USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 759 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 64 LYS NZ :NH3+ -127:sc= 1.09 (180deg=0.256) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 152:sc= -0.37 (180deg=-2.11!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -4.58! C(o=-4.6!,f=-9.3!) USER MOD Single : A 79 HIS : no HD1:sc= -1.69! K(o=-1.7!,f=-0.61) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0.00147 USER MOD Single : A 96 SER OG : rot 180:sc= -0.743 USER MOD Single : A 98 SER OG : rot 14:sc= 0.24 USER MOD Single : A 100 LYS NZ :NH3+ -138:sc= -0.622 (180deg=-1.5!) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 GLN : amide:sc= -2.66! K(o=-2.7!,f=-0.17) USER MOD Single : A 107 HIS : no HD1:sc= -1.81! K(o=-1.8!,f=-0.78) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot -87:sc= 1.49 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= -2.19 K(o=-2.2,f=-5.6!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 HIS : no HE2:sc= -10.6! C(o=-11!,f=-18!) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot -130:sc=-0.00563 USER MOD Single : A 141 SER OG : rot 151:sc= 0.0457 USER MOD Single : A 143 ASN : amide:sc= -0.147 X(o=-0.15,f=-0.018) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 145 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 GLN : amide:sc= -2.92! C(o=-2.9!,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N TRP A 60 0.770 -1.194 0.029 1.00 11.13 N ATOM 2 CA TRP A 60 1.415 -0.899 -1.245 1.00 62.12 C ATOM 3 C TRP A 60 1.911 -2.177 -1.913 1.00 35.10 C ATOM 4 O TRP A 60 2.749 -2.134 -2.813 1.00 42.33 O ATOM 5 CB TRP A 60 2.582 0.068 -1.038 1.00 31.02 C ATOM 6 CG TRP A 60 3.280 -0.117 0.275 1.00 4.23 C ATOM 7 CD1 TRP A 60 3.344 0.780 1.303 1.00 1.31 C ATOM 8 CD2 TRP A 60 4.016 -1.270 0.700 1.00 15.42 C ATOM 9 NE1 TRP A 60 4.075 0.255 2.341 1.00 33.43 N ATOM 10 CE2 TRP A 60 4.497 -1.002 1.997 1.00 71.13 C ATOM 11 CE3 TRP A 60 4.312 -2.502 0.113 1.00 62.33 C ATOM 12 CZ2 TRP A 60 5.259 -1.922 2.712 1.00 34.21 C ATOM 13 CZ3 TRP A 60 5.069 -3.414 0.824 1.00 75.31 C ATOM 14 CH2 TRP A 60 5.534 -3.121 2.113 1.00 61.14 C ATOM 0 HA TRP A 60 0.677 -0.433 -1.898 1.00 62.12 H new ATOM 0 HB2 TRP A 60 3.302 -0.064 -1.846 1.00 31.02 H new ATOM 0 HB3 TRP A 60 2.213 1.091 -1.104 1.00 31.02 H new ATOM 0 HD1 TRP A 60 2.887 1.759 1.300 1.00 1.31 H new ATOM 0 HE1 TRP A 60 4.272 0.725 3.225 1.00 33.43 H new ATOM 0 HE3 TRP A 60 3.956 -2.738 -0.879 1.00 62.33 H new ATOM 0 HZ2 TRP A 60 5.620 -1.697 3.705 1.00 34.21 H new ATOM 0 HZ3 TRP A 60 5.306 -4.369 0.378 1.00 75.31 H new ATOM 0 HH2 TRP A 60 6.121 -3.856 2.644 1.00 61.14 H new ATOM 25 N PHE A 61 1.387 -3.314 -1.467 1.00 31.12 N ATOM 26 CA PHE A 61 1.777 -4.605 -2.021 1.00 62.05 C ATOM 27 C PHE A 61 0.669 -5.177 -2.901 1.00 13.34 C ATOM 28 O PHE A 61 -0.515 -4.941 -2.658 1.00 51.03 O ATOM 29 CB PHE A 61 2.110 -5.588 -0.897 1.00 15.22 C ATOM 30 CG PHE A 61 1.871 -7.024 -1.266 1.00 32.03 C ATOM 31 CD1 PHE A 61 2.569 -7.610 -2.309 1.00 72.40 C ATOM 32 CD2 PHE A 61 0.948 -7.788 -0.569 1.00 52.44 C ATOM 33 CE1 PHE A 61 2.352 -8.932 -2.651 1.00 12.01 C ATOM 34 CE2 PHE A 61 0.727 -9.110 -0.906 1.00 52.44 C ATOM 35 CZ PHE A 61 1.429 -9.682 -1.949 1.00 73.21 C ATOM 0 H PHE A 61 0.691 -3.367 -0.723 1.00 31.12 H new ATOM 0 HA PHE A 61 2.664 -4.454 -2.636 1.00 62.05 H new ATOM 0 HB2 PHE A 61 3.155 -5.463 -0.614 1.00 15.22 H new ATOM 0 HB3 PHE A 61 1.511 -5.342 -0.020 1.00 15.22 H new ATOM 0 HD1 PHE A 61 3.291 -7.027 -2.862 1.00 72.40 H new ATOM 0 HD2 PHE A 61 0.395 -7.345 0.246 1.00 52.44 H new ATOM 0 HE1 PHE A 61 2.903 -9.377 -3.466 1.00 12.01 H new ATOM 0 HE2 PHE A 61 0.006 -9.695 -0.354 1.00 52.44 H new ATOM 0 HZ PHE A 61 1.256 -10.714 -2.215 1.00 73.21 H new ATOM 45 N PHE A 62 1.062 -5.929 -3.923 1.00 74.11 N ATOM 46 CA PHE A 62 0.102 -6.534 -4.840 1.00 45.23 C ATOM 47 C PHE A 62 0.434 -8.003 -5.083 1.00 63.22 C ATOM 48 O PHE A 62 1.600 -8.376 -5.206 1.00 4.33 O ATOM 49 CB PHE A 62 0.088 -5.776 -6.169 1.00 42.04 C ATOM 50 CG PHE A 62 -0.958 -4.700 -6.235 1.00 4.23 C ATOM 51 CD1 PHE A 62 -0.747 -3.473 -5.627 1.00 1.14 C ATOM 52 CD2 PHE A 62 -2.152 -4.916 -6.904 1.00 3.53 C ATOM 53 CE1 PHE A 62 -1.707 -2.480 -5.685 1.00 70.20 C ATOM 54 CE2 PHE A 62 -3.115 -3.927 -6.966 1.00 11.41 C ATOM 55 CZ PHE A 62 -2.893 -2.708 -6.355 1.00 12.02 C ATOM 0 H PHE A 62 2.038 -6.134 -4.138 1.00 74.11 H new ATOM 0 HA PHE A 62 -0.886 -6.474 -4.384 1.00 45.23 H new ATOM 0 HB2 PHE A 62 1.068 -5.329 -6.333 1.00 42.04 H new ATOM 0 HB3 PHE A 62 -0.079 -6.484 -6.980 1.00 42.04 H new ATOM 0 HD1 PHE A 62 0.179 -3.290 -5.101 1.00 1.14 H new ATOM 0 HD2 PHE A 62 -2.332 -5.868 -7.382 1.00 3.53 H new ATOM 0 HE1 PHE A 62 -1.530 -1.528 -5.207 1.00 70.20 H new ATOM 0 HE2 PHE A 62 -4.041 -4.107 -7.492 1.00 11.41 H new ATOM 0 HZ PHE A 62 -3.646 -1.935 -6.401 1.00 12.02 H new ATOM 65 N GLY A 63 -0.601 -8.834 -5.151 1.00 74.42 N ATOM 66 CA GLY A 63 -0.400 -10.253 -5.378 1.00 71.52 C ATOM 67 C GLY A 63 -0.614 -10.645 -6.827 1.00 44.10 C ATOM 68 O GLY A 63 -1.649 -10.335 -7.416 1.00 15.11 O ATOM 0 H GLY A 63 -1.576 -8.550 -5.053 1.00 74.42 H new ATOM 0 HA2 GLY A 63 0.611 -10.526 -5.077 1.00 71.52 H new ATOM 0 HA3 GLY A 63 -1.085 -10.819 -4.747 1.00 71.52 H new ATOM 72 N LYS A 64 0.369 -11.327 -7.405 1.00 3.10 N ATOM 73 CA LYS A 64 0.286 -11.761 -8.794 1.00 72.43 C ATOM 74 C LYS A 64 -0.237 -10.639 -9.685 1.00 12.01 C ATOM 75 O LYS A 64 -1.444 -10.514 -9.898 1.00 25.30 O ATOM 76 CB LYS A 64 -0.623 -12.987 -8.913 1.00 53.32 C ATOM 77 CG LYS A 64 -0.336 -14.060 -7.878 1.00 21.23 C ATOM 78 CD LYS A 64 1.008 -14.725 -8.122 1.00 64.13 C ATOM 79 CE LYS A 64 2.040 -14.292 -7.092 1.00 42.32 C ATOM 80 NZ LYS A 64 2.407 -15.404 -6.173 1.00 20.04 N ATOM 0 H LYS A 64 1.233 -11.591 -6.932 1.00 3.10 H new ATOM 0 HA LYS A 64 1.290 -12.026 -9.126 1.00 72.43 H new ATOM 0 HB2 LYS A 64 -1.661 -12.670 -8.817 1.00 53.32 H new ATOM 0 HB3 LYS A 64 -0.512 -13.416 -9.909 1.00 53.32 H new ATOM 0 HG2 LYS A 64 -0.349 -13.618 -6.882 1.00 21.23 H new ATOM 0 HG3 LYS A 64 -1.125 -14.812 -7.904 1.00 21.23 H new ATOM 0 HD2 LYS A 64 0.891 -15.808 -8.088 1.00 64.13 H new ATOM 0 HD3 LYS A 64 1.363 -14.474 -9.122 1.00 64.13 H new ATOM 0 HE2 LYS A 64 2.934 -13.933 -7.602 1.00 42.32 H new ATOM 0 HE3 LYS A 64 1.646 -13.457 -6.513 1.00 42.32 H new ATOM 0 HZ1 LYS A 64 2.290 -15.093 -5.188 1.00 20.04 H new ATOM 0 HZ2 LYS A 64 1.790 -16.221 -6.353 1.00 20.04 H new ATOM 0 HZ3 LYS A 64 3.398 -15.676 -6.335 1.00 20.04 H new ATOM 94 N ILE A 65 0.677 -9.826 -10.203 1.00 64.21 N ATOM 95 CA ILE A 65 0.308 -8.716 -11.073 1.00 34.44 C ATOM 96 C ILE A 65 1.291 -8.572 -12.229 1.00 23.51 C ATOM 97 O ILE A 65 2.500 -8.440 -12.035 1.00 70.54 O ATOM 98 CB ILE A 65 0.248 -7.388 -10.296 1.00 2.04 C ATOM 99 CG1 ILE A 65 1.620 -7.056 -9.704 1.00 34.54 C ATOM 100 CG2 ILE A 65 -0.804 -7.462 -9.199 1.00 71.33 C ATOM 101 CD1 ILE A 65 2.481 -6.207 -10.612 1.00 74.12 C ATOM 0 H ILE A 65 1.679 -9.915 -10.035 1.00 64.21 H new ATOM 0 HA ILE A 65 -0.682 -8.941 -11.468 1.00 34.44 H new ATOM 0 HB ILE A 65 -0.032 -6.593 -10.987 1.00 2.04 H new ATOM 0 HG12 ILE A 65 1.481 -6.535 -8.757 1.00 34.54 H new ATOM 0 HG13 ILE A 65 2.146 -7.985 -9.483 1.00 34.54 H new ATOM 0 HG21 ILE A 65 -0.834 -6.516 -8.659 1.00 71.33 H new ATOM 0 HG22 ILE A 65 -1.780 -7.657 -9.643 1.00 71.33 H new ATOM 0 HG23 ILE A 65 -0.553 -8.266 -8.508 1.00 71.33 H new ATOM 0 HD11 ILE A 65 3.438 -6.011 -10.128 1.00 74.12 H new ATOM 0 HD12 ILE A 65 2.651 -6.735 -11.551 1.00 74.12 H new ATOM 0 HD13 ILE A 65 1.976 -5.262 -10.813 1.00 74.12 H new ATOM 113 N PRO A 66 0.763 -8.596 -13.462 1.00 21.45 N ATOM 114 CA PRO A 66 1.577 -8.468 -14.674 1.00 52.41 C ATOM 115 C PRO A 66 2.150 -7.065 -14.841 1.00 3.41 C ATOM 116 O PRO A 66 1.498 -6.074 -14.510 1.00 43.05 O ATOM 117 CB PRO A 66 0.587 -8.778 -15.800 1.00 23.21 C ATOM 118 CG PRO A 66 -0.748 -8.437 -15.235 1.00 74.21 C ATOM 119 CD PRO A 66 -0.669 -8.751 -13.767 1.00 13.45 C ATOM 0 HA PRO A 66 2.443 -9.129 -14.655 1.00 52.41 H new ATOM 0 HB2 PRO A 66 0.803 -8.187 -16.690 1.00 23.21 H new ATOM 0 HB3 PRO A 66 0.637 -9.827 -16.093 1.00 23.21 H new ATOM 0 HG2 PRO A 66 -0.983 -7.385 -15.397 1.00 74.21 H new ATOM 0 HG3 PRO A 66 -1.535 -9.017 -15.716 1.00 74.21 H new ATOM 0 HD2 PRO A 66 -1.282 -8.070 -13.177 1.00 13.45 H new ATOM 0 HD3 PRO A 66 -1.019 -9.761 -13.553 1.00 13.45 H new ATOM 127 N ARG A 67 3.373 -6.988 -15.356 1.00 1.53 N ATOM 128 CA ARG A 67 4.034 -5.705 -15.566 1.00 23.24 C ATOM 129 C ARG A 67 3.020 -4.623 -15.923 1.00 1.43 C ATOM 130 O ARG A 67 3.053 -3.522 -15.374 1.00 5.41 O ATOM 131 CB ARG A 67 5.082 -5.823 -16.674 1.00 2.01 C ATOM 132 CG ARG A 67 5.587 -7.241 -16.887 1.00 54.21 C ATOM 133 CD ARG A 67 6.138 -7.835 -15.600 1.00 73.35 C ATOM 134 NE ARG A 67 7.568 -7.581 -15.449 1.00 12.25 N ATOM 135 CZ ARG A 67 8.488 -8.025 -16.298 1.00 14.40 C ATOM 136 NH1 ARG A 67 8.129 -8.741 -17.354 1.00 74.02 N ATOM 137 NH2 ARG A 67 9.770 -7.751 -16.092 1.00 34.51 N ATOM 0 H ARG A 67 3.926 -7.798 -15.635 1.00 1.53 H new ATOM 0 HA ARG A 67 4.528 -5.423 -14.636 1.00 23.24 H new ATOM 0 HB2 ARG A 67 4.655 -5.455 -17.607 1.00 2.01 H new ATOM 0 HB3 ARG A 67 5.927 -5.178 -16.433 1.00 2.01 H new ATOM 0 HG2 ARG A 67 4.775 -7.866 -17.259 1.00 54.21 H new ATOM 0 HG3 ARG A 67 6.364 -7.241 -17.651 1.00 54.21 H new ATOM 0 HD2 ARG A 67 5.603 -7.414 -14.748 1.00 73.35 H new ATOM 0 HD3 ARG A 67 5.958 -8.910 -15.590 1.00 73.35 H new ATOM 0 HE ARG A 67 7.878 -7.032 -14.647 1.00 12.25 H new ATOM 0 HH11 ARG A 67 7.144 -8.952 -17.516 1.00 74.02 H new ATOM 0 HH12 ARG A 67 8.837 -9.081 -18.005 1.00 74.02 H new ATOM 0 HH21 ARG A 67 10.050 -7.199 -15.281 1.00 34.51 H new ATOM 0 HH22 ARG A 67 10.476 -8.092 -16.745 1.00 34.51 H new ATOM 151 N ALA A 68 2.120 -4.944 -16.846 1.00 51.32 N ATOM 152 CA ALA A 68 1.096 -4.000 -17.275 1.00 54.34 C ATOM 153 C ALA A 68 0.307 -3.466 -16.084 1.00 44.22 C ATOM 154 O ALA A 68 0.181 -2.255 -15.902 1.00 44.41 O ATOM 155 CB ALA A 68 0.159 -4.657 -18.279 1.00 3.14 C ATOM 0 H ALA A 68 2.079 -5.851 -17.311 1.00 51.32 H new ATOM 0 HA ALA A 68 1.593 -3.157 -17.755 1.00 54.34 H new ATOM 0 HB1 ALA A 68 -0.601 -3.940 -18.591 1.00 3.14 H new ATOM 0 HB2 ALA A 68 0.729 -4.983 -19.149 1.00 3.14 H new ATOM 0 HB3 ALA A 68 -0.323 -5.519 -17.817 1.00 3.14 H new ATOM 161 N LYS A 69 -0.223 -4.377 -15.275 1.00 43.22 N ATOM 162 CA LYS A 69 -0.999 -3.998 -14.100 1.00 62.53 C ATOM 163 C LYS A 69 -0.238 -2.987 -13.248 1.00 75.14 C ATOM 164 O LYS A 69 -0.759 -1.921 -12.922 1.00 43.20 O ATOM 165 CB LYS A 69 -1.334 -5.236 -13.265 1.00 5.05 C ATOM 166 CG LYS A 69 -2.783 -5.292 -12.814 1.00 70.13 C ATOM 167 CD LYS A 69 -3.696 -5.769 -13.932 1.00 0.45 C ATOM 168 CE LYS A 69 -4.830 -6.629 -13.396 1.00 12.22 C ATOM 169 NZ LYS A 69 -5.434 -7.477 -14.461 1.00 0.32 N ATOM 0 H LYS A 69 -0.129 -5.383 -15.412 1.00 43.22 H new ATOM 0 HA LYS A 69 -1.925 -3.535 -14.440 1.00 62.53 H new ATOM 0 HB2 LYS A 69 -1.109 -6.129 -13.848 1.00 5.05 H new ATOM 0 HB3 LYS A 69 -0.688 -5.258 -12.387 1.00 5.05 H new ATOM 0 HG2 LYS A 69 -2.873 -5.961 -11.958 1.00 70.13 H new ATOM 0 HG3 LYS A 69 -3.100 -4.304 -12.481 1.00 70.13 H new ATOM 0 HD2 LYS A 69 -4.108 -4.908 -14.459 1.00 0.45 H new ATOM 0 HD3 LYS A 69 -3.117 -6.340 -14.658 1.00 0.45 H new ATOM 0 HE2 LYS A 69 -4.456 -7.265 -12.594 1.00 12.22 H new ATOM 0 HE3 LYS A 69 -5.598 -5.988 -12.963 1.00 12.22 H new ATOM 0 HZ1 LYS A 69 -6.203 -8.048 -14.056 1.00 0.32 H new ATOM 0 HZ2 LYS A 69 -5.814 -6.869 -15.215 1.00 0.32 H new ATOM 0 HZ3 LYS A 69 -4.707 -8.107 -14.857 1.00 0.32 H new ATOM 183 N ALA A 70 0.996 -3.329 -12.893 1.00 13.21 N ATOM 184 CA ALA A 70 1.828 -2.449 -12.082 1.00 44.03 C ATOM 185 C ALA A 70 2.001 -1.088 -12.749 1.00 32.41 C ATOM 186 O ALA A 70 1.761 -0.051 -12.133 1.00 13.23 O ATOM 187 CB ALA A 70 3.185 -3.091 -11.830 1.00 14.22 C ATOM 0 H ALA A 70 1.441 -4.209 -13.154 1.00 13.21 H new ATOM 0 HA ALA A 70 1.327 -2.295 -11.126 1.00 44.03 H new ATOM 0 HB1 ALA A 70 3.796 -2.423 -11.223 1.00 14.22 H new ATOM 0 HB2 ALA A 70 3.048 -4.036 -11.304 1.00 14.22 H new ATOM 0 HB3 ALA A 70 3.683 -3.274 -12.782 1.00 14.22 H new ATOM 193 N GLU A 71 2.419 -1.101 -14.011 1.00 32.52 N ATOM 194 CA GLU A 71 2.625 0.133 -14.760 1.00 34.25 C ATOM 195 C GLU A 71 1.363 0.992 -14.750 1.00 23.32 C ATOM 196 O GLU A 71 1.437 2.220 -14.769 1.00 72.23 O ATOM 197 CB GLU A 71 3.030 -0.181 -16.201 1.00 42.42 C ATOM 198 CG GLU A 71 4.357 -0.912 -16.315 1.00 30.42 C ATOM 199 CD GLU A 71 4.558 -1.548 -17.677 1.00 32.34 C ATOM 200 OE1 GLU A 71 3.600 -2.160 -18.194 1.00 13.23 O ATOM 201 OE2 GLU A 71 5.674 -1.434 -18.225 1.00 51.24 O ATOM 0 H GLU A 71 2.621 -1.952 -14.536 1.00 32.52 H new ATOM 0 HA GLU A 71 3.428 0.691 -14.278 1.00 34.25 H new ATOM 0 HB2 GLU A 71 2.251 -0.786 -16.665 1.00 42.42 H new ATOM 0 HB3 GLU A 71 3.088 0.750 -16.764 1.00 42.42 H new ATOM 0 HG2 GLU A 71 5.170 -0.213 -16.121 1.00 30.42 H new ATOM 0 HG3 GLU A 71 4.410 -1.683 -15.547 1.00 30.42 H new ATOM 208 N GLU A 72 0.208 0.335 -14.720 1.00 14.30 N ATOM 209 CA GLU A 72 -1.070 1.039 -14.709 1.00 64.22 C ATOM 210 C GLU A 72 -1.340 1.654 -13.339 1.00 53.12 C ATOM 211 O GLU A 72 -1.719 2.820 -13.235 1.00 4.41 O ATOM 212 CB GLU A 72 -2.206 0.085 -15.086 1.00 4.33 C ATOM 213 CG GLU A 72 -2.219 -0.295 -16.557 1.00 2.32 C ATOM 214 CD GLU A 72 -2.417 0.902 -17.467 1.00 33.03 C ATOM 215 OE1 GLU A 72 -3.497 1.526 -17.398 1.00 71.23 O ATOM 216 OE2 GLU A 72 -1.494 1.214 -18.247 1.00 2.41 O ATOM 0 H GLU A 72 0.130 -0.682 -14.703 1.00 14.30 H new ATOM 0 HA GLU A 72 -1.021 1.842 -15.445 1.00 64.22 H new ATOM 0 HB2 GLU A 72 -2.122 -0.821 -14.486 1.00 4.33 H new ATOM 0 HB3 GLU A 72 -3.159 0.549 -14.831 1.00 4.33 H new ATOM 0 HG2 GLU A 72 -1.280 -0.787 -16.810 1.00 2.32 H new ATOM 0 HG3 GLU A 72 -3.016 -1.018 -16.735 1.00 2.32 H new ATOM 223 N MET A 73 -1.144 0.860 -12.291 1.00 51.35 N ATOM 224 CA MET A 73 -1.366 1.327 -10.928 1.00 34.33 C ATOM 225 C MET A 73 -0.548 2.582 -10.642 1.00 54.24 C ATOM 226 O MET A 73 -0.999 3.480 -9.929 1.00 65.11 O ATOM 227 CB MET A 73 -1.004 0.229 -9.925 1.00 52.23 C ATOM 228 CG MET A 73 -1.879 -1.009 -10.037 1.00 50.12 C ATOM 229 SD MET A 73 -3.637 -0.613 -10.111 1.00 64.12 S ATOM 230 CE MET A 73 -3.920 -0.660 -11.879 1.00 50.11 C ATOM 0 H MET A 73 -0.832 -0.109 -12.360 1.00 51.35 H new ATOM 0 HA MET A 73 -2.423 1.572 -10.823 1.00 34.33 H new ATOM 0 HB2 MET A 73 0.037 -0.058 -10.073 1.00 52.23 H new ATOM 0 HB3 MET A 73 -1.084 0.630 -8.915 1.00 52.23 H new ATOM 0 HG2 MET A 73 -1.599 -1.568 -10.930 1.00 50.12 H new ATOM 0 HG3 MET A 73 -1.693 -1.659 -9.182 1.00 50.12 H new ATOM 0 HE1 MET A 73 -4.957 -0.932 -12.074 1.00 50.11 H new ATOM 0 HE2 MET A 73 -3.715 0.322 -12.306 1.00 50.11 H new ATOM 0 HE3 MET A 73 -3.260 -1.399 -12.334 1.00 50.11 H new ATOM 240 N LEU A 74 0.655 2.639 -11.203 1.00 14.01 N ATOM 241 CA LEU A 74 1.536 3.785 -11.008 1.00 51.14 C ATOM 242 C LEU A 74 1.176 4.917 -11.965 1.00 11.52 C ATOM 243 O LEU A 74 0.985 6.059 -11.547 1.00 3.51 O ATOM 244 CB LEU A 74 2.994 3.373 -11.214 1.00 65.33 C ATOM 245 CG LEU A 74 3.454 2.127 -10.455 1.00 14.52 C ATOM 246 CD1 LEU A 74 4.814 1.668 -10.956 1.00 32.20 C ATOM 247 CD2 LEU A 74 3.499 2.402 -8.959 1.00 2.03 C ATOM 0 H LEU A 74 1.042 1.905 -11.796 1.00 14.01 H new ATOM 0 HA LEU A 74 1.407 4.142 -9.986 1.00 51.14 H new ATOM 0 HB2 LEU A 74 3.156 3.206 -12.279 1.00 65.33 H new ATOM 0 HB3 LEU A 74 3.631 4.208 -10.922 1.00 65.33 H new ATOM 0 HG LEU A 74 2.735 1.328 -10.636 1.00 14.52 H new ATOM 0 HD11 LEU A 74 5.125 0.781 -10.404 1.00 32.20 H new ATOM 0 HD12 LEU A 74 4.750 1.431 -12.018 1.00 32.20 H new ATOM 0 HD13 LEU A 74 5.544 2.463 -10.805 1.00 32.20 H new ATOM 0 HD21 LEU A 74 3.828 1.505 -8.434 1.00 2.03 H new ATOM 0 HD22 LEU A 74 4.196 3.216 -8.759 1.00 2.03 H new ATOM 0 HD23 LEU A 74 2.505 2.682 -8.610 1.00 2.03 H new ATOM 259 N SER A 75 1.082 4.592 -13.250 1.00 43.22 N ATOM 260 CA SER A 75 0.746 5.582 -14.267 1.00 4.33 C ATOM 261 C SER A 75 -0.530 6.331 -13.895 1.00 3.22 C ATOM 262 O SER A 75 -0.642 7.538 -14.112 1.00 64.00 O ATOM 263 CB SER A 75 0.577 4.908 -15.629 1.00 74.24 C ATOM 264 OG SER A 75 0.644 5.857 -16.680 1.00 35.41 O ATOM 0 H SER A 75 1.234 3.651 -13.612 1.00 43.22 H new ATOM 0 HA SER A 75 1.564 6.300 -14.324 1.00 4.33 H new ATOM 0 HB2 SER A 75 1.354 4.155 -15.765 1.00 74.24 H new ATOM 0 HB3 SER A 75 -0.380 4.388 -15.665 1.00 74.24 H new ATOM 0 HG SER A 75 0.535 5.401 -17.540 1.00 35.41 H new ATOM 270 N LYS A 76 -1.491 5.606 -13.333 1.00 0.44 N ATOM 271 CA LYS A 76 -2.760 6.200 -12.928 1.00 70.42 C ATOM 272 C LYS A 76 -2.547 7.255 -11.848 1.00 54.51 C ATOM 273 O LYS A 76 -3.318 8.209 -11.740 1.00 34.53 O ATOM 274 CB LYS A 76 -3.713 5.117 -12.417 1.00 61.31 C ATOM 275 CG LYS A 76 -3.240 4.443 -11.140 1.00 41.54 C ATOM 276 CD LYS A 76 -4.409 4.030 -10.262 1.00 62.31 C ATOM 277 CE LYS A 76 -4.660 2.531 -10.338 1.00 2.42 C ATOM 278 NZ LYS A 76 -6.071 2.188 -10.009 1.00 11.20 N ATOM 0 H LYS A 76 -1.415 4.606 -13.147 1.00 0.44 H new ATOM 0 HA LYS A 76 -3.201 6.682 -13.800 1.00 70.42 H new ATOM 0 HB2 LYS A 76 -4.693 5.561 -12.242 1.00 61.31 H new ATOM 0 HB3 LYS A 76 -3.839 4.361 -13.192 1.00 61.31 H new ATOM 0 HG2 LYS A 76 -2.644 3.566 -11.390 1.00 41.54 H new ATOM 0 HG3 LYS A 76 -2.591 5.123 -10.588 1.00 41.54 H new ATOM 0 HD2 LYS A 76 -4.208 4.315 -9.229 1.00 62.31 H new ATOM 0 HD3 LYS A 76 -5.306 4.567 -10.572 1.00 62.31 H new ATOM 0 HE2 LYS A 76 -4.423 2.173 -11.340 1.00 2.42 H new ATOM 0 HE3 LYS A 76 -3.991 2.015 -9.649 1.00 2.42 H new ATOM 0 HZ1 LYS A 76 -6.202 1.158 -10.072 1.00 11.20 H new ATOM 0 HZ2 LYS A 76 -6.290 2.506 -9.043 1.00 11.20 H new ATOM 0 HZ3 LYS A 76 -6.709 2.660 -10.682 1.00 11.20 H new ATOM 292 N GLN A 77 -1.497 7.079 -11.053 1.00 42.22 N ATOM 293 CA GLN A 77 -1.184 8.018 -9.983 1.00 4.15 C ATOM 294 C GLN A 77 -0.917 9.412 -10.541 1.00 71.14 C ATOM 295 O GLN A 77 -0.771 9.589 -11.751 1.00 23.31 O ATOM 296 CB GLN A 77 0.031 7.533 -9.189 1.00 61.03 C ATOM 297 CG GLN A 77 -0.057 6.073 -8.774 1.00 11.43 C ATOM 298 CD GLN A 77 -1.306 5.770 -7.970 1.00 72.11 C ATOM 299 OE1 GLN A 77 -2.012 6.678 -7.531 1.00 2.41 O ATOM 300 NE2 GLN A 77 -1.587 4.487 -7.773 1.00 63.14 N ATOM 0 H GLN A 77 -0.849 6.295 -11.130 1.00 42.22 H new ATOM 0 HA GLN A 77 -2.046 8.072 -9.319 1.00 4.15 H new ATOM 0 HB2 GLN A 77 0.929 7.678 -9.790 1.00 61.03 H new ATOM 0 HB3 GLN A 77 0.142 8.150 -8.297 1.00 61.03 H new ATOM 0 HG2 GLN A 77 -0.041 5.444 -9.664 1.00 11.43 H new ATOM 0 HG3 GLN A 77 0.822 5.813 -8.184 1.00 11.43 H new ATOM 0 HE21 GLN A 77 -0.974 3.766 -8.155 1.00 63.14 H new ATOM 0 HE22 GLN A 77 -2.415 4.222 -7.240 1.00 63.14 H new ATOM 309 N ARG A 78 -0.856 10.398 -9.653 1.00 41.50 N ATOM 310 CA ARG A 78 -0.609 11.777 -10.058 1.00 42.00 C ATOM 311 C ARG A 78 0.743 12.261 -9.541 1.00 52.53 C ATOM 312 O ARG A 78 1.410 13.074 -10.183 1.00 33.11 O ATOM 313 CB ARG A 78 -1.722 12.690 -9.541 1.00 3.32 C ATOM 314 CG ARG A 78 -3.106 12.067 -9.616 1.00 62.34 C ATOM 315 CD ARG A 78 -3.480 11.713 -11.047 1.00 52.33 C ATOM 316 NE ARG A 78 -4.720 12.363 -11.465 1.00 21.41 N ATOM 317 CZ ARG A 78 -4.777 13.602 -11.938 1.00 42.45 C ATOM 318 NH1 ARG A 78 -3.670 14.323 -12.054 1.00 62.22 N ATOM 319 NH2 ARG A 78 -5.943 14.124 -12.298 1.00 22.22 N ATOM 0 H ARG A 78 -0.974 10.268 -8.648 1.00 41.50 H new ATOM 0 HA ARG A 78 -0.596 11.813 -11.147 1.00 42.00 H new ATOM 0 HB2 ARG A 78 -1.509 12.958 -8.506 1.00 3.32 H new ATOM 0 HB3 ARG A 78 -1.718 13.615 -10.117 1.00 3.32 H new ATOM 0 HG2 ARG A 78 -3.136 11.170 -8.998 1.00 62.34 H new ATOM 0 HG3 ARG A 78 -3.841 12.760 -9.207 1.00 62.34 H new ATOM 0 HD2 ARG A 78 -2.672 12.008 -11.717 1.00 52.33 H new ATOM 0 HD3 ARG A 78 -3.589 10.632 -11.137 1.00 52.33 H new ATOM 0 HE ARG A 78 -5.590 11.836 -11.389 1.00 21.41 H new ATOM 0 HH11 ARG A 78 -2.772 13.926 -11.779 1.00 62.22 H new ATOM 0 HH12 ARG A 78 -3.717 15.275 -12.418 1.00 62.22 H new ATOM 0 HH21 ARG A 78 -6.797 13.573 -12.211 1.00 22.22 H new ATOM 0 HH22 ARG A 78 -5.985 15.076 -12.661 1.00 22.22 H new ATOM 333 N HIS A 79 1.141 11.758 -8.377 1.00 74.22 N ATOM 334 CA HIS A 79 2.413 12.139 -7.774 1.00 13.10 C ATOM 335 C HIS A 79 3.584 11.654 -8.623 1.00 52.02 C ATOM 336 O HIS A 79 3.393 11.147 -9.729 1.00 22.23 O ATOM 337 CB HIS A 79 2.522 11.568 -6.360 1.00 2.21 C ATOM 338 CG HIS A 79 1.196 11.330 -5.706 1.00 1.44 C ATOM 339 ND1 HIS A 79 0.950 10.261 -4.870 1.00 51.41 N ATOM 340 CD2 HIS A 79 0.040 12.032 -5.767 1.00 3.35 C ATOM 341 CE1 HIS A 79 -0.300 10.315 -4.447 1.00 13.12 C ATOM 342 NE2 HIS A 79 -0.874 11.381 -4.976 1.00 30.31 N ATOM 0 H HIS A 79 0.601 11.086 -7.832 1.00 74.22 H new ATOM 0 HA HIS A 79 2.451 13.227 -7.722 1.00 13.10 H new ATOM 0 HB2 HIS A 79 3.073 10.628 -6.398 1.00 2.21 H new ATOM 0 HB3 HIS A 79 3.104 12.254 -5.744 1.00 2.21 H new ATOM 0 HD2 HIS A 79 -0.131 12.936 -6.333 1.00 3.35 H new ATOM 0 HE1 HIS A 79 -0.773 9.608 -3.782 1.00 13.12 H new ATOM 0 HE2 HIS A 79 -1.839 11.673 -4.822 1.00 30.31 H new ATOM 350 N ASP A 80 4.794 11.814 -8.100 1.00 1.03 N ATOM 351 CA ASP A 80 5.996 11.392 -8.810 1.00 1.25 C ATOM 352 C ASP A 80 6.865 10.502 -7.926 1.00 53.01 C ATOM 353 O ASP A 80 7.440 10.961 -6.940 1.00 60.32 O ATOM 354 CB ASP A 80 6.797 12.611 -9.270 1.00 55.41 C ATOM 355 CG ASP A 80 5.925 13.660 -9.933 1.00 33.32 C ATOM 356 OD1 ASP A 80 5.357 13.367 -11.006 1.00 22.23 O ATOM 357 OD2 ASP A 80 5.811 14.773 -9.379 1.00 55.51 O ATOM 0 H ASP A 80 4.969 12.233 -7.187 1.00 1.03 H new ATOM 0 HA ASP A 80 5.689 10.817 -9.684 1.00 1.25 H new ATOM 0 HB2 ASP A 80 7.304 13.053 -8.413 1.00 55.41 H new ATOM 0 HB3 ASP A 80 7.571 12.291 -9.968 1.00 55.41 H new ATOM 362 N GLY A 81 6.954 9.225 -8.287 1.00 12.33 N ATOM 363 CA GLY A 81 7.753 8.291 -7.516 1.00 32.23 C ATOM 364 C GLY A 81 6.919 7.183 -6.904 1.00 22.52 C ATOM 365 O GLY A 81 7.316 6.575 -5.910 1.00 20.20 O ATOM 0 H GLY A 81 6.487 8.821 -9.099 1.00 12.33 H new ATOM 0 HA2 GLY A 81 8.517 7.854 -8.159 1.00 32.23 H new ATOM 0 HA3 GLY A 81 8.273 8.830 -6.724 1.00 32.23 H new ATOM 369 N ALA A 82 5.760 6.920 -7.497 1.00 74.24 N ATOM 370 CA ALA A 82 4.868 5.877 -7.005 1.00 0.24 C ATOM 371 C ALA A 82 5.560 