USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 521 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 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -0.112 K(o=-0.11,f=-2.2!) USER MOD Single : A 88 GLN : amide:sc= -1.05 K(o=-1.1,f=-0.1) USER MOD Single : A 92 GLN : amide:sc= -0.0147 K(o=-0.015,f=-1.4!) USER MOD Single : A 93 LYS NZ :NH3+ 160:sc= -0.06 (180deg=-0.524) USER MOD Single : A 95 SER OG : rot 180:sc= -0.636 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.436 USER MOD Single : A 103 THR OG1 : rot -26:sc= 0.2 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= -0.176 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 113 THR OG1 : rot -44:sc= 0.287 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 50:sc= -3.04! USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ -175:sc= -0.0245 (180deg=-0.0433) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0.0209 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 82:sc= -0.0967 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl 153:sc= -0.161 (180deg=-1.12) USER MOD Single : A 147 SER OG : rot -155:sc= 0.519 USER MOD Single : A 149 LYS NZ :NH3+ 148:sc= -0.229 (180deg=-1.03) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.261 -0.885 -7.156 1.00 0.00 N ATOM 17 CA ALA A 82 34.982 -2.114 -6.444 1.00 0.00 C ATOM 18 C ALA A 82 33.529 -2.128 -6.003 1.00 0.00 C ATOM 19 O ALA A 82 33.173 -1.567 -4.968 1.00 0.00 O ATOM 20 CB ALA A 82 35.896 -2.231 -5.223 1.00 0.00 C ATOM 0 HA ALA A 82 35.167 -2.960 -7.106 1.00 0.00 H new ATOM 0 HB1 ALA A 82 35.679 -3.159 -4.694 1.00 0.00 H new ATOM 0 HB2 ALA A 82 36.937 -2.233 -5.547 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.724 -1.385 -4.558 1.00 0.00 H new ATOM 26 N TYR A 83 32.699 -2.778 -6.799 1.00 0.00 N ATOM 27 CA TYR A 83 31.278 -2.879 -6.498 1.00 0.00 C ATOM 28 C TYR A 83 31.093 -3.312 -5.052 1.00 0.00 C ATOM 29 O TYR A 83 30.009 -3.186 -4.485 1.00 0.00 O ATOM 30 CB TYR A 83 30.611 -3.893 -7.436 1.00 0.00 C ATOM 31 CG TYR A 83 31.180 -3.757 -8.835 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.277 -2.495 -9.439 1.00 0.00 C ATOM 33 CD2 TYR A 83 31.615 -4.896 -9.528 1.00 0.00 C ATOM 34 CE1 TYR A 83 31.807 -2.375 -10.729 1.00 0.00 C ATOM 35 CE2 TYR A 83 32.146 -4.773 -10.818 1.00 0.00 C ATOM 36 CZ TYR A 83 32.242 -3.514 -11.419 1.00 0.00 C ATOM 37 OH TYR A 83 32.768 -3.392 -12.689 1.00 0.00 O ATOM 0 H TYR A 83 32.983 -3.245 -7.660 1.00 0.00 H new ATOM 0 HA TYR A 83 30.812 -1.905 -6.645 1.00 0.00 H new ATOM 0 HB2 TYR A 83 30.773 -4.905 -7.065 1.00 0.00 H new ATOM 0 HB3 TYR A 83 29.534 -3.729 -7.455 1.00 0.00 H new ATOM 0 HD1 TYR A 83 30.943 -1.616 -8.909 1.00 0.00 H new ATOM 0 HD2 TYR A 83 31.540 -5.869 -9.066 1.00 0.00 H new ATOM 0 HE1 TYR A 83 31.881 -1.403 -11.193 1.00 0.00 H new ATOM 0 HE2 TYR A 83 32.482 -5.651 -11.349 1.00 0.00 H new ATOM 0 HH TYR A 83 33.022 -4.277 -13.024 1.00 0.00 H new ATOM 47 N LYS A 84 32.166 -3.818 -4.463 1.00 0.00 N ATOM 48 CA LYS A 84 32.120 -4.270 -3.079 1.00 0.00 C ATOM 49 C LYS A 84 31.812 -3.093 -2.163 1.00 0.00 C ATOM 50 O LYS A 84 31.062 -3.227 -1.200 1.00 0.00 O ATOM 51 CB LYS A 84 33.458 -4.902 -2.688 1.00 0.00 C ATOM 52 CG LYS A 84 33.677 -6.169 -3.517 1.00 0.00 C ATOM 53 CD LYS A 84 35.008 -6.814 -3.127 1.00 0.00 C ATOM 54 CE LYS A 84 35.227 -8.076 -3.963 1.00 0.00 C ATOM 55 NZ LYS A 84 36.517 -8.710 -3.573 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.073 -3.926 -4.917 1.00 0.00 H new ATOM 0 HA LYS A 84 31.334 -5.018 -2.975 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.271 -4.196 -2.859 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.463 -5.143 -1.625 1.00 0.00 H new ATOM 0 HG2 LYS A 84 32.859 -6.870 -3.351 1.00 0.00 H new ATOM 0 HG3 LYS A 84 33.677 -5.925 -4.579 1.00 0.00 H new ATOM 0 HD2 LYS A 84 35.826 -6.112 -3.288 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.006 -7.063 -2.066 1.00 0.00 H new ATOM 0 HE2 LYS A 84 34.405 -8.775 -3.809 1.00 0.00 H new ATOM 0 HE3 LYS A 84 35.238 -7.825 -5.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 36.668 -9.568 -4.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 37.297 -8.043 -3.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 36.489 -8.962 -2.564 1.00 0.00 H new ATOM 69 N ASN A 85 32.403 -1.944 -2.477 1.00 0.00 N ATOM 70 CA ASN A 85 32.187 -0.745 -1.673 1.00 0.00 C ATOM 71 C ASN A 85 30.720 -0.322 -1.716 1.00 0.00 C ATOM 72 O ASN A 85 30.135 0.026 -0.698 1.00 0.00 O ATOM 73 CB ASN A 85 33.067 0.400 -2.187 1.00 0.00 C ATOM 74 CG ASN A 85 34.510 0.180 -1.750 1.00 0.00 C ATOM 75 OD1 ASN A 85 34.771 -0.598 -0.833 1.00 0.00 O ATOM 76 ND2 ASN A 85 35.470 0.822 -2.353 1.00 0.00 N ATOM 0 H ASN A 85 33.028 -1.818 -3.273 1.00 0.00 H new ATOM 0 HA ASN A 85 32.456 -0.973 -0.642 1.00 0.00 H new ATOM 0 HB2 ASN A 85 33.011 0.454 -3.274 1.00 0.00 H new ATOM 0 HB3 ASN A 85 32.702 1.352 -1.802 1.00 0.00 H new ATOM 0 HD21 ASN A 85 36.438 0.680 -2.065 1.00 0.00 H new ATOM 0 HD22 ASN A 85 35.253 1.467 -3.113 1.00 0.00 H new ATOM 83 N LEU A 86 30.138 -0.332 -2.904 1.00 0.00 N ATOM 84 CA LEU A 86 28.745 0.063 -3.062 1.00 0.00 C ATOM 85 C LEU A 86 27.795 -0.984 -2.492 1.00 0.00 C ATOM 86 O LEU A 86 26.724 -0.652 -1.985 1.00 0.00 O ATOM 87 CB LEU A 86 28.430 0.286 -4.539 1.00 0.00 C ATOM 88 CG LEU A 86 26.973 0.792 -4.714 1.00 0.00 C ATOM 89 CD1 LEU A 86 26.923 1.864 -5.807 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.051 -0.363 -5.130 1.00 0.00 C ATOM 0 H LEU A 86 30.603 -0.607 -3.769 1.00 0.00 H new ATOM 0 HA LEU A 86 28.600 0.990 -2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.126 1.012 -4.960 1.00 0.00 H new ATOM 0 HB3 LEU A 86 28.567 -0.644 -5.091 1.00 0.00 H new ATOM 0 HG LEU A 86 26.639 1.205 -3.762 1.00 0.00 H new ATOM 0 HD11 LEU A 86 25.898 2.215 -5.925 1.00 0.00 H new ATOM 0 HD12 LEU A 86 27.563 2.700 -5.526 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.272 1.440 -6.749 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.033 0.009 -5.248 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.397 -0.782 -6.075 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.068 -1.137 -4.362 1.00 0.00 H new ATOM 102 N LEU A 87 28.188 -2.252 -2.599 1.00 0.00 N ATOM 103 CA LEU A 87 27.359 -3.351 -2.116 1.00 0.00 C ATOM 104 C LEU A 87 27.099 -3.204 -0.626 1.00 0.00 C ATOM 105 O LEU A 87 25.983 -3.420 -0.154 1.00 0.00 O ATOM 106 CB LEU A 87 28.071 -4.692 -2.391 1.00 0.00 C ATOM 107 CG LEU A 87 27.853 -5.120 -3.855 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.933 -6.133 -4.272 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.462 -5.762 -4.022 1.00 0.00 C ATOM 0 H LEU A 87 29.073 -2.542 -3.015 1.00 0.00 H new ATOM 0 HA LEU A 87 26.404 -3.330 -2.640 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.137 -4.594 -2.188 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.688 -5.460 -1.719 1.00 0.00 H new ATOM 0 HG LEU A 87 27.919 -4.235 -4.488 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.772 -6.431 -5.308 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.918 -5.676 -4.175 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.876 -7.011 -3.629 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.321 -6.060 -5.061 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.387 -6.639 -3.380 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.693 -5.042 -3.744 1.00 0.00 H new ATOM 121 N GLN A 88 28.125 -2.827 0.107 1.00 0.00 N ATOM 122 CA GLN A 88 27.976 -2.640 1.543 1.00 0.00 C ATOM 123 C GLN A 88 27.183 -1.366 1.838 1.00 0.00 C ATOM 124 O GLN A 88 26.496 -1.281 2.856 1.00 0.00 O ATOM 125 CB GLN A 88 29.343 -2.572 2.223 1.00 0.00 C ATOM 126 CG GLN A 88 30.190 -1.514 1.533 1.00 0.00 C ATOM 127 CD GLN A 88 31.503 -1.316 2.275 1.00 0.00 C ATOM 128 OE1 GLN A 88 31.516 -0.804 3.393 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.617 -1.690 1.708 1.00 0.00 N ATOM 0 H GLN A 88 29.060 -2.645 -0.257 1.00 