USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1070 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 MET CE :methyl 164:sc= -2.41 (180deg=-3.52!) USER MOD Set 1.2: A 148 LYS NZ :NH3+ 147:sc= -0.122 (180deg=-0.398) USER MOD Set 2.1: A 146 SER OG : rot -85:sc= 0.631 USER MOD Set 2.2: A 147 GLN :FLIP amide:sc= 0.525 F(o=-3.2!,f=1.2) USER MOD Set 3.1: A 58 ASN : amide:sc= -0.515 K(o=-1.2,f=-3.2!) USER MOD Set 3.2: A 59 ASN : amide:sc= -0.693 K(o=-1.2,f=-3.1) USER MOD Set 4.1: A 36 MET CE :methyl 158:sc= -0.0498 (180deg=0) USER MOD Set 4.2: A 41 GLN : amide:sc= -1.65 K(o=-7.3,f=-8.7) USER MOD Set 4.3: A 72 MET CE :methyl -168:sc= -2.07 (180deg=-0.99) USER MOD Set 4.4: A 75 GLN : amide:sc= -3.52! C(o=-7.3!,f=-8.5!) USER MOD Set 5.1: A 24 THR OG1 : rot 9:sc= -0.0508 USER MOD Set 5.2: A 62 GLN :FLIP amide:sc= -2.05 F(o=-12!,f=-2.1) USER MOD Set 6.1: A 5 THR OG1 : rot -85:sc= -0.0343 USER MOD Set 6.2: A 8 GLN : amide:sc= 0.277 K(o=0.24,f=-0.75) USER MOD Single : A 13 LYS NZ :NH3+ -169:sc=-0.00306 (180deg=-0.144) USER MOD Single : A 18 GLN : amide:sc= -0.198 K(o=-0.2,f=-0.86) USER MOD Single : A 21 LYS NZ :NH3+ 167:sc= -0.0313 (180deg=-0.256) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -156:sc= -0.222 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -160:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -0.219 X(o=-0.22,f=-0.2) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0292 USER MOD Single : A 49 GLN : amide:sc= -0.244 X(o=-0.24,f=-0.24) USER MOD Single : A 57 ASN : amide:sc= 0.0346 X(o=0.035,f=0) USER MOD Single : A 60 ASN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 64 ASN : amide:sc= -3.98! C(o=-4!,f=-3.7!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot 180:sc= -3.29! USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 174:sc= -2.85! (180deg=-2.93!) USER MOD Single : A 81 THR OG1 : rot 32:sc= 0.0279 USER MOD Single : A 85 MET CE :methyl -162:sc= -1.84 (180deg=-2.26) USER MOD Single : A 90 LYS NZ :NH3+ -111:sc= -0.76 (180deg=-2.07!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0.462 K(o=0.46,f=-0.64) USER MOD Single : A 115 LYS NZ :NH3+ -170:sc=-0.00579 (180deg=-0.161) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.219 USER MOD Single : A 124 MET CE :methyl -117:sc= -1.6 (180deg=-3.48!) USER MOD Single : A 135 MET CE :methyl -122:sc= -0.2 (180deg=-1.1) USER MOD Single : A 137 ASN : amide:sc= -0.0421 K(o=-0.042,f=-2.7!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 MET CE :methyl -170:sc= -4.72! (180deg=-4.89!) USER MOD ----------------------------------------------------------------- ATOM 27 N LEU A 4 -0.305 7.204 4.364 1.00 0.73 N ATOM 28 CA LEU A 4 -1.483 8.059 4.457 1.00 0.45 C ATOM 29 C LEU A 4 -1.398 8.980 5.673 1.00 0.47 C ATOM 30 O LEU A 4 -1.327 8.517 6.812 1.00 0.58 O ATOM 31 CB LEU A 4 -2.748 7.198 4.529 1.00 0.41 C ATOM 32 CG LEU A 4 -2.784 6.014 3.557 1.00 0.50 C ATOM 33 CD1 LEU A 4 -4.105 5.273 3.664 1.00 1.27 C ATOM 34 CD2 LEU A 4 -2.555 6.483 2.129 1.00 1.19 C ATOM 0 HA LEU A 4 -1.526 8.684 3.565 1.00 0.45 H new ATOM 0 HB2 LEU A 4 -2.852 6.817 5.545 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -3.613 7.833 4.336 1.00 0.41 H new ATOM 0 HG LEU A 4 -1.980 5.329 3.828 1.00 0.50 H new ATOM 0 HD11 LEU A 4 -4.110 4.436 2.966 1.00 1.27 H new ATOM 0 HD12 LEU A 4 -4.231 4.899 4.680 1.00 1.27 H new ATOM 0 HD13 LEU A 4 -4.923 5.952 3.423 1.00 1.27 H new ATOM 0 HD21 LEU A 4 -2.585 5.626 1.456 1.00 1.19 H new ATOM 0 HD22 LEU A 4 -3.335 7.192 1.849 1.00 1.19 H new ATOM 0 HD23 LEU A 4 -1.581 6.968 2.057 1.00 1.19 H new ATOM 46 N THR A 5 -1.409 10.286 5.420 1.00 0.47 N ATOM 47 CA THR A 5 -1.326 11.280 6.487 1.00 0.54 C ATOM 48 C THR A 5 -2.598 11.301 7.330 1.00 0.51 C ATOM 49 O THR A 5 -3.448 10.422 7.207 1.00 0.55 O ATOM 50 CB THR A 5 -1.072 12.691 5.925 1.00 0.62 C ATOM 51 OG1 THR A 5 -2.123 13.057 5.023 1.00 1.12 O ATOM 52 CG2 THR A 5 0.265 12.753 5.205 1.00 0.99 C ATOM 0 H THR A 5 -1.475 10.682 4.482 1.00 0.47 H new ATOM 0 HA THR A 5 -0.485 10.991 7.117 1.00 0.54 H new ATOM 0 HB THR A 5 -1.051 13.392 6.760 1.00 0.62 H new ATOM 0 HG1 THR A 5 -1.927 12.702 4.131 1.00 1.12 H new ATOM 0 HG21 THR A 5 0.423 13.759 4.816 1.00 0.99 H new ATOM 0 HG22 THR A 5 1.065 12.503 5.902 1.00 0.99 H new ATOM 0 HG23 THR A 5 0.267 12.041 4.380 1.00 0.99 H new ATOM 60 N GLU A 6 -2.724 12.313 8.183 1.00 0.60 N ATOM 61 CA GLU A 6 -3.892 12.438 9.051 1.00 0.62 C ATOM 62 C GLU A 6 -5.102 12.941 8.271 1.00 0.55 C ATOM 63 O GLU A 6 -6.229 12.501 8.500 1.00 0.53 O ATOM 64 CB GLU A 6 -3.592 13.375 10.221 1.00 0.75 C ATOM 65 CG GLU A 6 -3.233 14.785 9.792 1.00 1.46 C ATOM 66 CD GLU A 6 -2.835 15.667 10.959 1.00 1.74 C ATOM 67 OE1 GLU A 6 -1.636 15.681 11.311 1.00 2.20 O ATOM 68 OE2 GLU A 6 -3.721 16.345 11.520 1.00 2.00 O ATOM 0 H GLU A 6 -2.035 13.057 8.292 1.00 0.60 H new ATOM 0 HA GLU A 6 -4.126 11.449 9.444 1.00 0.62 H new ATOM 0 HB2 GLU A 6 -4.462 13.414 10.877 1.00 0.75 H new ATOM 0 HB3 GLU A 6 -2.770 12.961 10.806 1.00 0.75 H new ATOM 0 HG2 GLU A 6 -2.412 14.745 9.076 1.00 1.46 H new ATOM 0 HG3 GLU A 6 -4.084 15.232 9.278 1.00 1.46 H new ATOM 75 N GLU A 7 -4.860 13.864 7.346 1.00 0.58 N ATOM 76 CA GLU A 7 -5.927 14.431 6.533 1.00 0.58 C ATOM 77 C GLU A 7 -6.421 13.422 5.502 1.00 0.48 C ATOM 78 O GLU A 7 -7.624 13.288 5.276 1.00 0.46 O ATOM 79 CB GLU A 7 -5.443 15.704 5.835 1.00 0.69 C ATOM 80 CG GLU A 7 -4.229 15.491 4.945 1.00 0.69 C ATOM 81 CD GLU A 7 -3.791 16.762 4.246 1.00 1.02 C ATOM 82 OE1 GLU A 7 -4.340 17.064 3.165 1.00 1.19 O ATOM 83 OE2 GLU A 7 -2.900 17.456 4.778 1.00 1.35 O ATOM 0 H GLU A 7 -3.932 14.235 7.141 1.00 0.58 H new ATOM 0 HA GLU A 7 -6.759 14.682 7.191 1.00 0.58 H new ATOM 0 HB2 GLU A 7 -6.257 16.109 5.233 1.00 0.69 H new ATOM 0 HB3 GLU A 7 -5.202 16.452 6.590 1.00 0.69 H new ATOM 0 HG2 GLU A 7 -3.404 15.108 5.546 1.00 0.69 H new ATOM 0 HG3 GLU A 7 -4.459 14.731 4.199 1.00 0.69 H new ATOM 90 N GLN A 8 -5.484 12.716 4.878 1.00 0.44 N ATOM 91 CA GLN A 8 -5.823 11.715 3.874 1.00 0.37 C ATOM 92 C GLN A 8 -6.700 10.625 4.477 1.00 0.31 C ATOM 93 O GLN A 8 -7.729 10.253 3.908 1.00 0.29 O ATOM 94 CB GLN A 8 -4.551 11.095 3.291 1.00 0.40 C ATOM 95 CG GLN A 8 -3.791 12.027 2.363 1.00 0.48 C ATOM 96 CD GLN A 8 -2.528 11.394 1.812 1.00 1.35 C ATOM 97 OE1 GLN A 8 -1.453 11.517 2.397 1.00 2.22 O ATOM 98 NE2 GLN A 8 -2.655 10.708 0.682 1.00 1.68 N ATOM 0 H GLN A 8 -4.484 12.819 5.050 1.00 0.44 H new ATOM 0 HA GLN A 8 -6.377 12.208 3.075 1.00 0.37 H new ATOM 0 HB2 GLN A 8 -3.895 10.795 4.108 1.00 0.40 H new ATOM 0 HB3 GLN A 8 -4.815 10.189 2.746 1.00 0.40 H new ATOM 0 HG2 GLN A 8 -4.438 12.318 1.536 1.00 0.48 H new ATOM 0 HG3 GLN A 8 -3.532 12.939 2.901 1.00 0.48 H new ATOM 0 HE21 GLN A 8 -3.567 10.632 0.231 1.00 1.68 H new ATOM 0 HE22 GLN A 8 -1.841 10.257 0.265 1.00 1.68 H new ATOM 107 N ILE A 9 -6.284 10.120 5.635 1.00 0.33 N ATOM 108 CA ILE A 9 -7.027 9.073 6.323 1.00 0.33 C ATOM 109 C ILE A 9 -8.457 9.511 6.611 1.00 0.34 C ATOM 110 O ILE A 9 -9.405 8.815 6.262 1.00 0.36 O ATOM 111 CB ILE A 9 -6.337 8.664 7.642 1.00 0.42 C ATOM 112 CG1 ILE A 9 -5.030 7.925 7.342 1.00 0.44 C ATOM 113 CG2 ILE A 9 -7.260 7.793 8.485 1.00 0.51 C ATOM 114 CD1 ILE A 9 -4.193 7.638 8.570 1.00 0.54 C ATOM 0 H ILE A 9 -5.436 10.420 6.115 1.00 0.33 H new ATOM 0 HA ILE A 9 -7.048 8.210 5.658 1.00 0.33 H new ATOM 0 HB ILE A 9 -6.109 9.566 8.210 1.00 0.42 H new ATOM 0 HG12 ILE A 9 -5.262 6.984 6.844 1.00 0.44 H new ATOM 0 HG13 ILE A 9 -4.441 8.518 6.643 1.00 0.44 H new ATOM 0 HG21 ILE A 9 -6.754 7.516 9.410 1.00 0.51 H new ATOM 0 HG22 ILE A 9 -8.169 8.347 8.720 1.00 0.51 H new ATOM 0 HG23 ILE A 9 -7.518 6.892 7.929 1.00 0.51 H new ATOM 0 HD11 ILE A 9 -3.284 7.113 8.276 1.00 0.54 H new ATOM 0 HD12 ILE A 9 -3.929 8.576 9.057 1.00 0.54 H new ATOM 0 HD13 ILE A 9 -4.763 7.018 9.262 1.00 0.54 H new ATOM 126 N ALA A 10 -8.601 10.673 7.235 1.00 0.36 N ATOM 127 CA ALA A 10 -9.917 11.201 7.581 1.00 0.40 C ATOM 128 C ALA A 10 -10.785 11.433 6.344 1.00 0.35 C ATOM 129 O ALA A 10 -12.013 11.443 6.437 1.00 0.36 O ATOM 130 CB ALA A 10 -9.766 12.494 8.366 1.00 0.50 C ATOM 0 H ALA A 10 -7.822 11.270 7.513 1.00 0.36 H new ATOM 0 HA ALA A 10 -10.421 10.456 8.197 1.00 0.40 H new ATOM 0 HB1 ALA A 10 -10.752 12.882 8.621 1.00 0.50 H new ATOM 0 HB2 ALA A 10 -9.205 12.301 9.280 1.00 0.50 H new ATOM 0 HB3 ALA A 10 -9.233 13.227 7.761 1.00 0.50 H new ATOM 136 N GLU A 11 -10.151 11.611 5.188 1.00 0.33 N ATOM 137 CA GLU A 11 -10.887 11.859 3.950 1.00 0.33 C ATOM 138 C GLU A 11 -11.617 10.609 3.462 1.00 0.27 C ATOM 139 O GLU A 11 -12.842 10.618 3.303 1.00 0.28 O ATOM 140 CB GLU A 11 -9.937 12.358 2.859 1.00 0.37 C ATOM 141 CG GLU A 11 -10.615 12.581 1.515 1.00 0.41 C ATOM 142 CD GLU A 11 -9.650 13.067 0.452 1.00 1.27 C ATOM 143 OE1 GLU A 11 -9.463 14.297 0.336 1.00 1.19 O ATOM 144 OE2 GLU A 11 -9.081 12.217 -0.266 1.00 2.27 O ATOM 0 H GLU A 11 -9.137 11.589 5.082 1.00 0.33 H new ATOM 0 HA GLU A 11 -11.634 12.624 4.164 1.00 0.33 H new ATOM 0 HB2 GLU A 11 -9.481 13.293 3.186 1.00 0.37 H new ATOM 0 HB3 GLU A 11 -9.130 11.636 2.734 1.00 0.37 H new ATOM 0 HG2 GLU A 11 -11.075 11.650 1.185 1.00 0.41 H new ATOM 0 HG3 GLU A 11 -11.418 13.309 1.633 1.00 0.41 H new ATOM 151 N PHE A 12 -10.875 9.527 3.241 1.00 0.23 N ATOM 152 CA PHE A 12 -11.489 8.295 2.765 1.00 0.22 C ATOM 153 C PHE A 12 -12.194 7.570 3.906 1.00 0.19 C ATOM 154 O PHE A 12 -13.110 6.778 3.678 1.00 0.20 O ATOM 155 CB PHE A 12 -10.460 7.389 2.074 1.00 0.26 C ATOM 156 CG PHE A 12 -9.408 6.818 2.981 1.00 0.25 C ATOM 157 CD1 PHE A 12 -9.699 5.764 3.833 1.00 0.31 C ATOM 158 CD2 PHE A 12 -8.121 7.328 2.968 1.00 0.27 C ATOM 159 CE1 PHE A 12 -8.727 5.232 4.656 1.00 0.37 C ATOM 160 CE2 PHE A 12 -7.146 6.800 3.789 1.00 0.30 C ATOM 161 CZ PHE A 12 -7.449 5.752 4.634 1.00 0.35 C ATOM 0 H PHE A 12 -9.866 9.479 3.381 1.00 0.23 H new ATOM 0 HA PHE A 12 -12.240 8.557 2.019 1.00 0.22 H new ATOM 0 HB2 PHE A 12 -10.988 6.566 1.592 1.00 0.26 H new ATOM 0 HB3 PHE A 12 -9.968 7.958 1.285 1.00 0.26 H new ATOM 0 HD1 PHE A 12 -10.698 5.354 3.853 1.00 0.31 H new ATOM 0 HD2 PHE A 12 -7.878 8.148 2.308 1.00 0.27 H new ATOM 0 HE1 PHE A 12 -8.966 4.411 5.316 1.00 0.37 H new ATOM 0 HE2 PHE A 12 -6.146 7.207 3.770 1.00 0.30 H new ATOM 0 HZ PHE A 12 -6.686 5.339 5.278 1.00 0.35 H new ATOM 171 N LYS A 13 -11.767 7.844 5.138 1.00 0.19 N ATOM 172 CA LYS A 13 -12.387 7.235 6.308 1.00 0.22 C ATOM 173 C LYS A 13 -13.811 7.754 6.448 1.00 0.21 C ATOM 174 O LYS A 13 -14.714 7.025 6.857 1.00 0.23 O ATOM 175 CB LYS A 13 -11.576 7.528 7.576 1.00 0.28 C ATOM 176 CG LYS A 13 -12.337 7.285 8.871 1.00 0.32 C ATOM 177 CD LYS A 13 -12.731 5.823 9.028 1.00 0.33 C ATOM 178 CE LYS A 13 -13.559 5.602 10.284 1.00 0.48 C ATOM 179 NZ LYS A 13 -12.814 5.978 11.517 1.00 1.23 N ATOM 0 H LYS A 13 -10.998 8.481 5.349 1.00 0.19 H new ATOM 0 HA LYS A 13 -12.408 6.153 6.176 1.00 0.22 H new ATOM 0 HB2 LYS A 13 -10.680 6.908 7.572 1.00 0.28 H new ATOM 0 HB3 LYS A 13 -11.245 8.566 7.551 1.00 0.28 H new ATOM 0 HG2 LYS A 13 -11.721 7.589 9.717 1.00 0.32 H new ATOM 0 HG3 LYS A 13 -13.232 7.907 8.889 1.00 0.32 H new ATOM 0 HD2 LYS A 13 -13.299 5.502 8.155 1.00 0.33 H new ATOM 0 HD3 LYS A 13 -11.834 5.205 9.069 1.00 0.33 H new ATOM 0 HE2 LYS A 13 -14.476 6.188 10.222 1.00 0.48 H new ATOM 0 HE3 LYS A 13 -13.854 4.554 10.344 1.00 0.48 H new ATOM 0 HZ1 LYS A 13 -13.334 5.642 12.353 1.00 1.23 H new ATOM 0 HZ2 LYS A 13 -11.870 5.543 11.498 1.00 1.23 H new ATOM 0 HZ3 LYS A 13 -12.717 7.013 11.562 1.00 1.23 H new ATOM 193 N ASP A 14 -14.001 9.026 6.110 1.00 