4.518 -7.005 1.00 13.23 C ATOM 372 O ALA A 82 6.095 4.083 -8.024 1.00 44.14 O ATOM 373 CB ALA A 82 3.600 5.826 -7.844 1.00 43.44 C ATOM 0 H ALA A 82 5.416 7.415 -8.320 1.00 74.24 H new ATOM 0 HA ALA A 82 4.600 6.119 -5.977 1.00 0.24 H new ATOM 0 HB1 ALA A 82 2.944 5.043 -7.465 1.00 43.44 H new ATOM 0 HB2 ALA A 82 3.088 6.787 -7.788 1.00 43.44 H new ATOM 0 HB3 ALA A 82 3.858 5.612 -8.881 1.00 43.44 H new ATOM 379 N PHE A 83 5.545 3.852 -5.855 1.00 22.00 N ATOM 380 CA PHE A 83 6.173 2.542 -5.722 1.00 51.43 C ATOM 381 C PHE A 83 5.124 1.457 -5.498 1.00 63.24 C ATOM 382 O PHE A 83 4.080 1.702 -4.894 1.00 34.15 O ATOM 383 CB PHE A 83 7.173 2.548 -4.564 1.00 60.33 C ATOM 384 CG PHE A 83 6.523 2.560 -3.210 1.00 74.35 C ATOM 385 CD1 PHE A 83 6.200 3.757 -2.593 1.00 1.22 C ATOM 386 CD2 PHE A 83 6.234 1.373 -2.555 1.00 42.34 C ATOM 387 CE1 PHE A 83 5.601 3.772 -1.347 1.00 61.12 C ATOM 388 CE2 PHE A 83 5.635 1.382 -1.310 1.00 20.30 C ATOM 389 CZ PHE A 83 5.319 2.582 -0.705 1.00 2.34 C ATOM 0 H PHE A 83 5.105 4.197 -5.002 1.00 22.00 H new ATOM 0 HA PHE A 83 6.703 2.324 -6.649 1.00 51.43 H new ATOM 0 HB2 PHE A 83 7.813 1.669 -4.643 1.00 60.33 H new ATOM 0 HB3 PHE A 83 7.818 3.422 -4.656 1.00 60.33 H new ATOM 0 HD1 PHE A 83 6.419 4.690 -3.091 1.00 1.22 H new ATOM 0 HD2 PHE A 83 6.480 0.431 -3.023 1.00 42.34 H new ATOM 0 HE1 PHE A 83 5.354 4.712 -0.877 1.00 61.12 H new ATOM 0 HE2 PHE A 83 5.414 0.450 -0.810 1.00 20.30 H new ATOM 0 HZ PHE A 83 4.852 2.590 0.269 1.00 2.34 H new ATOM 399 N LEU A 84 5.410 0.257 -5.991 1.00 32.42 N ATOM 400 CA LEU A 84 4.492 -0.868 -5.846 1.00 30.12 C ATOM 401 C LEU A 84 5.243 -2.195 -5.902 1.00 51.52 C ATOM 402 O LEU A 84 5.899 -2.506 -6.897 1.00 0.33 O ATOM 403 CB LEU A 84 3.425 -0.826 -6.941 1.00 44.25 C ATOM 404 CG LEU A 84 2.591 -2.095 -7.115 1.00 60.43 C ATOM 405 CD1 LEU A 84 1.159 -1.746 -7.488 1.00 14.12 C ATOM 406 CD2 LEU A 84 3.212 -3.002 -8.168 1.00 50.43 C ATOM 0 H LEU A 84 6.270 0.038 -6.494 1.00 32.42 H new ATOM 0 HA LEU A 84 4.008 -0.787 -4.873 1.00 30.12 H new ATOM 0 HB2 LEU A 84 2.749 0.003 -6.730 1.00 44.25 H new ATOM 0 HB3 LEU A 84 3.915 -0.604 -7.889 1.00 44.25 H new ATOM 0 HG LEU A 84 2.577 -2.630 -6.165 1.00 60.43 H new ATOM 0 HD11 LEU A 84 0.581 -2.662 -7.608 1.00 14.12 H new ATOM 0 HD12 LEU A 84 0.716 -1.137 -6.700 1.00 14.12 H new ATOM 0 HD13 LEU A 84 1.153 -1.188 -8.424 1.00 14.12 H new ATOM 0 HD21 LEU A 84 2.605 -3.900 -8.278 1.00 50.43 H new ATOM 0 HD22 LEU A 84 3.257 -2.475 -9.121 1.00 50.43 H new ATOM 0 HD23 LEU A 84 4.220 -3.281 -7.860 1.00 50.43 H new ATOM 418 N ILE A 85 5.140 -2.973 -4.830 1.00 42.40 N ATOM 419 CA ILE A 85 5.807 -4.267 -4.759 1.00 51.14 C ATOM 420 C ILE A 85 4.845 -5.400 -5.099 1.00 32.11 C ATOM 421 O ILE A 85 3.758 -5.498 -4.528 1.00 44.31 O ATOM 422 CB ILE A 85 6.404 -4.517 -3.362 1.00 1.11 C ATOM 423 CG1 ILE A 85 7.349 -3.377 -2.976 1.00 20.12 C ATOM 424 CG2 ILE A 85 7.134 -5.851 -3.329 1.00 31.41 C ATOM 425 CD1 ILE A 85 7.806 -3.433 -1.535 1.00 22.20 C ATOM 0 H ILE A 85 4.601 -2.730 -3.999 1.00 42.40 H new ATOM 0 HA ILE A 85 6.614 -4.247 -5.491 1.00 51.14 H new ATOM 0 HB ILE A 85 5.591 -4.552 -2.637 1.00 1.11 H new ATOM 0 HG12 ILE A 85 8.223 -3.404 -3.627 1.00 20.12 H new ATOM 0 HG13 ILE A 85 6.848 -2.425 -3.153 1.00 20.12 H new ATOM 0 HG21 ILE A 85 7.550 -6.013 -2.335 1.00 31.41 H new ATOM 0 HG22 ILE A 85 6.436 -6.654 -3.565 1.00 31.41 H new ATOM 0 HG23 ILE A 85 7.940 -5.843 -4.063 1.00 31.41 H new ATOM 0 HD11 ILE A 85 8.473 -2.595 -1.332 1.00 22.20 H new ATOM 0 HD12 ILE A 85 6.940 -3.375 -0.876 1.00 22.20 H new ATOM 0 HD13 ILE A 85 8.335 -4.369 -1.357 1.00 22.20 H new ATOM 437 N ARG A 86 5.252 -6.256 -6.031 1.00 2.32 N ATOM 438 CA ARG A 86 4.427 -7.383 -6.446 1.00 73.21 C ATOM 439 C ARG A 86 5.111 -8.707 -6.120 1.00 62.43 C ATOM 440 O ARG A 86 6.314 -8.748 -5.864 1.00 30.21 O ATOM 441 CB ARG A 86 4.134 -7.303 -7.946 1.00 21.54 C ATOM 442 CG ARG A 86 5.367 -7.039 -8.793 1.00 45.55 C ATOM 443 CD ARG A 86 5.409 -5.599 -9.282 1.00 10.02 C ATOM 444 NE ARG A 86 5.543 -5.517 -10.734 1.00 32.22 N ATOM 445 CZ ARG A 86 6.671 -5.781 -11.384 1.00 33.11 C ATOM 446 NH1 ARG A 86 7.757 -6.142 -10.715 1.00 33.25 N ATOM 447 NH2 ARG A 86 6.714 -5.684 -12.707 1.00 33.54 N ATOM 0 H ARG A 86 6.149 -6.190 -6.513 1.00 2.32 H new ATOM 0 HA ARG A 86 3.487 -7.335 -5.896 1.00 73.21 H new ATOM 0 HB2 ARG A 86 3.675 -8.238 -8.268 1.00 21.54 H new ATOM 0 HB3 ARG A 86 3.405 -6.512 -8.124 1.00 21.54 H new ATOM 0 HG2 ARG A 86 6.263 -7.253 -8.210 1.00 45.55 H new ATOM 0 HG3 ARG A 86 5.374 -7.715 -9.648 1.00 45.55 H new ATOM 0 HD2 ARG A 86 4.499 -5.085 -8.972 1.00 10.02 H new ATOM 0 HD3 ARG A 86 6.244 -5.081 -8.811 1.00 10.02 H new ATOM 0 HE ARG A 86 4.726 -5.242 -11.279 1.00 32.22 H new ATOM 0 HH11 ARG A 86 7.728 -6.218 -9.698 1.00 33.25 H new ATOM 0 HH12 ARG A 86 8.622 -6.344 -11.217 1.00 33.25 H new ATOM 0 HH21 ARG A 86 5.881 -5.407 -13.225 1.00 33.54 H new ATOM 0 HH22 ARG A 86 7.581 -5.887 -13.205 1.00 33.54 H new ATOM 461 N GLU A 87 4.336 -9.787 -6.132 1.00 32.20 N ATOM 462 CA GLU A 87 4.868 -11.112 -5.836 1.00 61.22 C ATOM 463 C GLU A 87 4.947 -11.962 -7.101 1.00 40.35 C ATOM 464 O GLU A 87 3.992 -12.034 -7.874 1.00 54.54 O ATOM 465 CB GLU A 87 3.998 -11.814 -4.791 1.00 43.11 C ATOM 466 CG GLU A 87 4.676 -13.006 -4.136 1.00 40.31 C ATOM 467 CD GLU A 87 3.717 -13.840 -3.308 1.00 45.25 C ATOM 468 OE1 GLU A 87 2.794 -14.441 -3.897 1.00 44.44 O ATOM 469 OE2 GLU A 87 3.890 -13.892 -2.073 1.00 12.51 O ATOM 0 H GLU A 87 3.338 -9.770 -6.343 1.00 32.20 H new ATOM 0 HA GLU A 87 5.875 -10.990 -5.437 1.00 61.22 H new ATOM 0 HB2 GLU A 87 3.720 -11.096 -4.020 1.00 43.11 H new ATOM 0 HB3 GLU A 87 3.074 -12.147 -5.264 1.00 43.11 H new ATOM 0 HG2 GLU A 87 5.125 -13.633 -4.907 1.00 40.31 H new ATOM 0 HG3 GLU A 87 5.488 -12.653 -3.500 1.00 40.31 H new ATOM 476 N SER A 88 6.093 -12.603 -7.306 1.00 21.11 N ATOM 477 CA SER A 88 6.300 -13.444 -8.479 1.00 75.30 C ATOM 478 C SER A 88 5.305 -14.601 -8.500 1.00 30.11 C ATOM 479 O SER A 88 5.144 -15.312 -7.509 1.00 22.51 O ATOM 480 CB SER A 88 7.730 -13.986 -8.499 1.00 21.32 C ATOM 481 OG SER A 88 8.380 -13.667 -9.717 1.00 75.42 O ATOM 0 H SER A 88 6.893 -12.556 -6.675 1.00 21.11 H new ATOM 0 HA SER A 88 6.139 -12.832 -9.367 1.00 75.30 H new ATOM 0 HB2 SER A 88 8.292 -13.569 -7.663 1.00 21.32 H new ATOM 0 HB3 SER A 88 7.714 -15.068 -8.364 1.00 21.32 H new ATOM 0 HG SER A 88 9.293 -14.023 -9.704 1.00 75.42 H new ATOM 487 N GLU A 89 4.640 -14.782 -9.637 1.00 44.50 N ATOM 488 CA GLU A 89 3.661 -15.851 -9.787 1.00 32.20 C ATOM 489 C GLU A 89 4.345 -17.215 -9.822 1.00 0.34 C ATOM 490 O GLU A 89 3.848 -18.185 -9.251 1.00 74.42 O ATOM 491 CB GLU A 89 2.841 -15.647 -11.063 1.00 22.02 C ATOM 492 CG GLU A 89 3.688 -15.357 -12.290 1.00 41.15 C ATOM 493 CD GLU A 89 2.873 -15.330 -13.569 1.00 32.33 C ATOM 494 OE1 GLU A 89 2.567 -16.419 -14.099 1.00 52.22 O ATOM 495 OE2 GLU A 89 2.541 -14.222 -14.039 1.00 21.04 O ATOM 0 H GLU A 89 4.762 -14.202 -10.467 1.00 44.50 H new ATOM 0 HA GLU A 89 2.994 -15.820 -8.926 1.00 32.20 H new ATOM 0 HB2 GLU A 89 2.243 -16.540 -11.247 1.00 22.02 H new ATOM 0 HB3 GLU A 89 2.144 -14.823 -10.909 1.00 22.02 H new ATOM 0 HG2 GLU A 89 4.189 -14.397 -12.163 1.00 41.15 H new ATOM 0 HG3 GLU A 89 4.467 -16.114 -12.376 1.00 41.15 H new ATOM 502 N SER A 90 5.489 -17.279 -10.496 1.00 32.32 N ATOM 503 CA SER A 90 6.240 -18.524 -10.609 1.00 71.04 C ATOM 504 C SER A 90 7.214 -18.679 -9.445 1.00 73.02 C ATOM 505 O SER A 90 7.803 -19.742 -9.252 1.00 32.01 O ATOM 506 CB SER A 90 7.002 -18.565 -11.935 1.00 72.44 C ATOM 507 OG SER A 90 7.806 -17.410 -12.098 1.00 22.13 O ATOM 0 H SER A 90 5.916 -16.484 -10.972 1.00 32.32 H new ATOM 0 HA SER A 90 5.531 -19.351 -10.579 1.00 71.04 H new ATOM 0 HB2 SER A 90 7.629 -19.456 -11.970 1.00 72.44 H new ATOM 0 HB3 SER A 90 6.295 -18.640 -12.762 1.00 72.44 H new ATOM 0 HG SER A 90 8.284 -17.462 -12.952 1.00 22.13 H new ATOM 513 N ALA A 91 7.377 -17.610 -8.673 1.00 23.14 N ATOM 514 CA ALA A 91 8.278 -17.627 -7.526 1.00 55.33 C ATOM 515 C ALA A 91 7.592 -17.074 -6.282 1.00 13.34 C ATOM 516 O ALA A 91 7.582 -15.868 -6.033 1.00 22.04 O ATOM 517 CB ALA A 91 9.538 -16.832 -7.834 1.00 22.23 C ATOM 0 H ALA A 91 6.898 -16.722 -8.820 1.00 23.14 H new ATOM 0 HA ALA A 91 8.554 -18.662 -7.327 1.00 55.33 H new ATOM 0 HB1 ALA A 91 10.202 -16.853 -6.970 1.00 22.23 H new ATOM 0 HB2 ALA A 91 10.046 -17.273 -8.692 1.00 22.23 H new ATOM 0 HB3 ALA A 91 9.271 -15.800 -8.061 1.00 22.23 H new ATOM 523 N PRO A 92 7.003 -17.974 -5.480 1.00 53.33 N ATOM 524 CA PRO A 92 6.303 -17.598 -4.248 1.00 21.50 C ATOM 525 C PRO A 92 7.259 -17.113 -3.164 1.00 21.14 C ATOM 526 O PRO A 92 8.206 -17.809 -2.801 1.00 23.14 O ATOM 527 CB PRO A 92 5.622 -18.899 -3.817 1.00 35.42 C ATOM 528 CG PRO A 92 6.453 -19.980 -4.418 1.00 55.21 C ATOM 529 CD PRO A 92 6.975 -19.427 -5.715 1.00 73.14 C ATOM 0 HA PRO A 92 5.611 -16.771 -4.408 1.00 21.50 H new ATOM 0 HB2 PRO A 92 5.585 -18.986 -2.731 1.00 35.42 H new ATOM 0 HB3 PRO A 92 4.594 -18.945 -4.175 1.00 35.42 H new ATOM 0 HG2 PRO A 92 7.272 -20.258 -3.754 1.00 55.21 H new ATOM 0 HG3 PRO A 92 5.861 -20.879 -4.587 1.00 55.21 H new ATOM 0 HD2 PRO A 92 7.967 -19.816 -5.947 1.00 73.14 H new ATOM 0 HD3 PRO A 92 6.327 -19.686 -6.552 1.00 73.14 H new ATOM 537 N GLY A 93 7.004 -15.914 -2.649 1.00 53.22 N ATOM 538 CA GLY A 93 7.851 -15.356 -1.611 1.00 34.41 C ATOM 539 C GLY A 93 8.781 -14.281 -2.137 1.00 31.35 C ATOM 540 O GLY A 93 9.231 -13.418 -1.383 1.00 53.53 O ATOM 0 H GLY A 93 6.226 -15.319 -2.932 1.00 53.22 H new ATOM 0 HA2 GLY A 93 7.226 -14.937 -0.822 1.00 34.41 H new ATOM 0 HA3 GLY A 93 8.441 -16.154 -1.160 1.00 34.41 H new ATOM 544 N ASP A 94 9.072 -14.334 -3.432 1.00 34.34 N ATOM 545 CA ASP A 94 9.955 -13.358 -4.058 1.00 3.45 C ATOM 546 C ASP A 94 9.270 -12.000 -4.172 1.00 51.41 C ATOM 547 O ASP A 94 8.204 -11.879 -4.777 1.00 22.42 O ATOM 548 CB ASP A 94 10.388 -13.843 -5.442 1.00 11.11 C ATOM 549 CG ASP A 94 11.058 -12.753 -6.254 1.00 43.53 C ATOM 550 OD1 ASP A 94 12.145 -12.292 -5.846 1.00 73.01 O ATOM 551 OD2 ASP A 94 10.496 -12.359 -7.298 1.00 1.00 O ATOM 0 H ASP A 94 8.709 -15.043 -4.069 1.00 34.34 H new ATOM 0 HA ASP A 94 10.838 -13.248 -3.428 1.00 3.45 H new ATOM 0 HB2 ASP A 94 11.074 -14.683 -5.331 1.00 11.11 H new ATOM 0 HB3 ASP A 94 9.517 -14.212 -5.983 1.00 11.11 H new ATOM 556 N PHE A 95 9.888 -10.979 -3.587 1.00 21.23 N ATOM 557 CA PHE A 95 9.337 -9.630 -3.621 1.00 53.32 C ATOM 558 C PHE A 95 10.067 -8.770 -4.649 1.00 2.25 C ATOM 559 O PHE A 95 11.285 -8.867 -4.802 1.00 74.12 O ATOM 560 CB PHE A 95 9.431 -8.982 -2.238 1.00 53.01 C ATOM 561 CG PHE A 95 8.332 -9.401 -1.304 1.00 31.51 C ATOM 562 CD1 PHE A 95 7.035 -8.953 -1.493 1.00 12.42 C ATOM 563 CD2 PHE A 95 8.596 -10.244 -0.236 1.00 65.33 C ATOM 564 CE1 PHE A 95 6.021 -9.337 -0.635 1.00 63.01 C ATOM 565 CE2 PHE A 95 7.587 -10.632 0.624 1.00 20.32 C ATOM 566 CZ PHE A 95 6.298 -10.177 0.425 1.00 22.24 C ATOM 0 H PHE A 95 10.771 -11.061 -3.083 1.00 21.23 H new ATOM 0 HA PHE A 95 8.289 -9.700 -3.911 1.00 