0.00 H new ATOM 0 HA GLN A 88 27.430 -3.495 1.941 1.00 0.00 H new ATOM 0 HB2 GLN A 88 29.226 -2.330 3.279 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.837 -3.542 2.171 1.00 0.00 H new ATOM 0 HG2 GLN A 88 30.389 -1.813 0.504 1.00 0.00 H new ATOM 0 HG3 GLN A 88 29.643 -0.572 1.492 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.600 -2.114 0.781 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.505 -1.558 2.192 1.00 0.00 H new ATOM 138 N GLU A 89 27.281 -0.372 0.945 1.00 0.00 N ATOM 139 CA GLU A 89 26.560 0.888 1.146 1.00 0.00 C ATOM 140 C GLU A 89 25.049 0.678 1.078 1.00 0.00 C ATOM 141 O GLU A 89 24.301 1.226 1.886 1.00 0.00 O ATOM 142 CB GLU A 89 26.986 1.911 0.089 1.00 0.00 C ATOM 143 CG GLU A 89 28.387 2.434 0.414 1.00 0.00 C ATOM 144 CD GLU A 89 28.915 3.265 -0.747 1.00 0.00 C ATOM 145 OE1 GLU A 89 28.187 3.423 -1.714 1.00 0.00 O ATOM 146 OE2 GLU A 89 30.039 3.730 -0.658 1.00 0.00 O1- ATOM 0 H GLU A 89 27.841 -0.415 0.094 1.00 0.00 H new ATOM 0 HA GLU A 89 26.810 1.263 2.139 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.979 1.452 -0.899 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.276 2.737 0.062 1.00 0.00 H new ATOM 0 HG2 GLU A 89 28.357 3.038 1.321 1.00 0.00 H new ATOM 0 HG3 GLU A 89 29.060 1.599 0.610 1.00 0.00 H new ATOM 153 N ILE A 90 24.608 -0.116 0.112 1.00 0.00 N ATOM 154 CA ILE A 90 23.186 -0.394 -0.045 1.00 0.00 C ATOM 155 C ILE A 90 22.685 -1.313 1.067 1.00 0.00 C ATOM 156 O ILE A 90 21.549 -1.194 1.514 1.00 0.00 O ATOM 157 CB ILE A 90 22.927 -1.026 -1.414 1.00 0.00 C ATOM 158 CG1 ILE A 90 23.812 -2.261 -1.581 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.253 -0.012 -2.514 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.494 -2.945 -2.909 1.00 0.00 C ATOM 0 H ILE A 90 25.209 -0.577 -0.571 1.00 0.00 H new ATOM 0 HA ILE A 90 22.640 0.547 0.022 1.00 0.00 H new ATOM 0 HB ILE A 90 21.879 -1.317 -1.487 1.00 0.00 H new ATOM 0 HG12 ILE A 90 24.863 -1.974 -1.551 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.647 -2.953 -0.755 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.069 -0.462 -3.490 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.622 0.869 -2.395 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.301 0.280 -2.441 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.126 -3.825 -3.026 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.447 -3.246 -2.921 1.00 0.00 H new ATOM 0 HD13 ILE A 90 23.682 -2.252 -3.729 1.00 0.00 H new ATOM 172 N ALA A 91 23.534 -2.242 1.494 1.00 0.00 N ATOM 173 CA ALA A 91 23.154 -3.186 2.542 1.00 0.00 C ATOM 174 C ALA A 91 22.691 -2.451 3.796 1.00 0.00 C ATOM 175 O ALA A 91 21.629 -2.748 4.343 1.00 0.00 O ATOM 176 CB ALA A 91 24.337 -4.091 2.893 1.00 0.00 C ATOM 0 H ALA A 91 24.481 -2.362 1.135 1.00 0.00 H new ATOM 0 HA ALA A 91 22.330 -3.792 2.165 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.041 -4.790 3.675 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.645 -4.647 2.007 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.169 -3.482 3.247 1.00 0.00 H new ATOM 182 N GLN A 92 23.488 -1.486 4.242 1.00 0.00 N ATOM 183 CA GLN A 92 23.139 -0.713 5.426 1.00 0.00 C ATOM 184 C GLN A 92 21.922 0.165 5.152 1.00 0.00 C ATOM 185 O GLN A 92 21.062 0.339 6.016 1.00 0.00 O ATOM 186 CB GLN A 92 24.325 0.157 5.860 1.00 0.00 C ATOM 187 CG GLN A 92 24.826 0.973 4.668 1.00 0.00 C ATOM 188 CD GLN A 92 26.026 1.818 5.077 1.00 0.00 C ATOM 189 OE1 GLN A 92 26.624 1.587 6.126 1.00 0.00 O ATOM 190 NE2 GLN A 92 26.415 2.792 4.299 1.00 0.00 N ATOM 0 H GLN A 92 24.372 -1.223 3.806 1.00 0.00 H new ATOM 0 HA GLN A 92 22.895 -1.407 6.230 1.00 0.00 H new ATOM 0 HB2 GLN A 92 24.024 0.823 6.669 1.00 0.00 H new ATOM 0 HB3 GLN A 92 25.128 -0.471 6.247 1.00 0.00 H new ATOM 0 HG2 GLN A 92 25.103 0.306 3.852 1.00 0.00 H new ATOM 0 HG3 GLN A 92 24.028 1.616 4.297 1.00 0.00 H new ATOM 0 HE21 GLN A 92 25.916 2.980 3.429 1.00 0.00 H new ATOM 0 HE22 GLN A 92 27.218 3.364 4.561 1.00 0.00 H new ATOM 199 N LYS A 93 21.857 0.715 3.944 1.00 0.00 N ATOM 200 CA LYS A 93 20.742 1.575 3.568 1.00 0.00 C ATOM 201 C LYS A 93 19.433 0.792 3.599 1.00 0.00 C ATOM 202 O LYS A 93 18.437 1.248 4.157 1.00 0.00 O ATOM 203 CB LYS A 93 20.974 2.129 2.161 1.00 0.00 C ATOM 204 CG LYS A 93 19.870 3.129 1.817 1.00 0.00 C ATOM 205 CD LYS A 93 20.137 3.728 0.436 1.00 0.00 C ATOM 206 CE LYS A 93 19.041 4.739 0.098 1.00 0.00 C ATOM 207 NZ LYS A 93 19.110 5.883 1.051 1.00 0.00 N1+ ATOM 0 H LYS A 93 22.557 0.582 3.214 1.00 0.00 H new ATOM 0 HA LYS A 93 20.677 2.398 4.280 1.00 0.00 H new ATOM 0 HB2 LYS A 93 21.949 2.614 2.106 1.00 0.00 H new ATOM 0 HB3 LYS A 93 20.981 1.316 1.435 1.00 0.00 H new ATOM 0 HG2 LYS A 93 18.899 2.633 1.829 1.00 0.00 H new ATOM 0 HG3 LYS A 93 19.834 3.919 2.567 1.00 0.00 H new ATOM 0 HD2 LYS A 93 21.112 4.214 0.421 1.00 0.00 H new ATOM 0 HD3 LYS A 93 20.163 2.939 -0.316 1.00 0.00 H new ATOM 0 HE2 LYS A 93 19.163 5.096 -0.925 1.00 0.00 H new ATOM 0 HE3 LYS A 93 18.062 4.263 0.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 18.621 6.705 0.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 18.652 5.617 1.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 20.105 6.126 1.230 1.00 0.00 H new ATOM 221 N GLU A 94 19.452 -0.387 2.990 1.00 0.00 N ATOM 222 CA GLU A 94 18.269 -1.239 2.938 1.00 0.00 C ATOM 223 C GLU A 94 18.048 -1.928 4.280 1.00 0.00 C ATOM 224 O GLU A 94 17.073 -2.657 4.461 1.00 0.00 O ATOM 225 CB GLU A 94 18.445 -2.297 1.845 1.00 0.00 C ATOM 226 CG GLU A 94 18.509 -1.620 0.471 1.00 0.00 C ATOM 227 CD GLU A 94 17.174 -0.956 0.146 1.00 0.00 C ATOM 228 OE1 GLU A 94 16.166 -1.638 0.215 1.00 0.00 O ATOM 229 OE2 GLU A 94 17.181 0.223 -0.164 1.00 0.00 O1- ATOM 0 H GLU A 94 20.273 -0.775 2.525 1.00 0.00 H new ATOM 0 HA GLU A 94 17.402 -0.618 2.714 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.357 -2.868 2.022 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.616 -3.004 1.874 1.00 0.00 H new ATOM 0 HG2 GLU A 94 19.305 -0.876 0.461 1.00 0.00 H new ATOM 0 HG3 GLU A 94 18.752 -2.357 -0.294 1.00 0.00 H new ATOM 236 N SER A 95 18.965 -1.695 5.215 1.00 0.00 N ATOM 237 CA SER A 95 18.865 -2.303 6.537 1.00 0.00 C ATOM 238 C SER A 95 19.238 -3.782 6.459 1.00 0.00 C ATOM 239 O SER A 95 19.145 -4.511 7.447 1.00 0.00 O ATOM 240 CB SER A 95 17.434 -2.141 7.077 1.00 0.00 C ATOM 241 OG SER A 95 16.867 -0.952 6.542 1.00 0.00 O ATOM 0 H SER A 95 19.779 -1.095 5.083 1.00 0.00 H new ATOM 0 HA SER A 95 19.556 -1.804 7.216 1.00 0.00 H new ATOM 0 HB2 SER A 95 16.828 -3.004 6.801 1.00 0.00 H new ATOM 0 HB3 SER A 95 17.446 -2.095 8.166 1.00 0.00 H new ATOM 0 HG SER A 95 15.954 -0.844 6.881 1.00 0.00 H new ATOM 247 N SER A 96 19.664 -4.212 5.277 1.00 0.00 N ATOM 248 CA SER A 96 20.054 -5.602 5.069 1.00 0.00 C ATOM 249 C SER A 96 21.406 -5.875 5.720 1.00 0.00 C ATOM 250 O SER A 96 22.150 -4.946 6.036 1.00 0.00 O ATOM 251 CB SER A 96 20.125 -5.906 3.571 1.00 0.00 C ATOM 252 OG SER A 96 18.805 -6.042 3.060 1.00 0.00 O ATOM 0 H SER A 96 19.748 -3.621 4.450 1.00 0.00 H new ATOM 0 HA SER A 96 19.306 -6.248 5.529 1.00 0.00 H new ATOM 0 HB2 SER A 96 20.649 -5.105 3.049 1.00 0.00 H new ATOM 0 HB3 SER A 96 20.691 -6.822 3.400 1.00 0.00 H new ATOM 0 HG SER A 96 18.844 -6.235 2.100 1.00 0.00 H new ATOM 258 N LEU A 97 21.717 -7.150 5.920 1.00 0.00 N ATOM 259 CA LEU A 97 22.981 -7.522 6.540 1.00 0.00 C ATOM 260 C LEU A 97 24.129 -7.304 5.559 1.00 0.00 C ATOM 261 O LEU A 97 24.053 -7.702 4.398 1.00 0.00 O ATOM 262 CB LEU A 97 22.938 -8.996 6.971 1.00 0.00 C ATOM 263 CG LEU A 97 22.173 -9.126 8.292 1.00 0.00 C ATOM 264 CD1 LEU A 97 20.730 -8.652 8.102 1.00 0.00 C ATOM 265 CD2 LEU A 97 22.178 -10.591 8.733 1.00 0.00 C ATOM 0 H LEU A 97 21.118 -7.935 5.665 1.00 0.00 H new ATOM 0 HA LEU A 97 23.141 -6.897 7.418 1.00 0.00 H new ATOM 0 HB2 LEU A 97 22.456 -9.596 6.200 1.00 0.00 H new ATOM 0 HB3 LEU A 97 23.951 -9.381 7.087 1.00 0.00 H new