0.23 N ATOM 194 CA ASP A 14 -15.322 9.631 6.159 1.00 0.25 C ATOM 195 C ASP A 14 -16.190 8.997 5.084 1.00 0.22 C ATOM 196 O ASP A 14 -17.336 8.614 5.330 1.00 0.23 O ATOM 197 CB ASP A 14 -15.233 11.144 5.943 1.00 0.31 C ATOM 198 CG ASP A 14 -16.576 11.830 6.091 1.00 0.37 C ATOM 199 OD1 ASP A 14 -17.330 11.882 5.095 1.00 0.41 O ATOM 200 OD2 ASP A 14 -16.877 12.315 7.201 1.00 0.44 O ATOM 0 H ASP A 14 -13.258 9.653 5.801 1.00 0.23 H new ATOM 0 HA ASP A 14 -15.763 9.458 7.141 1.00 0.25 H new ATOM 0 HB2 ASP A 14 -14.530 11.570 6.659 1.00 0.31 H new ATOM 0 HB3 ASP A 14 -14.834 11.343 4.948 1.00 0.31 H new ATOM 205 N ALA A 15 -15.625 8.883 3.886 1.00 0.22 N ATOM 206 CA ALA A 15 -16.323 8.270 2.768 1.00 0.24 C ATOM 207 C ALA A 15 -16.556 6.786 3.042 1.00 0.22 C ATOM 208 O ALA A 15 -17.352 6.134 2.366 1.00 0.29 O ATOM 209 CB ALA A 15 -15.530 8.456 1.483 1.00 0.27 C ATOM 0 H ALA A 15 -14.684 9.209 3.667 1.00 0.22 H new ATOM 0 HA ALA A 15 -17.291 8.758 2.649 1.00 0.24 H new ATOM 0 HB1 ALA A 15 -16.065 7.992 0.655 1.00 0.27 H new ATOM 0 HB2 ALA A 15 -15.405 9.520 1.283 1.00 0.27 H new ATOM 0 HB3 ALA A 15 -14.551 7.989 1.589 1.00 0.27 H new ATOM 215 N PHE A 16 -15.853 6.264 4.046 1.00 0.20 N ATOM 216 CA PHE A 16 -15.966 4.860 4.424 1.00 0.22 C ATOM 217 C PHE A 16 -17.210 4.630 5.277 1.00 0.22 C ATOM 218 O PHE A 16 -18.025 3.759 4.981 1.00 0.25 O ATOM 219 CB PHE A 16 -14.709 4.422 5.187 1.00 0.26 C ATOM 220 CG PHE A 16 -14.751 3.007 5.696 1.00 0.31 C ATOM 221 CD1 PHE A 16 -15.322 2.715 6.924 1.00 0.37 C ATOM 222 CD2 PHE A 16 -14.231 1.967 4.940 1.00 0.38 C ATOM 223 CE1 PHE A 16 -15.372 1.415 7.390 1.00 0.45 C ATOM 224 CE2 PHE A 16 -14.276 0.664 5.402 1.00 0.46 C ATOM 225 CZ PHE A 16 -14.811 0.395 6.649 1.00 0.48 C ATOM 0 H PHE A 16 -15.196 6.798 4.614 1.00 0.20 H new ATOM 0 HA PHE A 16 -16.059 4.261 3.518 1.00 0.22 H new ATOM 0 HB2 PHE A 16 -13.844 4.534 4.533 1.00 0.26 H new ATOM 0 HB3 PHE A 16 -14.559 5.094 6.032 1.00 0.26 H new ATOM 0 HD1 PHE A 16 -15.733 3.513 7.524 1.00 0.37 H new ATOM 0 HD2 PHE A 16 -13.786 2.177 3.979 1.00 0.38 H new ATOM 0 HE1 PHE A 16 -15.850 1.197 8.334 1.00 0.45 H new ATOM 0 HE2 PHE A 16 -13.895 -0.141 4.791 1.00 0.46 H new ATOM 0 HZ PHE A 16 -14.790 -0.611 7.042 1.00 0.48 H new ATOM 235 N VAL A 17 -17.349 5.423 6.335 1.00 0.22 N ATOM 236 CA VAL A 17 -18.494 5.302 7.228 1.00 0.23 C ATOM 237 C VAL A 17 -19.785 5.618 6.486 1.00 0.23 C ATOM 238 O VAL A 17 -20.863 5.159 6.865 1.00 0.26 O ATOM 239 CB VAL A 17 -18.365 6.236 8.448 1.00 0.30 C ATOM 240 CG1 VAL A 17 -17.209 5.804 9.335 1.00 1.11 C ATOM 241 CG2 VAL A 17 -18.193 7.681 8.006 1.00 0.91 C ATOM 0 H VAL A 17 -16.685 6.153 6.593 1.00 0.22 H new ATOM 0 HA VAL A 17 -18.519 4.272 7.583 1.00 0.23 H new ATOM 0 HB VAL A 17 -19.285 6.166 9.028 1.00 0.30 H new ATOM 0 HG11 VAL A 17 -17.135 6.476 10.190 1.00 1.11 H new ATOM 0 HG12 VAL A 17 -17.381 4.787 9.687 1.00 1.11 H new ATOM 0 HG13 VAL A 17 -16.280 5.839 8.765 1.00 1.11 H new ATOM 0 HG21 VAL A 17 -18.104 8.322 8.883 1.00 0.91 H new ATOM 0 HG22 VAL A 17 -17.293 7.771 7.398 1.00 0.91 H new ATOM 0 HG23 VAL A 17 -19.059 7.988 7.419 1.00 0.91 H new ATOM 251 N GLN A 18 -19.660 6.405 5.423 1.00 0.24 N ATOM 252 CA GLN A 18 -20.807 6.785 4.609 1.00 0.29 C ATOM 253 C GLN A 18 -21.527 5.557 4.056 1.00 0.32 C ATOM 254 O GLN A 18 -22.734 5.594 3.816 1.00 0.43 O ATOM 255 CB GLN A 18 -20.355 7.685 3.458 1.00 0.33 C ATOM 256 CG GLN A 18 -20.136 9.133 3.866 1.00 0.34 C ATOM 257 CD GLN A 18 -21.416 9.811 4.314 1.00 1.09 C ATOM 258 OE1 GLN A 18 -22.508 9.466 3.859 1.00 1.54 O ATOM 259 NE2 GLN A 18 -21.289 10.784 5.208 1.00 1.60 N ATOM 0 H GLN A 18 -18.772 6.793 5.105 1.00 0.24 H new ATOM 0 HA GLN A 18 -21.506 7.329 5.244 1.00 0.29 H new ATOM 0 HB2 GLN A 18 -19.429 7.290 3.041 1.00 0.33 H new ATOM 0 HB3 GLN A 18 -21.102 7.649 2.665 1.00 0.33 H new ATOM 0 HG2 GLN A 18 -19.406 9.173 4.674 1.00 0.34 H new ATOM 0 HG3 GLN A 18 -19.712 9.683 3.026 1.00 0.34 H new ATOM 0 HE21 GLN A 18 -20.365 11.037 5.558 1.00 1.60 H new ATOM 0 HE22 GLN A 18 -22.115 11.278 5.545 1.00 1.60 H new ATOM 268 N PHE A 19 -20.785 4.470 3.855 1.00 0.28 N ATOM 269 CA PHE A 19 -21.364 3.238 3.323 1.00 0.33 C ATOM 270 C PHE A 19 -21.524 2.181 4.411 1.00 0.35 C ATOM 271 O PHE A 19 -21.339 0.989 4.161 1.00 0.64 O ATOM 272 CB PHE A 19 -20.504 2.688 2.183 1.00 0.36 C ATOM 273 CG PHE A 19 -20.516 3.554 0.957 1.00 0.37 C ATOM 274 CD1 PHE A 19 -19.833 4.758 0.934 1.00 0.41 C ATOM 275 CD2 PHE A 19 -21.218 3.165 -0.173 1.00 0.48 C ATOM 276 CE1 PHE A 19 -19.847 5.558 -0.192 1.00 0.44 C ATOM 277 CE2 PHE A 19 -21.237 3.960 -1.303 1.00 0.54 C ATOM 278 CZ PHE A 19 -20.550 5.158 -1.312 1.00 0.47 C ATOM 0 H PHE A 19 -19.786 4.417 4.052 1.00 0.28 H new ATOM 0 HA PHE A 19 -22.354 3.481 2.937 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.477 2.579 2.532 1.00 0.36 H new ATOM 0 HB3 PHE A 19 -20.858 1.692 1.919 1.00 0.36 H new ATOM 0 HD1 PHE A 19 -19.282 5.076 1.807 1.00 0.41 H new ATOM 0 HD2 PHE A 19 -21.757 2.229 -0.170 1.00 0.48 H new ATOM 0 HE1 PHE A 19 -19.309 6.495 -0.197 1.00 0.44 H new ATOM 0 HE2 PHE A 19 -21.788 3.645 -2.177 1.00 0.54 H new ATOM 0 HZ PHE A 19 -20.562 5.782 -2.194 1.00 0.47 H new ATOM 288 N ASP A 20 -21.868 2.621 5.616 1.00 0.29 N ATOM 289 CA ASP A 20 -22.064 1.707 6.735 1.00 0.28 C ATOM 290 C ASP A 20 -23.399 1.981 7.417 1.00 0.37 C ATOM 291 O ASP A 20 -23.449 2.462 8.549 1.00 0.44 O ATOM 292 CB ASP A 20 -20.917 1.831 7.741 1.00 0.25 C ATOM 293 CG ASP A 20 -21.069 0.875 8.907 1.00 0.27 C ATOM 294 OD1 ASP A 20 -21.231 -0.341 8.663 1.00 0.29 O ATOM 295 OD2 ASP A 20 -21.023 1.340 10.066 1.00 0.33 O ATOM 0 H ASP A 20 -22.017 3.604 5.843 1.00 0.29 H new ATOM 0 HA ASP A 20 -22.073 0.688 6.348 1.00 0.28 H new ATOM 0 HB2 ASP A 20 -19.971 1.637 7.236 1.00 0.25 H new ATOM 0 HB3 ASP A 20 -20.874 2.854 8.116 1.00 0.25 H new ATOM 300 N LYS A 21 -24.480 1.672 6.710 1.00 0.47 N ATOM 301 CA LYS A 21 -25.826 1.884 7.230 1.00 0.59 C ATOM 302 C LYS A 21 -26.260 0.729 8.125 1.00 0.64 C ATOM 303 O LYS A 21 -27.403 0.681 8.581 1.00 0.83 O ATOM 304 CB LYS A 21 -26.814 2.041 6.077 1.00 0.68 C ATOM 305 CG LYS A 21 -26.556 3.276 5.233 1.00 1.02 C ATOM 306 CD LYS A 21 -27.000 4.544 5.945 1.00 1.14 C ATOM 307 CE LYS A 21 -26.716 5.778 5.106 1.00 1.67 C ATOM 308 NZ LYS A 21 -27.429 5.735 3.800 1.00 2.10 N ATOM 0 H LYS A 21 -24.450 1.272 5.772 1.00 0.47 H new ATOM 0 HA LYS A 21 -25.816 2.795 7.828 1.00 0.59 H new ATOM 0 HB2 LYS A 21 -26.764 1.157 5.441 1.00 0.68 H new ATOM 0 HB3 LYS A 21 -27.826 2.088 6.478 1.00 0.68 H new ATOM 0 HG2 LYS A 21 -25.493 3.342 5.000 1.00 1.02 H new ATOM 0 HG3 LYS A 21 -27.086 3.186 4.285 1.00 1.02 H new ATOM 0 HD2 LYS A 21 -28.067 4.487 6.162 1.00 1.14 H new ATOM 0 HD3 LYS A 21 -26.484 4.626 6.902 1.00 1.14 H new ATOM 0 HE2 LYS A 21 -27.019 6.669 5.656 1.00 1.67 H new ATOM 0 HE3 LYS A 21 -25.643 5.860 4.932 1.00 1.67 H new ATOM 0 HZ1 LYS A 21 -27.393 6.674 3.354 1.00 2.10 H new ATOM 0 HZ2 LYS A 21 -26.972 5.038 3.178 1.00 2.10 H new ATOM 0 HZ3 LYS A 21 -28.421 5.463 3.955 1.00 2.10 H new ATOM 322 N GLU A 22 -25.345 -0.201 8.373 1.00 0.58 N ATOM 323 CA GLU A 22 -25.641 -1.360 9.206 1.00 0.63 C ATOM 324 C GLU A 22 -25.045 -1.203 10.601 1.00 0.60 C ATOM 325 O GLU A 22 -25.233 -2.058 11.466 1.00 0.80 O ATOM 326 CB GLU A 22 -25.109 -2.631 8.545 1.00 0.62 C ATOM 327 CG GLU A 22 -25.603 -2.823 7.120 1.00 0.71 C ATOM 328 CD GLU A 22 -25.090 -4.102 6.490 1.00 0.98 C ATOM 329 OE1 GLU A 22 -23.969 -4.084 5.939 1.00 1.80 O ATOM 330 OE2 GLU A 22 -25.809 -5.122 6.546 1.00 0.96 O ATOM 0 H GLU A 22 -24.392 -0.175 8.009 1.00 0.58 H new ATOM 0 HA GLU A 22 -26.723 -1.436 9.309 1.00 0.63 H new ATOM 0 HB2 GLU A 22 -24.019 -2.602 8.543 1.00 0.62 H new ATOM 0 HB3 GLU A 22 -25.404 -3.493 9.143 1.00 0.62 H new ATOM 0 HG2 GLU A 22 -26.693 -2.833 7.116 1.00 0.71 H new ATOM 0 HG3 GLU A 22 -25.290 -1.973 6.514 1.00 0.71 H new ATOM 337 N GLY A 23 -24.327 -0.104 10.812 1.00 0.45 N ATOM 338 CA GLY A 23 -23.716 0.149 12.105 1.00 0.46 C ATOM 339 C GLY A 23 -22.677 -0.891 12.478 1.00 0.39 C ATOM 340 O GLY A 23 -22.310 -1.019 13.646 1.00 0.45 O ATOM 0 H GLY A 23 -24.157 0.616 10.110 1.00 0.45 H new ATOM 0 HA2 GLY A 23 -23.250 1.134 12.095 1.00 0.46 H new ATOM 0 HA3 GLY A 23 -24.492 0.171 12.870 1.00 0.46 H new ATOM 344 N THR A 24 -22.203 -1.637 11.484 1.00 0.34 N ATOM 345 CA THR A 24 -21.201 -2.672 11.715 1.00 0.30 C ATOM 346 C THR A 24 -19.790 -2.126 11.529 1.00 0.28 C ATOM 347 O THR A 24 -18.818 -2.881 11.535 1.00 0.29 O ATOM 348 CB THR A 24 -21.402 -3.872 10.765 1.00 0.32 C ATOM 349 OG1 THR A 24 -21.460 -3.418 9.409 1.00 0.33 O ATOM 350 CG2 THR A 24 -22.678 -4.627 11.109 1.00 0.40 C ATOM 0 H THR A 24 -22.497 -1.544 10.512 1.00 0.34 H new ATOM 0 HA THR A 24 -21.326 -3.006 12.745 1.00 0.30 H new ATOM 0 HB THR A 24 -20.556 -4.549 10.885 1.00 0.32 H new ATOM 0 HG1 THR A 24 -21.215 -2.470 9.371 1.00 0.33 H new ATOM 0 HG21 THR A 24 -22.798 -5.468 10.426 1.00 0.40 H new ATOM 0 HG22 THR A 24 -22.617 -4.996 12.133 1.00 0.40 H new ATOM 0 HG23 THR A 24 -23.533 -3.958 11.015 1.00 0.40 H new ATOM 358 N GLY A 25 -19.684 -0.807 11.369 1.00 0.30 N ATOM 359 CA GLY A 25 -18.386 -0.185 11.172 1.00 0.32 C ATOM 360 C GLY A 25 -17.632 -0.811 10.017 1.00 0.28 C ATOM 361 O GLY A 25 -16.407 -0.712 9.931 1.00 0.33 O ATOM 0 H GLY A 25 -20.473 -0.161 11.372 1.00 0.30 H new ATOM 0 HA2 GLY A 25 -18.518 0.881 10.985 1.00 0.32 H new ATOM 0 HA3 GLY A 25 -17.796 -0.278 12.084 1.00 0.32 H new ATOM 365 N LYS A 26 -18.378 -1.456 9.129 1.00 0.22 N ATOM 366 CA LYS A 26 -17.807 -2.125 7.970 1.00 0.19 C ATOM 367 C LYS A 26 -18.602 -1.787 6.710 1.00 0.20 C ATOM 368 O LYS A 26 -19.779 -1.434 6.790 1.00 0.23 O ATOM 369 CB LYS A 26 -17.796 -3.638 8.210 1.00 0.20 C ATOM 370 CG LYS A 26 -16.825 -4.066 9.294 1.00 0.25 C ATOM 371 CD LYS A 26 -17.045 -5.513 9.708 1.00 0.62 C ATOM 372 CE LYS A 26 -16.535 -6.486 8.659 1.00 0.62 C ATOM 373 NZ LYS A 26 -17.173 -7.825 8.788 1.00 1.10 N ATOM 0 H LYS A 26 -19.393 -1.529 9.193 1.00 0.22 H new ATOM 0 HA LYS A 26 -16.784 -1.779 7.825 1.00 0.19 H new ATOM 0 HB2 LYS A 26 -18.800 -3.963 8.482 1.00 0.20 H new ATOM 0 HB3 LYS A 26 -17.538 -4.145 7.280 1.00 0.20 H new ATOM 0 HG2 LYS A 26 -15.803 -3.941 8.937 1.00 0.25 H new ATOM 0 HG3 LYS A 26 -16.940 -3.418 10.163 1.00 0.25 H new ATOM 0 HD2 LYS A 26 -16.538 -5.701 10.654 1.00 0.62 H new ATOM 0 HD3 LYS A 26 -18.108 -5.685 9.876 1.00 0.62 H new ATOM 0 HE2 LYS A 26 -16.732 -6.084 7.665 1.00 0.62 H new ATOM 0 HE3 LYS A 26 -15.454 -6.588 8.753 1.00 0.62 H new ATOM 0 HZ1 LYS A 26 -16.799 -8.460 8.054 1.00 1.10 H new ATOM 0 HZ2 LYS A 26 -16.964 -8.220 9.727 1.00 1.10 H new ATOM 0 HZ3 LYS A 26 -18.202 -7.732 8.672 1.00 1.10 H new ATOM 387 N ILE A 27 -17.961 -1.891 5.549 1.00 0.22 N ATOM 388 CA ILE A 27 -18.625 -1.587 4.281 1.00 0.26 C ATOM 389 C ILE A 27 -18.670 -2.807 3.360 1.00 0.24 C ATOM 390 O ILE A 27 -17.660 -3.470 3.142 1.00 0.25 O ATOM 391 CB ILE A 27 -17.923 -0.430 3.548 1.00 0.34 C ATOM 392 CG1 ILE A 27 -16.478 -0.806 3.219 1.00 0.40 C ATOM 393 CG2 ILE A 27 -17.971 0.832 4.397 1.00 0.33 C ATOM 394 CD1 ILE A 27 -15.772 0.207 2.351 1.00 0.50 C ATOM 0 H ILE A 27 -16.988 -2.182 5.458 1.00 0.22 H new ATOM 0 HA ILE A 27 -19.645 -1.293 4.527 1.00 0.26 H new ATOM 0 HB ILE A 27 -18.446 -0.237 2.611 1.00 0.34 H new ATOM 0 HG12 ILE A 27 -15.922 -0.926 4.149 1.00 0.40 H new ATOM 0 HG13 ILE A 27 -16.469 -1.773 2.715 1.00 0.40 H new ATOM 0 HG21 ILE A 27 -17.472 1.645 3.869 1.00 0.33 H new ATOM 0 HG22 ILE A 27 -19.009 1.105 4.584 1.00 0.33 H new ATOM 0 HG23 ILE A 27 -17.466 0.651 