53.32 H new ATOM 0 HB2 PHE A 95 10.393 -9.235 -1.792 1.00 53.01 H new ATOM 0 HB3 PHE A 95 9.407 -7.898 -2.351 1.00 53.01 H new ATOM 0 HD1 PHE A 95 6.813 -8.296 -2.321 1.00 12.42 H new ATOM 0 HD2 PHE A 95 9.602 -10.602 -0.074 1.00 65.33 H new ATOM 0 HE1 PHE A 95 5.014 -8.980 -0.794 1.00 63.01 H new ATOM 0 HE2 PHE A 95 7.806 -11.291 1.451 1.00 20.32 H new ATOM 0 HZ PHE A 95 5.508 -10.478 1.097 1.00 22.24 H new ATOM 576 N SER A 96 9.314 -7.929 -5.350 1.00 1.51 N ATOM 577 CA SER A 96 9.888 -7.054 -6.366 1.00 60.21 C ATOM 578 C SER A 96 9.205 -5.690 -6.358 1.00 33.21 C ATOM 579 O SER A 96 7.992 -5.589 -6.551 1.00 44.33 O ATOM 580 CB SER A 96 9.760 -7.693 -7.750 1.00 70.22 C ATOM 581 OG SER A 96 8.409 -8.004 -8.046 1.00 3.14 O ATOM 0 H SER A 96 8.305 -7.835 -5.233 1.00 1.51 H new ATOM 0 HA SER A 96 10.944 -6.913 -6.134 1.00 60.21 H new ATOM 0 HB2 SER A 96 10.154 -7.013 -8.506 1.00 70.22 H new ATOM 0 HB3 SER A 96 10.363 -8.600 -7.792 1.00 70.22 H new ATOM 0 HG SER A 96 8.354 -8.410 -8.936 1.00 3.14 H new ATOM 587 N LEU A 97 9.991 -4.643 -6.133 1.00 32.32 N ATOM 588 CA LEU A 97 9.463 -3.284 -6.099 1.00 42.41 C ATOM 589 C LEU A 97 9.451 -2.669 -7.495 1.00 61.43 C ATOM 590 O LEU A 97 10.282 -3.006 -8.339 1.00 54.54 O ATOM 591 CB LEU A 97 10.297 -2.415 -5.155 1.00 33.41 C ATOM 592 CG LEU A 97 10.019 -0.913 -5.204 1.00 52.41 C ATOM 593 CD1 LEU A 97 8.736 -0.582 -4.457 1.00 23.14 C ATOM 594 CD2 LEU A 97 11.191 -0.134 -4.625 1.00 63.22 C ATOM 0 H LEU A 97 10.996 -4.709 -5.971 1.00 32.32 H new ATOM 0 HA LEU A 97 8.438 -3.329 -5.732 1.00 42.41 H new ATOM 0 HB2 LEU A 97 10.133 -2.761 -4.135 1.00 33.41 H new ATOM 0 HB3 LEU A 97 11.351 -2.577 -5.381 1.00 33.41 H new ATOM 0 HG LEU A 97 9.894 -0.621 -6.247 1.00 52.41 H new ATOM 0 HD11 LEU A 97 8.555 0.492 -4.503 1.00 23.14 H new ATOM 0 HD12 LEU A 97 7.901 -1.111 -4.916 1.00 23.14 H new ATOM 0 HD13 LEU A 97 8.832 -0.890 -3.416 1.00 23.14 H new ATOM 0 HD21 LEU A 97 10.975 0.934 -4.668 1.00 63.22 H new ATOM 0 HD22 LEU A 97 11.348 -0.431 -3.588 1.00 63.22 H new ATOM 0 HD23 LEU A 97 12.090 -0.346 -5.203 1.00 63.22 H new ATOM 606 N SER A 98 8.505 -1.766 -7.731 1.00 31.04 N ATOM 607 CA SER A 98 8.384 -1.106 -9.025 1.00 15.40 C ATOM 608 C SER A 98 8.045 0.372 -8.851 1.00 74.24 C ATOM 609 O SER A 98 6.915 0.726 -8.513 1.00 61.12 O ATOM 610 CB SER A 98 7.310 -1.791 -9.872 1.00 54.22 C ATOM 611 OG SER A 98 7.367 -1.354 -11.219 1.00 13.20 O ATOM 0 H SER A 98 7.811 -1.475 -7.043 1.00 31.04 H new ATOM 0 HA SER A 98 9.344 -1.183 -9.536 1.00 15.40 H new ATOM 0 HB2 SER A 98 7.445 -2.872 -9.831 1.00 54.22 H new ATOM 0 HB3 SER A 98 6.325 -1.577 -9.458 1.00 54.22 H new ATOM 0 HG SER A 98 8.213 -0.885 -11.375 1.00 13.20 H new ATOM 617 N VAL A 99 9.032 1.230 -9.086 1.00 11.54 N ATOM 618 CA VAL A 99 8.840 2.670 -8.957 1.00 13.03 C ATOM 619 C VAL A 99 8.596 3.316 -10.316 1.00 21.20 C ATOM 620 O VAL A 99 9.094 2.844 -11.338 1.00 41.14 O ATOM 621 CB VAL A 99 10.056 3.341 -8.292 1.00 44.43 C ATOM 622 CG1 VAL A 99 10.507 4.550 -9.099 1.00 75.42 C ATOM 623 CG2 VAL A 99 9.730 3.738 -6.860 1.00 73.24 C ATOM 0 H VAL A 99 9.973 0.953 -9.367 1.00 11.54 H new ATOM 0 HA VAL A 99 7.964 2.817 -8.326 1.00 13.03 H new ATOM 0 HB VAL A 99 10.876 2.623 -8.268 1.00 44.43 H new ATOM 0 HG11 VAL A 99 11.367 5.011 -8.614 1.00 75.42 H new ATOM 0 HG12 VAL A 99 10.784 4.233 -10.105 1.00 75.42 H new ATOM 0 HG13 VAL A 99 9.693 5.273 -9.158 1.00 75.42 H new ATOM 0 HG21 VAL A 99 10.601 4.211 -6.406 1.00 73.24 H new ATOM 0 HG22 VAL A 99 8.895 4.438 -6.858 1.00 73.24 H new ATOM 0 HG23 VAL A 99 9.460 2.850 -6.289 1.00 73.24 H new ATOM 633 N LYS A 100 7.827 4.399 -10.321 1.00 14.03 N ATOM 634 CA LYS A 100 7.517 5.113 -11.554 1.00 30.21 C ATOM 635 C LYS A 100 8.500 6.256 -11.782 1.00 41.42 C ATOM 636 O LYS A 100 8.784 7.035 -10.872 1.00 1.22 O ATOM 637 CB LYS A 100 6.087 5.657 -11.507 1.00 63.23 C ATOM 638 CG LYS A 100 5.772 6.636 -12.625 1.00 63.31 C ATOM 639 CD LYS A 100 4.294 6.985 -12.660 1.00 71.25 C ATOM 640 CE LYS A 100 3.909 7.648 -13.974 1.00 60.22 C ATOM 641 NZ LYS A 100 2.656 8.443 -13.848 1.00 5.20 N ATOM 0 H LYS A 100 7.406 4.802 -9.484 1.00 14.03 H new ATOM 0 HA LYS A 100 7.605 4.411 -12.383 1.00 30.21 H new ATOM 0 HB2 LYS A 100 5.388 4.822 -11.558 1.00 63.23 H new ATOM 0 HB3 LYS A 100 5.926 6.149 -10.548 1.00 63.23 H new ATOM 0 HG2 LYS A 100 6.358 7.545 -12.490 1.00 63.31 H new ATOM 0 HG3 LYS A 100 6.068 6.205 -13.581 1.00 63.31 H new ATOM 0 HD2 LYS A 100 3.702 6.080 -12.520 1.00 71.25 H new ATOM 0 HD3 LYS A 100 4.057 7.652 -11.831 1.00 71.25 H new ATOM 0 HE2 LYS A 100 4.720 8.298 -14.304 1.00 60.22 H new ATOM 0 HE3 LYS A 100 3.779 6.885 -14.741 1.00 60.22 H new ATOM 0 HZ1 LYS A 100 2.059 8.285 -14.685 1.00 5.20 H new ATOM 0 HZ2 LYS A 100 2.141 8.146 -12.995 1.00 5.20 H new ATOM 0 HZ3 LYS A 100 2.892 9.453 -13.776 1.00 5.20 H new ATOM 655 N PHE A 101 9.016 6.353 -13.003 1.00 73.42 N ATOM 656 CA PHE A 101 9.967 7.402 -13.351 1.00 31.20 C ATOM 657 C PHE A 101 9.601 8.048 -14.684 1.00 15.02 C ATOM 658 O PHE A 101 9.979 7.560 -15.748 1.00 21.13 O ATOM 659 CB PHE A 101 11.385 6.831 -13.421 1.00 10.44 C ATOM 660 CG PHE A 101 12.003 6.596 -12.072 1.00 60.51 C ATOM 661 CD1 PHE A 101 11.967 7.579 -11.097 1.00 13.10 C ATOM 662 CD2 PHE A 101 12.621 5.390 -11.780 1.00 11.21 C ATOM 663 CE1 PHE A 101 12.534 7.365 -9.855 1.00 2.11 C ATOM 664 CE2 PHE A 101 13.190 5.170 -10.540 1.00 14.43 C ATOM 665 CZ PHE A 101 13.147 6.159 -9.576 1.00 44.44 C ATOM 0 H PHE A 101 8.791 5.717 -13.768 1.00 73.42 H new ATOM 0 HA PHE A 101 9.928 8.166 -12.574 1.00 31.20 H new ATOM 0 HB2 PHE A 101 11.363 5.890 -13.971 1.00 10.44 H new ATOM 0 HB3 PHE A 101 12.017 7.516 -13.987 1.00 10.44 H new ATOM 0 HD1 PHE A 101 11.490 8.524 -11.310 1.00 13.10 H new ATOM 0 HD2 PHE A 101 12.658 4.614 -12.530 1.00 11.21 H new ATOM 0 HE1 PHE A 101 12.498 8.140 -9.103 1.00 2.11 H new ATOM 0 HE2 PHE A 101 13.668 4.226 -10.325 1.00 14.43 H new ATOM 0 HZ PHE A 101 13.592 5.989 -8.607 1.00 44.44 H new ATOM 675 N GLY A 102 8.860 9.150 -14.617 1.00 12.33 N ATOM 676 CA GLY A 102 8.453 9.846 -15.824 1.00 24.40 C ATOM 677 C GLY A 102 7.679 8.954 -16.774 1.00 32.32 C ATOM 678 O GLY A 102 6.511 8.649 -16.536 1.00 20.42 O ATOM 0 H GLY A 102 8.534 9.573 -13.748 1.00 12.33 H new ATOM 0 HA2 GLY A 102 7.838 10.705 -15.555 1.00 24.40 H new ATOM 0 HA3 GLY A 102 9.336 10.233 -16.332 1.00 24.40 H new ATOM 682 N ASN A 103 8.330 8.536 -17.854 1.00 71.15 N ATOM 683 CA ASN A 103 7.694 7.675 -18.845 1.00 54.42 C ATOM 684 C ASN A 103 8.341 6.294 -18.862 1.00 34.14 C ATOM 685 O ASN A 103 8.319 5.599 -19.878 1.00 32.13 O ATOM 686 CB ASN A 103 7.783 8.309 -20.235 1.00 3.52 C ATOM 687 CG ASN A 103 6.425 8.453 -20.894 1.00 11.14 C ATOM 688 OD1 ASN A 103 5.723 7.466 -21.116 1.00 10.43 O ATOM 689 ND2 ASN A 103 6.048 9.687 -21.210 1.00 23.34 N ATOM 0 H ASN A 103 9.298 8.779 -18.066 1.00 71.15 H new ATOM 0 HA ASN A 103 6.645 7.562 -18.571 1.00 54.42 H new ATOM 0 HB2 ASN A 103 8.250 9.290 -20.154 1.00 3.52 H new ATOM 0 HB3 ASN A 103 8.428 7.700 -20.868 1.00 3.52 H new ATOM 0 HD21 ASN A 103 5.144 9.846 -21.655 1.00 23.34 H new ATOM 0 HD22 ASN A 103 6.662 10.476 -21.007 1.00 23.34 H new ATOM 696 N ASP A 104 8.915 5.902 -17.730 1.00 1.33 N ATOM 697 CA ASP A 104 9.567 4.603 -17.613 1.00 1.24 C ATOM 698 C ASP A 104 9.375 4.023 -16.215 1.00 73.41 C ATOM 699 O ASP A 104 9.765 4.632 -15.219 1.00 60.11 O ATOM 700 CB ASP A 104 11.059 4.727 -17.926 1.00 10.31 C ATOM 701 CG ASP A 104 11.320 5.024 -19.390 1.00 25.45 C ATOM 702 OD1 ASP A 104 11.157 4.105 -20.220 1.00 24.33 O ATOM 703 OD2 ASP A 104 11.687 6.175 -19.705 1.00 64.40 O ATOM 0 H ASP A 104 8.942 6.465 -16.880 1.00 1.33 H new ATOM 0 HA ASP A 104 9.107 3.927 -18.334 1.00 1.24 H new ATOM 0 HB2 ASP A 104 11.491 5.519 -17.315 1.00 10.31 H new ATOM 0 HB3 ASP A 104 11.563 3.801 -17.650 1.00 10.31 H new ATOM 708 N VAL A 105 8.769 2.841 -16.149 1.00 24.03 N ATOM 709 CA VAL A 105 8.525 2.178 -14.874 1.00 30.35 C ATOM 710 C VAL A 105 9.669 1.235 -14.516 1.00 53.12 C ATOM 711 O VAL A 105 9.813 0.166 -15.109 1.00 54.42 O ATOM 712 CB VAL A 105 7.207 1.381 -14.899 1.00 12.43 C ATOM 713 CG1 VAL A 105 6.968 0.702 -13.559 1.00 74.10 C ATOM 714 CG2 VAL A 105 6.042 2.291 -15.260 1.00 2.02 C ATOM 0 H VAL A 105 8.438 2.324 -16.964 1.00 24.03 H new ATOM 0 HA VAL A 105 8.454 2.961 -14.119 1.00 30.35 H new ATOM 0 HB VAL A 105 7.285 0.607 -15.663 1.00 12.43 H new ATOM 0 HG11 VAL A 105 6.032 0.144 -13.596 1.00 74.10 H new ATOM 0 HG12 VAL A 105 7.790 0.019 -13.346 1.00 74.10 H new ATOM 0 HG13 VAL A 105 6.910 1.456 -12.774 1.00 74.10 H new ATOM 0 HG21 VAL A 105 5.119 1.712 -15.273 1.00 2.02 H new ATOM 0 HG22 VAL A 105 5.960 3.088 -14.521 1.00 2.02 H new ATOM 0 HG23 VAL A 105 6.212 2.726 -16.245 1.00 2.02 H new ATOM 724 N GLN A 106 10.479 1.639 -13.543 1.00 32.20 N ATOM 725 CA GLN A 106 11.610 0.829 -13.107 1.00 5.42 C ATOM 726 C GLN A 106 11.226 -0.050 -11.922 1.00 20.14 C ATOM 727 O GLN A 106 10.124 0.063 -11.383 1.00 24.20 O ATOM 728 CB GLN A 106 12.791 1.726 -12.730 1.00 12.32 C ATOM 729 CG GLN A 106 13.232 2.654 -13.850 1.00 42.02 C ATOM 730 CD GLN A 106 13.580 1.908 -15.123 1.00 72.41 C ATOM 731 OE1 GLN A 106 14.752 1.671 -15.418 1.00 11.54 O ATOM 732 NE2 GLN A 106 12.560 1.531 -15.886 1.00 43.32 N ATOM 0 H GLN A 106 10.373 2.521 -13.042 1.00 32.20 H new ATOM 0 HA GLN A 106 11.902 0.183 -13.935 1.00 5.42 H new ATOM 0 HB2 GLN A 106 12.519 2.324 -11.860 1.00 12.32 H new ATOM 0 HB3 GLN A 106 13.633 1.099 -12.436 1.00 12.32 H new ATOM 0 HG2 GLN A 106 12.436 3.369 -14.059 1.00 42.02 H new ATOM 0 HG3 GLN A 106 14.098 3.228 -13.521 1.00 42.02 H new ATOM 0 HE21 GLN A 106 11.604 1.748 -15.604 1.00 43.32 H new ATOM 0 HE22 GLN A 106 12.733 1.024 -16.754 1.00 43.32 H new ATOM 741 N HIS A 107 12.141 -0.927 -11.520 1.00 40.21 N ATOM 742 CA HIS A 107 11.898 -1.826 -10.398 1.00 34.12 C ATOM 743 C HIS A 107 13.212 -2.281 -9.771 1.00 1.53 C ATOM 744 O HIS A 107 14.281 -2.116 -10.358 1.00 65.54 O ATOM 745 CB HIS A 107 11.091 -3.041 -10.856 1.00 72.33 C ATOM 746 CG HIS A 107 11.204 -3.316 -12.324 1.00 63.32 C ATOM 747 ND1 HIS A 107 10.187 -3.880 -13.065 1.00 61.11 N ATOM 748 CD2 HIS A 107 12.223 -3.100 -13.189 1.00 74.13 C ATOM 749 CE1 HIS A 107 10.575 -4.000 -14.322 1.00 64.40 C ATOM 750 NE2 HIS A 107 11.807 -3.534 -14.424 1.00 51.11 N ATOM 0 H HIS A 107 13.057 -1.034 -11.955 1.00 40.21 H new ATOM 0 HA HIS A 107 11.327 -1.282 -9.646 1.00 34.12 H new ATOM 0 HB2 HIS A 107 11.426 -3.919 -10.303 1.00 72.33 H new ATOM 0 HB3 HIS A 107 10.042 -2.886 -10.603 1.00 72.33 H new ATOM 0 HD2 HIS A 107 13.184 -2.667 -12.952 1.00 74.13 H new ATOM 0 HE1 HIS A 107 9.985 -4.409 -15.129 1.00 64.40 H new ATOM 0 HE2 HIS A 107 12.360 -3.502 -15.281 1.00 51.11 H new ATOM 758 N PHE A 108 13.125 -2.852 -8.574 1.00 11.51 N ATOM 759 CA PHE A 108 14.308 -3.328 -7.866 1.00 74.02 C ATOM 760 C PHE A 108 14.093 -4.745 -7.341 1.00 44.33 C ATOM 761 O PHE A 108 13.091 -5.032 -6.687 1.00 72.10 O ATOM 762 CB PHE A 108 14.647 -2.389 -6.707 1.00 44.42 C ATOM 763 CG PHE A 108 14.879 -0.968 -7.135 1.00 52.34 