ATOM 0 HG LEU A 97 22.653 -8.512 9.054 1.00 0.00 H new ATOM 0 HD11 LEU A 97 20.189 -8.746 9.044 1.00 0.00 H new ATOM 0 HD12 LEU A 97 20.728 -7.609 7.785 1.00 0.00 H new ATOM 0 HD13 LEU A 97 20.243 -9.263 7.342 1.00 0.00 H new ATOM 0 HD21 LEU A 97 21.635 -10.690 9.673 1.00 0.00 H new ATOM 0 HD22 LEU A 97 21.697 -11.202 7.970 1.00 0.00 H new ATOM 0 HD23 LEU A 97 23.206 -10.926 8.871 1.00 0.00 H new ATOM 277 N LEU A 98 25.189 -6.660 6.036 1.00 0.00 N ATOM 278 CA LEU A 98 26.345 -6.383 5.198 1.00 0.00 C ATOM 279 C LEU A 98 26.741 -7.627 4.393 1.00 0.00 C ATOM 280 O LEU A 98 26.547 -8.755 4.853 1.00 0.00 O ATOM 281 CB LEU A 98 27.526 -5.928 6.072 1.00 0.00 C ATOM 282 CG LEU A 98 27.362 -4.449 6.440 1.00 0.00 C ATOM 283 CD1 LEU A 98 26.082 -4.259 7.259 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.572 -3.995 7.258 1.00 0.00 C ATOM 0 H LEU A 98 25.270 -6.322 6.995 1.00 0.00 H new ATOM 0 HA LEU A 98 26.084 -5.588 4.500 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.575 -6.534 6.977 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.464 -6.077 5.537 1.00 0.00 H new ATOM 0 HG LEU A 98 27.294 -3.852 5.530 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.969 -3.206 7.519 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.223 -4.582 6.671 1.00 0.00 H new ATOM 0 HD13 LEU A 98 26.142 -4.853 8.171 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.459 -2.943 7.522 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.641 -4.592 8.167 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.479 -4.126 6.669 1.00 0.00 H new ATOM 296 N PRO A 99 27.290 -7.448 3.212 1.00 0.00 N ATOM 297 CA PRO A 99 27.717 -8.581 2.343 1.00 0.00 C ATOM 298 C PRO A 99 28.971 -9.262 2.884 1.00 0.00 C ATOM 299 O PRO A 99 29.856 -8.598 3.425 1.00 0.00 O ATOM 300 CB PRO A 99 27.988 -7.901 0.992 1.00 0.00 C ATOM 301 CG PRO A 99 28.411 -6.518 1.353 1.00 0.00 C ATOM 302 CD PRO A 99 27.576 -6.145 2.576 1.00 0.00 C ATOM 0 HA PRO A 99 26.971 -9.374 2.282 1.00 0.00 H new ATOM 0 HB2 PRO A 99 28.766 -8.422 0.434 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.097 -7.893 0.365 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.477 -6.479 1.578 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.234 -5.825 0.530 1.00 0.00 H new ATOM 0 HD2 PRO A 99 28.122 -5.482 3.247 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.660 -5.627 2.293 1.00 0.00 H new ATOM 310 N PHE A 100 29.050 -10.586 2.743 1.00 0.00 N ATOM 311 CA PHE A 100 30.201 -11.339 3.221 1.00 0.00 C ATOM 312 C PHE A 100 30.723 -12.190 2.087 1.00 0.00 C ATOM 313 O PHE A 100 29.955 -12.888 1.422 1.00 0.00 O ATOM 314 CB PHE A 100 29.802 -12.234 4.397 1.00 0.00 C ATOM 315 CG PHE A 100 30.996 -13.051 4.832 1.00 0.00 C ATOM 316 CD1 PHE A 100 32.046 -12.433 5.520 1.00 0.00 C ATOM 317 CD2 PHE A 100 31.056 -14.421 4.545 1.00 0.00 C ATOM 318 CE1 PHE A 100 33.156 -13.184 5.923 1.00 0.00 C ATOM 319 CE2 PHE A 100 32.166 -15.172 4.948 1.00 0.00 C ATOM 320 CZ PHE A 100 33.217 -14.552 5.637 1.00 0.00 C ATOM 0 H PHE A 100 28.328 -11.155 2.301 1.00 0.00 H new ATOM 0 HA PHE A 100 30.973 -10.649 3.561 1.00 0.00 H new ATOM 0 HB2 PHE A 100 29.442 -11.625 5.226 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.983 -12.892 4.106 1.00 0.00 H new ATOM 0 HD1 PHE A 100 32.000 -11.377 5.740 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.246 -14.897 4.013 1.00 0.00 H new ATOM 0 HE1 PHE A 100 33.966 -12.707 6.455 1.00 0.00 H new ATOM 0 HE2 PHE A 100 32.213 -16.228 4.728 1.00 0.00 H new ATOM 0 HZ PHE A 100 34.075 -15.131 5.947 1.00 0.00 H new ATOM 330 N TYR A 101 32.024 -12.126 1.849 1.00 0.00 N ATOM 331 CA TYR A 101 32.625 -12.890 0.768 1.00 0.00 C ATOM 332 C TYR A 101 33.281 -14.148 1.321 1.00 0.00 C ATOM 333 O TYR A 101 33.789 -14.149 2.442 1.00 0.00 O ATOM 334 CB TYR A 101 33.672 -12.040 0.047 1.00 0.00 C ATOM 335 CG TYR A 101 33.033 -10.754 -0.421 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.318 -10.718 -1.624 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.151 -9.597 0.357 1.00 0.00 C ATOM 338 CE1 TYR A 101 31.721 -9.524 -2.049 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.554 -8.403 -0.066 1.00 0.00 C ATOM 340 CZ TYR A 101 31.838 -8.367 -1.267 1.00 0.00 C ATOM 341 OH TYR A 101 31.246 -7.192 -1.678 1.00 0.00 O ATOM 0 H TYR A 101 32.679 -11.557 2.385 1.00 0.00 H new ATOM 0 HA TYR A 101 31.845 -13.174 0.062 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.505 -11.823 0.716 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.080 -12.588 -0.803 1.00 0.00 H new ATOM 0 HD1 TYR A 101 32.227 -11.611 -2.225 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.703 -9.625 1.285 1.00 0.00 H new ATOM 0 HE1 TYR A 101 31.171 -9.495 -2.978 1.00 0.00 H new ATOM 0 HE2 TYR A 101 32.646 -7.510 0.535 1.00 0.00 H new ATOM 0 HH TYR A 101 31.424 -6.488 -1.019 1.00 0.00 H new ATOM 351 N ALA A 102 33.269 -15.218 0.532 1.00 0.00 N ATOM 352 CA ALA A 102 33.870 -16.484 0.955 1.00 0.00 C ATOM 353 C ALA A 102 34.473 -17.211 -0.241 1.00 0.00 C ATOM 354 O ALA A 102 33.956 -17.121 -1.352 1.00 0.00 O ATOM 355 CB ALA A 102 32.817 -17.374 1.620 1.00 0.00 C ATOM 0 H ALA A 102 32.853 -15.237 -0.399 1.00 0.00 H new ATOM 0 HA ALA A 102 34.660 -16.266 1.674 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.277 -18.312 1.930 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.409 -16.864 2.493 1.00 0.00 H new ATOM 0 HB3 ALA A 102 32.015 -17.580 0.912 1.00 0.00 H new ATOM 361 N THR A 103 35.568 -17.936 -0.003 1.00 0.00 N ATOM 362 CA THR A 103 36.243 -18.689 -1.066 1.00 0.00 C ATOM 363 C THR A 103 36.301 -20.175 -0.711 1.00 0.00 C ATOM 364 O THR A 103 36.748 -20.544 0.375 1.00 0.00 O ATOM 365 CB THR A 103 37.668 -18.162 -1.259 1.00 0.00 C ATOM 366 OG1 THR A 103 37.617 -16.798 -1.650 1.00 0.00 O ATOM 367 CG2 THR A 103 38.376 -18.978 -2.341 1.00 0.00 C ATOM 0 H THR A 103 36.007 -18.019 0.914 1.00 0.00 H new ATOM 0 HA THR A 103 35.678 -18.562 -1.989 1.00 0.00 H new ATOM 0 HB THR A 103 38.218 -18.253 -0.322 1.00 0.00 H new ATOM 0 HG1 THR A 103 36.767 -16.619 -2.104 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.390 -18.601 -2.476 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.415 -20.025 -2.040 1.00 0.00 H new ATOM 0 HG23 THR A 103 37.828 -18.891 -3.279 1.00 0.00 H new ATOM 375 N ALA A 104 35.850 -21.030 -1.635 1.00 0.00 N ATOM 376 CA ALA A 104 35.859 -22.480 -1.414 1.00 0.00 C ATOM 377 C ALA A 104 36.787 -23.154 -2.421 1.00 0.00 C ATOM 378 O ALA A 104 36.874 -22.733 -3.572 1.00 0.00 O ATOM 379 CB ALA A 104 34.440 -23.036 -1.568 1.00 0.00 C ATOM 0 H ALA A 104 35.475 -20.744 -2.540 1.00 0.00 H new ATOM 0 HA ALA A 104 36.218 -22.684 -0.405 1.00 0.00 H new ATOM 0 HB1 ALA A 104 34.451 -24.113 -1.403 1.00 0.00 H new ATOM 0 HB2 ALA A 104 33.783 -22.564 -0.837 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.074 -22.827 -2.573 1.00 0.00 H new ATOM 385 N THR A 105 37.477 -24.208 -1.983 1.00 0.00 N ATOM 386 CA THR A 105 38.390 -24.940 -2.843 1.00 0.00 C ATOM 387 C THR A 105 37.784 -26.284 -3.220 1.00 0.00 C ATOM 388 O THR A 105 37.246 -26.994 -2.372 1.00 0.00 O ATOM 389 CB THR A 105 39.697 -25.170 -2.095 1.00 0.00 C ATOM 390 OG1 THR A 105 39.482 -26.111 -1.053 1.00 0.00 O ATOM 391 CG2 THR A 105 40.198 -23.850 -1.504 1.00 0.00 C ATOM 0 H THR A 105 37.416 -24.570 -1.032 1.00 0.00 H new ATOM 0 HA THR A 105 38.573 -24.364 -3.750 1.00 0.00 H new ATOM 0 HB THR A 105 40.447 -25.556 -2.786 1.00 0.00 H new ATOM 0 HG1 THR A 105 40.322 -26.263 -0.571 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.133 -24.022 -0.971 1.00 0.00 H new ATOM 0 HG22 THR A 105 40.365 -23.132 -2.307 1.00 0.00 H new ATOM 0 HG23 THR A 105 39.453 -23.455 -0.813 1.00 0.00 H new ATOM 399 N SER A 106 37.876 -26.630 -4.495 1.00 0.00 N ATOM 400 CA SER A 106 37.334 -27.893 -4.971 1.00 0.00 C ATOM 401 C SER A 106 37.894 -28.218 -6.344 1.00 0.00 C ATOM 402 O SER A 106 38.404 -27.336 -7.037 1.00 0.00 O ATOM 