5.346 1.00 0.33 H new ATOM 0 HD11 ILE A 27 -14.752 -0.126 2.159 1.00 0.50 H new ATOM 0 HD12 ILE A 27 -16.304 0.310 1.405 1.00 0.50 H new ATOM 0 HD13 ILE A 27 -15.749 1.170 2.861 1.00 0.50 H new ATOM 406 N ALA A 28 -19.852 -3.094 2.822 1.00 0.26 N ATOM 407 CA ALA A 28 -20.029 -4.232 1.923 1.00 0.26 C ATOM 408 C ALA A 28 -19.040 -4.173 0.765 1.00 0.23 C ATOM 409 O ALA A 28 -18.827 -3.117 0.170 1.00 0.25 O ATOM 410 CB ALA A 28 -21.458 -4.268 1.401 1.00 0.30 C ATOM 0 H ALA A 28 -20.701 -2.555 2.992 1.00 0.26 H new ATOM 0 HA ALA A 28 -19.835 -5.146 2.484 1.00 0.26 H new ATOM 0 HB1 ALA A 28 -21.580 -5.120 0.732 1.00 0.30 H new ATOM 0 HB2 ALA A 28 -22.149 -4.363 2.239 1.00 0.30 H new ATOM 0 HB3 ALA A 28 -21.670 -3.347 0.858 1.00 0.30 H new ATOM 416 N THR A 29 -18.434 -5.317 0.455 1.00 0.27 N ATOM 417 CA THR A 29 -17.462 -5.401 -0.630 1.00 0.30 C ATOM 418 C THR A 29 -18.105 -5.080 -1.972 1.00 0.29 C ATOM 419 O THR A 29 -17.423 -4.702 -2.925 1.00 0.39 O ATOM 420 CB THR A 29 -16.820 -6.799 -0.702 1.00 0.37 C ATOM 421 OG1 THR A 29 -15.894 -6.858 -1.795 1.00 1.03 O ATOM 422 CG2 THR A 29 -17.882 -7.875 -0.873 1.00 0.96 C ATOM 0 H THR A 29 -18.600 -6.198 0.941 1.00 0.27 H new ATOM 0 HA THR A 29 -16.688 -4.664 -0.417 1.00 0.30 H new ATOM 0 HB THR A 29 -16.290 -6.979 0.233 1.00 0.37 H new ATOM 0 HG1 THR A 29 -15.785 -7.789 -2.081 1.00 1.03 H new ATOM 0 HG21 THR A 29 -17.404 -8.853 -0.921 1.00 0.96 H new ATOM 0 HG22 THR A 29 -18.568 -7.847 -0.026 1.00 0.96 H new ATOM 0 HG23 THR A 29 -18.436 -7.696 -1.794 1.00 0.96 H new ATOM 430 N ARG A 30 -19.422 -5.234 -2.040 1.00 0.25 N ATOM 431 CA ARG A 30 -20.164 -4.957 -3.263 1.00 0.29 C ATOM 432 C ARG A 30 -20.353 -3.455 -3.443 1.00 0.28 C ATOM 433 O ARG A 30 -20.895 -3.002 -4.452 1.00 0.44 O ATOM 434 CB ARG A 30 -21.526 -5.650 -3.216 1.00 0.35 C ATOM 435 CG ARG A 30 -21.440 -7.133 -2.887 1.00 0.43 C ATOM 436 CD ARG A 30 -22.732 -7.639 -2.266 1.00 0.83 C ATOM 437 NE ARG A 30 -23.886 -7.391 -3.127 1.00 1.56 N ATOM 438 CZ ARG A 30 -25.128 -7.752 -2.819 1.00 2.17 C ATOM 439 NH1 ARG A 30 -25.380 -8.377 -1.677 1.00 2.25 N ATOM 440 NH2 ARG A 30 -26.122 -7.487 -3.656 1.00 3.08 N ATOM 0 H ARG A 30 -19.999 -5.550 -1.260 1.00 0.25 H new ATOM 0 HA ARG A 30 -19.595 -5.342 -4.109 1.00 0.29 H new ATOM 0 HB2 ARG A 30 -22.151 -5.156 -2.472 1.00 0.35 H new ATOM 0 HB3 ARG A 30 -22.021 -5.528 -4.179 1.00 0.35 H new ATOM 0 HG2 ARG A 30 -21.226 -7.697 -3.795 1.00 0.43 H new ATOM 0 HG3 ARG A 30 -20.612 -7.308 -2.200 1.00 0.43 H new ATOM 0 HD2 ARG A 30 -22.647 -8.708 -2.073 1.00 0.83 H new ATOM 0 HD3 ARG A 30 -22.887 -7.152 -1.303 1.00 0.83 H new ATOM 0 HE ARG A 30 -23.730 -6.914 -4.015 1.00 1.56 H new ATOM 0 HH11 ARG A 30 -24.619 -8.583 -1.030 1.00 2.25 H new ATOM 0 HH12 ARG A 30 -26.335 -8.652 -1.446 1.00 2.25 H new ATOM 0 HH21 ARG A 30 -25.934 -7.006 -4.536 1.00 3.08 H new ATOM 0 HH22 ARG A 30 -27.075 -7.764 -3.420 1.00 3.08 H new ATOM 454 N GLU A 31 -19.902 -2.690 -2.455 1.00 0.22 N ATOM 455 CA GLU A 31 -20.019 -1.238 -2.490 1.00 0.23 C ATOM 456 C GLU A 31 -18.648 -0.578 -2.588 1.00 0.21 C ATOM 457 O GLU A 31 -18.550 0.643 -2.722 1.00 0.21 O ATOM 458 CB GLU A 31 -20.753 -0.737 -1.247 1.00 0.30 C ATOM 459 CG GLU A 31 -22.218 -1.133 -1.215 1.00 0.32 C ATOM 460 CD GLU A 31 -23.062 -0.326 -2.182 1.00 1.30 C ATOM 461 OE1 GLU A 31 -23.076 -0.665 -3.383 1.00 2.26 O ATOM 462 OE2 GLU A 31 -23.707 0.646 -1.738 1.00 1.40 O ATOM 0 H GLU A 31 -19.450 -3.054 -1.616 1.00 0.22 H new ATOM 0 HA GLU A 31 -20.592 -0.968 -3.377 1.00 0.23 H new ATOM 0 HB2 GLU A 31 -20.258 -1.129 -0.358 1.00 0.30 H new ATOM 0 HB3 GLU A 31 -20.676 0.349 -1.201 1.00 0.30 H new ATOM 0 HG2 GLU A 31 -22.309 -2.192 -1.455 1.00 0.32 H new ATOM 0 HG3 GLU A 31 -22.604 -1.001 -0.204 1.00 0.32 H new ATOM 469 N LEU A 32 -17.591 -1.383 -2.513 1.00 0.21 N ATOM 470 CA LEU A 32 -16.232 -0.858 -2.603 1.00 0.24 C ATOM 471 C LEU A 32 -16.024 -0.166 -3.946 1.00 0.23 C ATOM 472 O LEU A 32 -15.454 0.923 -4.010 1.00 0.25 O ATOM 473 CB LEU A 32 -15.203 -1.977 -2.420 1.00 0.29 C ATOM 474 CG LEU A 32 -13.929 -1.579 -1.659 1.00 0.44 C ATOM 475 CD1 LEU A 32 -12.936 -2.725 -1.655 1.00 1.04 C ATOM 476 CD2 LEU A 32 -13.297 -0.333 -2.265 1.00 1.37 C ATOM 0 H LEU A 32 -17.649 -2.394 -2.391 1.00 0.21 H new ATOM 0 HA LEU A 32 -16.092 -0.130 -1.804 1.00 0.24 H new ATOM 0 HB2 LEU A 32 -15.679 -2.803 -1.892 1.00 0.29 H new ATOM 0 HB3 LEU A 32 -14.917 -2.350 -3.404 1.00 0.29 H new ATOM 0 HG LEU A 32 -14.207 -1.352 -0.630 1.00 0.44 H new ATOM 0 HD11 LEU A 32 -12.039 -2.427 -1.112 1.00 1.04 H new ATOM 0 HD12 LEU A 32 -13.383 -3.592 -1.169 1.00 1.04 H new ATOM 0 HD13 LEU A 32 -12.671 -2.980 -2.681 1.00 1.04 H new ATOM 0 HD21 LEU A 32 -12.397 -0.073 -1.707 1.00 1.37 H new ATOM 0 HD22 LEU A 32 -13.036 -0.527 -3.305 1.00 1.37 H new ATOM 0 HD23 LEU A 32 -14.005 0.494 -2.217 1.00 1.37 H new ATOM 488 N GLY A 33 -16.482 -0.806 -5.019 1.00 0.25 N ATOM 489 CA GLY A 33 -16.352 -0.213 -6.337 1.00 0.28 C ATOM 490 C GLY A 33 -17.039 1.135 -6.395 1.00 0.27 C ATOM 491 O GLY A 33 -16.503 2.097 -6.947 1.00 0.32 O ATOM 0 H GLY A 33 -16.938 -1.718 -4.999 1.00 0.25 H new ATOM 0 HA2 GLY A 33 -15.297 -0.099 -6.586 1.00 0.28 H new ATOM 0 HA3 GLY A 33 -16.785 -0.879 -7.084 1.00 0.28 H new ATOM 495 N THR A 34 -18.235 1.200 -5.817 1.00 0.23 N ATOM 496 CA THR A 34 -18.993 2.440 -5.771 1.00 0.24 C ATOM 497 C THR A 34 -18.251 3.457 -4.918 1.00 0.22 C ATOM 498 O THR A 34 -18.335 4.664 -5.148 1.00 0.23 O ATOM 499 CB THR A 34 -20.401 2.223 -5.187 1.00 0.26 C ATOM 500 OG1 THR A 34 -21.083 1.196 -5.920 1.00 0.31 O ATOM 501 CG2 THR A 34 -21.213 3.509 -5.235 1.00 0.29 C ATOM 0 H THR A 34 -18.698 0.406 -5.374 1.00 0.23 H new ATOM 0 HA THR A 34 -19.100 2.805 -6.792 1.00 0.24 H new ATOM 0 HB THR A 34 -20.294 1.918 -4.146 1.00 0.26 H new ATOM 0 HG1 THR A 34 -21.977 1.063 -5.541 1.00 0.31 H new ATOM 0 HG21 THR A 34 -22.204 3.330 -4.817 1.00 0.29 H new ATOM 0 HG22 THR A 34 -20.708 4.280 -4.653 1.00 0.29 H new ATOM 0 HG23 THR A 34 -21.310 3.840 -6.269 1.00 0.29 H new ATOM 509 N LEU A 35 -17.521 2.948 -3.930 1.00 0.22 N ATOM 510 CA LEU A 35 -16.742 3.793 -3.039 1.00 0.24 C ATOM 511 C LEU A 35 -15.654 4.500 -3.832 1.00 0.25 C ATOM 512 O LEU A 35 -15.306 5.648 -3.555 1.00 0.29 O ATOM 513 CB LEU A 35 -16.120 2.957 -1.914 1.00 0.29 C ATOM 514 CG LEU A 35 -15.518 3.754 -0.752 1.00 0.42 C ATOM 515 CD1 LEU A 35 -16.483 4.824 -0.266 1.00 1.24 C ATOM 516 CD2 LEU A 35 -15.151 2.819 0.390 1.00 1.16 C ATOM 0 H LEU A 35 -17.454 1.950 -3.728 1.00 0.22 H new ATOM 0 HA LEU A 35 -17.400 4.536 -2.589 1.00 0.24 H new ATOM 0 HB2 LEU A 35 -16.885 2.290 -1.516 1.00 0.29 H new ATOM 0 HB3 LEU A 35 -15.340 2.328 -2.342 1.00 0.29 H new ATOM 0 HG LEU A 35 -14.615 4.249 -1.110 1.00 0.42 H new ATOM 0 HD11 LEU A 35 -16.031 5.374 0.559 1.00 1.24 H new ATOM 0 HD12 LEU A 35 -16.705 5.511 -1.082 1.00 1.24 H new ATOM 0 HD13 LEU A 35 -17.406 4.354 0.074 1.00 1.24 H new ATOM 0 HD21 LEU A 35 -14.724 3.396 1.210 1.00 1.16 H new ATOM 0 HD22 LEU A 35 -16.045 2.301 0.738 1.00 1.16 H new ATOM 0 HD23 LEU A 35 -14.421 2.089 0.042 1.00 1.16 H new ATOM 528 N MET A 36 -15.118 3.795 -4.825 1.00 0.28 N ATOM 529 CA MET A 36 -14.085 4.348 -5.685 1.00 0.32 C ATOM 530 C MET A 36 -14.656 5.484 -6.513 1.00 0.30 C ATOM 531 O MET A 36 -14.012 6.509 -6.707 1.00 0.40 O ATOM 532 CB MET A 36 -13.526 3.268 -6.608 1.00 0.45 C ATOM 533 CG MET A 36 -12.702 2.222 -5.885 1.00 0.51 C ATOM 534 SD MET A 36 -11.325 2.943 -4.977 1.00 1.10 S ATOM 535 CE MET A 36 -10.468 1.462 -4.459 1.00 0.69 C ATOM 0 H MET A 36 -15.386 2.837 -5.051 1.00 0.28 H new ATOM 0 HA MET A 36 -13.277 4.728 -5.059 1.00 0.32 H new ATOM 0 HB2 MET A 36 -14.352 2.777 -7.122 1.00 0.45 H new ATOM 0 HB3 MET A 36 -12.910 3.739 -7.374 1.00 0.45 H new ATOM 0 HG2 MET A 36 -13.342 1.673 -5.194 1.00 0.51 H new ATOM 0 HG3 MET A 36 -12.320 1.501 -6.607 1.00 0.51 H new ATOM 0 HE1 MET A 36 -9.428 1.702 -4.239 1.00 0.69 H new ATOM 0 HE2 MET A 36 -10.945 1.060 -3.565 1.00 0.69 H new ATOM 0 HE3 MET A 36 -10.508 0.720 -5.257 1.00 0.69 H new ATOM 545 N ARG A 37 -15.872 5.281 -7.005 1.00 0.30 N ATOM 546 CA ARG A 37 -16.552 6.294 -7.802 1.00 0.34 C ATOM 547 C ARG A 37 -16.804 7.537 -6.957 1.00 0.33 C ATOM 548 O ARG A 37 -16.898 8.650 -7.474 1.00 0.43 O ATOM 549 CB ARG A 37 -17.875 5.747 -8.344 1.00 0.44 C ATOM 550 CG ARG A 37 -17.718 4.486 -9.173 1.00 0.64 C ATOM 551 CD ARG A 37 -19.060 3.819 -9.421 1.00 0.70 C ATOM 552 NE ARG A 37 -19.882 4.574 -10.363 1.00 1.40 N ATOM 553 CZ ARG A 37 -21.022 4.120 -10.874 1.00 1.73 C ATOM 554 NH1 ARG A 37 -21.466 2.913 -10.545 1.00 1.52 N ATOM 555 NH2 ARG A 37 -21.717 4.869 -11.718 1.00 2.69 N ATOM 0 H ARG A 37 -16.407 4.424 -6.866 1.00 0.30 H new ATOM 0 HA ARG A 37 -15.916 6.561 -8.646 1.00 0.34 H new ATOM 0 HB2 ARG A 37 -18.543 5.541 -7.508 1.00 0.44 H new ATOM 0 HB3 ARG A 37 -18.354 6.514 -8.952 1.00 0.44 H new ATOM 0 HG2 ARG A 37 -17.249 4.731 -10.126 1.00 0.64 H new ATOM 0 HG3 ARG A 37 -17.053 3.791 -8.660 1.00 0.64 H new ATOM 0 HD2 ARG A 37 -18.898 2.813 -9.807 1.00 0.70 H new ATOM 0 HD3 ARG A 37 -19.594 3.716 -8.476 1.00 0.70 H new ATOM 0 HE ARG A 37 -19.564 5.501 -10.644 1.00 1.40 H new ATOM 0 HH11 ARG A 37 -20.932 2.332 -9.899 1.00 1.52 H new ATOM 0 HH12 ARG A 37 -22.341 2.567 -10.938 1.00 1.52 H new ATOM 0 HH21 ARG A 37 -21.377 5.795 -11.976 1.00 2.69 H new ATOM 0 HH22 ARG A 37 -22.592 4.519 -12.109 1.00 2.69 H new ATOM 569 N THR A 38 -16.913 7.328 -5.648 1.00 0.31 N ATOM 570 CA THR A 38 -17.139 8.407 -4.704 1.00 0.39 C ATOM 571 C THR A 38 -15.826 9.139 -4.421 1.00 0.36 C ATOM 572 O THR A 38 -15.813 10.266 -3.923 1.00 0.43 O ATOM 573 CB THR A 38 -17.738 7.843 -3.396 1.00 0.50 C ATOM 574 OG1 THR A 38 -19.139 7.598 -3.568 1.00 1.06 O ATOM 575 CG2 THR A 38 -17.526 8.785 -2.227 1.00 0.61 C ATOM 0 H THR A 38 -16.847 6.406 -5.217 1.00 0.31 H new ATOM 0 HA THR A 38 -17.845 9.117 -5.134 1.00 0.39 H new ATOM 0 HB THR A 38 -17.222 6.909 -3.172 1.00 0.50 H new ATOM 0 HG1 THR A 38 -19.573 7.551 -2.691 1.00 1.06 H new ATOM 0 HG21 THR A 38 -17.962 8.352 -1.327 1.00 0.61 H new ATOM 0 HG22 THR A 38 -16.458 8.941 -2.074 1.00 0.61 H new ATOM 0 HG23 THR A 38 -18.006 9.741 -2.438 1.00 0.61 H new ATOM 583 N LEU A 39 -14.725 8.486 -4.776 1.00 0.30 N ATOM 584 CA LEU A 39 -13.388 9.037 -4.582 1.00 0.33 C ATOM 585 C LEU A 39 -12.729 9.307 -5.929 1.00 0.33 C ATOM 586 O LEU A 39 -13.122 8.743 -6.948 1.00 0.31 O ATOM 587 CB LEU A 39 -12.522 8.065 -3.775 1.00 0.38 C ATOM 588 CG LEU A 39 -12.574 8.233 -2.254 1.00 0.64 C ATOM 589 CD1 LEU A 39 -13.983 8.011 -1.729 1.00 1.26 C ATOM 590 CD2 LEU A 39 -11.598 7.277 -1.585 1.00 1.07 C ATOM 0 H LEU A 39 -14.734 7.561 -5.206 1.00 0.30 H new ATOM 0 HA LEU A 39 -13.479 9.974 -4.032 1.00 0.33 H new ATOM 0 HB2 LEU A 39 -12.826 7.047 -4.020 1.00 0.38 H new ATOM 0 HB3 LEU A 39 -11.487 8.175 -4.099 1.00 0.38 H new ATOM 0 HG LEU A 39 -12.283 9.256 -2.013 1.00 0.64 H new ATOM 0 HD11 LEU A 39 -13.992 8.136 -0.646 1.00 1.26 H new ATOM 0 HD12 LEU A 39 -14.659 8.735 -2.184 1.00 1.26 H new ATOM 0 HD13 LEU A 39 -14.310 7.002 -1.980 1.00 1.26 H new ATOM 0 HD21 LEU A 39 -11.645 7.407 -0.504 1.00 1.07 H new ATOM 0 HD22 LEU A 39 -11.862 6.250 -1.839 1.00 1.07 H new ATOM 0 HD23 LEU A 39 -10.586 7.488 -1.932 1.00 1.07 H new ATOM 602 N GLY A 40 -11.746 10.199 -5.937 1.00 0.42 N ATOM 603 CA GLY A 40 -11.049 10.516 -7.170 1.00 0.47 C ATOM 604 C GLY A 40 -10.101 9.410 -7.601 1.00 0.43 C ATOM 605 O GLY A 40 -9.024 9.681 -8.133 1.00 0.69 O ATOM 0 H GLY A 40 -11.419 10.707 -5.115 1.00 0.42 H new ATOM 0 HA2 GLY A 40 -11.778 10.694 -7.961 1.00 0.47 H