6.552 -3.205 -21.919 1.00 0.00 C ATOM 1442 CG TYR A 89 -5.631 -2.678 -20.816 1.00 0.00 C ATOM 1443 CD1 TYR A 89 -5.023 -1.447 -20.955 1.00 0.00 C ATOM 1444 CD2 TYR A 89 -5.409 -3.434 -19.683 1.00 0.00 C ATOM 1445 CE1 TYR A 89 -4.157 -0.951 -19.917 1.00 0.00 C ATOM 1446 CE2 TYR A 89 -4.542 -2.939 -18.645 1.00 0.00 C ATOM 1447 CZ TYR A 89 -3.959 -1.722 -18.814 1.00 0.00 C ATOM 1448 OH TYR A 89 -3.140 -1.253 -17.833 1.00 0.00 O ATOM 0 H TYR A 89 -7.525 -5.041 -23.120 1.00 0.00 H new ATOM 0 HA TYR A 89 -5.466 -3.094 -23.821 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -7.169 -2.385 -22.286 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -7.228 -3.945 -21.491 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -5.197 -0.856 -21.842 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -5.886 -4.397 -19.575 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -3.676 0.011 -20.012 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -4.359 -3.521 -17.753 1.00 0.00 H new ATOM 0 HH TYR A 89 -3.093 -1.908 -17.106 1.00 0.00 H new ATOM 1458 N ILE A 90 -4.835 -5.764 -22.033 1.00 0.00 N ATOM 1459 CA ILE A 90 -3.764 -6.584 -21.495 1.00 0.00 C ATOM 1460 C ILE A 90 -2.705 -6.807 -22.576 1.00 0.00 C ATOM 1461 O ILE A 90 -1.560 -6.385 -22.426 1.00 0.00 O ATOM 1462 CB ILE A 90 -4.325 -7.880 -20.907 1.00 0.00 C ATOM 1463 CG1 ILE A 90 -5.361 -7.586 -19.820 1.00 0.00 C ATOM 1464 CG2 ILE A 90 -3.200 -8.783 -20.397 1.00 0.00 C ATOM 1465 CD1 ILE A 90 -4.681 -7.273 -18.485 1.00 0.00 C ATOM 0 H ILE A 90 -5.766 -6.173 -21.954 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.272 -6.072 -20.668 1.00 0.00 H new ATOM 0 HB ILE A 90 -4.837 -8.422 -21.702 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.982 -6.743 -20.123 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -6.024 -8.443 -19.703 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -3.626 -9.697 -19.984 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.533 -9.034 -21.222 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.639 -8.262 -19.621 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -5.440 -7.068 -17.730 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -4.080 -8.128 -18.173 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -4.038 -6.400 -18.600 1.00 0.00 H new ATOM 1477 N SER A 91 -3.125 -7.471 -23.643 1.00 0.00 N ATOM 1478 CA SER A 91 -2.228 -7.756 -24.749 1.00 0.00 C ATOM 1479 C SER A 91 -1.428 -6.503 -25.110 1.00 0.00 C ATOM 1480 O SER A 91 -0.198 -6.514 -25.068 1.00 0.00 O ATOM 1481 CB SER A 91 -3.000 -8.262 -25.969 1.00 0.00 C ATOM 1482 OG SER A 91 -2.137 -8.554 -27.064 1.00 0.00 O ATOM 0 H SER A 91 -4.076 -7.820 -23.765 1.00 0.00 H new ATOM 0 HA SER A 91 -1.540 -8.542 -24.437 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.558 -9.158 -25.698 1.00 0.00 H new ATOM 0 HB3 SER A 91 -3.730 -7.512 -26.273 1.00 0.00 H new ATOM 