403 CB SER A 106 35.811 -27.815 -5.048 1.00 0.00 C ATOM 404 OG SER A 106 35.305 -29.034 -5.578 1.00 0.00 O ATOM 0 H SER A 106 38.318 -26.058 -5.215 1.00 0.00 H new ATOM 0 HA SER A 106 37.619 -28.679 -4.272 1.00 0.00 H new ATOM 0 HB2 SER A 106 35.394 -27.635 -4.057 1.00 0.00 H new ATOM 0 HB3 SER A 106 35.509 -26.978 -5.678 1.00 0.00 H new ATOM 0 HG SER A 106 34.327 -28.988 -5.627 1.00 0.00 H new ATOM 410 N GLY A 107 37.787 -29.486 -6.743 1.00 0.00 N ATOM 411 CA GLY A 107 38.280 -29.918 -8.053 1.00 0.00 C ATOM 412 C GLY A 107 39.306 -31.042 -7.916 1.00 0.00 C ATOM 413 O GLY A 107 39.594 -31.497 -6.810 1.00 0.00 O ATOM 0 H GLY A 107 37.367 -30.228 -6.183 1.00 0.00 H new ATOM 0 HA2 GLY A 107 37.444 -30.258 -8.665 1.00 0.00 H new ATOM 0 HA3 GLY A 107 38.731 -29.072 -8.571 1.00 0.00 H new ATOM 417 N PRO A 108 39.862 -31.495 -9.016 1.00 0.00 N ATOM 418 CA PRO A 108 40.882 -32.591 -9.017 1.00 0.00 C ATOM 419 C PRO A 108 42.134 -32.217 -8.233 1.00 0.00 C ATOM 420 O PRO A 108 42.512 -31.048 -8.163 1.00 0.00 O ATOM 421 CB PRO A 108 41.214 -32.790 -10.511 1.00 0.00 C ATOM 422 CG PRO A 108 40.779 -31.535 -11.180 1.00 0.00 C ATOM 423 CD PRO A 108 39.585 -31.020 -10.384 1.00 0.00 C ATOM 0 HA PRO A 108 40.504 -33.493 -8.536 1.00 0.00 H new ATOM 0 HB2 PRO A 108 42.280 -32.965 -10.657 1.00 0.00 H new ATOM 0 HB3 PRO A 108 40.690 -33.655 -10.919 1.00 0.00 H new ATOM 0 HG2 PRO A 108 41.585 -30.801 -11.192 1.00 0.00 H new ATOM 0 HG3 PRO A 108 40.503 -31.723 -12.218 1.00 0.00 H new ATOM 0 HD2 PRO A 108 39.512 -29.933 -10.426 1.00 0.00 H new ATOM 0 HD3 PRO A 108 38.645 -31.418 -10.766 1.00 0.00 H new ATOM 431 N SER A 109 42.780 -33.226 -7.666 1.00 0.00 N ATOM 432 CA SER A 109 43.999 -33.002 -6.908 1.00 0.00 C ATOM 433 C SER A 109 45.088 -32.463 -7.829 1.00 0.00 C ATOM 434 O SER A 109 46.077 -31.891 -7.366 1.00 0.00 O ATOM 435 CB SER A 109 44.471 -34.310 -6.273 1.00 0.00 C ATOM 436 OG SER A 109 45.634 -34.060 -5.494 1.00 0.00 O ATOM 0 H SER A 109 42.482 -34.200 -7.717 1.00 0.00 H new ATOM 0 HA SER A 109 43.795 -32.275 -6.121 1.00 0.00 H new ATOM 0 HB2 SER A 109 43.683 -34.729 -5.647 1.00 0.00 H new ATOM 0 HB3 SER A 109 44.689 -35.046 -7.047 1.00 0.00 H new ATOM 0 HG SER A 109 45.939 -34.896 -5.084 1.00 0.00 H new ATOM 442 N HIS A 110 44.899 -32.646 -9.139 1.00 0.00 N ATOM 443 CA HIS A 110 45.874 -32.168 -10.119 1.00 0.00 C ATOM 444 C HIS A 110 45.521 -30.762 -10.570 1.00 0.00 C ATOM 445 O HIS A 110 46.401 -29.922 -10.767 1.00 0.00 O ATOM 446 CB HIS A 110 45.909 -33.102 -11.332 1.00 0.00 C ATOM 447 CG HIS A 110 46.581 -34.392 -10.953 1.00 0.00 C ATOM 448 ND1 HIS A 110 45.888 -35.446 -10.383 1.00 0.00 N ATOM 449 CD2 HIS A 110 47.886 -34.808 -11.049 1.00 0.00 C ATOM 450 CE1 HIS A 110 46.770 -36.438 -10.158 1.00 0.00 C ATOM 451 NE2 HIS A 110 48.003 -36.101 -10.548 1.00 0.00 N ATOM 0 H HIS A 110 44.088 -33.117 -9.541 1.00 0.00 H new ATOM 0 HA HIS A 110 46.857 -32.156 -9.649 1.00 0.00 H new ATOM 0 HB2 HIS A 110 44.896 -33.297 -11.683 1.00 0.00 H new ATOM 0 HB3 HIS A 110 46.446 -32.628 -12.154 1.00 0.00 H new ATOM 0 HD2 HIS A 110 48.698 -34.221 -11.452 1.00 0.00 H new ATOM 0 HE1 HIS A 110 46.513 -37.389 -9.716 1.00 0.00 H new ATOM 0 HE2 HIS A 110 48.848 -36.669 -10.491 1.00 0.00 H new ATOM 459 N ALA A 111 44.223 -30.502 -10.723 1.00 0.00 N ATOM 460 CA ALA A 111 43.753 -29.182 -11.142 1.00 0.00 C ATOM 461 C ALA A 111 42.753 -28.624 -10.115 1.00 0.00 C ATOM 462 O ALA A 111 41.542 -28.670 -10.327 1.00 0.00 O ATOM 463 CB ALA A 111 43.123 -29.271 -12.553 1.00 0.00 C ATOM 0 H ALA A 111 43.481 -31.184 -10.564 1.00 0.00 H new ATOM 0 HA ALA A 111 44.598 -28.496 -11.191 1.00 0.00 H new ATOM 0 HB1 ALA A 111 42.775 -28.284 -12.859 1.00 0.00 H new ATOM 0 HB2 ALA A 111 43.869 -29.629 -13.263 1.00 0.00 H new ATOM 0 HB3 ALA A 111 42.281 -29.963 -12.532 1.00 0.00 H new ATOM 469 N PRO A 112 43.242 -28.086 -9.015 1.00 0.00 N ATOM 470 CA PRO A 112 42.375 -27.506 -7.950 1.00 0.00 C ATOM 471 C PRO A 112 41.911 -26.091 -8.292 1.00 0.00 C ATOM 472 O PRO A 112 42.722 -25.192 -8.517 1.00 0.00 O ATOM 473 CB PRO A 112 43.269 -27.525 -6.698 1.00 0.00 C ATOM 474 CG PRO A 112 44.680 -27.450 -7.211 1.00 0.00 C ATOM 475 CD PRO A 112 44.673 -27.977 -8.662 1.00 0.00 C ATOM 0 HA PRO A 112 41.452 -28.070 -7.816 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.044 -26.683 -6.043 1.00 0.00 H new ATOM 0 HB3 PRO A 112 43.111 -28.433 -6.116 1.00 0.00 H new ATOM 0 HG2 PRO A 112 45.047 -26.424 -7.177 1.00 0.00 H new ATOM 0 HG3 PRO A 112 45.347 -28.047 -6.589 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.196 -27.296 -9.333 1.00 0.00 H new ATOM 0 HD3 PRO A 112 45.173 -28.943 -8.735 1.00 0.00 H new ATOM 483 N THR A 113 40.592 -25.911 -8.333 1.00 0.00 N ATOM 484 CA THR A 113 39.990 -24.614 -8.647 1.00 0.00 C ATOM 485 C THR A 113 39.354 -24.023 -7.403 1.00 0.00 C ATOM 486 O THR A 113 39.253 -24.686 -6.371 1.00 0.00 O ATOM 487 CB THR A 113 38.926 -24.774 -9.740 1.00 0.00 C ATOM 488 OG1 THR A 113 37.706 -25.205 -9.152 1.00 0.00 O ATOM 489 CG2 THR A 113 39.391 -25.812 -10.766 1.00 0.00 C ATOM 0 H THR A 113 39.915 -26.652 -8.152 1.00 0.00 H new ATOM 0 HA THR A 113 40.772 -23.945 -9.006 1.00 0.00 H new ATOM 0 HB THR A 113 38.774 -23.817 -10.239 1.00 0.00 H new ATOM 0 HG1 THR A 113 37.890 -25.909 -8.496 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.632 -25.923 -11.541 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.326 -25.483 -11.218 1.00 0.00 H new ATOM 0 HG23 THR A 113 39.546 -26.770 -10.270 1.00 0.00 H new ATOM 497 N PHE A 114 38.929 -22.769 -7.503 1.00 0.00 N ATOM 498 CA PHE A 114 38.304 -22.084 -6.372 1.00 0.00 C ATOM 499 C PHE A 114 37.042 -21.362 -6.827 1.00 0.00 C ATOM 500 O PHE A 114 36.959 -20.898 -7.963 1.00 0.00 O ATOM 501 CB PHE A 114 39.297 -21.075 -5.773 1.00 0.00 C ATOM 502 CG PHE A 114 40.704 -21.573 -6.009 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.214 -22.633 -5.252 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.490 -20.980 -6.998 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.514 -23.094 -5.480 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.787 -21.440 -7.227 1.00 0.00 C ATOM 507 CZ PHE A 114 43.304 -22.496 -6.468 1.00 0.00 C ATOM 0 H PHE A 114 39.004 -22.206 -8.350 1.00 0.00 H new ATOM 0 HA PHE A 114 38.032 -22.819 -5.614 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.162 -20.096 -6.232 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.114 -20.955 -4.705 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.603 -23.096 -4.491 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.094 -20.165 -7.586 1.00 0.00 H new ATOM 0 HE1 PHE A 114 42.908 -23.911 -4.894 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.394 -20.980 -7.992 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.310 -22.848 -6.644 1.00 0.00 H new ATOM 517 N THR A 115 36.066 -21.262 -5.930 1.00 0.00 N ATOM 518 CA THR A 115 34.808 -20.581 -6.237 1.00 0.00 C ATOM 519 C THR A 115 34.481 -19.573 -5.149 1.00 0.00 C ATOM 520 O THR A 115 34.444 -19.915 -3.967 1.00 0.00 O ATOM 521 CB THR A 115 33.675 -21.601 -6.337 1.00 0.00 C ATOM 522 OG1 THR A 115 33.967 -22.531 -7.370 1.00 0.00 O ATOM 523 CG2 THR A 115 32.363 -20.877 -6.650 1.00 0.00 C ATOM 0 H THR A 115 36.120 -21.643 -4.985 1.00 0.00 H new ATOM 0 HA THR A 115 34.915 -20.062 -7.189 1.00 0.00 H new ATOM 0 HB THR A 115 33.576 -22.132 -5.390 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.242 -23.187 -7.434 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.554 -21.604 -6.722 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.142 -20.165 -5.855 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.458 -20.345 -7.597 1.00 0.00 H new ATOM 531 N SER A 116 34.240 -18.326 -5.549 1.00 0.00 N ATOM 532 CA SER A 116 33.912 -17.277 -4.589 1.00 0.00 C ATOM 533 C SER A 116 32.403 -17.102 -4.494 1.00 0.00 C ATOM 534 O SER A 116 31.738 -16.816 -5.489 1.00 0.00 O ATOM 535 CB