new ATOM 0 HA3 GLY A 40 -10.488 11.441 -7.039 1.00 0.47 H new ATOM 609 N GLN A 41 -10.501 8.160 -7.371 1.00 0.44 N ATOM 610 CA GLN A 41 -9.682 7.010 -7.735 1.00 0.40 C ATOM 611 C GLN A 41 -9.978 6.547 -9.157 1.00 0.51 C ATOM 612 O GLN A 41 -9.154 6.709 -10.058 1.00 1.45 O ATOM 613 CB GLN A 41 -9.927 5.851 -6.765 1.00 0.48 C ATOM 614 CG GLN A 41 -9.740 6.214 -5.300 1.00 0.74 C ATOM 615 CD GLN A 41 -8.564 7.143 -5.067 1.00 1.06 C ATOM 616 OE1 GLN A 41 -8.689 8.363 -5.174 1.00 1.97 O ATOM 617 NE2 GLN A 41 -7.419 6.568 -4.727 1.00 1.30 N ATOM 0 H GLN A 41 -11.390 7.920 -6.933 1.00 0.44 H new ATOM 0 HA GLN A 41 -8.638 7.320 -7.679 1.00 0.40 H new ATOM 0 HB2 GLN A 41 -10.942 5.480 -6.909 1.00 0.48 H new ATOM 0 HB3 GLN A 41 -9.250 5.034 -7.015 1.00 0.48 H new ATOM 0 HG2 GLN A 41 -10.649 6.687 -4.929 1.00 0.74 H new ATOM 0 HG3 GLN A 41 -9.596 5.302 -4.721 1.00 0.74 H new ATOM 0 HE21 GLN A 41 -7.361 5.553 -4.650 1.00 1.30 H new ATOM 0 HE22 GLN A 41 -6.596 7.141 -4.542 1.00 1.30 H new ATOM 626 N ASN A 42 -11.160 5.967 -9.346 1.00 0.74 N ATOM 627 CA ASN A 42 -11.572 5.459 -10.650 1.00 0.68 C ATOM 628 C ASN A 42 -10.605 4.378 -11.133 1.00 0.53 C ATOM 629 O ASN A 42 -9.876 4.576 -12.106 1.00 0.62 O ATOM 630 CB ASN A 42 -11.652 6.594 -11.674 1.00 0.85 C ATOM 631 CG ASN A 42 -12.234 6.138 -12.997 1.00 1.87 C ATOM 632 OD1 ASN A 42 -11.508 5.711 -13.895 1.00 2.57 O ATOM 633 ND2 ASN A 42 -13.553 6.223 -13.124 1.00 2.66 N ATOM 0 H ASN A 42 -11.852 5.837 -8.608 1.00 0.74 H new ATOM 0 HA ASN A 42 -12.564 5.019 -10.545 1.00 0.68 H new ATOM 0 HB2 ASN A 42 -12.263 7.402 -11.270 1.00 0.85 H new ATOM 0 HB3 ASN A 42 -10.655 7.001 -11.840 1.00 0.85 H new ATOM 0 HD21 ASN A 42 -14.002 5.928 -13.991 1.00 2.66 H new ATOM 0 HD22 ASN A 42 -14.117 6.583 -12.354 1.00 2.66 H new ATOM 640 N PRO A 43 -10.582 3.217 -10.451 1.00 0.41 N ATOM 641 CA PRO A 43 -9.698 2.104 -10.812 1.00 0.40 C ATOM 642 C PRO A 43 -10.148 1.391 -12.082 1.00 0.39 C ATOM 643 O PRO A 43 -11.074 1.835 -12.762 1.00 0.51 O ATOM 644 CB PRO A 43 -9.812 1.163 -9.613 1.00 0.44 C ATOM 645 CG PRO A 43 -11.171 1.426 -9.065 1.00 0.45 C ATOM 646 CD PRO A 43 -11.414 2.894 -9.273 1.00 0.44 C ATOM 0 HA PRO A 43 -8.683 2.443 -11.018 1.00 0.40 H new ATOM 0 HB2 PRO A 43 -9.699 0.121 -9.913 1.00 0.44 H new ATOM 0 HB3 PRO A 43 -9.038 1.367 -8.873 1.00 0.44 H new ATOM 0 HG2 PRO A 43 -11.923 0.828 -9.579 1.00 0.45 H new ATOM 0 HG3 PRO A 43 -11.224 1.166 -8.008 1.00 0.45 H new ATOM 0 HD2 PRO A 43 -12.468 3.105 -9.456 1.00 0.44 H new ATOM 0 HD3 PRO A 43 -11.119 3.477 -8.401 1.00 0.44 H new ATOM 654 N THR A 44 -9.485 0.283 -12.392 1.00 0.35 N ATOM 655 CA THR A 44 -9.813 -0.503 -13.574 1.00 0.36 C ATOM 656 C THR A 44 -10.802 -1.610 -13.236 1.00 0.32 C ATOM 657 O THR A 44 -10.819 -2.112 -12.112 1.00 0.33 O ATOM 658 CB THR A 44 -8.554 -1.131 -14.198 1.00 0.43 C ATOM 659 OG1 THR A 44 -7.606 -1.451 -13.173 1.00 0.73 O ATOM 660 CG2 THR A 44 -7.923 -0.189 -15.211 1.00 0.69 C ATOM 0 H THR A 44 -8.714 -0.092 -11.839 1.00 0.35 H new ATOM 0 HA THR A 44 -10.264 0.180 -14.294 1.00 0.36 H new ATOM 0 HB THR A 44 -8.848 -2.045 -14.715 1.00 0.43 H new ATOM 0 HG1 THR A 44 -6.809 -1.852 -13.578 1.00 0.73 H new ATOM 0 HG21 THR A 44 -7.035 -0.655 -15.638 1.00 0.69 H new ATOM 0 HG22 THR A 44 -8.639 0.024 -16.005 1.00 0.69 H new ATOM 0 HG23 THR A 44 -7.642 0.741 -14.717 1.00 0.69 H new ATOM 668 N GLU A 45 -11.627 -1.987 -14.209 1.00 0.32 N ATOM 669 CA GLU A 45 -12.610 -3.042 -14.000 1.00 0.33 C ATOM 670 C GLU A 45 -11.936 -4.312 -13.495 1.00 0.32 C ATOM 671 O GLU A 45 -12.402 -4.930 -12.542 1.00 0.34 O ATOM 672 CB GLU A 45 -13.375 -3.331 -15.293 1.00 0.40 C ATOM 673 CG GLU A 45 -14.650 -2.517 -15.437 1.00 1.14 C ATOM 674 CD GLU A 45 -15.386 -2.812 -16.730 1.00 1.84 C ATOM 675 OE1 GLU A 45 -16.217 -3.745 -16.741 1.00 2.70 O ATOM 676 OE2 GLU A 45 -15.132 -2.109 -17.731 1.00 2.04 O ATOM 0 H GLU A 45 -11.634 -1.580 -15.144 1.00 0.32 H new ATOM 0 HA GLU A 45 -13.318 -2.700 -13.246 1.00 0.33 H new ATOM 0 HB2 GLU A 45 -12.725 -3.127 -16.144 1.00 0.40 H new ATOM 0 HB3 GLU A 45 -13.624 -4.392 -15.329 1.00 0.40 H new ATOM 0 HG2 GLU A 45 -15.307 -2.726 -14.593 1.00 1.14 H new ATOM 0 HG3 GLU A 45 -14.406 -1.455 -15.396 1.00 1.14 H new ATOM 683 N ALA A 46 -10.831 -4.687 -14.134 1.00 0.33 N ATOM 684 CA ALA A 46 -10.093 -5.884 -13.742 1.00 0.37 C ATOM 685 C ALA A 46 -9.702 -5.829 -12.270 1.00 0.33 C ATOM 686 O ALA A 46 -9.986 -6.754 -11.510 1.00 0.34 O ATOM 687 CB ALA A 46 -8.854 -6.050 -14.609 1.00 0.46 C ATOM 0 H ALA A 46 -10.428 -4.181 -14.923 1.00 0.33 H new ATOM 0 HA ALA A 46 -10.745 -6.745 -13.889 1.00 0.37 H new ATOM 0 HB1 ALA A 46 -8.314 -6.947 -14.305 1.00 0.46 H new ATOM 0 HB2 ALA A 46 -9.151 -6.142 -15.654 1.00 0.46 H new ATOM 0 HB3 ALA A 46 -8.208 -5.180 -14.491 1.00 0.46 H new ATOM 693 N GLU A 47 -9.052 -4.738 -11.876 1.00 0.32 N ATOM 694 CA GLU A 47 -8.618 -4.561 -10.492 1.00 0.32 C ATOM 695 C GLU A 47 -9.791 -4.717 -9.530 1.00 0.28 C ATOM 696 O GLU A 47 -9.692 -5.425 -8.530 1.00 0.28 O ATOM 697 CB GLU A 47 -7.970 -3.187 -10.313 1.00 0.37 C ATOM 698 CG GLU A 47 -7.420 -2.948 -8.917 1.00 0.43 C ATOM 699 CD GLU A 47 -6.698 -1.621 -8.795 1.00 1.24 C ATOM 700 OE1 GLU A 47 -7.380 -0.579 -8.716 1.00 2.23 O ATOM 701 OE2 GLU A 47 -5.448 -1.625 -8.779 1.00 1.27 O ATOM 0 H GLU A 47 -8.814 -3.963 -12.495 1.00 0.32 H new ATOM 0 HA GLU A 47 -7.883 -5.333 -10.264 1.00 0.32 H new ATOM 0 HB2 GLU A 47 -7.161 -3.080 -11.036 1.00 0.37 H new ATOM 0 HB3 GLU A 47 -8.706 -2.416 -10.541 1.00 0.37 H new ATOM 0 HG2 GLU A 47 -8.238 -2.980 -8.198 1.00 0.43 H new ATOM 0 HG3 GLU A 47 -6.735 -3.755 -8.657 1.00 0.43 H new ATOM 708 N LEU A 48 -10.901 -4.056 -9.842 1.00 0.29 N ATOM 709 CA LEU A 48 -12.091 -4.130 -9.004 1.00 0.31 C ATOM 710 C LEU A 48 -12.597 -5.565 -8.900 1.00 0.30 C ATOM 711 O LEU A 48 -12.920 -6.036 -7.814 1.00 0.35 O ATOM 712 CB LEU A 48 -13.193 -3.223 -9.554 1.00 0.35 C ATOM 713 CG LEU A 48 -13.138 -1.770 -9.078 1.00 0.65 C ATOM 714 CD1 LEU A 48 -14.149 -0.923 -9.837 1.00 1.34 C ATOM 715 CD2 LEU A 48 -13.395 -1.690 -7.579 1.00 1.36 C ATOM 0 H LEU A 48 -11.001 -3.465 -10.667 1.00 0.29 H new ATOM 0 HA LEU A 48 -11.819 -3.788 -8.005 1.00 0.31 H new ATOM 0 HB2 LEU A 48 -13.141 -3.234 -10.643 1.00 0.35 H new ATOM 0 HB3 LEU A 48 -14.160 -3.643 -9.277 1.00 0.35 H new ATOM 0 HG LEU A 48 -12.140 -1.379 -9.278 1.00 0.65 H new ATOM 0 HD11 LEU A 48 -14.097 0.108 -9.486 1.00 1.34 H new ATOM 0 HD12 LEU A 48 -13.923 -0.955 -10.903 1.00 1.34 H new ATOM 0 HD13 LEU A 48 -15.152 -1.314 -9.666 1.00 1.34 H new ATOM 0 HD21 LEU A 48 -13.352 -0.649 -7.258 1.00 1.36 H new ATOM 0 HD22 LEU A 48 -14.381 -2.098 -7.357 1.00 1.36 H new ATOM 0 HD23 LEU A 48 -12.636 -2.265 -7.049 1.00 1.36 H new ATOM 727 N GLN A 49 -12.656 -6.259 -10.031 1.00 0.30 N ATOM 728 CA GLN A 49 -13.130 -7.639 -10.053 1.00 0.35 C ATOM 729 C GLN A 49 -12.217 -8.548 -9.234 1.00 0.35 C ATOM 730 O GLN A 49 -12.677 -9.505 -8.613 1.00 0.38 O ATOM 731 CB GLN A 49 -13.217 -8.159 -11.490 1.00 0.41 C ATOM 732 CG GLN A 49 -14.229 -7.424 -12.356 1.00 0.48 C ATOM 733 CD GLN A 49 -15.581 -7.276 -11.687 1.00 0.78 C ATOM 734 OE1 GLN A 49 -16.419 -8.175 -11.749 1.00 1.22 O ATOM 735 NE2 GLN A 49 -15.807 -6.127 -11.060 1.00 1.19 N ATOM 0 H GLN A 49 -12.383 -5.891 -10.942 1.00 0.30 H new ATOM 0 HA GLN A 49 -14.125 -7.651 -9.608 1.00 0.35 H new ATOM 0 HB2 GLN A 49 -12.234 -8.081 -11.953 1.00 0.41 H new ATOM 0 HB3 GLN A 49 -13.475 -9.218 -11.467 1.00 0.41 H new ATOM 0 HG2 GLN A 49 -13.840 -6.436 -12.601 1.00 0.48 H new ATOM 0 HG3 GLN A 49 -14.352 -7.960 -13.297 1.00 0.48 H new ATOM 0 HE21 GLN A 49 -15.083 -5.409 -11.034 1.00 1.19 H new ATOM 0 HE22 GLN A 49 -16.705 -5.962 -10.605 1.00 1.19 H new ATOM 744 N ASP A 50 -10.924 -8.241 -9.232 1.00 0.34 N ATOM 745 CA ASP A 50 -9.947 -9.041 -8.500 1.00 0.38 C ATOM 746 C ASP A 50 -10.062 -8.852 -6.988 1.00 0.35 C ATOM 747 O ASP A 50 -10.201 -9.823 -6.244 1.00 0.39 O ATOM 748 CB ASP A 50 -8.527 -8.693 -8.957 1.00 0.43 C ATOM 749 CG ASP A 50 -8.162 -9.361 -10.268 1.00 0.49 C ATOM 750 OD1 ASP A 50 -7.772 -10.547 -10.242 1.00 0.62 O ATOM 751 OD2 ASP A 50 -8.262 -8.698 -11.322 1.00 0.53 O ATOM 0 H ASP A 50 -10.528 -7.444 -9.729 1.00 0.34 H new ATOM 0 HA ASP A 50 -10.159 -10.087 -8.721 1.00 0.38 H new ATOM 0 HB2 ASP A 50 -8.438 -7.612 -9.066 1.00 0.43 H new ATOM 0 HB3 ASP A 50 -7.816 -8.996 -8.188 1.00 0.43 H new ATOM 756 N LEU A 51 -10.005 -7.603 -6.539 1.00 0.32 N ATOM 757 CA LEU A 51 -10.077 -7.298 -5.111 1.00 0.33 C ATOM 758 C LEU A 51 -11.469 -7.559 -4.536 1.00 0.32 C ATOM 759 O LEU A 51 -11.597 -8.087 -3.431 1.00 0.35 O ATOM 760 CB LEU A 51 -9.665 -5.847 -4.861 1.00 0.36 C ATOM 761 CG LEU A 51 -10.568 -4.796 -5.500 1.00 0.30 C ATOM 762 CD1 LEU A 51 -11.583 -4.281 -4.493 1.00 0.39 C ATOM 763 CD2 LEU A 51 -9.739 -3.650 -6.061 1.00 0.31 C ATOM 0 H LEU A 51 -9.909 -6.785 -7.141 1.00 0.32 H new ATOM 0 HA LEU A 51 -9.384 -7.965 -4.599 1.00 0.33 H new ATOM 0 HB2 LEU A 51 -9.638 -5.674 -3.785 1.00 0.36 H new ATOM 0 HB3 LEU A 51 -8.650 -5.705 -5.232 1.00 0.36 H new ATOM 0 HG LEU A 51 -11.109 -5.262 -6.323 1.00 0.30 H new ATOM 0 HD11 LEU A 51 -12.218 -3.532 -4.967 1.00 0.39 H new ATOM 0 HD12 LEU A 51 -12.199 -5.109 -4.141 1.00 0.39 H new ATOM 0 HD13 LEU A 51 -11.061 -3.832 -3.648 1.00 0.39 H new ATOM 0 HD21 LEU A 51 -10.400 -2.910 -6.513 1.00 0.31 H new ATOM 0 HD22 LEU A 51 -9.170 -3.185 -5.256 1.00 0.31 H new ATOM 0 HD23 LEU A 51 -9.053 -4.033 -6.816 1.00 0.31 H new ATOM 775 N ILE A 52 -12.510 -7.190 -5.279 1.00 0.31 N ATOM 776 CA ILE A 52 -13.881 -7.389 -4.816 1.00 0.34 C ATOM 777 C ILE A 52 -14.209 -8.873 -4.694 1.00 0.37 C ATOM 778 O ILE A 52 -14.899 -9.285 -3.763 1.00 0.41 O ATOM 779 CB ILE A 52 -14.909 -6.709 -5.748 1.00 0.38 C ATOM 780 CG1 ILE A 52 -14.750 -5.187 -5.693 1.00 0.42 C ATOM 781 CG2 ILE A 52 -16.329 -7.112 -5.366 1.00 0.50 C ATOM 782 CD1 ILE A 52 -15.632 -4.446 -6.676 1.00 0.50 C ATOM 0 H ILE A 52 -12.432 -6.755 -6.198 1.00 0.31 H new ATOM 0 HA ILE A 52 -13.949 -6.924 -3.832 1.00 0.34 H new ATOM 0 HB ILE A 52 -14.723 -7.041 -6.769 1.00 0.38 H new ATOM 0 HG12 ILE A 52 -14.977 -4.843 -4.684 1.00 0.42 H new ATOM 0 HG13 ILE A 52 -13.709 -4.932 -5.889 1.00 0.42 H new ATOM 0 HG21 ILE A 52 -17.038 -6.623 -6.034 1.00 0.50 H new ATOM 0 HG22 ILE A 52 -16.436 -8.193 -5.452 1.00 0.50 H new ATOM 0 HG23 ILE A 52 -16.529 -6.808 -4.339 1.00 0.50 H new ATOM 0 HD11 ILE A 52 -15.464 -3.373 -6.579 1.00 0.50 H new ATOM 0 HD12 ILE A 52 -15.390 -4.760 -7.691 1.00 0.50 H new ATOM 0 HD13 ILE A 52 -16.678 -4.670 -6.467 1.00 0.50 H new ATOM 794 N ALA A 53 -13.718 -9.671 -5.638 1.00 0.41 N ATOM 795 CA ALA A 53 -13.962 -11.109 -5.611 1.00 0.50 C ATOM 796 C ALA A 53 -13.246 -11.749 -4.432 1.00 0.49 C ATOM 797 O ALA A 53 -13.767 -12.668 -3.799 1.00 0.58 O ATOM 798 CB ALA A 53 -13.518 -11.751 -6.916 1.00 0.59 C ATOM 0 H ALA A 53 -13.154 -9.350 -6.425 1.00 0.41 H new ATOM 0 HA ALA A 53 -15.033 -11.273 -5.494 1.00 0.50 H new ATOM 0 HB1 ALA A 53 -13.708 -12.824 -6.877 1.00 0.59 H new ATOM 0 HB2 ALA A 53 -14.075 -11.314 -7.745 1.00 0.59 H new ATOM 0 HB3 ALA A 53 -12.452 -11.576 -7.063 1.00 0.59 H new ATOM 804 N GLU A 54 -12.044 -11.260 -4.143 1.00 0.45 N ATOM 805 CA GLU A 54 -11.265 -11.774 -3.028 1.00 0.51 C ATOM 806 C GLU A 54 -11.982 -11.486 -1.715 1.00 0.50 C ATOM 807 O GLU A 54 -12.021 -12.328 -0.818 1.00 0.59 O ATOM 808 CB GLU A 54 -9.869 -11.146 -3.015 1.00 0.57 C ATOM 809 CG GLU A 54 -8.979 -11.661 -1.895 1.00 1.07 C ATOM 810 CD GLU A 54 -8.776 -13.162 -1.955 1.00 1.77 C ATOM 811 OE1 GLU A 54 -7.824 -13.606 -2.630 1.00 