C ATOM 764 CD1 PHE A 108 13.810 -0.131 -7.413 1.00 11.24 C ATOM 765 CD2 PHE A 108 16.165 -0.469 -7.261 1.00 45.03 C ATOM 766 CE1 PHE A 108 14.019 1.177 -7.807 1.00 3.45 C ATOM 767 CE2 PHE A 108 16.381 0.838 -7.654 1.00 50.44 C ATOM 768 CZ PHE A 108 15.307 1.662 -7.929 1.00 12.25 C ATOM 0 H PHE A 108 12.248 -2.996 -8.074 1.00 11.51 H new ATOM 0 HA PHE A 108 15.141 -3.342 -8.569 1.00 74.02 H new ATOM 0 HB2 PHE A 108 13.835 -2.413 -5.981 1.00 44.42 H new ATOM 0 HB3 PHE A 108 15.539 -2.758 -6.200 1.00 44.42 H new ATOM 0 HD1 PHE A 108 12.801 -0.506 -7.321 1.00 11.24 H new ATOM 0 HD2 PHE A 108 17.009 -1.109 -7.050 1.00 45.03 H new ATOM 0 HE1 PHE A 108 13.177 1.819 -8.019 1.00 3.45 H new ATOM 0 HE2 PHE A 108 17.389 1.215 -7.746 1.00 50.44 H new ATOM 0 HZ PHE A 108 15.474 2.683 -8.239 1.00 12.25 H new ATOM 778 N LYS A 109 15.043 -5.627 -7.633 1.00 73.25 N ATOM 779 CA LYS A 109 14.961 -7.014 -7.192 1.00 33.32 C ATOM 780 C LYS A 109 15.307 -7.135 -5.711 1.00 72.32 C ATOM 781 O LYS A 109 16.449 -6.910 -5.310 1.00 14.52 O ATOM 782 CB LYS A 109 15.902 -7.891 -8.020 1.00 25.41 C ATOM 783 CG LYS A 109 15.201 -8.662 -9.125 1.00 23.31 C ATOM 784 CD LYS A 109 14.875 -10.082 -8.694 1.00 20.33 C ATOM 785 CE LYS A 109 16.017 -11.037 -9.008 1.00 0.51 C ATOM 786 NZ LYS A 109 15.672 -12.445 -8.669 1.00 41.00 N ATOM 0 H LYS A 109 15.879 -5.405 -8.174 1.00 73.25 H new ATOM 0 HA LYS A 109 13.936 -7.355 -7.337 1.00 33.32 H new ATOM 0 HB2 LYS A 109 16.676 -7.263 -8.461 1.00 25.41 H new ATOM 0 HB3 LYS A 109 16.404 -8.597 -7.358 1.00 25.41 H new ATOM 0 HG2 LYS A 109 14.283 -8.146 -9.404 1.00 23.31 H new ATOM 0 HG3 LYS A 109 15.835 -8.686 -10.011 1.00 23.31 H new ATOM 0 HD2 LYS A 109 14.668 -10.100 -7.624 1.00 20.33 H new ATOM 0 HD3 LYS A 109 13.969 -10.418 -9.199 1.00 20.33 H new ATOM 0 HE2 LYS A 109 16.266 -10.969 -10.067 1.00 0.51 H new ATOM 0 HE3 LYS A 109 16.905 -10.737 -8.452 1.00 0.51 H new ATOM 0 HZ1 LYS A 109 16.476 -13.064 -8.898 1.00 41.00 H new ATOM 0 HZ2 LYS A 109 15.459 -12.515 -7.654 1.00 41.00 H new ATOM 0 HZ3 LYS A 109 14.840 -12.741 -9.219 1.00 41.00 H new ATOM 800 N VAL A 110 14.314 -7.494 -4.903 1.00 61.23 N ATOM 801 CA VAL A 110 14.515 -7.648 -3.467 1.00 54.23 C ATOM 802 C VAL A 110 15.103 -9.015 -3.138 1.00 20.03 C ATOM 803 O VAL A 110 14.606 -10.044 -3.597 1.00 62.22 O ATOM 804 CB VAL A 110 13.194 -7.469 -2.694 1.00 65.31 C ATOM 805 CG1 VAL A 110 13.395 -7.774 -1.217 1.00 70.44 C ATOM 806 CG2 VAL A 110 12.651 -6.062 -2.887 1.00 54.11 C ATOM 0 H VAL A 110 13.363 -7.684 -5.219 1.00 61.23 H new ATOM 0 HA VAL A 110 15.216 -6.872 -3.160 1.00 54.23 H new ATOM 0 HB VAL A 110 12.462 -8.173 -3.090 1.00 65.31 H new ATOM 0 HG11 VAL A 110 12.452 -7.642 -0.687 1.00 70.44 H new ATOM 0 HG12 VAL A 110 13.736 -8.803 -1.101 1.00 70.44 H new ATOM 0 HG13 VAL A 110 14.141 -7.096 -0.804 1.00 70.44 H new ATOM 0 HG21 VAL A 110 11.718 -5.953 -2.334 1.00 54.11 H new ATOM 0 HG22 VAL A 110 13.378 -5.338 -2.519 1.00 54.11 H new ATOM 0 HG23 VAL A 110 12.468 -5.885 -3.947 1.00 54.11 H new ATOM 816 N LEU A 111 16.164 -9.019 -2.339 1.00 22.04 N ATOM 817 CA LEU A 111 16.822 -10.261 -1.946 1.00 15.32 C ATOM 818 C LEU A 111 16.665 -10.510 -0.449 1.00 73.12 C ATOM 819 O LEU A 111 16.636 -9.571 0.347 1.00 65.51 O ATOM 820 CB LEU A 111 18.306 -10.214 -2.314 1.00 15.21 C ATOM 821 CG LEU A 111 18.656 -10.633 -3.742 1.00 25.22 C ATOM 822 CD1 LEU A 111 18.372 -9.500 -4.716 1.00 25.50 C ATOM 823 CD2 LEU A 111 20.114 -11.061 -3.829 1.00 22.11 C ATOM 0 H LEU A 111 16.587 -8.176 -1.950 1.00 22.04 H new ATOM 0 HA LEU A 111 16.347 -11.081 -2.484 1.00 15.32 H new ATOM 0 HB2 LEU A 111 18.667 -9.198 -2.156 1.00 15.21 H new ATOM 0 HB3 LEU A 111 18.852 -10.857 -1.624 1.00 15.21 H new ATOM 0 HG LEU A 111 18.031 -11.483 -4.015 1.00 25.22 H new ATOM 0 HD11 LEU A 111 18.627 -9.817 -5.727 1.00 25.50 H new ATOM 0 HD12 LEU A 111 17.314 -9.240 -4.673 1.00 25.50 H new ATOM 0 HD13 LEU A 111 18.971 -8.630 -4.446 1.00 25.50 H new ATOM 0 HD21 LEU A 111 20.346 -11.356 -4.852 1.00 22.11 H new ATOM 0 HD22 LEU A 111 20.755 -10.230 -3.537 1.00 22.11 H new ATOM 0 HD23 LEU A 111 20.286 -11.904 -3.160 1.00 22.11 H new ATOM 835 N ARG A 112 16.565 -11.781 -0.074 1.00 22.04 N ATOM 836 CA ARG A 112 16.413 -12.154 1.328 1.00 55.15 C ATOM 837 C ARG A 112 17.118 -13.475 1.618 1.00 34.54 C ATOM 838 O ARG A 112 17.375 -14.266 0.710 1.00 21.15 O ATOM 839 CB ARG A 112 14.930 -12.264 1.689 1.00 3.25 C ATOM 840 CG ARG A 112 14.218 -13.414 0.997 1.00 71.02 C ATOM 841 CD ARG A 112 13.005 -12.930 0.218 1.00 41.24 C ATOM 842 NE ARG A 112 11.761 -13.150 0.950 1.00 74.05 N ATOM 843 CZ ARG A 112 11.250 -14.353 1.185 1.00 33.31 C ATOM 844 NH1 ARG A 112 11.873 -15.439 0.749 1.00 24.01 N ATOM 845 NH2 ARG A 112 10.113 -14.472 1.859 1.00 73.43 N ATOM 0 H ARG A 112 16.586 -12.570 -0.721 1.00 22.04 H new ATOM 0 HA ARG A 112 16.872 -11.376 1.938 1.00 55.15 H new ATOM 0 HB2 ARG A 112 14.836 -12.386 2.768 1.00 3.25 H new ATOM 0 HB3 ARG A 112 14.431 -11.330 1.429 1.00 3.25 H new ATOM 0 HG2 ARG A 112 14.909 -13.917 0.321 1.00 71.02 H new ATOM 0 HG3 ARG A 112 13.906 -14.149 1.739 1.00 71.02 H new ATOM 0 HD2 ARG A 112 13.114 -11.868 0.000 1.00 41.24 H new ATOM 0 HD3 ARG A 112 12.959 -13.449 -0.740 1.00 41.24 H new ATOM 0 HE ARG A 112 11.257 -12.335 1.300 1.00 74.05 H new ATOM 0 HH11 ARG A 112 12.748 -15.352 0.231 1.00 24.01 H new ATOM 0 HH12 ARG A 112 11.478 -16.361 0.931 1.00 24.01 H new ATOM 0 HH21 ARG A 112 9.631 -13.639 2.197 1.00 73.43 H new ATOM 0 HH22 ARG A 112 9.721 -15.396 2.039 1.00 73.43 H new ATOM 859 N ASP A 113 17.427 -13.708 2.889 1.00 1.42 N ATOM 860 CA ASP A 113 18.102 -14.933 3.300 1.00 31.42 C ATOM 861 C ASP A 113 17.099 -15.957 3.822 1.00 74.31 C ATOM 862 O ASP A 113 15.890 -15.729 3.791 1.00 1.44 O ATOM 863 CB ASP A 113 19.146 -14.630 4.376 1.00 51.01 C ATOM 864 CG ASP A 113 20.402 -15.464 4.215 1.00 13.05 C ATOM 865 OD1 ASP A 113 20.692 -15.888 3.077 1.00 55.22 O ATOM 866 OD2 ASP A 113 21.095 -15.692 5.228 1.00 23.13 O ATOM 0 H ASP A 113 17.221 -13.064 3.653 1.00 1.42 H new ATOM 0 HA ASP A 113 18.602 -15.353 2.427 1.00 31.42 H new ATOM 0 HB2 ASP A 113 19.408 -13.573 4.337 1.00 51.01 H new ATOM 0 HB3 ASP A 113 18.714 -14.815 5.360 1.00 51.01 H new ATOM 871 N GLY A 114 17.609 -17.088 4.300 1.00 71.32 N ATOM 872 CA GLY A 114 16.744 -18.131 4.820 1.00 12.11 C ATOM 873 C GLY A 114 16.359 -17.896 6.267 1.00 30.44 C ATOM 874 O GLY A 114 16.215 -18.844 7.040 1.00 43.43 O ATOM 0 H GLY A 114 18.606 -17.301 4.336 1.00 71.32 H new ATOM 0 HA2 GLY A 114 15.841 -18.187 4.212 1.00 12.11 H new ATOM 0 HA3 GLY A 114 17.248 -19.094 4.733 1.00 12.11 H new ATOM 878 N ALA A 115 16.193 -16.630 6.636 1.00 23.43 N ATOM 879 CA ALA A 115 15.823 -16.274 8.000 1.00 33.54 C ATOM 880 C ALA A 115 14.642 -15.309 8.014 1.00 21.54 C ATOM 881 O ALA A 115 13.698 -15.480 8.785 1.00 50.54 O ATOM 882 CB ALA A 115 17.012 -15.667 8.729 1.00 43.11 C ATOM 0 H ALA A 115 16.309 -15.834 6.009 1.00 23.43 H new ATOM 0 HA ALA A 115 15.521 -17.185 8.517 1.00 33.54 H new ATOM 0 HB1 ALA A 115 16.720 -15.406 9.746 1.00 43.11 H new ATOM 0 HB2 ALA A 115 17.828 -16.389 8.759 1.00 43.11 H new ATOM 0 HB3 ALA A 115 17.341 -14.770 8.205 1.00 43.11 H new ATOM 888 N GLY A 116 14.703 -14.295 7.157 1.00 14.33 N ATOM 889 CA GLY A 116 13.632 -13.317 7.088 1.00 4.05 C ATOM 890 C GLY A 116 14.150 -11.894 7.026 1.00 4.21 C ATOM 891 O GLY A 116 13.500 -10.966 7.508 1.00 31.31 O ATOM 0 H GLY A 116 15.474 -14.133 6.509 1.00 14.33 H new ATOM 0 HA2 GLY A 116 13.019 -13.516 6.209 1.00 4.05 H new ATOM 0 HA3 GLY A 116 12.986 -13.428 7.959 1.00 4.05 H new ATOM 895 N LYS A 117 15.326 -11.719 6.432 1.00 22.42 N ATOM 896 CA LYS A 117 15.933 -10.399 6.308 1.00 31.33 C ATOM 897 C LYS A 117 15.983 -9.959 4.849 1.00 44.51 C ATOM 898 O LYS A 117 16.356 -10.735 3.969 1.00 40.54 O ATOM 899 CB LYS A 117 17.345 -10.407 6.899 1.00 13.20 C ATOM 900 CG LYS A 117 17.375 -10.205 8.404 1.00 23.32 C ATOM 901 CD LYS A 117 17.270 -11.527 9.146 1.00 31.20 C ATOM 902 CE LYS A 117 16.362 -11.413 10.361 1.00 23.53 C ATOM 903 NZ LYS A 117 17.037 -10.723 11.495 1.00 42.42 N ATOM 0 H LYS A 117 15.878 -12.476 6.029 1.00 22.42 H new ATOM 0 HA LYS A 117 15.318 -9.690 6.862 1.00 31.33 H new ATOM 0 HB2 LYS A 117 17.825 -11.355 6.658 1.00 13.20 H new ATOM 0 HB3 LYS A 117 17.933 -9.622 6.424 1.00 13.20 H new ATOM 0 HG2 LYS A 117 18.299 -9.701 8.686 1.00 23.32 H new ATOM 0 HG3 LYS A 117 16.553 -9.554 8.701 1.00 23.32 H new ATOM 0 HD2 LYS A 117 16.885 -12.294 8.473 1.00 31.20 H new ATOM 0 HD3 LYS A 117 18.263 -11.849 9.461 1.00 31.20 H new ATOM 0 HE2 LYS A 117 15.459 -10.867 10.089 1.00 23.53 H new ATOM 0 HE3 LYS A 117 16.050 -12.409 10.676 1.00 23.53 H new ATOM 0 HZ1 LYS A 117 16.385 -10.665 12.304 1.00 42.42 H new ATOM 0 HZ2 LYS A 117 17.885 -11.258 11.771 1.00 42.42 H new ATOM 0 HZ3 LYS A 117 17.312 -9.764 11.203 1.00 42.42 H new ATOM 917 N TYR A 118 15.608 -8.709 4.600 1.00 51.01 N ATOM 918 CA TYR A 118 15.610 -8.166 3.247 1.00 54.41 C ATOM 919 C TYR A 118 16.837 -7.290 3.013 1.00 61.41 C ATOM 920 O TYR A 118 17.461 -6.810 3.959 1.00 2.13 O ATOM 921 CB TYR A 118 14.337 -7.355 2.999 1.00 55.13 C ATOM 922 CG TYR A 118 13.096 -8.206 2.852 1.00 75.00 C ATOM 923 CD1 TYR A 118 12.958 -9.090 1.789 1.00 74.12 C ATOM 924 CD2 TYR A 118 12.061 -8.126 3.775 1.00 13.34 C ATOM 925 CE1 TYR A 118 11.825 -9.869 1.650 1.00 24.41 C ATOM 926 CE2 TYR A 118 10.926 -8.902 3.645 1.00 35.15 C ATOM 927 CZ TYR A 118 10.812 -9.772 2.581 1.00 24.22 C ATOM 928 OH TYR A 118 9.683 -10.546 2.447 1.00 34.35 O ATOM 0 H TYR A 118 15.299 -8.053 5.317 1.00 51.01 H new ATOM 0 HA TYR A 118 15.644 -9.001 2.548 1.00 54.41 H new ATOM 0 HB2 TYR A 118 14.194 -6.658 3.825 1.00 55.13 H new ATOM 0 HB3 TYR A 118 14.467 -6.758 2.097 1.00 55.13 H new ATOM 0 HD1 TYR A 118 13.750 -9.170 1.059 1.00 74.12 H new ATOM 0 HD2 TYR A 118 12.145 -7.445 4.609 1.00 13.34 H new ATOM 0 HE1 TYR A 118 11.733 -10.550 0.817 1.00 24.41 H new ATOM 0 HE2 TYR A 118 10.132 -8.828 4.373 1.00 35.15 H new ATOM 0 HH TYR A 118 9.034 -10.082 1.877 1.00 34.35 H new ATOM 938 N PHE A 119 17.178 -7.087 1.745 1.00 55.05 N ATOM 939 CA PHE A 119 18.330 -6.270 1.384 1.00 43.01 C ATOM 940 C PHE A 119 18.372 -6.023 -0.121 1.00 65.13 C ATOM 941 O PHE A 119 17.887 -6.836 -0.909 1.00 51.12 O ATOM 942 CB PHE A 119 19.625 -6.948 1.837 1.00 33.24 C ATOM 943 CG PHE A 119 19.484 -8.429 2.046 1.00 64.14 C ATOM 944 CD1 PHE A 119 19.320 -9.281 0.966 1.00 74.42 C ATOM 945 CD2 PHE A 119 19.517 -8.969 3.321 1.00 12.34 C ATOM 946 CE1 PHE A 119 19.191 -10.645 1.154 1.00 55.31 C ATOM 947 CE2 PHE A 119 19.389 -10.331 3.516 1.00 73.14 C ATOM 948 CZ PHE A 119 19.224 -11.170 2.431 1.00 41.13 C ATOM 0 H PHE A 119 16.672 -7.477 0.950 1.00 55.05 H new ATOM 0 HA PHE A 119 18.235 -5.309 1.890 1.00 43.01 H new ATOM 0 HB2 PHE A 119 20.401 -6.766 1.093 1.00 33.24 H new ATOM 0 HB3 PHE A 119 19.961 -6.488 2.766 1.00 33.24 H new ATOM 0 HD1 PHE A 119 19.293 -8.875 -0.034 1.00 74.42 H new ATOM 0 HD2 PHE A 119 19.644 -8.318 4.173 1.00 12.34 H new ATOM 0 HE1 PHE A 119 19.065 -11.299 0.304 1.00 