SER A 116 34.536 -15.955 -5.032 1.00 0.00 C ATOM 536 OG SER A 116 33.941 -14.887 -4.306 1.00 0.00 O ATOM 0 H SER A 116 34.265 -18.020 -6.522 1.00 0.00 H new ATOM 0 HA SER A 116 34.306 -17.565 -3.614 1.00 0.00 H new ATOM 0 HB2 SER A 116 35.612 -15.972 -4.859 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.387 -15.810 -6.102 1.00 0.00 H new ATOM 0 HG SER A 116 33.953 -15.096 -3.349 1.00 0.00 H new ATOM 542 N THR A 117 31.865 -17.276 -3.289 1.00 0.00 N ATOM 543 CA THR A 117 30.426 -17.138 -3.065 1.00 0.00 C ATOM 544 C THR A 117 30.149 -15.924 -2.189 1.00 0.00 C ATOM 545 O THR A 117 30.766 -15.750 -1.139 1.00 0.00 O ATOM 546 CB THR A 117 29.886 -18.395 -2.378 1.00 0.00 C ATOM 547 OG1 THR A 117 30.060 -19.512 -3.238 1.00 0.00 O ATOM 548 CG2 THR A 117 28.400 -18.216 -2.067 1.00 0.00 C ATOM 0 H THR A 117 32.401 -17.512 -2.454 1.00 0.00 H new ATOM 0 HA THR A 117 29.930 -17.008 -4.027 1.00 0.00 H new ATOM 0 HB THR A 117 30.429 -18.561 -1.448 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.717 -20.319 -2.800 1.00 0.00 H new ATOM 0 HG21 THR A 117 28.020 -19.113 -1.578 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.267 -17.359 -1.407 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.852 -18.048 -2.994 1.00 0.00 H new ATOM 556 N VAL A 118 29.216 -15.080 -2.632 1.00 0.00 N ATOM 557 CA VAL A 118 28.859 -13.870 -1.885 1.00 0.00 C ATOM 558 C VAL A 118 27.428 -13.976 -1.373 1.00 0.00 C ATOM 559 O VAL A 118 26.551 -14.497 -2.059 1.00 0.00 O ATOM 560 CB VAL A 118 28.998 -12.640 -2.784 1.00 0.00 C ATOM 561 CG1 VAL A 118 27.913 -12.667 -3.863 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.848 -11.375 -1.937 1.00 0.00 C ATOM 0 H VAL A 118 28.695 -15.210 -3.500 1.00 0.00 H new ATOM 0 HA VAL A 118 29.534 -13.769 -1.035 1.00 0.00 H new ATOM 0 HB VAL A 118 29.978 -12.646 -3.260 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.014 -11.790 -4.502 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.021 -13.569 -4.465 1.00 0.00 H new ATOM 0 HG13 VAL A 118 26.930 -12.661 -3.391 1.00 0.00 H new ATOM 0 HG21 VAL A 118 28.947 -10.496 -2.575 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.867 -11.370 -1.461 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.623 -11.356 -1.171 1.00 0.00 H new ATOM 572 N GLU A 119 27.201 -13.479 -0.156 1.00 0.00 N ATOM 573 CA GLU A 119 25.869 -13.524 0.452 1.00 0.00 C ATOM 574 C GLU A 119 25.428 -12.130 0.872 1.00 0.00 C ATOM 575 O GLU A 119 26.175 -11.401 1.521 1.00 0.00 O ATOM 576 CB GLU A 119 25.884 -14.444 1.672 1.00 0.00 C ATOM 577 CG GLU A 119 24.463 -14.586 2.219 1.00 0.00 C ATOM 578 CD GLU A 119 24.448 -15.575 3.378 1.00 0.00 C ATOM 579 OE1 GLU A 119 25.412 -16.309 3.517 1.00 0.00 O ATOM 580 OE2 GLU A 119 23.472 -15.583 4.111 1.00 0.00 O1- ATOM 0 H GLU A 119 27.917 -13.043 0.425 1.00 0.00 H new ATOM 0 HA GLU A 119 25.165 -13.910 -0.286 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.280 -15.422 1.399 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.542 -14.037 2.440 1.00 0.00 H new ATOM 0 HG2 GLU A 119 24.094 -13.616 2.553 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.793 -14.927 1.430 1.00 0.00 H new ATOM 587 N PHE A 120 24.203 -11.774 0.503 1.00 0.00 N ATOM 588 CA PHE A 120 23.665 -10.466 0.860 1.00 0.00 C ATOM 589 C PHE A 120 22.157 -10.425 0.617 1.00 0.00 C ATOM 590 O PHE A 120 21.627 -11.219 -0.156 1.00 0.00 O ATOM 591 CB PHE A 120 24.347 -9.375 0.035 1.00 0.00 C ATOM 592 CG PHE A 120 23.959 -9.519 -1.414 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.805 -8.886 -1.887 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.749 -10.276 -2.286 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.440 -9.008 -3.231 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.383 -10.400 -3.632 1.00 0.00 C ATOM 597 CZ PHE A 120 23.229 -9.765 -4.104 1.00 0.00 C ATOM 0 H PHE A 120 23.570 -12.364 -0.037 1.00 0.00 H new ATOM 0 HA PHE A 120 23.858 -10.291 1.918 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.056 -8.391 0.404 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.429 -9.448 0.141 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.195 -8.302 -1.213 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.641 -10.764 -1.921 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.549 -8.518 -3.595 1.00 0.00 H new ATOM 0 HE2 PHE A 120 24.991 -10.986 -4.305 1.00 0.00 H new ATOM 0 HZ PHE A 120 22.947 -9.859 -5.142 1.00 0.00 H new ATOM 607 N ALA A 121 21.470 -9.489 1.266 1.00 0.00 N ATOM 608 CA ALA A 121 20.024 -9.360 1.099 1.00 0.00 C ATOM 609 C ALA A 121 19.324 -10.692 1.362 1.00 0.00 C ATOM 610 O ALA A 121 18.179 -10.894 0.955 1.00 0.00 O ATOM 611 CB ALA A 121 19.700 -8.890 -0.323 1.00 0.00 C ATOM 0 H ALA A 121 21.886 -8.814 1.907 1.00 0.00 H new ATOM 0 HA ALA A 121 19.665 -8.626 1.820 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.620 -8.797 -0.438 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.169 -7.922 -0.502 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.080 -9.616 -1.042 1.00 0.00 H new ATOM 617 N GLY A 122 20.017 -11.594 2.052 1.00 0.00 N ATOM 618 CA GLY A 122 19.449 -12.901 2.372 1.00 0.00 C ATOM 619 C GLY A 122 19.502 -13.838 1.170 1.00 0.00 C ATOM 620 O GLY A 122 18.773 -14.829 1.108 1.00 0.00 O ATOM 0 H GLY A 122 20.965 -11.446 2.398 1.00 0.00 H new ATOM 0 HA2 GLY A 122 19.996 -13.343 3.205 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.415 -12.781 2.697 1.00 0.00 H new ATOM 624 N LYS A 123 20.375 -13.518 0.219 1.00 0.00 N ATOM 625 CA LYS A 123 20.539 -14.325 -0.991 1.00 0.00 C ATOM 626 C LYS A 123 22.014 -14.592 -1.255 1.00 0.00 C ATOM 627 O LYS A 123 22.877 -13.809 -0.859 1.00 0.00 O ATOM 628 CB LYS A 123 19.926 -13.597 -2.185 1.00 0.00 C ATOM 629 CG LYS A 123 18.408 -13.565 -2.034 1.00 0.00 C ATOM 630 CD LYS A 123 17.795 -12.841 -3.232 1.00 0.00 C ATOM 631 CE LYS A 123 16.276 -12.798 -3.074 1.00 0.00 C ATOM 632 NZ LYS A 123 15.675 -12.071 -4.227 1.00 0.00 N1+ ATOM 0 H LYS A 123 20.984 -12.701 0.262 1.00 0.00 H new ATOM 0 HA LYS A 123 20.030 -15.278 -0.847 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.318 -12.582 -2.246 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.200 -14.101 -3.112 1.00 0.00 H new ATOM 0 HG2 LYS A 123 18.016 -14.580 -1.969 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.134 -13.058 -1.109 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.193 -11.829 -3.302 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.061 -13.354 -4.156 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.877 -13.811 -3.021 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.011 -12.302 -2.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.641 -12.042 -4.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.047 -11.100 -4.