1.99 O ATOM 812 OE2 GLU A 54 -9.570 -13.894 -1.329 1.00 2.54 O ATOM 0 H GLU A 54 -11.591 -10.510 -4.666 1.00 0.45 H new ATOM 0 HA GLU A 54 -11.158 -12.852 -3.145 1.00 0.51 H new ATOM 0 HB2 GLU A 54 -9.384 -11.340 -3.972 1.00 0.57 H new ATOM 0 HB3 GLU A 54 -9.967 -10.065 -2.921 1.00 0.57 H new ATOM 0 HG2 GLU A 54 -8.010 -11.165 -1.949 1.00 1.07 H new ATOM 0 HG3 GLU A 54 -9.420 -11.396 -0.934 1.00 1.07 H new ATOM 819 N ALA A 55 -12.552 -10.288 -1.613 1.00 0.43 N ATOM 820 CA ALA A 55 -13.283 -9.892 -0.417 1.00 0.47 C ATOM 821 C ALA A 55 -14.692 -10.475 -0.419 1.00 0.46 C ATOM 822 O ALA A 55 -15.372 -10.485 0.607 1.00 0.53 O ATOM 823 CB ALA A 55 -13.337 -8.377 -0.305 1.00 0.50 C ATOM 0 H ALA A 55 -12.521 -9.577 -2.344 1.00 0.43 H new ATOM 0 HA ALA A 55 -12.753 -10.288 0.449 1.00 0.47 H new ATOM 0 HB1 ALA A 55 -13.887 -8.098 0.594 1.00 0.50 H new ATOM 0 HB2 ALA A 55 -12.323 -7.980 -0.248 1.00 0.50 H new ATOM 0 HB3 ALA A 55 -13.840 -7.965 -1.180 1.00 0.50 H new ATOM 829 N GLU A 56 -15.128 -10.959 -1.581 1.00 0.41 N ATOM 830 CA GLU A 56 -16.459 -11.542 -1.717 1.00 0.44 C ATOM 831 C GLU A 56 -16.574 -12.832 -0.912 1.00 0.49 C ATOM 832 O GLU A 56 -17.518 -13.013 -0.142 1.00 0.63 O ATOM 833 CB GLU A 56 -16.771 -11.817 -3.190 1.00 0.47 C ATOM 834 CG GLU A 56 -18.162 -12.385 -3.426 1.00 0.52 C ATOM 835 CD GLU A 56 -19.262 -11.461 -2.940 1.00 1.26 C ATOM 836 OE1 GLU A 56 -19.664 -10.562 -3.707 1.00 1.66 O ATOM 837 OE2 GLU A 56 -19.720 -11.636 -1.791 1.00 1.95 O ATOM 0 H GLU A 56 -14.578 -10.958 -2.440 1.00 0.41 H new ATOM 0 HA GLU A 56 -17.182 -10.826 -1.327 1.00 0.44 H new ATOM 0 HB2 GLU A 56 -16.667 -10.890 -3.753 1.00 0.47 H new ATOM 0 HB3 GLU A 56 -16.032 -12.514 -3.584 1.00 0.47 H new ATOM 0 HG2 GLU A 56 -18.297 -12.575 -4.491 1.00 0.52 H new ATOM 0 HG3 GLU A 56 -18.249 -13.345 -2.918 1.00 0.52 H new ATOM 844 N ASN A 57 -15.608 -13.725 -1.096 1.00 0.53 N ATOM 845 CA ASN A 57 -15.598 -15.000 -0.386 1.00 0.68 C ATOM 846 C ASN A 57 -14.933 -14.855 0.978 1.00 0.79 C ATOM 847 O ASN A 57 -14.261 -15.771 1.454 1.00 1.19 O ATOM 848 CB ASN A 57 -14.872 -16.062 -1.214 1.00 0.87 C ATOM 849 CG ASN A 57 -15.533 -16.297 -2.557 1.00 1.67 C ATOM 850 OD1 ASN A 57 -16.415 -17.145 -2.688 1.00 2.38 O ATOM 851 ND2 ASN A 57 -15.109 -15.543 -3.565 1.00 2.48 N ATOM 0 H ASN A 57 -14.821 -13.590 -1.731 1.00 0.53 H new ATOM 0 HA ASN A 57 -16.631 -15.314 -0.234 1.00 0.68 H new ATOM 0 HB2 ASN A 57 -13.838 -15.754 -1.370 1.00 0.87 H new ATOM 0 HB3 ASN A 57 -14.845 -16.998 -0.656 1.00 0.87 H new ATOM 0 HD21 ASN A 57 -15.518 -15.655 -4.493 1.00 2.48 H new ATOM 0 HD22 ASN A 57 -14.375 -14.852 -3.411 1.00 2.48 H new ATOM 858 N ASN A 58 -15.126 -13.699 1.604 1.00 0.84 N ATOM 859 CA ASN A 58 -14.546 -13.433 2.913 1.00 1.03 C ATOM 860 C ASN A 58 -15.326 -12.342 3.638 1.00 1.09 C ATOM 861 O ASN A 58 -15.932 -11.476 3.006 1.00 1.84 O ATOM 862 CB ASN A 58 -13.079 -13.022 2.767 1.00 1.12 C ATOM 863 CG ASN A 58 -12.299 -13.187 4.058 1.00 1.81 C ATOM 864 OD1 ASN A 58 -12.228 -12.272 4.878 1.00 2.48 O ATOM 865 ND2 ASN A 58 -11.710 -14.363 4.245 1.00 2.14 N ATOM 0 H ASN A 58 -15.680 -12.931 1.225 1.00 0.84 H new ATOM 0 HA ASN A 58 -14.601 -14.347 3.504 1.00 1.03 H new ATOM 0 HB2 ASN A 58 -12.613 -13.622 1.985 1.00 1.12 H new ATOM 0 HB3 ASN A 58 -13.027 -11.982 2.445 1.00 1.12 H new ATOM 0 HD21 ASN A 58 -11.173 -14.535 5.095 1.00 2.14 H new ATOM 0 HD22 ASN A 58 -11.795 -15.094 3.539 1.00 2.14 H new ATOM 872 N ASN A 59 -15.311 -12.400 4.966 1.00 1.04 N ATOM 873 CA ASN A 59 -16.011 -11.420 5.793 1.00 1.01 C ATOM 874 C ASN A 59 -17.520 -11.471 5.561 1.00 0.88 C ATOM 875 O ASN A 59 -18.255 -10.595 6.018 1.00 0.91 O ATOM 876 CB ASN A 59 -15.493 -10.010 5.510 1.00 1.08 C ATOM 877 CG ASN A 59 -13.986 -9.959 5.353 1.00 1.31 C ATOM 878 OD1 ASN A 59 -13.465 -10.041 4.240 1.00 2.05 O ATOM 879 ND2 ASN A 59 -13.277 -9.828 6.467 1.00 1.51 N ATOM 0 H ASN A 59 -14.819 -13.119 5.496 1.00 1.04 H new ATOM 0 HA ASN A 59 -15.815 -11.672 6.835 1.00 1.01 H new ATOM 0 HB2 ASN A 59 -15.961 -9.631 4.602 1.00 1.08 H new ATOM 0 HB3 ASN A 59 -15.792 -9.348 6.323 1.00 1.08 H new ATOM 0 HD21 ASN A 59 -12.259 -9.792 6.422 1.00 1.51 H new ATOM 0 HD22 ASN A 59 -13.750 -9.764 7.368 1.00 1.51 H new ATOM 886 N ASN A 60 -17.973 -12.497 4.843 1.00 0.80 N ATOM 887 CA ASN A 60 -19.395 -12.673 4.550 1.00 0.76 C ATOM 888 C ASN A 60 -19.950 -11.521 3.714 1.00 0.74 C ATOM 889 O ASN A 60 -21.165 -11.374 3.579 1.00 1.42 O ATOM 890 CB ASN A 60 -20.196 -12.810 5.849 1.00 0.86 C ATOM 891 CG ASN A 60 -19.816 -14.049 6.638 1.00 0.95 C ATOM 892 OD1 ASN A 60 -19.454 -15.116 5.934 1.00 1.47 O flip ATOM 893 ND2 ASN A 60 -19.851 -14.049 7.869 1.00 1.19 N flip ATOM 0 H ASN A 60 -17.373 -13.223 4.451 1.00 0.80 H new ATOM 0 HA ASN A 60 -19.496 -13.588 3.966 1.00 0.76 H new ATOM 0 HB2 ASN A 60 -20.035 -11.926 6.466 1.00 0.86 H new ATOM 0 HB3 ASN A 60 -21.260 -12.845 5.614 1.00 0.86 H new ATOM 0 HD21 ASN A 60 -20.135 -13.208 8.371 1.00 1.19 H new ATOM 0 HD22 ASN A 60 -19.596 -14.890 8.386 1.00 1.19 H new ATOM 900 N GLY A 61 -19.059 -10.707 3.154 1.00 0.43 N ATOM 901 CA GLY A 61 -19.493 -9.591 2.331 1.00 0.40 C ATOM 902 C GLY A 61 -19.367 -8.256 3.039 1.00 0.32 C ATOM 903 O GLY A 61 -20.225 -7.387 2.894 1.00 0.38 O ATOM 0 H GLY A 61 -18.048 -10.799 3.255 1.00 0.43 H new ATOM 0 HA2 GLY A 61 -18.902 -9.569 1.415 1.00 0.40 H new ATOM 0 HA3 GLY A 61 -20.531 -9.745 2.036 1.00 0.40 H new ATOM 907 N GLN A 62 -18.295 -8.095 3.806 1.00 0.36 N ATOM 908 CA GLN A 62 -18.057 -6.855 4.533 1.00 0.29 C ATOM 909 C GLN A 62 -16.571 -6.508 4.545 1.00 0.31 C ATOM 910 O GLN A 62 -15.717 -7.378 4.393 1.00 0.38 O ATOM 911 CB GLN A 62 -18.596 -6.958 5.965 1.00 0.27 C ATOM 912 CG GLN A 62 -20.063 -6.583 6.090 1.00 0.27 C ATOM 913 CD GLN A 62 -20.265 -5.086 6.200 1.00 0.23 C ATOM 914 OE1 GLN A 62 -19.349 -4.325 5.615 1.00 0.25 O flip ATOM 915 NE2 GLN A 62 -21.230 -4.615 6.807 1.00 0.21 N flip ATOM 0 H GLN A 62 -17.578 -8.807 3.940 1.00 0.36 H new ATOM 0 HA GLN A 62 -18.589 -6.054 4.020 1.00 0.29 H new ATOM 0 HB2 GLN A 62 -18.458 -7.978 6.324 1.00 0.27 H new ATOM 0 HB3 GLN A 62 -18.007 -6.310 6.614 1.00 0.27 H new ATOM 0 HG2 GLN A 62 -20.607 -6.958 5.223 1.00 0.27 H new ATOM 0 HG3 GLN A 62 -20.487 -7.070 6.968 1.00 0.27 H new ATOM 0 HE21 GLN A 62 -21.911 -5.237 7.243 1.00 0.21 H new ATOM 0 HE22 GLN A 62 -21.347 -3.604 6.873 1.00 0.21 H new ATOM 924 N LEU A 63 -16.269 -5.225 4.709 1.00 0.30 N ATOM 925 CA LEU A 63 -14.887 -4.759 4.735 1.00 0.36 C ATOM 926 C LEU A 63 -14.617 -3.931 5.980 1.00 0.31 C ATOM 927 O LEU A 63 -15.523 -3.322 6.538 1.00 0.27 O ATOM 928 CB LEU A 63 -14.585 -3.902 3.507 1.00 0.45 C ATOM 929 CG LEU A 63 -14.945 -4.520 2.158 1.00 0.79 C ATOM 930 CD1 LEU A 63 -14.840 -3.471 1.064 1.00 1.41 C ATOM 931 CD2 LEU A 63 -14.042 -5.705 1.854 1.00 1.43 C ATOM 0 H LEU A 63 -16.964 -4.488 4.826 1.00 0.30 H new ATOM 0 HA LEU A 63 -14.246 -5.641 4.738 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -15.120 -2.958 3.607 1.00 0.45 H new ATOM 0 HB3 LEU A 63 -13.521 -3.667 3.505 1.00 0.45 H new ATOM 0 HG LEU A 63 -15.973 -4.881 2.200 1.00 0.79 H new ATOM 0 HD11 LEU A 63 -15.098 -3.919 0.104 1.00 1.41 H new ATOM 0 HD12 LEU A 63 -15.526 -2.652 1.278 1.00 1.41 H new ATOM 0 HD13 LEU A 63 -13.820 -3.089 1.023 1.00 1.41 H new ATOM 0 HD21 LEU A 63 -14.314 -6.132 0.889 1.00 1.43 H new ATOM 0 HD22 LEU A 63 -13.004 -5.373 1.824 1.00 1.43 H new ATOM 0 HD23 LEU A 63 -14.159 -6.461 2.631 1.00 1.43 H new ATOM 943 N ASN A 64 -13.362 -3.898 6.397 1.00 0.33 N ATOM 944 CA ASN A 64 -12.972 -3.126 7.565 1.00 0.31 C ATOM 945 C ASN A 64 -12.048 -1.991 7.144 1.00 0.31 C ATOM 946 O ASN A 64 -11.440 -2.054 6.076 1.00 0.33 O ATOM 947 CB ASN A 64 -12.269 -4.003 8.602 1.00 0.34 C ATOM 948 CG ASN A 64 -12.736 -5.443 8.570 1.00 0.53 C ATOM 949 OD1 ASN A 64 -13.621 -5.835 9.326 1.00 1.19 O ATOM 950 ND2 ASN A 64 -12.135 -6.241 7.694 1.00 0.99 N ATOM 0 H ASN A 64 -12.596 -4.397 5.944 1.00 0.33 H new ATOM 0 HA ASN A 64 -13.875 -2.719 8.020 1.00 0.31 H new ATOM 0 HB2 ASN A 64 -11.193 -3.971 8.428 1.00 0.34 H new ATOM 0 HB3 ASN A 64 -12.443 -3.592 9.596 1.00 0.34 H new ATOM 0 HD21 ASN A 64 -12.404 -7.223 7.630 1.00 0.99 H new ATOM 0 HD22 ASN A 64 -11.404 -5.872 7.085 1.00 0.99 H new ATOM 957 N PHE A 65 -11.970 -0.946 7.958 1.00 0.30 N ATOM 958 CA PHE A 65 -11.113 0.198 7.655 1.00 0.30 C ATOM 959 C PHE A 65 -9.763 -0.251 7.088 1.00 0.29 C ATOM 960 O PHE A 65 -9.188 0.422 6.234 1.00 0.31 O ATOM 961 CB PHE A 65 -10.896 1.039 8.914 1.00 0.32 C ATOM 962 CG PHE A 65 -9.943 2.185 8.721 1.00 0.33 C ATOM 963 CD1 PHE A 65 -10.355 3.340 8.076 1.00 0.37 C ATOM 964 CD2 PHE A 65 -8.639 2.107 9.183 1.00 0.35 C ATOM 965 CE1 PHE A 65 -9.484 4.396 7.896 1.00 0.40 C ATOM 966 CE2 PHE A 65 -7.764 3.161 9.004 1.00 0.38 C ATOM 967 CZ PHE A 65 -8.179 4.301 8.369 1.00 0.39 C ATOM 0 H PHE A 65 -12.488 -0.865 8.833 1.00 0.30 H new ATOM 0 HA PHE A 65 -11.614 0.801 6.898 1.00 0.30 H new ATOM 0 HB2 PHE A 65 -11.857 1.430 9.249 1.00 0.32 H new ATOM 0 HB3 PHE A 65 -10.520 0.395 9.709 1.00 0.32 H new ATOM 0 HD1 PHE A 65 -11.368 3.415 7.710 1.00 0.37 H new ATOM 0 HD2 PHE A 65 -8.303 1.213 9.688 1.00 0.35 H new ATOM 0 HE1 PHE A 65 -9.814 5.291 7.390 1.00 0.40 H new ATOM 0 HE2 PHE A 65 -6.749 3.086 9.366 1.00 0.38 H new ATOM 0 HZ PHE A 65 -7.494 5.125 8.235 1.00 0.39 H new ATOM 977 N THR A 66 -9.271 -1.395 7.560 1.00 0.31 N ATOM 978 CA THR A 66 -7.989 -1.926 7.101 1.00 0.32 C ATOM 979 C THR A 66 -8.073 -2.435 5.666 1.00 0.31 C ATOM 980 O THR A 66 -7.142 -2.258 4.884 1.00 0.30 O ATOM 981 CB THR A 66 -7.503 -3.078 7.998 1.00 0.40 C ATOM 982 OG1 THR A 66 -7.650 -2.724 9.377 1.00 0.56 O ATOM 983 CG2 THR A 66 -6.048 -3.413 7.708 1.00 0.81 C ATOM 0 H THR A 66 -9.740 -1.971 8.259 1.00 0.31 H new ATOM 0 HA THR A 66 -7.280 -1.099 7.152 1.00 0.32 H new ATOM 0 HB THR A 66 -8.112 -3.956 7.783 1.00 0.40 H new ATOM 0 HG1 THR A 66 -7.340 -3.464 9.940 1.00 0.56 H new ATOM 0 HG21 THR A 66 -5.727 -4.230 8.354 1.00 0.81 H new ATOM 0 HG22 THR A 66 -5.945 -3.713 6.665 1.00 0.81 H new ATOM 0 HG23 THR A 66 -5.428 -2.536 7.897 1.00 0.81 H new ATOM 991 N GLU A 67 -9.181 -3.087 5.333 1.00 0.34 N ATOM 992 CA GLU A 67 -9.382 -3.616 3.987 1.00 0.37 C ATOM 993 C GLU A 67 -9.336 -2.498 2.954 1.00 0.32 C ATOM 994 O GLU A 67 -8.543 -2.534 2.011 1.00 0.35 O ATOM 995 CB GLU A 67 -10.727 -4.343 3.897 1.00 0.42 C ATOM 996 CG GLU A 67 -10.745 -5.683 4.613 1.00 0.49 C ATOM 997 CD GLU A 67 -9.724 -6.657 4.057 1.00 0.88 C ATOM 998 OE1 GLU A 67 -8.567 -6.637 4.526 1.00 1.21 O ATOM 999 OE2 GLU A 67 -10.083 -7.439 3.152 1.00 1.36 O ATOM 0 H GLU A 67 -9.954 -3.262 5.975 1.00 0.34 H new ATOM 0 HA GLU A 67 -8.577 -4.321 3.778 1.00 0.37 H new ATOM 0 HB2 GLU A 67 -11.504 -3.705 4.319 1.00 0.42 H new ATOM 0 HB3 GLU A 67 -10.977 -4.498 2.847 1.00 0.42 H new ATOM 0 HG2 GLU A 67 -10.551 -5.526 5.674 1.00 0.49 H new ATOM 0 HG3 GLU A 67 -11.740 -6.120 4.532 1.00 0.49 H new ATOM 1006 N PHE A 68 -10.187 -1.500 3.150 1.00 0.29 N ATOM 1007 CA PHE A 68 -10.260 -0.368 2.240 1.00 0.27 C ATOM 1008 C PHE A 68 -8.957 0.418 2.236 1.00 0.26 C ATOM 1009 O PHE A 68 -8.390 0.675 1.177 1.00 0.32 O ATOM 1010 CB PHE A 68 -11.422 0.544 2.624 1.00 0.26 C ATOM 1011 CG PHE A 68 -11.620 1.696 1.683 1.00 0.30 C ATOM 1012 CD1 PHE A 68 -11.692 1.477 0.321 1.00 0.38 C ATOM 1013 CD2 PHE A 68 -11.724 2.996 2.159 1.00 0.35 C ATOM 1014 CE1 PHE A 68 -11.864 2.529 -0.555 1.00 0.48 C ATOM 1015 CE2 PHE A 68 -11.899 4.053 1.286 1.00 0.45 C ATOM 1016 CZ PHE A 68 -12.002 3.837 -0.044 1.00 0.51 C ATOM 0 H PHE A 68 -10.838 -1.453 3.934 