55.31 H new ATOM 0 HE2 PHE A 119 19.418 -10.739 4.516 1.00 73.14 H new ATOM 0 HZ PHE A 119 19.121 -12.235 2.581 1.00 41.13 H new ATOM 958 N LEU A 120 18.956 -4.896 -0.514 1.00 14.24 N ATOM 959 CA LEU A 120 19.062 -4.540 -1.924 1.00 55.03 C ATOM 960 C LEU A 120 20.306 -3.696 -2.181 1.00 62.42 C ATOM 961 O LEU A 120 21.323 -4.202 -2.657 1.00 10.32 O ATOM 962 CB LEU A 120 17.814 -3.778 -2.374 1.00 35.05 C ATOM 963 CG LEU A 120 16.537 -4.607 -2.519 1.00 30.11 C ATOM 964 CD1 LEU A 120 15.785 -4.665 -1.198 1.00 52.14 C ATOM 965 CD2 LEU A 120 15.651 -4.034 -3.615 1.00 54.10 C ATOM 0 H LEU A 120 19.363 -4.213 0.125 1.00 14.24 H new ATOM 0 HA LEU A 120 19.145 -5.462 -2.500 1.00 55.03 H new ATOM 0 HB2 LEU A 120 17.624 -2.977 -1.659 1.00 35.05 H new ATOM 0 HB3 LEU A 120 18.027 -3.305 -3.333 1.00 35.05 H new ATOM 0 HG LEU A 120 16.816 -5.623 -2.799 1.00 30.11 H new ATOM 0 HD11 LEU A 120 14.879 -5.259 -1.321 1.00 52.14 H new ATOM 0 HD12 LEU A 120 16.419 -5.122 -0.438 1.00 52.14 H new ATOM 0 HD13 LEU A 120 15.517 -3.655 -0.887 1.00 52.14 H new ATOM 0 HD21 LEU A 120 14.747 -4.636 -3.704 1.00 54.10 H new ATOM 0 HD22 LEU A 120 15.380 -3.008 -3.365 1.00 54.10 H new ATOM 0 HD23 LEU A 120 16.190 -4.046 -4.562 1.00 54.10 H new ATOM 977 N TRP A 121 20.219 -2.410 -1.862 1.00 31.45 N ATOM 978 CA TRP A 121 21.339 -1.497 -2.056 1.00 23.12 C ATOM 979 C TRP A 121 22.238 -1.469 -0.825 1.00 3.24 C ATOM 980 O TRP A 121 22.034 -0.667 0.087 1.00 31.11 O ATOM 981 CB TRP A 121 20.828 -0.088 -2.362 1.00 24.31 C ATOM 982 CG TRP A 121 20.275 0.055 -3.747 1.00 72.24 C ATOM 983 CD1 TRP A 121 18.987 0.354 -4.088 1.00 75.44 C ATOM 984 CD2 TRP A 121 20.992 -0.097 -4.977 1.00 25.11 C ATOM 985 NE1 TRP A 121 18.860 0.397 -5.456 1.00 22.30 N ATOM 986 CE2 TRP A 121 20.077 0.125 -6.024 1.00 34.40 C ATOM 987 CE3 TRP A 121 22.320 -0.397 -5.295 1.00 53.43 C ATOM 988 CZ2 TRP A 121 20.447 0.054 -7.364 1.00 44.51 C ATOM 989 CZ3 TRP A 121 22.686 -0.466 -6.626 1.00 21.11 C ATOM 990 CH2 TRP A 121 21.753 -0.241 -7.647 1.00 3.30 C ATOM 0 H TRP A 121 19.384 -1.976 -1.468 1.00 31.45 H new ATOM 0 HA TRP A 121 21.925 -1.855 -2.902 1.00 23.12 H new ATOM 0 HB2 TRP A 121 20.054 0.175 -1.641 1.00 24.31 H new ATOM 0 HB3 TRP A 121 21.643 0.623 -2.229 1.00 24.31 H new ATOM 0 HD1 TRP A 121 18.186 0.531 -3.386 1.00 75.44 H new ATOM 0 HE1 TRP A 121 18.000 0.599 -5.966 1.00 22.30 H new ATOM 0 HE3 TRP A 121 23.046 -0.572 -4.515 1.00 53.43 H new ATOM 0 HZ2 TRP A 121 19.729 0.226 -8.152 1.00 44.51 H new ATOM 0 HZ3 TRP A 121 23.709 -0.697 -6.884 1.00 21.11 H new ATOM 0 HH2 TRP A 121 22.071 -0.302 -8.677 1.00 3.30 H new ATOM 1001 N VAL A 122 23.235 -2.348 -0.804 1.00 73.52 N ATOM 1002 CA VAL A 122 24.166 -2.423 0.315 1.00 10.11 C ATOM 1003 C VAL A 122 23.469 -2.102 1.632 1.00 33.34 C ATOM 1004 O VAL A 122 24.070 -1.534 2.544 1.00 44.34 O ATOM 1005 CB VAL A 122 25.350 -1.456 0.125 1.00 21.32 C ATOM 1006 CG1 VAL A 122 26.216 -1.896 -1.046 1.00 11.24 C ATOM 1007 CG2 VAL A 122 24.849 -0.034 -0.076 1.00 3.03 C ATOM 0 H VAL A 122 23.418 -3.019 -1.550 1.00 73.52 H new ATOM 0 HA VAL A 122 24.542 -3.446 0.346 1.00 10.11 H new ATOM 0 HB VAL A 122 25.962 -1.477 1.026 1.00 21.32 H new ATOM 0 HG11 VAL A 122 27.047 -1.201 -1.165 1.00 11.24 H new ATOM 0 HG12 VAL A 122 26.604 -2.897 -0.856 1.00 11.24 H new ATOM 0 HG13 VAL A 122 25.618 -1.906 -1.957 1.00 11.24 H new ATOM 0 HG21 VAL A 122 25.699 0.636 -0.209 1.00 3.03 H new ATOM 0 HG22 VAL A 122 24.214 0.006 -0.961 1.00 3.03 H new ATOM 0 HG23 VAL A 122 24.275 0.276 0.797 1.00 3.03 H new ATOM 1017 N VAL A 123 22.195 -2.472 1.727 1.00 42.52 N ATOM 1018 CA VAL A 123 21.415 -2.225 2.934 1.00 62.04 C ATOM 1019 C VAL A 123 20.565 -3.438 3.296 1.00 50.43 C ATOM 1020 O VAL A 123 20.112 -4.176 2.421 1.00 53.22 O ATOM 1021 CB VAL A 123 20.497 -0.999 2.768 1.00 24.21 C ATOM 1022 CG1 VAL A 123 19.389 -1.293 1.769 1.00 41.15 C ATOM 1023 CG2 VAL A 123 19.918 -0.582 4.112 1.00 62.54 C ATOM 0 H VAL A 123 21.682 -2.944 0.982 1.00 42.52 H new ATOM 0 HA VAL A 123 22.126 -2.031 3.737 1.00 62.04 H new ATOM 0 HB VAL A 123 21.091 -0.171 2.381 1.00 24.21 H new ATOM 0 HG11 VAL A 123 18.751 -0.416 1.665 1.00 41.15 H new ATOM 0 HG12 VAL A 123 19.827 -1.540 0.802 1.00 41.15 H new ATOM 0 HG13 VAL A 123 18.794 -2.135 2.123 1.00 41.15 H new ATOM 0 HG21 VAL A 123 19.272 0.285 3.977 1.00 62.54 H new ATOM 0 HG22 VAL A 123 19.338 -1.405 4.529 1.00 62.54 H new ATOM 0 HG23 VAL A 123 20.729 -0.327 4.794 1.00 62.54 H new ATOM 1033 N LYS A 124 20.351 -3.638 4.592 1.00 44.33 N ATOM 1034 CA LYS A 124 19.554 -4.760 5.072 1.00 53.11 C ATOM 1035 C LYS A 124 18.434 -4.278 5.989 1.00 20.51 C ATOM 1036 O LYS A 124 18.472 -3.157 6.495 1.00 12.24 O ATOM 1037 CB LYS A 124 20.441 -5.762 5.815 1.00 54.24 C ATOM 1038 CG LYS A 124 21.771 -6.022 5.129 1.00 12.40 C ATOM 1039 CD LYS A 124 22.803 -6.564 6.103 1.00 45.11 C ATOM 1040 CE LYS A 124 23.848 -5.514 6.450 1.00 52.12 C ATOM 1041 NZ LYS A 124 24.124 -5.468 7.912 1.00 34.04 N ATOM 0 H LYS A 124 20.719 -3.037 5.329 1.00 44.33 H new ATOM 0 HA LYS A 124 19.107 -5.252 4.208 1.00 53.11 H new ATOM 0 HB2 LYS A 124 20.628 -5.392 6.823 1.00 54.24 H new ATOM 0 HB3 LYS A 124 19.904 -6.705 5.916 1.00 54.24 H new ATOM 0 HG2 LYS A 124 21.629 -6.733 4.315 1.00 12.40 H new ATOM 0 HG3 LYS A 124 22.139 -5.097 4.684 1.00 12.40 H new ATOM 0 HD2 LYS A 124 22.305 -6.898 7.013 1.00 45.11 H new ATOM 0 HD3 LYS A 124 23.292 -7.436 5.669 1.00 45.11 H new ATOM 0 HE2 LYS A 124 24.772 -5.730 5.913 1.00 52.12 H new ATOM 0 HE3 LYS A 124 23.505 -4.535 6.114 1.00 52.12 H new ATOM 0 HZ1 LYS A 124 24.841 -4.740 8.107 1.00 34.04 H new ATOM 0 HZ2 LYS A 124 23.248 -5.237 8.424 1.00 34.04 H new ATOM 0 HZ3 LYS A 124 24.476 -6.394 8.228 1.00 34.04 H new ATOM 1055 N PHE A 125 17.439 -5.134 6.200 1.00 41.10 N ATOM 1056 CA PHE A 125 16.309 -4.796 7.057 1.00 11.40 C ATOM 1057 C PHE A 125 15.643 -6.056 7.602 1.00 4.13 C ATOM 1058 O PHE A 125 16.061 -7.172 7.298 1.00 60.22 O ATOM 1059 CB PHE A 125 15.287 -3.960 6.283 1.00 1.34 C ATOM 1060 CG PHE A 125 15.450 -2.480 6.481 1.00 2.23 C ATOM 1061 CD1 PHE A 125 15.391 -1.927 7.750 1.00 4.43 C ATOM 1062 CD2 PHE A 125 15.663 -1.642 5.399 1.00 51.15 C ATOM 1063 CE1 PHE A 125 15.540 -0.565 7.935 1.00 24.10 C ATOM 1064 CE2 PHE A 125 15.813 -0.280 5.577 1.00 0.51 C ATOM 1065 CZ PHE A 125 15.753 0.259 6.847 1.00 13.33 C ATOM 0 H PHE A 125 17.393 -6.066 5.789 1.00 41.10 H new ATOM 0 HA PHE A 125 16.685 -4.212 7.897 1.00 11.40 H new ATOM 0 HB2 PHE A 125 15.373 -4.188 5.221 1.00 1.34 H new ATOM 0 HB3 PHE A 125 14.283 -4.251 6.591 1.00 1.34 H new ATOM 0 HD1 PHE A 125 15.227 -2.567 8.604 1.00 4.43 H new ATOM 0 HD2 PHE A 125 15.712 -2.058 4.404 1.00 51.15 H new ATOM 0 HE1 PHE A 125 15.490 -0.146 8.929 1.00 24.10 H new ATOM 0 HE2 PHE A 125 15.977 0.362 4.724 1.00 0.51 H new ATOM 0 HZ PHE A 125 15.872 1.323 6.989 1.00 13.33 H new ATOM 1075 N ASN A 126 14.606 -5.867 8.411 1.00 74.32 N ATOM 1076 CA ASN A 126 13.882 -6.988 9.000 1.00 23.22 C ATOM 1077 C ASN A 126 12.667 -7.357 8.154 1.00 4.22 C ATOM 1078 O ASN A 126 12.298 -8.527 8.056 1.00 25.10 O ATOM 1079 CB ASN A 126 13.441 -6.645 10.424 1.00 32.04 C ATOM 1080 CG ASN A 126 14.509 -5.893 11.195 1.00 33.55 C ATOM 1081 OD1 ASN A 126 15.670 -6.300 11.226 1.00 63.40 O ATOM 1082 ND2 ASN A 126 14.119 -4.790 11.824 1.00 72.44 N ATOM 0 H ASN A 126 14.248 -4.949 8.674 1.00 74.32 H new ATOM 0 HA ASN A 126 14.554 -7.846 9.031 1.00 23.22 H new ATOM 0 HB2 ASN A 126 12.533 -6.043 10.385 1.00 32.04 H new ATOM 0 HB3 ASN A 126 13.192 -7.563 10.955 1.00 32.04 H new ATOM 0 HD21 ASN A 126 14.793 -4.243 12.360 1.00 72.44 H new ATOM 0 HD22 ASN A 126 13.146 -4.490 11.771 1.00 72.44 H new ATOM 1089 N SER A 127 12.050 -6.350 7.544 1.00 1.14 N ATOM 1090 CA SER A 127 10.875 -6.567 6.709 1.00 31.20 C ATOM 1091 C SER A 127 10.884 -5.631 5.505 1.00 53.53 C ATOM 1092 O SER A 127 11.833 -4.873 5.300 1.00 52.52 O ATOM 1093 CB SER A 127 9.598 -6.356 7.524 1.00 35.21 C ATOM 1094 OG SER A 127 8.952 -7.590 7.788 1.00 15.53 O ATOM 0 H SER A 127 12.345 -5.376 7.613 1.00 1.14 H new ATOM 0 HA SER A 127 10.901 -7.595 6.348 1.00 31.20 H new ATOM 0 HB2 SER A 127 9.840 -5.860 8.464 1.00 35.21 H new ATOM 0 HB3 SER A 127 8.921 -5.696 6.981 1.00 35.21 H new ATOM 0 HG SER A 127 8.140 -7.428 8.312 1.00 15.53 H new ATOM 1100 N LEU A 128 9.820 -5.688 4.711 1.00 64.54 N ATOM 1101 CA LEU A 128 9.704 -4.846 3.525 1.00 12.24 C ATOM 1102 C LEU A 128 9.383 -3.405 3.911 1.00 64.21 C ATOM 1103 O LEU A 128 9.975 -2.465 3.383 1.00 51.24 O ATOM 1104 CB LEU A 128 8.619 -5.390 2.594 1.00 45.44 C ATOM 1105 CG LEU A 128 8.925 -6.725 1.915 1.00 25.42 C ATOM 1106 CD1 LEU A 128 7.728 -7.200 1.106 1.00 3.13 C ATOM 1107 CD2 LEU A 128 10.156 -6.604 1.029 1.00 42.35 C ATOM 0 H LEU A 128 9.025 -6.308 4.867 1.00 64.54 H new ATOM 0 HA LEU A 128 10.661 -4.859 3.004 1.00 12.24 H new ATOM 0 HB2 LEU A 128 7.698 -5.499 3.167 1.00 45.44 H new ATOM 0 HB3 LEU A 128 8.427 -4.647 1.820 1.00 45.44 H new ATOM 0 HG LEU A 128 9.131 -7.465 2.689 1.00 25.42 H new ATOM 0 HD11 LEU A 128 7.965 -8.152 0.630 1.00 3.13 H new ATOM 0 HD12 LEU A 128 6.870 -7.328 1.766 1.00 3.13 H new ATOM 0 HD13 LEU A 128 7.490 -6.461 0.341 1.00 3.13 H new ATOM 0 HD21 LEU A 128 10.358 -7.564 0.554 1.00 42.35 H new ATOM 0 HD22 LEU A 128 9.980 -5.850 0.262 1.00 42.35 H new ATOM 0 HD23 LEU A 128 11.013 -6.311 1.635 1.00 42.35 H new ATOM 1119 N ASN A 129 8.444 -3.241 4.837 1.00 3.20 N ATOM 1120 CA ASN A 129 8.046 -1.915 5.295 1.00 44.51 C ATOM 1121 C ASN A 129 9.269 -1.061 5.619 1.00 20.41 C ATOM 1122 O ASN A 129 9.371 0.084 5.183 1.00 44.45 O ATOM 1123 CB ASN A 129 7.147 -2.026 6.528 1.00 62.42 C ATOM 1124 CG ASN A 129 7.611 -3.106 7.486 1.00 63.42 C ATOM 1125 OD1 ASN A 129 8.545 -2.904 8.262 1.00 44.13 O ATOM 1126 ND2 ASN A 129 6.959 -4.262 7.435 1.00 11.03 N ATOM 0 H ASN A 129 7.945 -4.009 5.285 1.00 3.20 H new ATOM 0 HA ASN A 129 7.490 -1.433 4.491 1.00 44.51 H new ATOM 0 HB2 ASN A 129 7.127 -1.068 7.047 1.00 62.42 H new ATOM 0 HB3 ASN A 129 6.126 -2.239 6.212 1.00 62.42 H new ATOM 0 HD21 ASN A 129 7.227 -5.026 8.055 1.00 11.03 H new ATOM 0 HD22 ASN A 129 6.190 -4.385 6.776 1.00 11.03 H new ATOM 1133 N GLU A 130 10.193 -1.630 6.387 1.00 5.52 N ATOM 1134 CA GLU A 130 11.409 -0.920 6.770 1.00 71.53 C ATOM 1135 C GLU A 130 12.230 -0.545 5.539 1.00 20.43 C ATOM 1136 O GLU A 130 13.033 0.388 5.576 1.00 64.44 O ATOM 1137 CB GLU A 130 12.251 -1.779 7.716 1.00 73.33 C ATOM 1138 CG GLU A 130 11.506 -2.217 8.965 1.00 35.44 C ATOM 1139 CD GLU A 130 12.042 -1.563 10.224 1.00 54.12 C ATOM 1140 OE1 GLU A 130 11.578 -0.452 10.557 1.00 23.15 O ATOM 1141 OE2 GLU A 130 12.924 -2.161 10.874 1.00 11.45 O ATOM 0 H GLU A 130 10.123 -2.578 6.756 1.00 5.52 H new ATOM 0 HA GLU A 130 11.118 -0.004 7.285 1.00 71.53 H new ATOM 0 HB2 GLU A 130 12.596 -2.663 7.180 1.00 73.33 H new ATOM 0 HB3 GLU A 130 13.138 -1.218 8.010 1.00 73.33 H new ATOM 0 HG2 GLU A 130 10.449 -1.975 8.856 1.00 35.44 H new ATOM 0 HG3 GLU A 130 11.577 -3.300 9.064 1.00 35.44 H new ATOM 1148 N LEU A 131 12.023 -1.279 4.451 1.00 22.14 N ATOM 1149 CA LEU