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.917 -12.562 -5.111 1.00 0.00 H new ATOM 646 N VAL A 124 22.300 -15.707 -1.929 1.00 0.00 N ATOM 647 CA VAL A 124 23.679 -16.084 -2.248 1.00 0.00 C ATOM 648 C VAL A 124 23.866 -16.220 -3.755 1.00 0.00 C ATOM 649 O VAL A 124 23.110 -16.923 -4.426 1.00 0.00 O ATOM 650 CB VAL A 124 24.018 -17.416 -1.572 1.00 0.00 C ATOM 651 CG1 VAL A 124 23.123 -18.523 -2.138 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.484 -17.759 -1.837 1.00 0.00 C ATOM 0 H VAL A 124 21.596 -16.365 -2.265 1.00 0.00 H new ATOM 0 HA VAL A 124 24.345 -15.303 -1.881 1.00 0.00 H new ATOM 0 HB VAL A 124 23.851 -17.332 -0.498 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.366 -19.470 -1.656 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.078 -18.278 -1.950 1.00 0.00 H new ATOM 0 HG13 VAL A 124 23.287 -18.610 -3.212 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.728 -18.707 -1.357 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.650 -17.843 -2.911 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.121 -16.972 -1.432 1.00 0.00 H new ATOM 662 N PHE A 125 24.881 -15.537 -4.286 1.00 0.00 N ATOM 663 CA PHE A 125 25.172 -15.582 -5.721 1.00 0.00 C ATOM 664 C PHE A 125 26.483 -16.317 -5.973 1.00 0.00 C ATOM 665 O PHE A 125 27.539 -15.912 -5.474 1.00 0.00 O ATOM 666 CB PHE A 125 25.276 -14.158 -6.268 1.00 0.00 C ATOM 667 CG PHE A 125 23.943 -13.467 -6.121 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.518 -13.052 -4.855 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.136 -13.237 -7.242 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.287 -12.406 -4.708 1.00 0.00 C ATOM 671 CE2 PHE A 125 21.904 -12.589 -7.093 1.00 0.00 C ATOM 672 CZ PHE A 125 21.479 -12.176 -5.826 1.00 0.00 C ATOM 0 H PHE A 125 25.514 -14.947 -3.746 1.00 0.00 H new ATOM 0 HA PHE A 125 24.365 -16.113 -6.226 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.046 -13.605 -5.730 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.573 -14.180 -7.316 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.141 -13.231 -3.991 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.463 -13.559 -8.220 1.00 0.00 H new ATOM 0 HE1 PHE A 125 21.960 -12.084 -3.730 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.281 -12.408 -7.957 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.527 -11.679 -5.711 1.00 0.00 H new ATOM 682 N SER A 126 26.407 -17.397 -6.742 1.00 0.00 N ATOM 683 CA SER A 126 27.596 -18.179 -7.059 1.00 0.00 C ATOM 684 C SER A 126 28.402 -17.494 -8.160 1.00 0.00 C ATOM 685 O SER A 126 27.859 -17.130 -9.203 1.00 0.00 O ATOM 686 CB SER A 126 27.184 -19.580 -7.519 1.00 0.00 C ATOM 687 OG SER A 126 26.201 -20.097 -6.632 1.00 0.00 O ATOM 0 H SER A 126 25.543 -17.749 -7.154 1.00 0.00 H new ATOM 0 HA SER A 126 28.215 -18.257 -6.165 1.00 0.00 H new ATOM 0 HB2 SER A 126 26.789 -19.540 -8.534 1.00 0.00 H new ATOM 0 HB3 SER A 126 28.053 -20.238 -7.541 1.00 0.00 H new ATOM 0 HG SER A 126 25.934 -20.993 -6.926 1.00 0.00 H new ATOM 693 N GLY A 127 29.698 -17.319 -7.922 1.00 0.00 N ATOM 694 CA GLY A 127 30.567 -16.674 -8.903 1.00 0.00 C ATOM 695 C GLY A 127 31.055 -17.671 -9.943 1.00 0.00 C ATOM 696 O GLY A 127 30.618 -18.824 -9.967 1.00 0.00 O ATOM 0 H GLY A 127 30.168 -17.612 -7.065 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.027 -15.865 -9.395 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.421 -16.225 -8.397 1.00 0.00 H new ATOM 700 N GLU A 128 31.964 -17.224 -10.805 1.00 0.00 N ATOM 701 CA GLU A 128 32.509 -18.070 -11.838 1.00 0.00 C ATOM 702 C GLU A 128 33.557 -19.014 -11.256 1.00 0.00 C ATOM 703 O GLU A 128 34.034 -18.811 -10.140 1.00 0.00 O ATOM 704 CB GLU A 128 33.124 -17.195 -12.933 1.00 0.00 C ATOM 705 CG GLU A 128 33.716 -18.082 -14.013 1.00 0.00 C ATOM 706 CD GLU A 128 34.038 -17.268 -15.263 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.559 -16.152 -15.359 1.00 0.00 O ATOM 708 OE2 GLU A 128 34.753 -17.781 -16.110 1.00 0.00 O1- ATOM 0 H GLU A 128 32.334 -16.274 -10.800 1.00 0.00 H new ATOM 0 HA GLU A 128 31.711 -18.676 -12.267 1.00 0.00 H new ATOM 0 HB2 GLU A 128 32.364 -16.540 -13.360 1.00 0.00 H new ATOM 0 HB3 GLU A 128 33.897 -16.553 -12.510 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.622 -18.561 -13.641 1.00 0.00 H new ATOM 0 HG3 GLU A 128 33.014 -18.878 -14.262 1.00 0.00 H new ATOM 715 N GLU A 129 33.926 -20.035 -12.028 1.00 0.00 N ATOM 716 CA GLU A 129 34.935 -21.002 -11.599 1.00 0.00 C ATOM 717 C GLU A 129 36.240 -20.757 -12.349 1.00 0.00 C ATOM 718 O GLU A 129 36.237 -20.459 -13.544 1.00 0.00 O ATOM 719 CB GLU A 129 34.437 -22.425 -11.861 1.00 0.00 C ATOM 720 CG GLU A 129 34.209 -22.627 -13.358 1.00 0.00 C ATOM 721 CD GLU A 129 33.615 -24.008 -13.605 1.00 0.00 C ATOM 722 OE1 GLU A 129 32.791 -24.427 -12.807 1.00 0.00 O ATOM 723 OE2 GLU A 129 33.989 -24.630 -14.586 1.00 0.00 O1- ATOM 0 H GLU A 129 33.541 -20.214 -12.955 1.00 0.00 H new ATOM 0 HA GLU A 129 35.114 -20.882 -10.530 1.00 0.00 H new ATOM 0 HB2 GLU A 129 35.165 -23.148 -11.494 1.00 0.00 H new ATOM 0 HB3 GLU A 129 33.510 -22.602 -11.316 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.538 -21.858 -13.740 1.00 0.00 H new ATOM 0 HG3 GLU A 129 35.151 -22.524 -13.896 1.00 0.00 H new ATOM 730 N ALA A 130 37.351 -20.893 -11.635 1.00 0.00 N ATOM 731 CA ALA A 130 38.663 -20.694 -12.239 1.00 0.00 C ATOM 732 C ALA A 130 39.772 -21.107 -11.277 1.00 0.00 C ATOM 733 O ALA A 130 39.537 -21.285 -10.082 1.00 0.00 O ATOM 734 CB ALA A 130 38.848 -19.229 -12.644 1.00 0.00 C ATOM 0 H ALA A 130 37.371 -21.138 -10.645 1.00 0.00 H new ATOM 0 HA ALA A 130 38.722 -21.321 -13.129 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.832 -19.097 -13.093 1.00 0.00 H new ATOM 0 HB2 ALA A 130 38.080 -18.951 -13.366 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.764 -18.594 -11.762 1.00 0.00 H new ATOM 740 N LYS A 131 40.985 -21.235 -11.806 1.00 0.00 N ATOM 741 CA LYS A 131 42.146 -21.605 -11.001 1.00 0.00 C ATOM 742 C LYS A 131 42.762 -20.366 -10.376 1.00 0.00 C ATOM 743 O LYS A 131 43.980 -20.276 -10.224 1.00 0.00 O ATOM 744 CB LYS A 131 43.192 -22.327 -11.847 1.00 0.00 C ATOM 745 CG LYS A 131 42.678 -23.718 -12.211 1.00 0.00 C ATOM 746 CD LYS A 131 43.732 -24.446 -13.046 1.00 0.00 C ATOM 747 CE LYS A 131 43.224 -25.842 -13.405 1.00 0.00 C ATOM 748 NZ LYS A 131 44.256 -26.549 -14.215 1.00 0.00 N1+ ATOM 0 H LYS A 131 41.191 -21.087 -12.794 1.00 0.00 H new ATOM 0 HA LYS A 131 41.811 -22.281 -10.215 1.00 0.00 H new ATOM 0 HB2 LYS A 131 43.401 -21.756 -12.752 1.00 0.00 H new ATOM 0 HB3 LYS A 131 44.129 -22.406 -11.296 1.00 0.00 H new ATOM 0 HG2 LYS A 131 42.459 -24.285 -11.306 1.00 0.00 H new ATOM 0 HG3 LYS A 131 41.746 -23.639 -12.771 1.00 0.00 H new ATOM 0 HD2 LYS A 131 43.946 -23.881 -13.953 1.00 0.00 H new ATOM 0 HD3 LYS A 131 44.666 -24.520 -12.488 1.00 0.00 H new ATOM 0 HE2 LYS A 131 43.007 -26.407 -12.498 1.00 0.00 H new ATOM 0 HE3 LYS A 131 42.292 -25.769 -13.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 43.880 -27.465 -14.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 44.503 -25.971 -15.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 45.105 -26.705 -13.635 1.00 0.00 H new ATOM 762 N THR A 132 41.915 -19.414 -10.008 1.00 0.00 N ATOM 763 CA THR A 132 42.384 -18.175 -9.390 1.00 0.00 C ATOM 764 C THR A 132 41.311 -17.582 -8.479 1.00 0.00 C ATOM 765 O THR A 132 40.117 -17.665 -8.771 1.00 0.00 O ATOM 766 CB THR A 132 42.750 -17.162 -10.474 1.00 0.00 C ATOM 767 OG1 THR A 132 43.084 -15.922 -9.867 1.00 0.00 O ATOM 768 CG2 THR A 132 41.558 -16.964 -11.411 1.00 0.00 C ATOM 0 H THR A 132 40.903 -19.473 -10.125 1.00 0.00 H new ATOM 0 HA THR A 132 43.264 -18.404 -8.789 1.00 0.00 H new ATOM 0 HB THR A 132 43.603 -17.531 -11.044 1.00 0.00 H new ATOM 0 HG1 THR A 132 43.321 -15.271 -10.561 1.00 0.00 H new ATOM 0 HG21 THR A 132 41.819 -16.241 -12.184 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.299 -17.915 -11.876 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.705 -16.594 -10.842 1.00 0.00 H new ATOM 776 N LYS A 133 41.748 -16.974 -7.379 1.00 0.00 N ATOM 777 CA LYS A 133 40.824 -16.356 -6.433 1.00 0.00 C ATOM 778 C LYS A 133 40.425 -14.958 -6.894 1.00 0.00 C ATOM 779 O LYS A 133 39.396 -14.429 -6.480 1.00 0.00 O ATOM 780 CB LYS A 133 41.471 -16.270 -5.049 1.00 0.00 C ATOM 781 CG LYS A 133 41.668 -17.682 -4.502 1.00 0.00 C ATOM 782 CD LYS A 133 42.321 -17.610 -3.120 1.00 0.00 C ATOM 783 CE LYS A 133 42.534 -19.027 -2.583 1.00 0.00 C ATOM 784 NZ LYS A 133 43.195 -18.956 -1.250 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.732 -16.896 -7.122 1.00 0.00 H new ATOM 0 HA LYS A 133 39.929 -16.975 -6.381 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.429 -15.754 -5.113 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.841 -15.690 -4.375 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.708 -18.194 -4.436 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.293 -18.262 -5.181 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.275 -17.086 -3.183 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.690 -17.042 -2.437 1.00 0.00 H new ATOM 0 HE2 LYS A 133 41.578 -19.544 -2.500 1.00 0.00 H new ATOM 0 HE3 LYS A 133 43.148 -19.602 -3.