0 HG SER A 91 -2.668 -8.876 -27.822 1.00 0.00 H new ATOM 1488 N ASN A 92 -2.158 -5.453 -25.456 1.00 0.00 N ATOM 1489 CA ASN A 92 -1.531 -4.194 -25.823 1.00 0.00 C ATOM 1490 C ASN A 92 -0.357 -3.920 -24.881 1.00 0.00 C ATOM 1491 O ASN A 92 0.764 -3.688 -25.332 1.00 0.00 O ATOM 1492 CB ASN A 92 -2.518 -3.031 -25.700 1.00 0.00 C ATOM 1493 CG ASN A 92 -3.471 -2.992 -26.896 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -3.110 -3.297 -28.021 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -4.705 -2.600 -26.592 1.00 0.00 N ATOM 0 H ASN A 92 -3.177 -5.448 -25.490 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.194 -4.273 -26.857 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -3.090 -3.131 -24.778 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.971 -2.090 -25.635 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -5.415 -2.540 -27.321 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -4.941 -2.359 -25.629 1.00 0.00 H new ATOM 1502 N LYS A 93 -0.655 -3.955 -23.591 1.00 0.00 N ATOM 1503 CA LYS A 93 0.362 -3.713 -22.581 1.00 0.00 C ATOM 1504 C LYS A 93 1.128 -5.010 -22.314 1.00 0.00 C ATOM 1505 O LYS A 93 0.969 -5.990 -23.040 1.00 0.00 O ATOM 1506 CB LYS A 93 -0.263 -3.098 -21.328 1.00 0.00 C ATOM 1507 CG LYS A 93 0.121 -1.623 -21.191 1.00 0.00 C ATOM 1508 CD LYS A 93 -1.082 -0.781 -20.761 1.00 0.00 C ATOM 1509 CE LYS A 93 -0.632 0.472 -20.007 1.00 0.00 C ATOM 1510 NZ LYS A 93 -1.424 1.647 -20.436 1.00 0.00 N ATOM 0 H LYS A 93 -1.586 -4.147 -23.221 1.00 0.00 H new ATOM 0 HA LYS A 93 1.087 -2.982 -22.938 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -1.348 -3.192 -21.375 1.00 0.00 H new ATOM 0 HB3 LYS A 93 0.067 -3.647 -20.446 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.923 -1.519 -20.460 1.00 0.00 H new ATOM 0 HG3 LYS A 93 0.507 -1.254 -22.141 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.662 -0.494 -21.638 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.739 -1.376 -20.126 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.748 0.320 -18.934 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.427 0.653 -20.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -1.502 2.320 -19.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -0.952 2.109 -21.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.375 1.339 -20.724 1.00 0.00 H new ATOM 1524 N ARG A 94 1.942 -4.975 -21.269 1.00 0.00 N ATOM 1525 CA ARG A 94 2.733 -6.135 -20.896 1.00 0.00 C ATOM 1526 C ARG A 94 3.423 -6.725 -22.128 1.00 0.00 C ATOM 1527 O ARG A 94 3.346 -6.159 -23.217 1.00 0.00 O ATOM 1528 CB ARG A 94 1.860 -7.210 -20.245 1.00 0.00 C ATOM 1529 CG ARG A 94 1.274 -6.713 -18.922 1.00 0.00 C ATOM 1530 CD ARG A 94 1.847 -7.498 -17.740 1.00 0.00 C ATOM 1531 NE ARG A 94 3.321 -7.367 -17.712 1.00 0.00 N ATOM 1532 CZ ARG A 94 4.136 -8.188 -17.036 1.00 0.00 C ATOM 1533 NH1 ARG A 94 3.625 -9.205 -16.328 1.00 0.00 N ATOM 1534 NH2 ARG A 94 5.461 -7.994 -17.069 1.00 0.00 N ATOM 0 H ARG A 94 2.071 -4.161 -20.669 1.00 0.00 H new ATOM 0 HA ARG A 94 3.484 -5.808 -20.177 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.053 -7.488 -20.923 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.453 -8.108 -20.070 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.492 -5.652 -18.799 1.00 0.00 H new ATOM 0 HG3 ARG A 94 0.189 -6.815 -18.939 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.423 -7.127 -16.807 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.569 -8.549 -17.821 1.00 0.00 H new ATOM 0 HE ARG A 94 3.743 -6.604 -18.241 1.00 0.00 H new ATOM 0 HH11 ARG A 94 2.616 -9.354 -16.304 1.00 0.00 H new ATOM 0 HH12 ARG A 94 4.245 -9.830 -15.813 1.00 0.00 H new ATOM 0 HH21 ARG A 94 5.850 -7.221 -17.609 1.00 0.00 H new ATOM 0 HH22 ARG A 94 6.081 -8.619 -16.554 1.00 0.00 H new ATOM 1548 N LYS A 95 4.080 -7.856 -21.913 1.00 0.00 N ATOM 1549 CA LYS A 95 4.783 -8.528 -22.993 1.00 0.00 C ATOM 1550 C LYS A 95 5.871 -7.603 -23.542 1.00 0.00 C ATOM 1551 O LYS A 95 5.722 -6.383 -23.519 1.00 0.00 O ATOM 1552 CB LYS A 95 3.795 -9.014 -24.055 1.00 0.00 C ATOM 1553 CG LYS A 95 3.816 -10.540 -24.166 1.00 0.00 C ATOM 1554 CD LYS A 95 2.991 -11.014 -25.365 1.00 0.00 C ATOM 1555 CE LYS A 95 3.354 -12.450 -25.746 1.00 0.00 C ATOM 1556 NZ LYS A 95 2.687 -12.835 -27.010 1.00 0.00 N ATOM 0 H LYS A 95 4.140 -8.323 -21.008 1.00 0.00 H new ATOM 0 HA LYS A 95 5.283 -9.423 -22.623 1.00 0.00 H new ATOM 0 HB2 LYS A 95 2.789 -8.678 -23.802 1.00 0.00 H new ATOM 0 HB3 LYS A 95 4.046 -8.572 -25.019 1.00 0.00 H new ATOM 0 HG2 LYS A 95 4.844 -10.887 -24.268 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.420 -10.980 -23.251 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.929 -10.954 -25.127 1.00 0.00 H new ATOM 0 HD3 LYS A 95 3.165 -10.353 -26.215 1.00 0.00 H new ATOM 0 HE2 LYS A 95 4.435 -12.541 -25.856 1.00 0.00 H new ATOM 0 HE3 LYS A 95 3.056 -13.131 -24.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 2.944 -13.813 -27.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.656 -12.767 -26.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.992 -12.196 -27.772 1.00 0.00 H new ATOM 1570 N SER A 96 6.940 -8.220 -24.024 1.00 0.00 N ATOM 1571 CA SER A 96 8.052 -7.467 -24.578 1.00 0.00 C ATOM 1572 C SER A 96 9.100 -8.425 -25.148 1.00 0.00 C ATOM 1573 O SER A 96 9.945 -8.935 -24.414 1.00 0.00 O ATOM 1574 CB SER A 96 8.683 -6.558 -23.522 1.00 0.00 C ATOM 1575 OG SER A 96 7.917 -5.376 -23.309 1.00 0.00 O ATOM 0 H SER A 96 7.059 -9.233 -24.042 1.00 0.00 H new ATOM 0 HA SER A 96 7.671 -6.836 -25.381 1.00 0.00 H new ATOM 0 HB2 SER A 96 8.776 -7.104 -22.583 1.00 0.00 H new ATOM 0 HB3 SER A 96 9.691 -6.285 -23.834 1.00 0.00 H new ATOM 0 HG SER A 96 7.034 -5.480 -23.721 1.00 0.00 H new ATOM 1581 N GLY A 97 9.010 -8.641 -26.453 1.00 0.00 N ATOM 1582 CA GLY A 97 9.940 -9.529 -27.130 1.00 0.00 C ATOM 1583 C GLY A 97 10.049 -9.180 -28.615 1.00 0.00 C ATOM 1584 O GLY A 97 9.320 -8.322 -29.110 1.00 0.00 O ATOM 0 H GLY A 97 8.308 -8.216 -27.059 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.922 -9.457 -26.663 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.609 -10.561 -27.019 1.00 0.00 H new ATOM 1588 N PRO A 98 10.989 -9.881 -29.303 1.00 0.00 N ATOM 1589 CA PRO A 98 11.202 -9.654 -30.723 1.00 0.00 C ATOM 1590 C PRO A 98 10.079 -10.279 -31.553 1.00 0.00 C ATOM 1591 O PRO A 98 9.437 -9.596 -32.349 1.00 0.00 O ATOM 1592 CB PRO A 98 12.565 -10.259 -31.017 1.00 0.00 C ATOM 1593 CG PRO A 98 12.859 -11.207 -29.866 1.00 0.00 C ATOM 1594 CD PRO A 98 11.871 -10.905 -28.751 1.00 0.00 C ATOM 0 HA PRO A 98 11.184 -8.597 -30.988 1.00 0.00 H new ATOM 0 HB2 PRO A 98 12.559 -10.791 -31.969 1.00 0.00 H new ATOM 0 HB3 PRO A 98 13.328 -9.484 -31.089 1.00 0.00 H new ATOM 0 HG2 PRO A 98 12.763 -12.243 -30.191 1.00 0.00 H new ATOM 0 HG3 PRO A 98 13.883 -11.076 -29.515 1.00 0.00 H new ATOM 0 HD2 PRO A 98 11.312 -11.796 -28.465 1.00 0.00 H new ATOM 0 HD3 PRO A 98 12.381 -10.548 -27.856 1.00 0.00 H new ATOM 1602 N SER A 99 9.876 -11.570 -31.338 1.00 0.00 N ATOM 1603 CA SER A 99 8.841 -12.295 -32.056 1.00 0.00 C ATOM 1604 C SER A 99 7.667 -12.594 -31.122 1.00 0.00 C ATOM 1605 O SER A 99 7.864 -12.862 -29.937 1.00 0.00 O ATOM 1606 CB SER A 99 9.390 -13.593 -32.651 1.00 0.00 C ATOM 1607 OG SER A 99 9.137 -13.687 -34.051 1.00 0.00 O ATOM 0 H SER A 99 10.411 -12.133 -30.677 1.00 0.00 H new ATOM 0 HA SER A 99 8.493 -11.669 -32.878 1.00 0.00 H new ATOM 0 HB2 SER A 99 10.464 -13.648 -32.472 1.00 0.00 H new ATOM 0 HB3 SER A 99 8.938 -14.445 -32.143 1.00 0.00 H new ATOM 0 HG SER A 99 9.504 -14.528 -34.394 1.00 0.00 H new ATOM 1613 N SER A 100 6.471 -12.539 -31.690 1.00 0.00 N ATOM 1614 CA SER A 100 5.265 -12.801 -30.922 1.00 0.00 C ATOM 1615 C SER A 100 4.513 -13.991 -31.520 1.00 0.00 C ATOM 1616 O SER A 100 4.737 -14.357 -32.673 1.00 0.00 O ATOM 1617 CB SER A 100 4.361 -11.568 -30.880 1.00 0.00 C ATOM 1618 OG SER A 100 3.820 -11.258 -32.162 1.00 0.00 O ATOM 0 H SER A 100 6.311 -12.317 -32.673 1.00 0.00 H new ATOM 0 HA SER A 100 5.555 -13.040 -29.899 1.00 0.00 H new ATOM 0 HB2 SER A 100 3.547 -11.739 -30.175 1.00 0.00 H new ATOM 0 HB3 SER A 100 4.929 -10.714 -30.510 1.00 0.00 H new ATOM 0 HG SER A 100 3.247 -10.466 -32.093 1.00 0.00 H new ATOM 1624 N GLY A 101 3.635 -14.564 -30.709 1.00 0.00 N ATOM 1625 CA GLY A 101 2.848 -15.705 -31.144 1.00 0.00 C ATOM 1626 C GLY A 101 1.628 -15.905 -30.243 1.00 0.00 C ATOM 1627 O GLY A 101 1.034 -16.982 -30.225 1.00 0.00 O ATOM 0 H GLY A 101 3.452 -14.259 -29.753 1.00 0.00 H new ATOM 0 HA2 GLY A 101 2.523 -15.556 -32.174 1.00 0.00 H new ATOM 0 HA3 GLY A 101 3.465 -16.603 -31.131 1.00 0.00 H new TER 1631 GLY A 101