1.00 0.29 H new ATOM 0 HA PHE A 68 -10.427 -0.754 1.234 1.00 0.27 H new ATOM 0 HB2 PHE A 68 -12.338 -0.045 2.661 1.00 0.26 H new ATOM 0 HB3 PHE A 68 -11.252 0.932 3.628 1.00 0.26 H new ATOM 0 HD1 PHE A 68 -11.613 0.471 -0.063 1.00 0.38 H new ATOM 0 HD2 PHE A 68 -11.668 3.183 3.221 1.00 0.35 H new ATOM 0 HE1 PHE A 68 -11.893 2.353 -1.620 1.00 0.48 H new ATOM 0 HE2 PHE A 68 -11.954 5.061 1.670 1.00 0.45 H new ATOM 0 HZ PHE A 68 -12.189 4.663 -0.714 1.00 0.51 H new ATOM 1026 N CYS A 69 -8.489 0.805 3.421 1.00 0.23 N ATOM 1027 CA CYS A 69 -7.242 1.557 3.537 1.00 0.23 C ATOM 1028 C CYS A 69 -6.122 0.812 2.832 1.00 0.27 C ATOM 1029 O CYS A 69 -5.282 1.407 2.157 1.00 0.31 O ATOM 1030 CB CYS A 69 -6.867 1.750 5.003 1.00 0.23 C ATOM 1031 SG CYS A 69 -5.539 2.939 5.286 1.00 0.75 S ATOM 0 H CYS A 69 -8.951 0.612 4.309 1.00 0.23 H new ATOM 0 HA CYS A 69 -7.386 2.533 3.073 1.00 0.23 H new ATOM 0 HB2 CYS A 69 -7.751 2.075 5.551 1.00 0.23 H new ATOM 0 HB3 CYS A 69 -6.570 0.787 5.419 1.00 0.23 H new ATOM 0 HG CYS A 69 -5.301 3.029 6.561 1.00 0.75 H new ATOM 1037 N GLY A 70 -6.126 -0.502 3.011 1.00 0.30 N ATOM 1038 CA GLY A 70 -5.127 -1.350 2.394 1.00 0.35 C ATOM 1039 C GLY A 70 -5.048 -1.127 0.910 1.00 0.37 C ATOM 1040 O GLY A 70 -3.961 -0.966 0.342 1.00 0.41 O ATOM 0 H GLY A 70 -6.812 -1.000 3.579 1.00 0.30 H new ATOM 0 HA2 GLY A 70 -4.154 -1.153 2.844 1.00 0.35 H new ATOM 0 HA3 GLY A 70 -5.364 -2.395 2.593 1.00 0.35 H new ATOM 1044 N ILE A 71 -6.204 -1.092 0.278 1.00 0.37 N ATOM 1045 CA ILE A 71 -6.265 -0.884 -1.146 1.00 0.41 C ATOM 1046 C ILE A 71 -5.956 0.548 -1.508 1.00 0.40 C ATOM 1047 O ILE A 71 -5.209 0.812 -2.437 1.00 0.44 O ATOM 1048 CB ILE A 71 -7.625 -1.258 -1.701 1.00 0.42 C ATOM 1049 CG1 ILE A 71 -7.892 -2.710 -1.350 1.00 0.47 C ATOM 1050 CG2 ILE A 71 -7.646 -1.018 -3.202 1.00 0.46 C ATOM 1051 CD1 ILE A 71 -9.355 -3.085 -1.396 1.00 0.51 C ATOM 0 H ILE A 71 -7.110 -1.205 0.732 1.00 0.37 H new ATOM 0 HA ILE A 71 -5.510 -1.532 -1.590 1.00 0.41 H new ATOM 0 HB ILE A 71 -8.413 -0.643 -1.267 1.00 0.42 H new ATOM 0 HG12 ILE A 71 -7.340 -3.349 -2.039 1.00 0.47 H new ATOM 0 HG13 ILE A 71 -7.506 -2.910 -0.351 1.00 0.47 H new ATOM 0 HG21 ILE A 71 -8.624 -1.287 -3.600 1.00 0.46 H new ATOM 0 HG22 ILE A 71 -7.449 0.035 -3.405 1.00 0.46 H new ATOM 0 HG23 ILE A 71 -6.880 -1.629 -3.679 1.00 0.46 H new ATOM 0 HD11 ILE A 71 -9.469 -4.137 -1.134 1.00 0.51 H new ATOM 0 HD12 ILE A 71 -9.910 -2.472 -0.686 1.00 0.51 H new ATOM 0 HD13 ILE A 71 -9.742 -2.917 -2.401 1.00 0.51 H new ATOM 1063 N MET A 72 -6.561 1.467 -0.782 1.00 0.38 N ATOM 1064 CA MET A 72 -6.336 2.885 -1.018 1.00 0.41 C ATOM 1065 C MET A 72 -4.847 3.186 -1.021 1.00 0.45 C ATOM 1066 O MET A 72 -4.381 4.064 -1.740 1.00 0.52 O ATOM 1067 CB MET A 72 -7.015 3.726 0.058 1.00 0.39 C ATOM 1068 CG MET A 72 -8.527 3.737 -0.033 1.00 0.41 C ATOM 1069 SD MET A 72 -9.171 5.368 -0.441 1.00 1.01 S ATOM 1070 CE MET A 72 -8.539 5.570 -2.103 1.00 0.58 C ATOM 0 H MET A 72 -7.212 1.261 -0.024 1.00 0.38 H new ATOM 0 HA MET A 72 -6.763 3.137 -1.989 1.00 0.41 H new ATOM 0 HB2 MET A 72 -6.723 3.349 1.038 1.00 0.39 H new ATOM 0 HB3 MET A 72 -6.649 4.751 -0.011 1.00 0.39 H new ATOM 0 HG2 MET A 72 -8.849 3.021 -0.789 1.00 0.41 H new ATOM 0 HG3 MET A 72 -8.949 3.409 0.917 1.00 0.41 H new ATOM 0 HE1 MET A 72 -8.666 6.606 -2.417 1.00 0.58 H new ATOM 0 HE2 MET A 72 -7.480 5.312 -2.123 1.00 0.58 H new ATOM 0 HE3 MET A 72 -9.085 4.915 -2.782 1.00 0.58 H new ATOM 1080 N ALA A 73 -4.110 2.450 -0.203 1.00 0.46 N ATOM 1081 CA ALA A 73 -2.670 2.626 -0.104 1.00 0.53 C ATOM 1082 C ALA A 73 -1.977 2.168 -1.384 1.00 0.59 C ATOM 1083 O ALA A 73 -1.176 2.904 -1.963 1.00 0.70 O ATOM 1084 CB ALA A 73 -2.134 1.866 1.100 1.00 0.54 C ATOM 0 H ALA A 73 -4.488 1.722 0.404 1.00 0.46 H new ATOM 0 HA ALA A 73 -2.458 3.687 0.029 1.00 0.53 H new ATOM 0 HB1 ALA A 73 -1.055 2.004 1.166 1.00 0.54 H new ATOM 0 HB2 ALA A 73 -2.604 2.244 2.008 1.00 0.54 H new ATOM 0 HB3 ALA A 73 -2.358 0.805 0.990 1.00 0.54 H new ATOM 1090 N LYS A 74 -2.292 0.951 -1.826 1.00 0.55 N ATOM 1091 CA LYS A 74 -1.690 0.401 -3.040 1.00 0.62 C ATOM 1092 C LYS A 74 -2.186 1.125 -4.293 1.00 0.63 C ATOM 1093 O LYS A 74 -1.489 1.184 -5.305 1.00 0.70 O ATOM 1094 CB LYS A 74 -1.986 -1.097 -3.155 1.00 0.63 C ATOM 1095 CG LYS A 74 -3.458 -1.434 -3.304 1.00 0.65 C ATOM 1096 CD LYS A 74 -3.665 -2.938 -3.411 1.00 0.74 C ATOM 1097 CE LYS A 74 -5.112 -3.289 -3.716 1.00 0.73 C ATOM 1098 NZ LYS A 74 -5.315 -4.759 -3.828 1.00 1.38 N ATOM 0 H LYS A 74 -2.957 0.330 -1.365 1.00 0.55 H new ATOM 0 HA LYS A 74 -0.613 0.550 -2.966 1.00 0.62 H new ATOM 0 HB2 LYS A 74 -1.445 -1.497 -4.013 1.00 0.63 H new ATOM 0 HB3 LYS A 74 -1.598 -1.601 -2.270 1.00 0.63 H new ATOM 0 HG2 LYS A 74 -4.012 -1.047 -2.449 1.00 0.65 H new ATOM 0 HG3 LYS A 74 -3.859 -0.944 -4.191 1.00 0.65 H new ATOM 0 HD2 LYS A 74 -3.021 -3.339 -4.194 1.00 0.74 H new ATOM 0 HD3 LYS A 74 -3.365 -3.413 -2.477 1.00 0.74 H new ATOM 0 HE2 LYS A 74 -5.755 -2.893 -2.930 1.00 0.73 H new ATOM 0 HE3 LYS A 74 -5.413 -2.809 -4.647 1.00 0.73 H new ATOM 0 HZ1 LYS A 74 -6.315 -4.957 -4.036 1.00 1.38 H new ATOM 0 HZ2 LYS A 74 -4.721 -5.134 -4.595 1.00 1.38 H new ATOM 0 HZ3 LYS A 74 -5.052 -5.215 -2.931 1.00 1.38 H new ATOM 1112 N GLN A 75 -3.393 1.674 -4.215 1.00 0.59 N ATOM 1113 CA GLN A 75 -3.999 2.379 -5.339 1.00 0.63 C ATOM 1114 C GLN A 75 -3.475 3.806 -5.462 1.00 0.67 C ATOM 1115 O GLN A 75 -2.981 4.205 -6.516 1.00 0.79 O ATOM 1116 CB GLN A 75 -5.515 2.389 -5.195 1.00 0.63 C ATOM 1117 CG GLN A 75 -6.244 2.803 -6.460 1.00 1.04 C ATOM 1118 CD GLN A 75 -7.728 2.512 -6.387 1.00 1.23 C ATOM 1119 OE1 GLN A 75 -8.513 3.347 -5.943 1.00 1.98 O ATOM 1120 NE2 GLN A 75 -8.119 1.320 -6.819 1.00 1.54 N ATOM 0 H GLN A 75 -3.975 1.644 -3.378 1.00 0.59 H new ATOM 0 HA GLN A 75 -3.725 1.846 -6.250 1.00 0.63 H new ATOM 0 HB2 GLN A 75 -5.850 1.394 -4.902 1.00 0.63 H new ATOM 0 HB3 GLN A 75 -5.790 3.068 -4.388 1.00 0.63 H new ATOM 0 HG2 GLN A 75 -6.093 3.869 -6.632 1.00 1.04 H new ATOM 0 HG3 GLN A 75 -5.814 2.278 -7.313 1.00 1.04 H new ATOM 0 HE21 GLN A 75 -7.432 0.658 -7.180 1.00 1.54 H new ATOM 0 HE22 GLN A 75 -9.106 1.066 -6.790 1.00 1.54 H new ATOM 1129 N MET A 76 -3.592 4.573 -4.380 1.00 0.65 N ATOM 1130 CA MET A 76 -3.142 5.952 -4.370 1.00 0.73 C ATOM 1131 C MET A 76 -1.685 6.059 -4.808 1.00 0.89 C ATOM 1132 O MET A 76 -1.342 6.893 -5.646 1.00 1.06 O ATOM 1133 CB MET A 76 -3.325 6.551 -2.980 1.00 0.76 C ATOM 1134 CG MET A 76 -4.703 7.159 -2.764 1.00 0.80 C ATOM 1135 SD MET A 76 -4.788 8.199 -1.294 1.00 1.20 S ATOM 1136 CE MET A 76 -5.128 6.976 -0.032 1.00 0.75 C ATOM 0 H MET A 76 -3.997 4.256 -3.499 1.00 0.65 H new ATOM 0 HA MET A 76 -3.747 6.514 -5.082 1.00 0.73 H new ATOM 0 HB2 MET A 76 -3.156 5.776 -2.233 1.00 0.76 H new ATOM 0 HB3 MET A 76 -2.568 7.318 -2.820 1.00 0.76 H new ATOM 0 HG2 MET A 76 -4.974 7.751 -3.638 1.00 0.80 H new ATOM 0 HG3 MET A 76 -5.439 6.359 -2.680 1.00 0.80 H new ATOM 0 HE1 MET A 76 -5.103 7.449 0.950 1.00 0.75 H new ATOM 0 HE2 MET A 76 -6.114 6.543 -0.201 1.00 0.75 H new ATOM 0 HE3 MET A 76 -4.374 6.190 -0.075 1.00 0.75 H new ATOM 1211 N THR A 81 7.971 3.489 -8.770 1.00 5.18 N ATOM 1212 CA THR A 81 9.164 3.344 -9.601 1.00 6.15 C ATOM 1213 C THR A 81 10.069 2.243 -9.053 1.00 6.80 C ATOM 1214 O THR A 81 10.952 2.505 -8.241 1.00 7.13 O ATOM 1215 CB THR A 81 9.952 4.667 -9.685 1.00 6.60 C ATOM 1216 OG1 THR A 81 9.155 5.674 -10.319 1.00 7.29 O ATOM 1217 CG2 THR A 81 11.251 4.486 -10.454 1.00 6.89 C ATOM 0 HA THR A 81 8.834 3.073 -10.604 1.00 6.15 H new ATOM 0 HB THR A 81 10.194 4.978 -8.669 1.00 6.60 H new ATOM 0 HG1 THR A 81 8.210 5.526 -10.106 1.00 7.29 H new ATOM 0 HG21 THR A 81 11.784 5.436 -10.496 1.00 6.89 H new ATOM 0 HG22 THR A 81 11.871 3.744 -9.951 1.00 6.89 H new ATOM 0 HG23 THR A 81 11.030 4.148 -11.467 1.00 6.89 H new ATOM 1225 N GLU A 82 9.844 1.012 -9.506 1.00 7.25 N ATOM 1226 CA GLU A 82 10.622 -0.136 -9.040 1.00 8.05 C ATOM 1227 C GLU A 82 11.985 -0.237 -9.725 1.00 8.92 C ATOM 1228 O GLU A 82 12.872 -0.942 -9.244 1.00 9.53 O ATOM 1229 CB GLU A 82 9.837 -1.428 -9.269 1.00 8.64 C ATOM 1230 CG GLU A 82 8.488 -1.453 -8.568 1.00 8.69 C ATOM 1231 CD GLU A 82 7.736 -2.749 -8.799 1.00 9.34 C ATOM 1232 OE1 GLU A 82 7.061 -2.867 -9.843 1.00 9.74 O ATOM 1233 OE2 GLU A 82 7.821 -3.646 -7.935 1.00 9.63 O ATOM 0 H GLU A 82 9.129 0.782 -10.196 1.00 7.25 H new ATOM 0 HA GLU A 82 10.801 0.011 -7.975 1.00 8.05 H new ATOM 0 HB2 GLU A 82 9.683 -1.565 -10.339 1.00 8.64 H new ATOM 0 HB3 GLU A 82 10.433 -2.272 -8.922 1.00 8.64 H new ATOM 0 HG2 GLU A 82 8.636 -1.309 -7.498 1.00 8.69 H new ATOM 0 HG3 GLU A 82 7.883 -0.618 -8.922 1.00 8.69 H new ATOM 1240 N GLU A 83 12.154 0.462 -10.841 1.00 9.15 N ATOM 1241 CA GLU A 83 13.418 0.419 -11.574 1.00 10.17 C ATOM 1242 C GLU A 83 14.541 1.111 -10.802 1.00 10.27 C ATOM 1243 O GLU A 83 15.582 0.508 -10.529 1.00 11.05 O ATOM 1244 CB GLU A 83 13.251 1.066 -12.950 1.00 10.55 C ATOM 1245 CG GLU A 83 12.270 0.332 -13.848 1.00 10.83 C ATOM 1246 CD GLU A 83 12.139 0.971 -15.216 1.00 11.60 C ATOM 1247 OE1 GLU A 83 12.914 0.599 -16.122 1.00 11.85 O ATOM 1248 OE2 GLU A 83 11.260 1.844 -15.382 1.00 12.11 O ATOM 0 H GLU A 83 11.441 1.061 -11.257 1.00 9.15 H new ATOM 0 HA GLU A 83 13.695 -0.628 -11.698 1.00 10.17 H new ATOM 0 HB2 GLU A 83 12.914 2.095 -12.821 1.00 10.55 H new ATOM 0 HB3 GLU A 83 14.222 1.108 -13.443 1.00 10.55 H new ATOM 0 HG2 GLU A 83 12.594 -0.702 -13.964 1.00 10.83 H new ATOM 0 HG3 GLU A 83 11.292 0.308 -13.368 1.00 10.83 H new ATOM 1255 N GLU A 84 14.325 2.374 -10.446 1.00 9.63 N ATOM 1256 CA GLU A 84 15.323 3.144 -9.709 1.00 9.95 C ATOM 1257 C GLU A 84 15.582 2.533 -8.335 1.00 9.87 C ATOM 1258 O GLU A 84 16.578 2.844 -7.682 1.00 10.51 O ATOM 1259 CB GLU A 84 14.863 4.596 -9.557 1.00 9.47 C ATOM 1260 CG GLU A 84 15.906 5.504 -8.923 1.00 9.88 C ATOM 1261 CD GLU A 84 15.437 6.941 -8.812 1.00 10.40 C ATOM 1262 OE1 GLU A 84 14.819 7.285 -7.783 1.00 10.87 O ATOM 1263 OE2 GLU A 84 15.687 7.722 -9.754 1.00 10.49 O ATOM 0 H GLU A 84 13.468 2.886 -10.656 1.00 9.63 H new ATOM 0 HA GLU A 84 16.254 3.120 -10.275 1.00 9.95 H new ATOM 0 HB2 GLU A 84 14.600 4.989 -10.539 1.00 9.47 H new ATOM 0 HB3 GLU A 84 13.957 4.619 -8.951 1.00 9.47 H new ATOM 0 HG2 GLU A 84 16.154 5.129 -7.930 1.00 9.88 H new ATOM 0 HG3 GLU A 84 16.821 5.469 -9.515 1.00 9.88 H new ATOM 1270 N MET A 85 14.687 1.650 -7.911 1.00 9.31 N ATOM 1271 CA MET A 85 14.812 0.999 -6.615 1.00 9.45 C ATOM 1272 C MET A 85 15.801 -0.145 -6.697 1.00 10.49 C ATOM 1273 O MET A 85 16.747 -0.222 -5.917 1.00 11.09 O ATOM 1274 CB MET A 85 13.461 0.471 -6.154 1.00 8.75 C ATOM 1275 CG MET A 85 12.433 1.557 -5.915 1.00 7.71 C ATOM 1276 SD MET A 85 10.771 0.894 -5.723 1.00 7.19 S ATOM 1277 CE MET A 85 10.067 2.094 -4.604 1.00 6.73 C ATOM 0 H MET A 85 13.866 1.368 -8.447 1.00 9.31 H new ATOM 0 HA MET A 85 15.172 1.734 -5.895 1.00 9.45 H new ATOM 0 HB2 MET A 85 13.077 -0.222 -6.902 1.00 8.75 H new ATOM 0 HB3 MET A 85 13.597 -0.097 -5.234 1.00 8.75 H new ATOM 0 HG2 MET A 85 12.703 2.119 -5.021 1.00 7.71 H new ATOM 0 HG3 MET A 85 12.448 2.258 -6.749 1.00 7.71 H new ATOM 0 HE1 MET A 85 9.175 1.676 -4.137 1.00 6.73 H new ATOM 0 HE2 MET A 85 10.796 2.345 -3.834 1.00 6.73 H new ATOM 0 HE3 MET A 85 9.799 2.994 -5.157 1.00 6.73 H new ATOM 1287 N ARG A 86 15.558 -1.036 -7.647 1.00 10.82 N ATOM 1288 CA ARG A 86 16.420 -2.183 -7.864 1.00 11.88 C ATOM 1289 C ARG A 86 17.874 -1.738 -7.994 1.00 12.66 C ATOM 1290 O ARG A 86 18.779 -2.378 -7.459 1.00 13.43 O ATOM 1291 CB ARG A 86 15.963 -2.933 -9.116 