A 131 12.744 -1.025 3.209 1.00 70.12 C ATOM 1150 C LEU A 131 12.137 0.157 2.459 1.00 25.13 C ATOM 1151 O LEU A 131 12.817 1.146 2.184 1.00 61.21 O ATOM 1152 CB LEU A 131 12.725 -2.271 2.321 1.00 14.31 C ATOM 1153 CG LEU A 131 14.007 -2.558 1.539 1.00 0.24 C ATOM 1154 CD1 LEU A 131 14.698 -3.799 2.084 1.00 54.52 C ATOM 1155 CD2 LEU A 131 13.703 -2.721 0.057 1.00 31.43 C ATOM 0 H LEU A 131 11.362 -2.054 4.404 1.00 22.14 H new ATOM 0 HA LEU A 131 13.776 -0.781 3.460 1.00 70.12 H new ATOM 0 HB2 LEU A 131 12.504 -3.135 2.947 1.00 14.31 H new ATOM 0 HB3 LEU A 131 11.904 -2.174 1.611 1.00 14.31 H new ATOM 0 HG LEU A 131 14.681 -1.710 1.659 1.00 0.24 H new ATOM 0 HD11 LEU A 131 15.608 -3.988 1.515 1.00 54.52 H new ATOM 0 HD12 LEU A 131 14.951 -3.644 3.133 1.00 54.52 H new ATOM 0 HD13 LEU A 131 14.030 -4.656 1.995 1.00 54.52 H new ATOM 0 HD21 LEU A 131 14.627 -2.925 -0.484 1.00 31.43 H new ATOM 0 HD22 LEU A 131 13.010 -3.551 -0.083 1.00 31.43 H new ATOM 0 HD23 LEU A 131 13.254 -1.804 -0.325 1.00 31.43 H new ATOM 1167 N VAL A 132 10.853 0.049 2.134 1.00 62.54 N ATOM 1168 CA VAL A 132 10.154 1.110 1.419 1.00 34.51 C ATOM 1169 C VAL A 132 10.309 2.448 2.133 1.00 70.33 C ATOM 1170 O VAL A 132 10.282 3.505 1.503 1.00 12.42 O ATOM 1171 CB VAL A 132 8.654 0.791 1.269 1.00 1.13 C ATOM 1172 CG1 VAL A 132 8.457 -0.495 0.481 1.00 2.21 C ATOM 1173 CG2 VAL A 132 7.991 0.696 2.635 1.00 21.32 C ATOM 0 H VAL A 132 10.276 -0.762 2.354 1.00 62.54 H new ATOM 0 HA VAL A 132 10.605 1.176 0.429 1.00 34.51 H new ATOM 0 HB VAL A 132 8.181 1.603 0.716 1.00 1.13 H new ATOM 0 HG11 VAL A 132 7.391 -0.704 0.386 1.00 2.21 H new ATOM 0 HG12 VAL A 132 8.895 -0.385 -0.511 1.00 2.21 H new ATOM 0 HG13 VAL A 132 8.943 -1.320 1.003 1.00 2.21 H new ATOM 0 HG21 VAL A 132 6.932 0.470 2.510 1.00 21.32 H new ATOM 0 HG22 VAL A 132 8.465 -0.096 3.215 1.00 21.32 H new ATOM 0 HG23 VAL A 132 8.100 1.645 3.159 1.00 21.32 H new ATOM 1183 N ASP A 133 10.472 2.394 3.450 1.00 63.11 N ATOM 1184 CA ASP A 133 10.634 3.602 4.250 1.00 11.23 C ATOM 1185 C ASP A 133 12.022 4.203 4.053 1.00 23.23 C ATOM 1186 O ASP A 133 12.159 5.347 3.619 1.00 31.22 O ATOM 1187 CB ASP A 133 10.403 3.294 5.731 1.00 64.45 C ATOM 1188 CG ASP A 133 10.056 4.532 6.533 1.00 54.13 C ATOM 1189 OD1 ASP A 133 8.929 5.045 6.372 1.00 13.41 O ATOM 1190 OD2 ASP A 133 10.911 4.989 7.321 1.00 75.34 O ATOM 0 H ASP A 133 10.495 1.527 3.986 1.00 63.11 H new ATOM 0 HA ASP A 133 9.893 4.329 3.918 1.00 11.23 H new ATOM 0 HB2 ASP A 133 9.598 2.566 5.826 1.00 64.45 H new ATOM 0 HB3 ASP A 133 11.299 2.834 6.147 1.00 64.45 H new ATOM 1195 N TYR A 134 13.049 3.424 4.376 1.00 1.42 N ATOM 1196 CA TYR A 134 14.427 3.881 4.238 1.00 21.42 C ATOM 1197 C TYR A 134 14.621 4.639 2.929 1.00 64.34 C ATOM 1198 O TYR A 134 15.307 5.661 2.885 1.00 73.11 O ATOM 1199 CB TYR A 134 15.388 2.692 4.300 1.00 4.52 C ATOM 1200 CG TYR A 134 16.794 3.027 3.855 1.00 2.25 C ATOM 1201 CD1 TYR A 134 17.066 3.351 2.532 1.00 44.21 C ATOM 1202 CD2 TYR A 134 17.850 3.019 4.758 1.00 23.41 C ATOM 1203 CE1 TYR A 134 18.349 3.657 2.121 1.00 43.13 C ATOM 1204 CE2 TYR A 134 19.136 3.325 4.356 1.00 20.52 C ATOM 1205 CZ TYR A 134 19.381 3.643 3.037 1.00 74.14 C ATOM 1206 OH TYR A 134 20.660 3.947 2.632 1.00 62.10 O ATOM 0 H TYR A 134 12.953 2.474 4.735 1.00 1.42 H new ATOM 0 HA TYR A 134 14.644 4.559 5.064 1.00 21.42 H new ATOM 0 HB2 TYR A 134 15.420 2.314 5.322 1.00 4.52 H new ATOM 0 HB3 TYR A 134 14.999 1.888 3.674 1.00 4.52 H new ATOM 0 HD1 TYR A 134 16.261 3.364 1.812 1.00 44.21 H new ATOM 0 HD2 TYR A 134 17.662 2.769 5.792 1.00 23.41 H new ATOM 0 HE1 TYR A 134 18.543 3.906 1.088 1.00 43.13 H new ATOM 0 HE2 TYR A 134 19.945 3.315 5.071 1.00 20.52 H new ATOM 0 HH TYR A 134 21.268 3.892 3.399 1.00 62.10 H new ATOM 1216 N HIS A 135 14.012 4.130 1.862 1.00 2.21 N ATOM 1217 CA HIS A 135 14.116 4.759 0.550 1.00 22.11 C ATOM 1218 C HIS A 135 13.276 6.031 0.489 1.00 5.33 C ATOM 1219 O HIS A 135 13.681 7.025 -0.114 1.00 50.23 O ATOM 1220 CB HIS A 135 13.669 3.786 -0.542 1.00 2.32 C ATOM 1221 CG HIS A 135 13.858 4.316 -1.930 1.00 13.32 C ATOM 1222 ND1 HIS A 135 14.304 5.594 -2.193 1.00 50.14 N ATOM 1223 CD2 HIS A 135 13.659 3.733 -3.135 1.00 22.31 C ATOM 1224 CE1 HIS A 135 14.370 5.774 -3.500 1.00 42.24 C ATOM 1225 NE2 HIS A 135 13.985 4.659 -4.095 1.00 14.34 N ATOM 0 H HIS A 135 13.442 3.284 1.880 1.00 2.21 H new ATOM 0 HA HIS A 135 15.160 5.026 0.384 1.00 22.11 H new ATOM 0 HB2 HIS A 135 14.227 2.855 -0.438 1.00 2.32 H new ATOM 0 HB3 HIS A 135 12.616 3.545 -0.394 1.00 2.32 H new ATOM 0 HD1 HIS A 135 14.545 6.291 -1.489 1.00 50.14 H new ATOM 0 HD2 HIS A 135 13.309 2.726 -3.309 1.00 22.31 H new ATOM 0 HE1 HIS A 135 14.685 6.679 -3.998 1.00 42.24 H new ATOM 1233 N ARG A 136 12.106 5.993 1.117 1.00 31.45 N ATOM 1234 CA ARG A 136 11.209 7.142 1.133 1.00 72.32 C ATOM 1235 C ARG A 136 11.910 8.372 1.701 1.00 24.32 C ATOM 1236 O ARG A 136 11.535 9.506 1.404 1.00 33.32 O ATOM 1237 CB ARG A 136 9.958 6.828 1.957 1.00 44.43 C ATOM 1238 CG ARG A 136 9.078 8.041 2.213 1.00 61.24 C ATOM 1239 CD ARG A 136 7.617 7.647 2.361 1.00 72.23 C ATOM 1240 NE ARG A 136 6.755 8.808 2.565 1.00 31.01 N ATOM 1241 CZ ARG A 136 6.525 9.353 3.755 1.00 65.52 C ATOM 1242 NH1 ARG A 136 7.091 8.844 4.841 1.00 64.04 N ATOM 1243 NH2 ARG A 136 5.729 10.409 3.860 1.00 71.51 N ATOM 0 H ARG A 136 11.757 5.178 1.622 1.00 31.45 H new ATOM 0 HA ARG A 136 10.915 7.356 0.105 1.00 72.32 H new ATOM 0 HB2 ARG A 136 9.373 6.068 1.439 1.00 44.43 H new ATOM 0 HB3 ARG A 136 10.261 6.401 2.913 1.00 44.43 H new ATOM 0 HG2 ARG A 136 9.412 8.550 3.117 1.00 61.24 H new ATOM 0 HG3 ARG A 136 9.184 8.749 1.391 1.00 61.24 H new ATOM 0 HD2 ARG A 136 7.295 7.108 1.470 1.00 72.23 H new ATOM 0 HD3 ARG A 136 7.509 6.963 3.203 1.00 72.23 H new ATOM 0 HE ARG A 136 6.305 9.223 1.749 1.00 31.01 H new ATOM 0 HH11 ARG A 136 7.704 8.033 4.764 1.00 64.04 H new ATOM 0 HH12 ARG A 136 6.913 9.264 5.753 1.00 64.04 H new ATOM 0 HH21 ARG A 136 5.293 10.804 3.027 1.00 71.51 H new ATOM 0 HH22 ARG A 136 5.553 10.826 4.774 1.00 71.51 H new ATOM 1257 N SER A 137 12.931 8.139 2.520 1.00 21.22 N ATOM 1258 CA SER A 137 13.683 9.227 3.134 1.00 54.52 C ATOM 1259 C SER A 137 14.951 9.527 2.340 1.00 30.34 C ATOM 1260 O SER A 137 15.384 10.676 2.248 1.00 72.12 O ATOM 1261 CB SER A 137 14.042 8.876 4.579 1.00 43.23 C ATOM 1262 OG SER A 137 13.318 9.680 5.494 1.00 25.12 O ATOM 0 H SER A 137 13.256 7.206 2.774 1.00 21.22 H new ATOM 0 HA SER A 137 13.054 10.117 3.130 1.00 54.52 H new ATOM 0 HB2 SER A 137 13.827 7.824 4.765 1.00 43.23 H new ATOM 0 HB3 SER A 137 15.112 9.015 4.735 1.00 43.23 H new ATOM 0 HG SER A 137 13.564 9.435 6.410 1.00 25.12 H new ATOM 1268 N THR A 138 15.544 8.483 1.768 1.00 12.14 N ATOM 1269 CA THR A 138 16.763 8.632 0.984 1.00 72.13 C ATOM 1270 C THR A 138 16.633 7.942 -0.369 1.00 45.04 C ATOM 1271 O THR A 138 16.133 6.821 -0.460 1.00 11.10 O ATOM 1272 CB THR A 138 17.983 8.055 1.727 1.00 51.54 C ATOM 1273 OG1 THR A 138 18.370 8.935 2.788 1.00 25.22 O ATOM 1274 CG2 THR A 138 19.152 7.856 0.774 1.00 41.41 C ATOM 0 H THR A 138 15.199 7.525 1.834 1.00 12.14 H new ATOM 0 HA THR A 138 16.913 9.701 0.831 1.00 72.13 H new ATOM 0 HB THR A 138 17.704 7.086 2.142 1.00 51.54 H new ATOM 0 HG1 THR A 138 19.145 8.561 3.257 1.00 25.22 H new ATOM 0 HG21 THR A 138 20.002 7.448 1.321 1.00 41.41 H new ATOM 0 HG22 THR A 138 18.863 7.164 -0.017 1.00 41.41 H new ATOM 0 HG23 THR A 138 19.430 8.814 0.334 1.00 41.41 H new ATOM 1282 N SER A 139 17.088 8.618 -1.419 1.00 44.43 N ATOM 1283 CA SER A 139 17.020 8.071 -2.769 1.00 45.11 C ATOM 1284 C SER A 139 17.952 6.872 -2.917 1.00 30.24 C ATOM 1285 O SER A 139 18.897 6.706 -2.145 1.00 15.04 O ATOM 1286 CB SER A 139 17.386 9.144 -3.796 1.00 51.34 C ATOM 1287 OG SER A 139 18.774 9.426 -3.767 1.00 43.35 O ATOM 0 H SER A 139 17.508 9.546 -1.361 1.00 44.43 H new ATOM 0 HA SER A 139 15.997 7.739 -2.949 1.00 45.11 H new ATOM 0 HB2 SER A 139 17.101 8.809 -4.793 1.00 51.34 H new ATOM 0 HB3 SER A 139 16.823 10.054 -3.592 1.00 51.34 H new ATOM 0 HG SER A 139 18.910 10.395 -3.709 1.00 43.35 H new ATOM 1293 N VAL A 140 17.678 6.037 -3.914 1.00 44.13 N ATOM 1294 CA VAL A 140 18.491 4.853 -4.165 1.00 44.02 C ATOM 1295 C VAL A 140 18.864 4.744 -5.640 1.00 13.45 C ATOM 1296 O VAL A 140 19.643 3.875 -6.031 1.00 54.43 O ATOM 1297 CB VAL A 140 17.759 3.568 -3.736 1.00 73.10 C ATOM 1298 CG1 VAL A 140 17.226 3.705 -2.318 1.00 12.10 C ATOM 1299 CG2 VAL A 140 16.634 3.246 -4.708 1.00 51.54 C ATOM 0 H VAL A 140 16.899 6.159 -4.561 1.00 44.13 H new ATOM 0 HA VAL A 140 19.398 4.961 -3.571 1.00 44.02 H new ATOM 0 HB VAL A 140 18.471 2.743 -3.753 1.00 73.10 H new ATOM 0 HG11 VAL A 140 16.712 2.787 -2.032 1.00 12.10 H new ATOM 0 HG12 VAL A 140 18.055 3.885 -1.633 1.00 12.10 H new ATOM 0 HG13 VAL A 140 16.529 4.541 -2.271 1.00 12.10 H new ATOM 0 HG21 VAL A 140 16.128 2.335 -4.389 1.00 51.54 H new ATOM 0 HG22 VAL A 140 15.921 4.070 -4.725 1.00 51.54 H new ATOM 0 HG23 VAL A 140 17.046 3.102 -5.707 1.00 51.54 H new ATOM 1309 N SER A 141 18.302 5.633 -6.453 1.00 42.01 N ATOM 1310 CA SER A 141 18.573 5.635 -7.886 1.00 54.40 C ATOM 1311 C SER A 141 19.839 6.426 -8.199 1.00 25.15 C ATOM 1312 O SER A 141 20.196 7.358 -7.478 1.00 1.21 O ATOM 1313 CB SER A 141 17.387 6.228 -8.649 1.00 54.23 C ATOM 1314 OG SER A 141 16.625 5.212 -9.278 1.00 65.33 O ATOM 0 H SER A 141 17.657 6.360 -6.144 1.00 42.01 H new ATOM 0 HA SER A 141 18.722 4.603 -8.204 1.00 54.40 H new ATOM 0 HB2 SER A 141 16.753 6.790 -7.963 1.00 54.23 H new ATOM 0 HB3 SER A 141 17.748 6.932 -9.398 1.00 54.23 H new ATOM 0 HG SER A 141 15.690 5.497 -9.342 1.00 65.33 H new ATOM 1320 N ARG A 142 20.515 6.046 -9.278 1.00 41.21 N ATOM 1321 CA ARG A 142 21.743 6.718 -9.686 1.00 70.24 C ATOM 1322 C ARG A 142 21.446 7.837 -10.680 1.00 71.12 C ATOM 1323 O ARG A 142 22.346 8.562 -11.101 1.00 2.24 O ATOM 1324 CB ARG A 142 22.716 5.714 -10.308 1.00 50.30 C ATOM 1325 CG ARG A 142 22.773 4.385 -9.572 1.00 40.53 C ATOM 1326 CD ARG A 142 24.111 4.191 -8.876 1.00 11.20 C ATOM 1327 NE ARG A 142 25.203 4.015 -9.829 1.00 24.31 N ATOM 1328 CZ ARG A 142 25.440 2.877 -10.473 1.00 41.41 C ATOM 1329 NH1 ARG A 142 24.665 1.822 -10.268 1.00 33.41 N ATOM 1330 NH2 ARG A 142 26.454 2.795 -11.325 1.00 71.32 N ATOM 0 H ARG A 142 20.233 5.277 -9.885 1.00 41.21 H new ATOM 0 HA ARG A 142 22.200 7.156 -8.799 1.00 70.24 H new ATOM 0 HB2 ARG A 142 22.427 5.534 -11.343 1.00 50.30 H new ATOM 0 HB3 ARG A 142 23.714 6.152 -10.327 1.00 50.30 H new ATOM 0 HG2 ARG A 142 21.969 4.340 -8.837 1.00 40.53 H new ATOM 0 HG3 ARG A 142 22.607 3.570 -10.277 1.00 40.53 H new ATOM 0 HD2 ARG A 142 24.318 5.053 -8.242 1.00 11.20 H new ATOM 0 HD3 ARG A 142 24.057 3.321 -8.222 1.00 11.20 H new ATOM 0 HE ARG A 142 25.817 4.809 -10.010 1.00 24.31 H new ATOM 0 HH11 ARG A 142 23.884 1.882 -9.615 1.00 33.41 H new ATOM 0 HH12 ARG A 142 24.849 0.950 -10.764 1.00 33.41 H new ATOM 0 HH21 ARG A 142 27.052 3.606 -11.486 1.00 71.32 H new ATOM 0 HH22 ARG A 142 26.636 1.921 -11.819 1.00 71.32 H new ATOM 1344 N ASN A 143 20.177 