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.341 -19.918 -0.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 44.114 -18.478 -1.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 42.592 -18.422 -0.592 1.00 0.00 H new ATOM 798 N LYS A 134 41.255 -14.359 -7.744 1.00 0.00 N ATOM 799 CA LYS A 134 40.974 -13.014 -8.234 1.00 0.00 C ATOM 800 C LYS A 134 39.761 -13.006 -9.160 1.00 0.00 C ATOM 801 O LYS A 134 38.814 -12.251 -8.949 1.00 0.00 O ATOM 802 CB LYS A 134 42.190 -12.476 -8.993 1.00 0.00 C ATOM 803 CG LYS A 134 43.324 -12.197 -8.004 1.00 0.00 C ATOM 804 CD LYS A 134 44.587 -11.771 -8.766 1.00 0.00 C ATOM 805 CE LYS A 134 44.452 -10.327 -9.260 1.00 0.00 C ATOM 806 NZ LYS A 134 45.784 -9.841 -9.729 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.114 -14.776 -8.103 1.00 0.00 H new ATOM 0 HA LYS A 134 40.759 -12.380 -7.374 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.515 -13.199 -9.741 1.00 0.00 H new ATOM 0 HB3 LYS A 134 41.925 -11.563 -9.526 1.00 0.00 H new ATOM 0 HG2 LYS A 134 43.027 -11.413 -7.308 1.00 0.00 H new ATOM 0 HG3 LYS A 134 43.529 -13.088 -7.411 1.00 0.00 H new ATOM 0 HD2 LYS A 134 45.458 -11.860 -8.117 1.00 0.00 H new ATOM 0 HD3 LYS A 134 44.751 -12.438 -9.613 1.00 0.00 H new ATOM 0 HE2 LYS A 134 43.726 -10.274 -10.071 1.00 0.00 H new ATOM 0 HE3 LYS A 134 44.081 -9.689 -8.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 45.697 -8.861 -10.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 46.464 -9.878 -8.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 46.120 -10.445 -10.506 1.00 0.00 H new ATOM 820 N LEU A 135 39.803 -13.842 -10.192 1.00 0.00 N ATOM 821 CA LEU A 135 38.713 -13.917 -11.148 1.00 0.00 C ATOM 822 C LEU A 135 37.433 -14.411 -10.479 1.00 0.00 C ATOM 823 O LEU A 135 36.340 -13.934 -10.783 1.00 0.00 O ATOM 824 CB LEU A 135 39.096 -14.870 -12.299 1.00 0.00 C ATOM 825 CG LEU A 135 38.341 -14.476 -13.585 1.00 0.00 C ATOM 826 CD1 LEU A 135 39.125 -13.376 -14.319 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.192 -15.700 -14.500 1.00 0.00 C ATOM 0 H LEU A 135 40.580 -14.474 -10.384 1.00 0.00 H new ATOM 0 HA LEU A 135 38.533 -12.917 -11.542 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.171 -14.830 -12.472 1.00 0.00 H new ATOM 0 HB3 LEU A 135 38.855 -15.898 -12.027 1.00 0.00 H new ATOM 0 HG LEU A 135 37.350 -14.106 -13.322 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.594 -13.096 -15.228 1.00 0.00 H new ATOM 0 HD12 LEU A 135 39.221 -12.504 -13.672 1.00 0.00 H new ATOM 0 HD13 LEU A 135 40.117 -13.747 -14.578 1.00 0.00 H new ATOM 0 HD21 LEU A 135 37.658 -15.414 -15.406 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.179 -16.079 -14.765 1.00 0.00 H new ATOM 0 HD23 LEU A 135 37.633 -16.478 -13.979 1.00 0.00 H new ATOM 839 N ALA A 136 37.578 -15.370 -9.573 1.00 0.00 N ATOM 840 CA ALA A 136 36.423 -15.922 -8.881 1.00 0.00 C ATOM 841 C ALA A 136 35.675 -14.830 -8.128 1.00 0.00 C ATOM 842 O ALA A 136 34.470 -14.653 -8.312 1.00 0.00 O ATOM 843 CB ALA A 136 36.875 -17.003 -7.900 1.00 0.00 C ATOM 0 H ALA A 136 38.474 -15.777 -9.303 1.00 0.00 H new ATOM 0 HA ALA A 136 35.753 -16.358 -9.622 1.00 0.00 H new ATOM 0 HB1 ALA A 136 36.006 -17.413 -7.385 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.383 -17.799 -8.444 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.559 -16.569 -7.170 1.00 0.00 H new ATOM 849 N GLU A 137 36.388 -14.102 -7.271 1.00 0.00 N ATOM 850 CA GLU A 137 35.769 -13.033 -6.494 1.00 0.00 C ATOM 851 C GLU A 137 35.174 -11.973 -7.412 1.00 0.00 C ATOM 852 O GLU A 137 34.070 -11.483 -7.178 1.00 0.00 O ATOM 853 CB GLU A 137 36.825 -12.389 -5.585 1.00 0.00 C ATOM 854 CG GLU A 137 37.275 -13.389 -4.515 1.00 0.00 C ATOM 855 CD GLU A 137 36.130 -13.673 -3.548 1.00 0.00 C ATOM 856 OE1 GLU A 137 35.232 -12.850 -3.468 1.00 0.00 O ATOM 857 OE2 GLU A 137 36.170 -14.705 -2.900 1.00 0.00 O1- ATOM 0 H GLU A 137 37.385 -14.231 -7.099 1.00 0.00 H new ATOM 0 HA GLU A 137 34.967 -13.459 -5.891 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.681 -12.069 -6.179 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.414 -11.497 -5.111 1.00 0.00 H new ATOM 0 HG2 GLU A 137 37.601 -14.316 -4.987 1.00 0.00 H new ATOM 0 HG3 GLU A 137 38.131 -12.990 -3.970 1.00 0.00 H new ATOM 864 N MET A 138 35.918 -11.616 -8.451 1.00 0.00 N ATOM 865 CA MET A 138 35.454 -10.602 -9.391 1.00 0.00 C ATOM 866 C MET A 138 34.170 -11.061 -10.074 1.00 0.00 C ATOM 867 O MET A 138 33.235 -10.281 -10.247 1.00 0.00 O ATOM 868 CB MET A 138 36.533 -10.331 -10.446 1.00 0.00 C ATOM 869 CG MET A 138 37.661 -9.502 -9.828 1.00 0.00 C ATOM 870 SD MET A 138 38.953 -9.234 -11.064 1.00 0.00 S ATOM 871 CE MET A 138 40.203 -8.561 -9.942 1.00 0.00 C ATOM 0 H MET A 138 36.835 -12.008 -8.664 1.00 0.00 H new ATOM 0 HA MET A 138 35.252 -9.683 -8.840 1.00 0.00 H new ATOM 0 HB2 MET A 138 36.928 -11.273 -10.827 1.00 0.00 H new ATOM 0 HB3 MET A 138 36.101 -9.800 -11.294 1.00 0.00 H new ATOM 0 HG2 MET A 138 37.274 -8.545 -9.477 1.00 0.00 H new ATOM 0 HG3 MET A 138 38.073 -10.017 -8.960 1.00 0.00 H new ATOM 0 HE1 MET A 138 41.105 -8.320 -10.505 1.00 0.00 H new ATOM 0 HE2 MET A 138 39.818 -7.657 -9.469 1.00 0.00 H new ATOM 0 HE3 MET A 138 40.439 -9.299 -9.176 1.00 0.00 H new ATOM 881 N SER A 139 34.129 -12.334 -10.452 1.00 0.00 N ATOM 882 CA SER A 139 32.950 -12.884 -11.110 1.00 0.00 C ATOM 883 C SER A 139 31.747 -12.881 -10.170 1.00 0.00 C ATOM 884 O SER A 139 30.618 -12.645 -10.600 1.00 0.00 O ATOM 885 CB SER A 139 33.230 -14.310 -11.577 1.00 0.00 C ATOM 886 OG SER A 139 34.115 -14.268 -12.689 1.00 0.00 O ATOM 0 H SER A 139 34.891 -12.999 -10.316 1.00 0.00 H new ATOM 0 HA SER A 139 32.719 -12.256 -11.971 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.670 -14.892 -10.767 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.299 -14.805 -11.855 1.00 0.00 H new ATOM 0 HG SER A 139 35.036 -14.167 -12.370 1.00 0.00 H new ATOM 892 N ALA A 140 31.991 -13.142 -8.887 1.00 0.00 N ATOM 893 CA ALA A 140 30.915 -13.166 -7.900 1.00 0.00 C ATOM 894 C ALA A 140 30.271 -11.790 -7.778 1.00 0.00 C ATOM 895 O ALA A 140 29.048 -11.661 -7.765 1.00 0.00 O ATOM 896 CB ALA A 140 31.473 -13.595 -6.541 1.00 0.00 C ATOM 0 H ALA A 140 32.918 -13.338 -8.509 1.00 0.00 H new ATOM 0 HA ALA A 140 30.158 -13.879 -8.226 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.668 -13.612 -5.806 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.909 -14.590 -6.625 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.240 -12.888 -6.223 1.00 0.00 H new ATOM 902 N ALA A 141 31.102 -10.763 -7.681 1.00 0.00 N ATOM 903 CA ALA A 141 30.602 -9.402 -7.563 1.00 0.00 C ATOM 904 C ALA A 141 29.972 -8.944 -8.874 1.00 0.00 C ATOM 905 O ALA A 141 29.120 -8.057 -8.889 1.00 0.00 O ATOM 906 CB ALA A 141 31.742 -8.454 -7.181 1.00 0.00 C ATOM 0 H ALA A 141 32.119 -10.845 -7.682 1.00 0.00 H new ATOM 0 HA ALA A 141 29.841 -9.384 -6.783 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.357 -7.438 -7.095 1.00 0.00 H new ATOM 0 HB2 ALA A 141 32.167 -8.763 -6.226 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.514 -8.486 -7.949 1.00 0.00 H new ATOM 912 N LYS A 142 30.393 -9.560 -9.978 1.00 0.00 N ATOM 913 CA LYS A 142 29.857 -9.210 -11.288 1.00 0.00 C ATOM 914 C LYS A 142 28.410 -9.680 -11.439 1.00 0.00 C ATOM 915 O LYS A 142 27.535 -8.914 -11.844 1.00 0.00 O ATOM 916 CB LYS A 142 30.716 -9.861 -12.375 1.00 0.00 C ATOM 917 CG LYS A 142 30.270 -9.365 -13.754 1.00 0.00 C ATOM 918 CD LYS A 142 31.095 -10.043 -14.853 1.00 0.00 C ATOM 919 CE LYS A 142 32.503 -9.438 -14.924 1.00 0.00 C ATOM 920 NZ LYS A 142 33.182 -9.932 -16.158 1.00 0.00 N1+ ATOM 0 H LYS A 142 31.098 -10.297 -9.990 1.00 0.00 H new ATOM 0 HA LYS A 142 29.877 -8.125 -11.388 1.00 0.00 H new ATOM 0 HB2 LYS A 142 31.767 -9.620 -12.214 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.626 -10.946 -12.322 1.00 0.00 H new ATOM 0 HG2 LYS A 142 29.211 -9.578 -13.900 1.00 0.00 H new ATOM 0 HG3 LYS A 142 30.389 -8.283 -13.815 1.00 0.00 H new ATOM 0 HD2 LYS A 142 31.163 -11.113 -14.656 1.00 0.00 H new ATOM 0 HD3 LYS A 142 30.595 -9.927 -15.814 1.00 0.00 H new ATOM 0 HE2 LYS A 142 32.445 -8.350 -14.936 1.00 0.00 H new ATOM 0 HE3 LYS A 142 33.078 -9.717 -14.