1.00 12.21 C ATOM 1292 CG ARG A 86 17.054 -3.742 -9.787 1.00 13.16 C ATOM 1293 CD ARG A 86 16.520 -4.487 -10.999 1.00 13.63 C ATOM 1294 NE ARG A 86 17.538 -5.331 -11.616 1.00 14.25 N ATOM 1295 CZ ARG A 86 17.283 -6.204 -12.586 1.00 14.86 C ATOM 1296 NH1 ARG A 86 16.048 -6.342 -13.052 1.00 14.96 N ATOM 1297 NH2 ARG A 86 18.263 -6.939 -13.092 1.00 15.52 N ATOM 0 H ARG A 86 14.763 -0.983 -8.284 1.00 10.82 H new ATOM 0 HA ARG A 86 16.352 -2.854 -7.008 1.00 11.88 H new ATOM 0 HB2 ARG A 86 15.144 -3.600 -8.848 1.00 12.21 H new ATOM 0 HB3 ARG A 86 15.566 -2.214 -9.833 1.00 12.21 H new ATOM 0 HG2 ARG A 86 17.865 -3.081 -10.092 1.00 13.16 H new ATOM 0 HG3 ARG A 86 17.473 -4.453 -9.075 1.00 13.16 H new ATOM 0 HD2 ARG A 86 15.671 -5.102 -10.701 1.00 13.63 H new ATOM 0 HD3 ARG A 86 16.152 -3.769 -11.732 1.00 13.63 H new ATOM 0 HE ARG A 86 18.499 -5.247 -11.285 1.00 14.25 H new ATOM 0 HH11 ARG A 86 15.291 -5.777 -12.666 1.00 14.96 H new ATOM 0 HH12 ARG A 86 15.856 -7.013 -13.796 1.00 14.96 H new ATOM 0 HH21 ARG A 86 19.214 -6.835 -12.737 1.00 15.52 H new ATOM 0 HH22 ARG A 86 18.066 -7.608 -13.836 1.00 15.52 H new ATOM 1311 N GLU A 87 18.087 -0.634 -8.703 1.00 12.58 N ATOM 1312 CA GLU A 87 19.428 -0.094 -8.890 1.00 13.44 C ATOM 1313 C GLU A 87 19.938 0.527 -7.592 1.00 13.54 C ATOM 1314 O GLU A 87 21.128 0.457 -7.284 1.00 14.45 O ATOM 1315 CB GLU A 87 19.434 0.951 -10.010 1.00 13.42 C ATOM 1316 CG GLU A 87 20.791 1.598 -10.233 1.00 14.12 C ATOM 1317 CD GLU A 87 20.779 2.603 -11.368 1.00 14.57 C ATOM 1318 OE1 GLU A 87 20.367 3.759 -11.135 1.00 14.85 O ATOM 1319 OE2 GLU A 87 21.183 2.234 -12.492 1.00 14.77 O ATOM 0 H GLU A 87 17.348 -0.097 -9.157 1.00 12.58 H new ATOM 0 HA GLU A 87 20.091 -0.912 -9.172 1.00 13.44 H new ATOM 0 HB2 GLU A 87 19.109 0.479 -10.937 1.00 13.42 H new ATOM 0 HB3 GLU A 87 18.705 1.727 -9.775 1.00 13.42 H new ATOM 0 HG2 GLU A 87 21.107 2.095 -9.316 1.00 14.12 H new ATOM 0 HG3 GLU A 87 21.528 0.824 -10.446 1.00 14.12 H new ATOM 1326 N ALA A 88 19.027 1.133 -6.835 1.00 12.70 N ATOM 1327 CA ALA A 88 19.383 1.760 -5.569 1.00 12.92 C ATOM 1328 C ALA A 88 19.764 0.713 -4.527 1.00 13.38 C ATOM 1329 O ALA A 88 20.555 0.984 -3.624 1.00 14.11 O ATOM 1330 CB ALA A 88 18.235 2.621 -5.063 1.00 12.02 C ATOM 0 H ALA A 88 18.039 1.202 -7.077 1.00 12.70 H new ATOM 0 HA ALA A 88 20.250 2.398 -5.739 1.00 12.92 H new ATOM 0 HB1 ALA A 88 18.516 3.083 -4.116 1.00 12.02 H new ATOM 0 HB2 ALA A 88 18.013 3.398 -5.794 1.00 12.02 H new ATOM 0 HB3 ALA A 88 17.352 2.000 -4.915 1.00 12.02 H new ATOM 1336 N PHE A 89 19.198 -0.484 -4.659 1.00 13.10 N ATOM 1337 CA PHE A 89 19.481 -1.572 -3.729 1.00 13.68 C ATOM 1338 C PHE A 89 20.873 -2.137 -3.979 1.00 14.81 C ATOM 1339 O PHE A 89 21.641 -2.359 -3.045 1.00 15.53 O ATOM 1340 CB PHE A 89 18.434 -2.678 -3.864 1.00 13.32 C ATOM 1341 CG PHE A 89 18.672 -3.847 -2.949 1.00 14.09 C ATOM 1342 CD1 PHE A 89 18.441 -3.734 -1.587 1.00 14.41 C ATOM 1343 CD2 PHE A 89 19.123 -5.056 -3.451 1.00 14.63 C ATOM 1344 CE1 PHE A 89 18.656 -4.807 -0.744 1.00 15.22 C ATOM 1345 CE2 PHE A 89 19.341 -6.132 -2.612 1.00 15.44 C ATOM 1346 CZ PHE A 89 19.119 -6.006 -1.258 1.00 15.73 C ATOM 0 H PHE A 89 18.541 -0.724 -5.401 1.00 13.10 H new ATOM 0 HA PHE A 89 19.441 -1.175 -2.715 1.00 13.68 H new ATOM 0 HB2 PHE A 89 17.448 -2.261 -3.658 1.00 13.32 H new ATOM 0 HB3 PHE A 89 18.421 -3.031 -4.895 1.00 13.32 H new ATOM 0 HD1 PHE A 89 18.089 -2.797 -1.181 1.00 14.41 H new ATOM 0 HD2 PHE A 89 19.306 -5.159 -4.510 1.00 14.63 H new ATOM 0 HE1 PHE A 89 18.463 -4.711 0.314 1.00 15.22 H new ATOM 0 HE2 PHE A 89 19.685 -7.072 -3.018 1.00 15.44 H new ATOM 0 HZ PHE A 89 19.306 -6.841 -0.599 1.00 15.73 H new ATOM 1356 N LYS A 90 21.186 -2.375 -5.248 1.00 15.06 N ATOM 1357 CA LYS A 90 22.494 -2.903 -5.625 1.00 16.18 C ATOM 1358 C LYS A 90 23.598 -1.971 -5.146 1.00 16.76 C ATOM 1359 O LYS A 90 24.658 -2.415 -4.707 1.00 17.66 O ATOM 1360 CB LYS A 90 22.591 -3.065 -7.141 1.00 16.38 C ATOM 1361 CG LYS A 90 21.524 -3.971 -7.730 1.00 16.21 C ATOM 1362 CD LYS A 90 21.701 -4.138 -9.226 1.00 16.55 C ATOM 1363 CE LYS A 90 20.513 -4.849 -9.852 1.00 16.86 C ATOM 1364 NZ LYS A 90 20.730 -5.126 -11.299 1.00 17.18 N ATOM 0 H LYS A 90 20.554 -2.211 -6.032 1.00 15.06 H new ATOM 0 HA LYS A 90 22.614 -3.878 -5.154 1.00 16.18 H new ATOM 0 HB2 LYS A 90 22.518 -2.083 -7.607 1.00 16.38 H new ATOM 0 HB3 LYS A 90 23.573 -3.465 -7.392 1.00 16.38 H new ATOM 0 HG2 LYS A 90 21.566 -4.947 -7.246 1.00 16.21 H new ATOM 0 HG3 LYS A 90 20.538 -3.555 -7.523 1.00 16.21 H new ATOM 0 HD2 LYS A 90 21.826 -3.160 -9.690 1.00 16.55 H new ATOM 0 HD3 LYS A 90 22.611 -4.704 -9.425 1.00 16.55 H new ATOM 0 HE2 LYS A 90 20.333 -5.787 -9.326 1.00 16.86 H new ATOM 0 HE3 LYS A 90 19.619 -4.238 -9.730 1.00 16.86 H new ATOM 0 HZ1 LYS A 90 20.091 -4.533 -11.866 1.00 17.18 H new ATOM 0 HZ2 LYS A 90 21.716 -4.910 -11.550 1.00 17.18 H new ATOM 0 HZ3 LYS A 90 20.535 -6.129 -11.494 1.00 17.18 H new ATOM 1378 N ILE A 91 23.334 -0.671 -5.235 1.00 16.32 N ATOM 1379 CA ILE A 91 24.297 0.338 -4.819 1.00 16.96 C ATOM 1380 C ILE A 91 24.362 0.449 -3.300 1.00 17.21 C ATOM 1381 O ILE A 91 25.439 0.627 -2.730 1.00 18.15 O ATOM 1382 CB ILE A 91 23.952 1.720 -5.414 1.00 16.50 C ATOM 1383 CG1 ILE A 91 24.088 1.687 -6.939 1.00 16.43 C ATOM 1384 CG2 ILE A 91 24.846 2.800 -4.815 1.00 17.34 C ATOM 1385 CD1 ILE A 91 23.651 2.966 -7.621 1.00 16.26 C ATOM 0 H ILE A 91 22.457 -0.292 -5.593 1.00 16.32 H new ATOM 0 HA ILE A 91 25.270 0.021 -5.194 1.00 16.96 H new ATOM 0 HB ILE A 91 22.919 1.960 -5.164 1.00 16.50 H new ATOM 0 HG12 ILE A 91 25.128 1.486 -7.197 1.00 16.43 H new ATOM 0 HG13 ILE A 91 23.497 0.858 -7.329 1.00 16.43 H new ATOM 0 HG21 ILE A 91 24.588 3.767 -5.247 1.00 17.34 H new ATOM 0 HG22 ILE A 91 24.701 2.834 -3.735 1.00 17.34 H new ATOM 0 HG23 ILE A 91 25.889 2.572 -5.034 1.00 17.34 H new ATOM 0 HD11 ILE A 91 23.777 2.865 -8.699 1.00 16.26 H new ATOM 0 HD12 ILE A 91 22.602 3.159 -7.395 1.00 16.26 H new ATOM 0 HD13 ILE A 91 24.259 3.796 -7.261 1.00 16.26 H new ATOM 1397 N PHE A 92 23.209 0.343 -2.648 1.00 16.44 N ATOM 1398 CA PHE A 92 23.152 0.442 -1.195 1.00 16.75 C ATOM 1399 C PHE A 92 23.871 -0.728 -0.537 1.00 17.52 C ATOM 1400 O PHE A 92 24.808 -0.527 0.234 1.00 18.34 O ATOM 1401 CB PHE A 92 21.700 0.496 -0.719 1.00 15.83 C ATOM 1402 CG PHE A 92 21.339 1.780 -0.030 1.00 15.63 C ATOM 1403 CD1 PHE A 92 21.055 2.920 -0.767 1.00 15.79 C ATOM 1404 CD2 PHE A 92 21.286 1.852 1.352 1.00 15.41 C ATOM 1405 CE1 PHE A 92 20.727 4.105 -0.138 1.00 15.74 C ATOM 1406 CE2 PHE A 92 20.958 3.035 1.987 1.00 15.39 C ATOM 1407 CZ PHE A 92 20.661 4.155 1.246 1.00 15.56 C ATOM 0 H PHE A 92 22.307 0.190 -3.099 1.00 16.44 H new ATOM 0 HA PHE A 92 23.656 1.363 -0.903 1.00 16.75 H new ATOM 0 HB2 PHE A 92 21.041 0.355 -1.575 1.00 15.83 H new ATOM 0 HB3 PHE A 92 21.519 -0.335 -0.038 1.00 15.83 H new ATOM 0 HD1 PHE A 92 21.091 2.881 -1.846 1.00 15.79 H new ATOM 0 HD2 PHE A 92 21.504 0.973 1.941 1.00 15.41 H new ATOM 0 HE1 PHE A 92 20.523 4.990 -0.722 1.00 15.74 H new ATOM 0 HE2 PHE A 92 20.935 3.080 3.066 1.00 15.39 H new ATOM 0 HZ PHE A 92 20.377 5.072 1.741 1.00 15.56 H new ATOM 1417 N ASP A 93 23.449 -1.950 -0.864 1.00 17.35 N ATOM 1418 CA ASP A 93 24.059 -3.150 -0.296 1.00 18.13 C ATOM 1419 C ASP A 93 25.579 -3.076 -0.413 1.00 19.15 C ATOM 1420 O ASP A 93 26.120 -2.919 -1.508 1.00 19.29 O ATOM 1421 CB ASP A 93 23.526 -4.405 -0.996 1.00 17.78 C ATOM 1422 CG ASP A 93 23.900 -5.682 -0.265 1.00 18.61 C ATOM 1423 OD1 ASP A 93 24.212 -5.604 0.942 1.00 18.94 O ATOM 1424 OD2 ASP A 93 23.888 -6.761 -0.900 1.00 18.99 O ATOM 0 H ASP A 93 22.688 -2.134 -1.518 1.00 17.35 H new ATOM 0 HA ASP A 93 23.795 -3.208 0.760 1.00 18.13 H new ATOM 0 HB2 ASP A 93 22.441 -4.340 -1.075 1.00 17.78 H new ATOM 0 HB3 ASP A 93 23.918 -4.444 -2.012 1.00 17.78 H new ATOM 1429 N ARG A 94 26.262 -3.190 0.723 1.00 19.94 N ATOM 1430 CA ARG A 94 27.715 -3.104 0.750 1.00 20.98 C ATOM 1431 C ARG A 94 28.368 -4.477 0.613 1.00 21.56 C ATOM 1432 O ARG A 94 29.586 -4.582 0.480 1.00 22.25 O ATOM 1433 CB ARG A 94 28.182 -2.426 2.034 1.00 21.74 C ATOM 1434 CG ARG A 94 27.582 -1.046 2.237 1.00 21.43 C ATOM 1435 CD ARG A 94 26.419 -1.099 3.206 1.00 21.19 C ATOM 1436 NE ARG A 94 25.162 -1.485 2.566 1.00 21.42 N ATOM 1437 CZ ARG A 94 23.985 -0.926 2.840 1.00 21.61 C ATOM 1438 NH1 ARG A 94 23.904 0.068 3.709 1.00 21.58 N ATOM 1439 NH2 ARG A 94 22.887 -1.356 2.232 1.00 21.94 N ATOM 0 H ARG A 94 25.831 -3.342 1.635 1.00 19.94 H new ATOM 0 HA ARG A 94 28.023 -2.504 -0.106 1.00 20.98 H new ATOM 0 HB2 ARG A 94 27.922 -3.056 2.885 1.00 21.74 H new ATOM 0 HB3 ARG A 94 29.269 -2.343 2.019 1.00 21.74 H new ATOM 0 HG2 ARG A 94 28.345 -0.366 2.615 1.00 21.43 H new ATOM 0 HG3 ARG A 94 27.245 -0.647 1.280 1.00 21.43 H new ATOM 0 HD2 ARG A 94 26.648 -1.807 4.002 1.00 21.19 H new ATOM 0 HD3 ARG A 94 26.298 -0.122 3.674 1.00 21.19 H new ATOM 0 HE ARG A 94 25.189 -2.228 1.867 1.00 21.42 H new ATOM 0 HH11 ARG A 94 24.746 0.410 4.173 1.00 21.58 H new ATOM 0 HH12 ARG A 94 23.000 0.493 3.915 1.00 21.58 H new ATOM 0 HH21 ARG A 94 22.944 -2.116 1.554 1.00 21.94 H new ATOM 0 HH22 ARG A 94 21.986 -0.927 2.443 1.00 21.94 H new ATOM 1453 N ASP A 95 27.553 -5.526 0.647 1.00 21.37 N ATOM 1454 CA ASP A 95 28.063 -6.888 0.521 1.00 21.99 C ATOM 1455 C ASP A 95 27.341 -7.638 -0.591 1.00 21.37 C ATOM 1456 O ASP A 95 26.502 -7.074 -1.293 1.00 20.39 O ATOM 1457 CB ASP A 95 27.895 -7.645 1.838 1.00 22.48 C ATOM 1458 CG ASP A 95 28.230 -6.793 3.046 1.00 22.92 C ATOM 1459 OD1 ASP A 95 29.432 -6.551 3.281 1.00 23.34 O ATOM 1460 OD2 ASP A 95 27.293 -6.371 3.754 1.00 22.92 O ATOM 0 H ASP A 95 26.541 -5.461 0.760 1.00 21.37 H new ATOM 0 HA ASP A 95 29.123 -6.826 0.273 1.00 21.99 H new ATOM 0 HB2 ASP A 95 26.867 -7.999 1.921 1.00 22.48 H new ATOM 0 HB3 ASP A 95 28.536 -8.527 1.831 1.00 22.48 H new ATOM 1465 N GLY A 96 27.681 -8.914 -0.747 1.00 22.00 N ATOM 1466 CA GLY A 96 27.056 -9.732 -1.768 1.00 21.64 C ATOM 1467 C GLY A 96 25.970 -10.625 -1.202 1.00 21.55 C ATOM 1468 O GLY A 96 25.348 -11.396 -1.934 1.00 21.40 O ATOM 0 H GLY A 96 28.380 -9.396 -0.182 1.00 22.00 H new ATOM 0 HA2 GLY A 96 26.630 -9.087 -2.537 1.00 21.64 H new ATOM 0 HA3 GLY A 96 27.814 -10.347 -2.252 1.00 21.64 H new ATOM 1472 N ASP A 97 25.744 -10.522 0.105 1.00 21.75 N ATOM 1473 CA ASP A 97 24.727 -11.329 0.773 1.00 21.82 C ATOM 1474 C ASP A 97 23.329 -10.977 0.277 1.00 20.80 C ATOM 1475 O ASP A 97 22.477 -11.853 0.120 1.00 20.85 O ATOM 1476 CB ASP A 97 24.808 -11.147 2.292 1.00 22.28 C ATOM 1477 CG ASP A 97 25.173 -9.731 2.696 1.00 21.72 C ATOM 1478 OD1 ASP A 97 24.455 -8.790 2.296 1.00 21.34 O ATOM 1479 OD2 ASP A 97 26.177 -9.564 3.419 1.00 21.74 O ATOM 0 H ASP A 97 26.251 -9.888 0.722 1.00 21.75 H new ATOM 0 HA ASP A 97 24.921 -12.374 0.531 1.00 21.82 H new ATOM 0 HB2 ASP A 97 23.848 -11.411 2.737 1.00 22.28 H new ATOM 0 HB3 ASP A 97 25.548 -11.838 2.697 1.00 22.28 H new ATOM 1484 N GLY A 98 23.098 -9.692 0.031 1.00 19.93 N ATOM 1485 CA GLY A 98 21.802 -9.247 -0.447 1.00 18.92 C ATOM 1486 C GLY A 98 20.903 -8.766 0.672 1.00 18.54 C ATOM 1487 O GLY A 98 19.682 -8.714 0.519 1.00 17.94 O ATOM 0 H GLY A 98 23.786 -8.949 0.154 1.00 19.93 H new ATOM 0 HA2 GLY A 98 21.942 -8.441 -1.168 1.00 18.92 H new ATOM 0 HA3 GLY A 98 21.313 -10.066 -0.975 1.00 18.92 H new ATOM 1491 N PHE A 99 21.506 -8.414 1.804 1.00 19.01 N ATOM 1492 CA PHE A 99 20.751 -7.931 2.955 1.00 18.88 C ATOM 1493 C PHE A 99 21.433 -6.718 3.580 1.00 18.97 C ATOM 1494 O PHE A 99 22.654 -6.569 3.495 1.00 19.56 O ATOM 1495 