7.970 -11.052 1.00 13.04 N ATOM 1345 CA ASN A 143 19.761 9.000 -11.997 1.00 31.21 C ATOM 1346 C ASN A 143 19.364 10.280 -11.267 1.00 73.53 C ATOM 1347 O ASN A 143 19.873 11.359 -11.567 1.00 11.22 O ATOM 1348 CB ASN A 143 18.591 8.499 -12.846 1.00 53.51 C ATOM 1349 CG ASN A 143 19.051 7.806 -14.114 1.00 1.31 C ATOM 1350 OD1 ASN A 143 18.722 6.645 -14.354 1.00 20.51 O ATOM 1351 ND2 ASN A 143 19.817 8.518 -14.932 1.00 41.14 N ATOM 0 H ASN A 143 19.419 7.377 -10.713 1.00 13.04 H new ATOM 0 HA ASN A 143 20.605 9.223 -12.649 1.00 31.21 H new ATOM 0 HB2 ASN A 143 17.988 7.809 -12.257 1.00 53.51 H new ATOM 0 HB3 ASN A 143 17.949 9.340 -13.107 1.00 53.51 H new ATOM 0 HD21 ASN A 143 20.158 8.105 -15.800 1.00 41.14 H new ATOM 0 HD22 ASN A 143 20.065 9.478 -14.692 1.00 41.14 H new ATOM 1358 N GLN A 144 18.452 10.149 -10.309 1.00 2.21 N ATOM 1359 CA GLN A 144 17.987 11.295 -9.537 1.00 10.32 C ATOM 1360 C GLN A 144 17.811 10.927 -8.067 1.00 71.54 C ATOM 1361 O GLN A 144 18.003 9.774 -7.680 1.00 54.25 O ATOM 1362 CB GLN A 144 16.667 11.818 -10.105 1.00 53.14 C ATOM 1363 CG GLN A 144 16.738 13.260 -10.581 1.00 14.20 C ATOM 1364 CD GLN A 144 15.859 13.521 -11.788 1.00 75.43 C ATOM 1365 OE1 GLN A 144 14.641 13.346 -11.733 1.00 52.12 O ATOM 1366 NE2 GLN A 144 16.472 13.941 -12.888 1.00 63.23 N ATOM 0 H GLN A 144 18.021 9.262 -10.049 1.00 2.21 H new ATOM 0 HA GLN A 144 18.741 12.079 -9.609 1.00 10.32 H new ATOM 0 HB2 GLN A 144 16.363 11.184 -10.938 1.00 53.14 H new ATOM 0 HB3 GLN A 144 15.894 11.734 -9.341 1.00 53.14 H new ATOM 0 HG2 GLN A 144 16.438 13.922 -9.768 1.00 14.20 H new ATOM 0 HG3 GLN A 144 17.771 13.506 -10.828 1.00 14.20 H new ATOM 0 HE21 GLN A 144 17.483 14.073 -12.890 1.00 63.23 H new ATOM 0 HE22 GLN A 144 15.932 14.132 -13.732 1.00 63.23 H new ATOM 1375 N GLN A 145 17.445 11.913 -7.255 1.00 24.43 N ATOM 1376 CA GLN A 145 17.245 11.691 -5.828 1.00 31.15 C ATOM 1377 C GLN A 145 15.760 11.686 -5.481 1.00 13.32 C ATOM 1378 O GLN A 145 15.320 12.406 -4.584 1.00 13.31 O ATOM 1379 CB GLN A 145 17.967 12.768 -5.016 1.00 52.12 C ATOM 1380 CG GLN A 145 17.501 14.181 -5.330 1.00 70.31 C ATOM 1381 CD GLN A 145 18.186 15.225 -4.471 1.00 52.42 C ATOM 1382 OE1 GLN A 145 17.917 15.335 -3.274 1.00 65.04 O ATOM 1383 NE2 GLN A 145 19.077 16.000 -5.079 1.00 14.42 N ATOM 0 H GLN A 145 17.281 12.872 -7.560 1.00 24.43 H new ATOM 0 HA GLN A 145 17.662 10.716 -5.576 1.00 31.15 H new ATOM 0 HB2 GLN A 145 17.817 12.572 -3.954 1.00 52.12 H new ATOM 0 HB3 GLN A 145 19.038 12.697 -5.205 1.00 52.12 H new ATOM 0 HG2 GLN A 145 17.693 14.398 -6.381 1.00 70.31 H new ATOM 0 HG3 GLN A 145 16.423 14.245 -5.183 1.00 70.31 H new ATOM 0 HE21 GLN A 145 19.269 15.874 -6.073 1.00 14.42 H new ATOM 0 HE22 GLN A 145 19.569 16.721 -4.552 1.00 14.42 H new ATOM 1392 N ILE A 146 14.993 10.871 -6.197 1.00 14.31 N ATOM 1393 CA ILE A 146 13.557 10.773 -5.964 1.00 1.21 C ATOM 1394 C ILE A 146 13.256 9.913 -4.742 1.00 21.45 C ATOM 1395 O ILE A 146 14.086 9.109 -4.315 1.00 0.53 O ATOM 1396 CB ILE A 146 12.828 10.183 -7.185 1.00 54.23 C ATOM 1397 CG1 ILE A 146 13.014 11.089 -8.405 1.00 21.55 C ATOM 1398 CG2 ILE A 146 11.349 9.995 -6.879 1.00 41.54 C ATOM 1399 CD1 ILE A 146 13.435 10.343 -9.652 1.00 4.43 C ATOM 0 H ILE A 146 15.342 10.269 -6.943 1.00 14.31 H new ATOM 0 HA ILE A 146 13.196 11.786 -5.790 1.00 1.21 H new ATOM 0 HB ILE A 146 13.259 9.208 -7.411 1.00 54.23 H new ATOM 0 HG12 ILE A 146 12.080 11.614 -8.603 1.00 21.55 H new ATOM 0 HG13 ILE A 146 13.763 11.847 -8.174 1.00 21.55 H new ATOM 0 HG21 ILE A 146 10.847 9.577 -7.752 1.00 41.54 H new ATOM 0 HG22 ILE A 146 11.236 9.315 -6.035 1.00 41.54 H new ATOM 0 HG23 ILE A 146 10.903 10.958 -6.631 1.00 41.54 H new ATOM 0 HD11 ILE A 146 13.548 11.047 -10.476 1.00 4.43 H new ATOM 0 HD12 ILE A 146 14.385 9.840 -9.472 1.00 4.43 H new ATOM 0 HD13 ILE A 146 12.676 9.604 -9.908 1.00 4.43 H new ATOM 1411 N PHE A 147 12.063 10.085 -4.183 1.00 33.30 N ATOM 1412 CA PHE A 147 11.651 9.323 -3.010 1.00 12.15 C ATOM 1413 C PHE A 147 10.425 8.469 -3.318 1.00 54.13 C ATOM 1414 O PHE A 147 9.620 8.809 -4.187 1.00 31.32 O ATOM 1415 CB PHE A 147 11.349 10.266 -1.843 1.00 52.43 C ATOM 1416 CG PHE A 147 12.551 11.027 -1.361 1.00 13.12 C ATOM 1417 CD1 PHE A 147 13.769 10.389 -1.192 1.00 32.04 C ATOM 1418 CD2 PHE A 147 12.462 12.380 -1.076 1.00 1.21 C ATOM 1419 CE1 PHE A 147 14.877 11.086 -0.748 1.00 51.10 C ATOM 1420 CE2 PHE A 147 13.567 13.082 -0.633 1.00 12.54 C ATOM 1421 CZ PHE A 147 14.775 12.434 -0.467 1.00 43.52 C ATOM 0 H PHE A 147 11.364 10.746 -4.523 1.00 33.30 H new ATOM 0 HA PHE A 147 12.472 8.662 -2.732 1.00 12.15 H new ATOM 0 HB2 PHE A 147 10.579 10.974 -2.149 1.00 52.43 H new ATOM 0 HB3 PHE A 147 10.939 9.687 -1.015 1.00 52.43 H new ATOM 0 HD1 PHE A 147 13.854 9.335 -1.410 1.00 32.04 H new ATOM 0 HD2 PHE A 147 11.519 12.891 -1.201 1.00 1.21 H new ATOM 0 HE1 PHE A 147 15.821 10.577 -0.621 1.00 51.10 H new ATOM 0 HE2 PHE A 147 13.486 14.137 -0.417 1.00 12.54 H new ATOM 0 HZ PHE A 147 15.639 12.981 -0.118 1.00 43.52 H new ATOM 1431 N LEU A 148 10.289 7.359 -2.602 1.00 20.33 N ATOM 1432 CA LEU A 148 9.161 6.454 -2.798 1.00 45.23 C ATOM 1433 C LEU A 148 7.861 7.095 -2.325 1.00 34.42 C ATOM 1434 O LEU A 148 7.651 7.285 -1.127 1.00 31.44 O ATOM 1435 CB LEU A 148 9.399 5.141 -2.050 1.00 11.41 C ATOM 1436 CG LEU A 148 10.651 4.359 -2.448 1.00 74.43 C ATOM 1437 CD1 LEU A 148 10.590 2.941 -1.902 1.00 31.33 C ATOM 1438 CD2 LEU A 148 10.810 4.342 -3.961 1.00 45.55 C ATOM 0 H LEU A 148 10.946 7.063 -1.880 1.00 20.33 H new ATOM 0 HA LEU A 148 9.074 6.246 -3.864 1.00 45.23 H new ATOM 0 HB2 LEU A 148 9.455 5.359 -0.983 1.00 11.41 H new ATOM 0 HB3 LEU A 148 8.531 4.499 -2.199 1.00 11.41 H new ATOM 0 HG LEU A 148 11.519 4.856 -2.016 1.00 74.43 H new ATOM 0 HD11 LEU A 148 11.489 2.399 -2.195 1.00 31.33 H new ATOM 0 HD12 LEU A 148 10.524 2.972 -0.814 1.00 31.33 H new ATOM 0 HD13 LEU A 148 9.713 2.434 -2.305 1.00 31.33 H new ATOM 0 HD21 LEU A 148 11.706 3.781 -4.226 1.00 45.55 H new ATOM 0 HD22 LEU A 148 9.938 3.869 -4.413 1.00 45.55 H new ATOM 0 HD23 LEU A 148 10.899 5.364 -4.329 1.00 45.55 H new ATOM 1450 N ARG A 149 6.989 7.423 -3.273 1.00 45.41 N ATOM 1451 CA ARG A 149 5.708 8.041 -2.953 1.00 5.42 C ATOM 1452 C ARG A 149 4.652 6.981 -2.656 1.00 63.22 C ATOM 1453 O ARG A 149 4.491 6.023 -3.412 1.00 73.14 O ATOM 1454 CB ARG A 149 5.244 8.930 -4.108 1.00 12.20 C ATOM 1455 CG ARG A 149 5.965 10.266 -4.177 1.00 4.21 C ATOM 1456 CD ARG A 149 5.578 11.169 -3.016 1.00 52.13 C ATOM 1457 NE ARG A 149 6.705 11.969 -2.545 1.00 23.44 N ATOM 1458 CZ ARG A 149 6.585 12.971 -1.682 1.00 2.25 C ATOM 1459 NH1 ARG A 149 5.394 13.295 -1.198 1.00 51.00 N ATOM 1460 NH2 ARG A 149 7.658 13.652 -1.300 1.00 24.21 N ATOM 0 H ARG A 149 7.147 7.271 -4.269 1.00 45.41 H new ATOM 0 HA ARG A 149 5.842 8.655 -2.062 1.00 5.42 H new ATOM 0 HB2 ARG A 149 5.393 8.398 -5.047 1.00 12.20 H new ATOM 0 HB3 ARG A 149 4.173 9.109 -4.010 1.00 12.20 H new ATOM 0 HG2 ARG A 149 7.042 10.100 -4.167 1.00 4.21 H new ATOM 0 HG3 ARG A 149 5.727 10.761 -5.119 1.00 4.21 H new ATOM 0 HD2 ARG A 149 4.768 11.830 -3.325 1.00 52.13 H new ATOM 0 HD3 ARG A 149 5.197 10.561 -2.195 1.00 52.13 H new ATOM 0 HE ARG A 149 7.636 11.746 -2.898 1.00 23.44 H new ATOM 0 HH11 ARG A 149 4.567 12.774 -1.488 1.00 51.00 H new ATOM 0 HH12 ARG A 149 5.305 14.065 -0.535 1.00 51.00 H new ATOM 0 HH21 ARG A 149 8.576 13.406 -1.669 1.00 24.21 H new ATOM 0 HH22 ARG A 149 7.564 14.421 -0.637 1.00 24.21 H new ATOM 1474 N ASP A 150 3.937 7.159 -1.551 1.00 72.22 N ATOM 1475 CA ASP A 150 2.896 6.218 -1.155 1.00 34.14 C ATOM 1476 C ASP A 150 1.837 6.087 -2.245 1.00 51.41 C ATOM 1477 O ASP A 150 1.098 7.033 -2.523 1.00 21.44 O ATOM 1478 CB ASP A 150 2.245 6.667 0.155 1.00 75.24 C ATOM 1479 CG ASP A 150 2.332 8.166 0.360 1.00 0.33 C ATOM 1480 OD1 ASP A 150 3.413 8.649 0.758 1.00 22.11 O ATOM 1481 OD2 ASP A 150 1.320 8.857 0.123 1.00 54.34 O ATOM 0 H ASP A 150 4.059 7.946 -0.914 1.00 72.22 H new ATOM 0 HA ASP A 150 3.360 5.243 -1.006 1.00 34.14 H new ATOM 0 HB2 ASP A 150 1.198 6.363 0.160 1.00 75.24 H new ATOM 0 HB3 ASP A 150 2.729 6.160 0.990 1.00 75.24 H new ATOM 1486 N ILE A 151 1.770 4.912 -2.860 1.00 63.52 N ATOM 1487 CA ILE A 151 0.802 4.658 -3.920 1.00 43.21 C ATOM 1488 C ILE A 151 -0.621 4.638 -3.372 1.00 5.41 C ATOM 1489 O ILE A 151 -0.852 4.231 -2.234 1.00 63.32 O ATOM 1490 CB ILE A 151 1.084 3.322 -4.633 1.00 4.34 C ATOM 1491 CG1 ILE A 151 0.477 3.330 -6.037 1.00 43.21 C ATOM 1492 CG2 ILE A 151 0.534 2.161 -3.818 1.00 41.03 C ATOM 1493 CD1 ILE A 151 0.546 1.989 -6.733 1.00 24.22 C ATOM 0 H ILE A 151 2.375 4.120 -2.643 1.00 63.52 H new ATOM 0 HA ILE A 151 0.901 5.472 -4.638 1.00 43.21 H new ATOM 0 HB ILE A 151 2.163 3.197 -4.725 1.00 4.34 H new ATOM 0 HG12 ILE A 151 -0.565 3.643 -5.972 1.00 43.21 H new ATOM 0 HG13 ILE A 151 0.995 4.072 -6.644 1.00 43.21 H new ATOM 0 HG21 ILE A 151 0.741 1.224 -4.334 1.00 41.03 H new ATOM 0 HG22 ILE A 151 1.009 2.147 -2.837 1.00 41.03 H new ATOM 0 HG23 ILE A 151 -0.543 2.279 -3.698 1.00 41.03 H new ATOM 0 HD11 ILE A 151 0.097 2.069 -7.723 1.00 24.22 H new ATOM 0 HD12 ILE A 151 1.588 1.683 -6.830 1.00 24.22 H new ATOM 0 HD13 ILE A 151 0.003 1.247 -6.148 1.00 24.22 H new ATOM 1505 N GLU A 152 -1.570 5.080 -4.190 1.00 54.32 N ATOM 1506 CA GLU A 152 -2.971 5.112 -3.787 1.00 13.13 C ATOM 1507 C GLU A 152 -3.561 3.705 -3.756 1.00 62.12 C ATOM 1508 O GLU A 152 -4.134 3.240 -4.741 1.00 45.02 O ATOM 1509 CB GLU A 152 -3.780 5.995 -4.740 1.00 23.11 C ATOM 1510 CG GLU A 152 -3.961 7.420 -4.244 1.00 20.43 C ATOM 1511 CD GLU A 152 -5.300 8.010 -4.642 1.00 4.11 C ATOM 1512 OE1 GLU A 152 -6.272 7.238 -4.776 1.00 21.42 O ATOM 1513 OE2 GLU A 152 -5.375 9.244 -4.820 1.00 33.32 O ATOM 0 H GLU A 152 -1.395 5.421 -5.135 1.00 54.32 H new ATOM 0 HA GLU A 152 -3.023 5.532 -2.782 1.00 13.13 H new ATOM 0 HB2 GLU A 152 -3.284 6.017 -5.710 1.00 23.11 H new ATOM 0 HB3 GLU A 152 -4.761 5.545 -4.894 1.00 23.11 H new ATOM 0 HG2 GLU A 152 -3.869 7.437 -3.158 1.00 20.43 H new ATOM 0 HG3 GLU A 152 -3.161 8.044 -4.642 1.00 20.43 H new ATOM 1520 N GLN A 153 -3.415 3.033 -2.619 1.00 1.24 N ATOM 1521 CA GLN A 153 -3.932 1.679 -2.460 1.00 65.11 C ATOM 1522 C GLN A 153 -5.372 1.585 -2.951 1.00 73.13 C ATOM 1523 O GLN A 153 -6.067 2.595 -3.067 1.00 20.33 O ATOM 1524 CB GLN A 153 -3.851 1.248 -0.995 1.00 23.23 C ATOM 1525 CG GLN A 153 -3.869 -0.260 -0.802 1.00 52.01 C ATOM 1526 CD GLN A 153 -2.646 -0.938 -1.387 1.00 60.10 C ATOM 1527 OE1 GLN A 153 -1.679 -1.218 -0.678 1.00 62.23 O ATOM 1528 NE2 GLN A 153 -2.682 -1.206 -2.687 1.00 72.11 N ATOM 0 H GLN A 153 -2.943 3.404 -1.794 1.00 1.24 H new ATOM 0 HA GLN A 153 -3.318 1.010 -3.062 1.00 65.11 H new ATOM 0 HB2 GLN A 153 -2.938 1.651 -0.556 1.00 23.23 H new ATOM 0 HB3 GLN A 153 -4.687 1.686 -0.449 1.00 23.23 H new ATOM 0 HG2 GLN A 153 -3.930 -0.485 0.263 1.00 52.01 H new ATOM 0 HG3 GLN A 153 -4.765 -0.671 -1.267 1.00 52.01 H new ATOM 0 HE21 GLN A 153 -3.504 -0.956 -3.237 1.00 72.11 H new ATOM 0 HE22 GLN A 153 -1.887 -1.662 -3.136 1.00 72.11 H new