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 34.138 -9.526 -16.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 33.247 -10.969 -16.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 32.634 -9.645 -16.994 1.00 0.00 H new ATOM 934 N VAL A 143 28.171 -10.951 -11.118 1.00 0.00 N ATOM 935 CA VAL A 143 26.831 -11.522 -11.230 1.00 0.00 C ATOM 936 C VAL A 143 25.888 -10.906 -10.207 1.00 0.00 C ATOM 937 O VAL A 143 24.731 -10.617 -10.515 1.00 0.00 O ATOM 938 CB VAL A 143 26.880 -13.043 -11.046 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.537 -13.379 -9.708 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.455 -13.609 -11.061 1.00 0.00 C ATOM 0 H VAL A 143 28.882 -11.600 -10.781 1.00 0.00 H new ATOM 0 HA VAL A 143 26.453 -11.296 -12.227 1.00 0.00 H new ATOM 0 HB VAL A 143 27.459 -13.482 -11.858 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.570 -14.461 -9.580 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.551 -12.980 -9.690 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.959 -12.936 -8.897 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.492 -14.690 -10.930 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.878 -13.165 -10.250 1.00 0.00 H new ATOM 0 HG23 VAL A 143 24.980 -13.375 -12.014 1.00 0.00 H new ATOM 950 N ALA A 144 26.380 -10.703 -8.991 1.00 0.00 N ATOM 951 CA ALA A 144 25.562 -10.120 -7.941 1.00 0.00 C ATOM 952 C ALA A 144 25.129 -8.710 -8.322 1.00 0.00 C ATOM 953 O ALA A 144 23.966 -8.344 -8.171 1.00 0.00 O ATOM 954 CB ALA A 144 26.364 -10.072 -6.639 1.00 0.00 C ATOM 0 H ALA A 144 27.334 -10.932 -8.711 1.00 0.00 H new ATOM 0 HA ALA A 144 24.673 -10.736 -7.806 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.752 -9.635 -5.850 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.656 -11.083 -6.354 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.257 -9.464 -6.784 1.00 0.00 H new ATOM 960 N PHE A 145 26.077 -7.922 -8.816 1.00 0.00 N ATOM 961 CA PHE A 145 25.783 -6.552 -9.208 1.00 0.00 C ATOM 962 C PHE A 145 24.706 -6.523 -10.285 1.00 0.00 C ATOM 963 O PHE A 145 23.780 -5.720 -10.225 1.00 0.00 O ATOM 964 CB PHE A 145 27.050 -5.866 -9.727 1.00 0.00 C ATOM 965 CG PHE A 145 26.767 -4.400 -9.965 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.703 -3.519 -8.880 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.571 -3.921 -11.267 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.442 -2.160 -9.095 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.310 -2.561 -11.481 1.00 0.00 C ATOM 970 CZ PHE A 145 26.247 -1.682 -10.395 1.00 0.00 C ATOM 0 H PHE A 145 27.047 -8.206 -8.953 1.00 0.00 H new ATOM 0 HA PHE A 145 25.419 -6.016 -8.331 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.859 -5.979 -9.006 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.380 -6.339 -10.652 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.855 -3.887 -7.876 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.621 -4.600 -12.105 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.391 -1.481 -8.257 1.00 0.00 H new ATOM 0 HE2 PHE A 145 26.158 -2.192 -12.484 1.00 0.00 H new ATOM 0 HZ PHE A 145 26.048 -0.633 -10.560 1.00 0.00 H new ATOM 980 N MET A 146 24.832 -7.403 -11.271 1.00 0.00 N ATOM 981 CA MET A 146 23.863 -7.462 -12.360 1.00 0.00 C ATOM 982 C MET A 146 22.472 -7.804 -11.835 1.00 0.00 C ATOM 983 O MET A 146 21.473 -7.263 -12.305 1.00 0.00 O ATOM 984 CB MET A 146 24.295 -8.517 -13.384 1.00 0.00 C ATOM 985 CG MET A 146 23.314 -8.527 -14.560 1.00 0.00 C ATOM 986 SD MET A 146 23.887 -9.704 -15.812 1.00 0.00 S ATOM 987 CE MET A 146 23.654 -11.218 -14.844 1.00 0.00 C ATOM 0 H MET A 146 25.590 -8.082 -11.340 1.00 0.00 H new ATOM 0 HA MET A 146 23.824 -6.482 -12.835 1.00 0.00 H new ATOM 0 HB2 MET A 146 25.302 -8.301 -13.740 1.00 0.00 H new ATOM 0 HB3 MET A 146 24.326 -9.501 -12.916 1.00 0.00 H new ATOM 0 HG2 MET A 146 22.318 -8.803 -14.214 1.00 0.00 H new ATOM 0 HG3 MET A 146 23.236 -7.529 -14.992 1.00 0.00 H new ATOM 0 HE1 MET A 146 23.480 -12.057 -15.517 1.00 0.00 H new ATOM 0 HE2 MET A 146 24.546 -11.410 -14.248 1.00 0.00 H new ATOM 0 HE3 MET A 146 22.795 -11.099 -14.183 1.00 0.00 H new ATOM 997 N SER A 147 22.410 -8.704 -10.864 1.00 0.00 N ATOM 998 CA SER A 147 21.129 -9.096 -10.293 1.00 0.00 C ATOM 999 C SER A 147 20.499 -7.938 -9.525 1.00 0.00 C ATOM 1000 O SER A 147 19.302 -7.677 -9.645 1.00 0.00 O ATOM 1001 CB SER A 147 21.317 -10.286 -9.361 1.00 0.00 C ATOM 1002 OG SER A 147 20.150 -10.445 -8.564 1.00 0.00 O ATOM 0 H SER A 147 23.221 -9.172 -10.459 1.00 0.00 H new ATOM 0 HA SER A 147 20.463 -9.375 -11.109 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.503 -11.191 -9.940 1.00 0.00 H new ATOM 0 HB3 SER A 147 22.188 -10.131 -8.725 1.00 0.00 H new ATOM 0 HG SER A 147 20.384 -10.900 -7.728 1.00 0.00 H new ATOM 1008 N ILE A 148 21.315 -7.249 -8.727 1.00 0.00 N ATOM 1009 CA ILE A 148 20.829 -6.121 -7.932 1.00 0.00 C ATOM 1010 C ILE A 148 20.203 -5.053 -8.824 1.00 0.00 C ATOM 1011 O ILE A 148 19.297 -4.335 -8.402 1.00 0.00 O ATOM 1012 CB ILE A 148 21.981 -5.512 -7.125 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.433 -6.506 -6.053 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.520 -4.214 -6.457 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.741 -6.019 -5.432 1.00 0.00 C ATOM 0 H ILE A 148 22.309 -7.450 -8.614 1.00 0.00 H new ATOM 0 HA ILE A 148 20.064 -6.491 -7.249 1.00 0.00 H new ATOM 0 HB ILE A 148 22.812 -5.293 -7.795 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.666 -6.603 -5.284 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.571 -7.494 -6.492 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.344 -3.787 -5.885 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.202 -3.505 -7.221 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.685 -4.425 -5.788 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.066 -6.725 -4.668 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.505 -5.944 -6.205 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.586 -5.040 -4.979 1.00 0.00 H new ATOM 1027 N LYS A 149 20.687 -4.953 -10.055 1.00 0.00 N ATOM 1028 CA LYS A 149 20.159 -3.967 -10.993 1.00 0.00 C ATOM 1029 C LYS A 149 18.699 -4.269 -11.321 1.00 0.00 C ATOM 1030 O LYS A 149 18.021 -3.471 -11.967 1.00 0.00 O ATOM 1031 CB LYS A 149 20.979 -3.963 -12.284 1.00 0.00 C ATOM 1032 CG LYS A 149 22.354 -3.339 -12.020 1.00 0.00 C ATOM 1033 CD LYS A 149 23.237 -3.452 -13.276 1.00 0.00 C ATOM 1034 CE LYS A 149 22.950 -2.290 -14.232 1.00 0.00 C ATOM 1035 NZ LYS A 149 23.315 -1.006 -13.573 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.437 -5.536 -10.426 1.00 0.00 H new ATOM 0 HA LYS A 149 20.225 -2.985 -10.524 1.00 0.00 H new ATOM 0 HB2 LYS A 149 21.096 -4.981 -12.655 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.456 -3.400 -13.057 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.239 -2.292 -11.740 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.835 -3.842 -11.181 1.00 0.00 H new ATOM 0 HD2 LYS A 149 24.289 -3.447 -12.991 1.00 0.00 H new ATOM 0 HD3 LYS A 149 23.048 -4.401 -13.778 1.00 0.00 H new ATOM 0 HE2 LYS A 149 23.519 -2.413 -15.153 1.00 0.00 H new ATOM 0 HE3 LYS A 149 21.895 -2.283 -14.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 23.645 -0.329 -14.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 22.482 -0.617 -13.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 24.073 -1.174 -12.881 1.00 0.00 H new