CB PHE A 99 20.597 -9.042 3.995 1.00 19.81 C ATOM 1496 CG PHE A 99 19.857 -10.243 3.479 1.00 19.89 C ATOM 1497 CD1 PHE A 99 18.474 -10.249 3.424 1.00 19.90 C ATOM 1498 CD2 PHE A 99 20.548 -11.367 3.051 1.00 20.07 C ATOM 1499 CE1 PHE A 99 17.791 -11.354 2.952 1.00 20.10 C ATOM 1500 CE2 PHE A 99 19.870 -12.474 2.578 1.00 20.28 C ATOM 1501 CZ PHE A 99 18.488 -12.463 2.519 1.00 20.30 C ATOM 0 H PHE A 99 22.515 -8.454 1.948 1.00 19.01 H new ATOM 0 HA PHE A 99 19.761 -7.631 2.611 1.00 18.88 H new ATOM 0 HB2 PHE A 99 21.585 -9.352 4.334 1.00 19.81 H new ATOM 0 HB3 PHE A 99 20.071 -8.646 4.864 1.00 19.81 H new ATOM 0 HD1 PHE A 99 17.923 -9.381 3.753 1.00 19.90 H new ATOM 0 HD2 PHE A 99 21.627 -11.377 3.088 1.00 20.07 H new ATOM 0 HE1 PHE A 99 16.711 -11.349 2.922 1.00 20.10 H new ATOM 0 HE2 PHE A 99 20.418 -13.347 2.255 1.00 20.28 H new ATOM 0 HZ PHE A 99 17.956 -13.321 2.135 1.00 20.30 H new ATOM 1511 N ILE A 100 20.640 -5.852 4.208 1.00 18.48 N ATOM 1512 CA ILE A 100 21.173 -4.651 4.837 1.00 18.67 C ATOM 1513 C ILE A 100 20.990 -4.680 6.353 1.00 19.37 C ATOM 1514 O ILE A 100 19.911 -4.989 6.857 1.00 19.21 O ATOM 1515 CB ILE A 100 20.500 -3.384 4.277 1.00 17.64 C ATOM 1516 CG1 ILE A 100 20.549 -3.390 2.747 1.00 16.97 C ATOM 1517 CG2 ILE A 100 21.175 -2.136 4.831 1.00 18.04 C ATOM 1518 CD1 ILE A 100 19.785 -2.250 2.110 1.00 15.92 C ATOM 0 H ILE A 100 19.629 -5.961 4.293 1.00 18.48 H new ATOM 0 HA ILE A 100 22.239 -4.627 4.609 1.00 18.67 H new ATOM 0 HB ILE A 100 19.456 -3.376 4.589 1.00 17.64 H new ATOM 0 HG12 ILE A 100 21.589 -3.343 2.425 1.00 16.97 H new ATOM 0 HG13 ILE A 100 20.145 -4.335 2.383 1.00 16.97 H new ATOM 0 HG21 ILE A 100 20.688 -1.249 4.426 1.00 18.04 H new ATOM 0 HG22 ILE A 100 21.093 -2.130 5.918 1.00 18.04 H new ATOM 0 HG23 ILE A 100 22.227 -2.134 4.546 1.00 18.04 H new ATOM 0 HD11 ILE A 100 19.865 -2.320 1.025 1.00 15.92 H new ATOM 0 HD12 ILE A 100 18.736 -2.307 2.401 1.00 15.92 H new ATOM 0 HD13 ILE A 100 20.203 -1.300 2.444 1.00 15.92 H new ATOM 1530 N SER A 101 22.062 -4.350 7.067 1.00 20.25 N ATOM 1531 CA SER A 101 22.044 -4.313 8.526 1.00 21.07 C ATOM 1532 C SER A 101 22.249 -2.881 9.018 1.00 21.23 C ATOM 1533 O SER A 101 22.815 -2.062 8.300 1.00 20.98 O ATOM 1534 CB SER A 101 23.135 -5.221 9.097 1.00 22.16 C ATOM 1535 OG SER A 101 22.878 -6.582 8.793 1.00 22.49 O ATOM 0 H SER A 101 22.961 -4.102 6.655 1.00 20.25 H new ATOM 0 HA SER A 101 21.074 -4.672 8.870 1.00 21.07 H new ATOM 0 HB2 SER A 101 24.104 -4.931 8.690 1.00 22.16 H new ATOM 0 HB3 SER A 101 23.192 -5.091 10.178 1.00 22.16 H new ATOM 0 HG SER A 101 23.590 -7.141 9.167 1.00 22.49 H new ATOM 1541 N PRO A 102 21.790 -2.557 10.243 1.00 21.74 N ATOM 1542 CA PRO A 102 21.925 -1.208 10.805 1.00 22.05 C ATOM 1543 C PRO A 102 23.298 -0.595 10.542 1.00 22.55 C ATOM 1544 O PRO A 102 23.402 0.551 10.106 1.00 22.43 O ATOM 1545 CB PRO A 102 21.713 -1.437 12.299 1.00 23.00 C ATOM 1546 CG PRO A 102 20.792 -2.606 12.370 1.00 22.78 C ATOM 1547 CD PRO A 102 21.122 -3.477 11.185 1.00 22.19 C ATOM 0 HA PRO A 102 21.221 -0.505 10.359 1.00 22.05 H new ATOM 0 HB2 PRO A 102 22.655 -1.643 12.807 1.00 23.00 H new ATOM 0 HB3 PRO A 102 21.278 -0.559 12.777 1.00 23.00 H new ATOM 0 HG2 PRO A 102 20.928 -3.152 13.304 1.00 22.78 H new ATOM 0 HG3 PRO A 102 19.751 -2.284 12.338 1.00 22.78 H new ATOM 0 HD2 PRO A 102 21.774 -4.304 11.466 1.00 22.19 H new ATOM 0 HD3 PRO A 102 20.224 -3.914 10.748 1.00 22.19 H new ATOM 1555 N ALA A 103 24.345 -1.368 10.801 1.00 23.17 N ATOM 1556 CA ALA A 103 25.713 -0.901 10.592 1.00 23.77 C ATOM 1557 C ALA A 103 25.944 -0.518 9.135 1.00 23.02 C ATOM 1558 O ALA A 103 26.559 0.507 8.834 1.00 23.22 O ATOM 1559 CB ALA A 103 26.701 -1.976 11.007 1.00 24.56 C ATOM 0 H ALA A 103 24.275 -2.322 11.156 1.00 23.17 H new ATOM 0 HA ALA A 103 25.866 -0.015 11.208 1.00 23.77 H new ATOM 0 HB1 ALA A 103 27.718 -1.617 10.847 1.00 24.56 H new ATOM 0 HB2 ALA A 103 26.561 -2.211 12.062 1.00 24.56 H new ATOM 0 HB3 ALA A 103 26.535 -2.873 10.410 1.00 24.56 H new ATOM 1565 N GLU A 104 25.438 -1.351 8.235 1.00 22.23 N ATOM 1566 CA GLU A 104 25.580 -1.117 6.806 1.00 21.53 C ATOM 1567 C GLU A 104 24.822 0.136 6.413 1.00 20.75 C ATOM 1568 O GLU A 104 25.379 1.060 5.822 1.00 20.59 O ATOM 1569 CB GLU A 104 25.036 -2.308 6.017 1.00 20.94 C ATOM 1570 CG GLU A 104 25.979 -3.498 5.955 1.00 21.74 C ATOM 1571 CD GLU A 104 25.524 -4.540 4.949 1.00 21.28 C ATOM 1572 OE1 GLU A 104 25.615 -4.269 3.733 1.00 20.84 O ATOM 1573 OE2 GLU A 104 25.078 -5.626 5.374 1.00 21.43 O ATOM 0 H GLU A 104 24.923 -2.199 8.472 1.00 22.23 H new ATOM 0 HA GLU A 104 26.638 -0.991 6.576 1.00 21.53 H new ATOM 0 HB2 GLU A 104 24.095 -2.627 6.466 1.00 20.94 H new ATOM 0 HB3 GLU A 104 24.811 -1.984 5.001 1.00 20.94 H new ATOM 0 HG2 GLU A 104 26.979 -3.153 5.691 1.00 21.74 H new ATOM 0 HG3 GLU A 104 26.049 -3.955 6.942 1.00 21.74 H new ATOM 1580 N LEU A 105 23.540 0.145 6.752 1.00 20.36 N ATOM 1581 CA LEU A 105 22.668 1.270 6.464 1.00 19.67 C ATOM 1582 C LEU A 105 23.318 2.572 6.914 1.00 20.33 C ATOM 1583 O LEU A 105 23.162 3.612 6.277 1.00 19.95 O ATOM 1584 CB LEU A 105 21.329 1.074 7.179 1.00 19.42 C ATOM 1585 CG LEU A 105 20.401 2.285 7.177 1.00 18.62 C ATOM 1586 CD1 LEU A 105 20.009 2.664 5.755 1.00 17.90 C ATOM 1587 CD2 LEU A 105 19.167 2.003 8.017 1.00 18.59 C ATOM 0 H LEU A 105 23.078 -0.627 7.233 1.00 20.36 H new ATOM 0 HA LEU A 105 22.498 1.324 5.389 1.00 19.67 H new ATOM 0 HB2 LEU A 105 20.807 0.237 6.714 1.00 19.42 H new ATOM 0 HB3 LEU A 105 21.527 0.791 8.213 1.00 19.42 H new ATOM 0 HG LEU A 105 20.934 3.129 7.615 1.00 18.62 H new ATOM 0 HD11 LEU A 105 19.347 3.530 5.779 1.00 17.90 H new ATOM 0 HD12 LEU A 105 20.905 2.907 5.183 1.00 17.90 H new ATOM 0 HD13 LEU A 105 19.494 1.827 5.284 1.00 17.90 H new ATOM 0 HD21 LEU A 105 18.513 2.875 8.007 1.00 18.59 H new ATOM 0 HD22 LEU A 105 18.635 1.146 7.605 1.00 18.59 H new ATOM 0 HD23 LEU A 105 19.467 1.786 9.042 1.00 18.59 H new ATOM 1599 N ARG A 106 24.059 2.493 8.010 1.00 21.40 N ATOM 1600 CA ARG A 106 24.742 3.650 8.570 1.00 22.20 C ATOM 1601 C ARG A 106 25.894 4.089 7.671 1.00 22.44 C ATOM 1602 O ARG A 106 26.166 5.279 7.532 1.00 22.57 O ATOM 1603 CB ARG A 106 25.263 3.310 9.966 1.00 23.35 C ATOM 1604 CG ARG A 106 25.533 4.522 10.840 1.00 24.22 C ATOM 1605 CD ARG A 106 26.941 5.061 10.639 1.00 25.21 C ATOM 1606 NE ARG A 106 27.958 4.138 11.137 1.00 25.76 N ATOM 1607 CZ ARG A 106 28.761 4.409 12.163 1.00 26.69 C ATOM 1608 NH1 ARG A 106 28.657 5.564 12.806 1.00 27.16 N ATOM 1609 NH2 ARG A 106 29.668 3.521 12.549 1.00 27.19 N ATOM 0 H ARG A 106 24.203 1.630 8.534 1.00 21.40 H new ATOM 0 HA ARG A 106 24.033 4.475 8.638 1.00 22.20 H new ATOM 0 HB2 ARG A 106 24.537 2.669 10.467 1.00 23.35 H new ATOM 0 HB3 ARG A 106 26.183 2.734 9.868 1.00 23.35 H new ATOM 0 HG2 ARG A 106 24.809 5.304 10.611 1.00 24.22 H new ATOM 0 HG3 ARG A 106 25.393 4.254 11.887 1.00 24.22 H new ATOM 0 HD2 ARG A 106 27.109 5.248 9.578 1.00 25.21 H new ATOM 0 HD3 ARG A 106 27.039 6.018 11.151 1.00 25.21 H new ATOM 0 HE ARG A 106 28.058 3.236 10.672 1.00 25.76 H new ATOM 0 HH11 ARG A 106 27.959 6.249 12.515 1.00 27.16 H new ATOM 0 HH12 ARG A 106 29.275 5.768 13.592 1.00 27.16 H new ATOM 0 HH21 ARG A 106 29.750 2.630 12.059 1.00 27.19 H new ATOM 0 HH22 ARG A 106 30.283 3.729 13.335 1.00 27.19 H new ATOM 1623 N PHE A 107 26.563 3.115 7.061 1.00 22.61 N ATOM 1624 CA PHE A 107 27.697 3.392 6.182 1.00 22.97 C ATOM 1625 C PHE A 107 27.275 4.126 4.907 1.00 22.14 C ATOM 1626 O PHE A 107 27.886 5.127 4.532 1.00 22.53 O ATOM 1627 CB PHE A 107 28.408 2.088 5.820 1.00 23.24 C ATOM 1628 CG PHE A 107 29.689 2.289 5.059 1.00 23.93 C ATOM 1629 CD1 PHE A 107 30.827 2.746 5.703 1.00 24.48 C ATOM 1630 CD2 PHE A 107 29.753 2.023 3.702 1.00 24.11 C ATOM 1631 CE1 PHE A 107 32.007 2.932 5.007 1.00 25.19 C ATOM 1632 CE2 PHE A 107 30.929 2.206 3.000 1.00 24.82 C ATOM 1633 CZ PHE A 107 32.057 2.662 3.653 1.00 25.36 C ATOM 0 H PHE A 107 26.340 2.125 7.159 1.00 22.61 H new ATOM 0 HA PHE A 107 28.378 4.046 6.726 1.00 22.97 H new ATOM 0 HB2 PHE A 107 28.622 1.535 6.735 1.00 23.24 H new ATOM 0 HB3 PHE A 107 27.735 1.471 5.225 1.00 23.24 H new ATOM 0 HD1 PHE A 107 30.792 2.960 6.761 1.00 24.48 H new ATOM 0 HD2 PHE A 107 28.873 1.668 3.186 1.00 24.11 H new ATOM 0 HE1 PHE A 107 32.888 3.288 5.521 1.00 25.19 H new ATOM 0 HE2 PHE A 107 30.966 1.993 1.942 1.00 24.82 H new ATOM 0 HZ PHE A 107 32.977 2.807 3.106 1.00 25.36 H new ATOM 1643 N VAL A 108 26.235 3.627 4.240 1.00 21.06 N ATOM 1644 CA VAL A 108 25.762 4.239 2.998 1.00 20.23 C ATOM 1645 C VAL A 108 25.148 5.617 3.234 1.00 20.08 C ATOM 1646 O VAL A 108 25.481 6.570 2.533 1.00 20.21 O ATOM 1647 CB VAL A 108 24.738 3.344 2.272 1.00 19.12 C ATOM 1648 CG1 VAL A 108 24.197 4.038 1.029 1.00 18.33 C ATOM 1649 CG2 VAL A 108 25.373 2.014 1.904 1.00 19.13 C ATOM 0 H VAL A 108 25.707 2.806 4.536 1.00 21.06 H new ATOM 0 HA VAL A 108 26.643 4.353 2.367 1.00 20.23 H new ATOM 0 HB VAL A 108 23.902 3.159 2.947 1.00 19.12 H new ATOM 0 HG11 VAL A 108 23.476 3.387 0.534 1.00 18.33 H new ATOM 0 HG12 VAL A 108 23.708 4.969 1.316 1.00 18.33 H new ATOM 0 HG13 VAL A 108 25.019 4.255 0.347 1.00 18.33 H new ATOM 0 HG21 VAL A 108 24.640 1.390 1.392 1.00 19.13 H new ATOM 0 HG22 VAL A 108 26.225 2.187 1.247 1.00 19.13 H new ATOM 0 HG23 VAL A 108 25.710 1.509 2.809 1.00 19.13 H new ATOM 1659 N MET A 109 24.248 5.718 4.214 1.00 19.93 N ATOM 1660 CA MET A 109 23.598 6.993 4.525 1.00 19.90 C ATOM 1661 C MET A 109 24.618 8.127 4.563 1.00 20.93 C ATOM 1662 O MET A 109 24.315 9.261 4.192 1.00 20.91 O ATOM 1663 CB MET A 109 22.863 6.909 5.864 1.00 20.00 C ATOM 1664 CG MET A 109 21.633 6.014 5.837 1.00 18.99 C ATOM 1665 SD MET A 109 20.093 6.937 5.669 1.00 18.30 S ATOM 1666 CE MET A 109 20.112 7.319 3.920 1.00 17.64 C ATOM 0 H MET A 109 23.954 4.938 4.802 1.00 19.93 H new ATOM 0 HA MET A 109 22.874 7.202 3.737 1.00 19.90 H new ATOM 0 HB2 MET A 109 23.552 6.540 6.623 1.00 20.00 H new ATOM 0 HB3 MET A 109 22.564 7.912 6.167 1.00 20.00 H new ATOM 0 HG2 MET A 109 21.721 5.310 5.009 1.00 18.99 H new ATOM 0 HG3 MET A 109 21.599 5.425 6.754 1.00 18.99 H new ATOM 0 HE1 MET A 109 19.116 7.630 3.605 1.00 17.64 H new ATOM 0 HE2 MET A 109 20.820 8.126 3.731 1.00 17.64 H new ATOM 0 HE3 MET A 109 20.411 6.435 3.358 1.00 17.64 H new ATOM 1676 N ILE A 110 25.829 7.810 5.012 1.00 21.91 N ATOM 1677 CA ILE A 110 26.900 8.796 5.090 1.00 22.98 C ATOM 1678 C ILE A 110 27.444 9.114 3.702 1.00 22.97 C ATOM 1679 O ILE A 110 27.663 10.275 3.360 1.00 23.58 O ATOM 1680 CB ILE A 110 28.054 8.299 5.982 1.00 24.01 C ATOM 1681 CG1 ILE A 110 27.534 7.961 7.380 1.00 24.18 C ATOM 1682 CG2 ILE A 110 29.155 9.348 6.059 1.00 25.13 C ATOM 1683 CD1 ILE A 110 28.521 7.179 8.220 1.00 25.10 C ATOM 0 H ILE A 110 26.092 6.877 5.328 1.00 21.91 H new ATOM 0 HA ILE A 110 26.476 9.699 5.530 1.00 22.98 H new ATOM 0 HB ILE A 110 28.473 7.395 5.541 1.00 24.01 H new ATOM 0 HG12 ILE A 110 27.281 8.886 7.898 1.00 24.18 H new ATOM 0 HG13 ILE A 110 26.613 7.386 7.287 1.00 24.18 H new ATOM 0 HG21 ILE A 110 29.963 8.982 6.693 1.00 25.13 H new ATOM 0 HG22 ILE A 110 29.540 9.546 5.059 1.00 25.13 H new ATOM 0 HG23 ILE A 110 28.752 10.269 6.481 1.00 25.13 H new ATOM 0 HD11 ILE A 110 28.085 6.975 9.198 1.00 25.10 H new ATOM 0 HD12 ILE A 110 28.756 6.237 7.723 1.00 25.10 H new ATOM 0 HD13 ILE A 110 29.434 7.761 8.344 1.00 25.10 H new ATOM 1695 N ASN A 111 27.657 8.068 2.906 1.00 22.36 N ATOM 1696 CA ASN A 111 28.168 8.228 1.550 1.00 22.40 C ATOM 1697 C ASN A 111 27.228 9.090 0.719 1.00 21.78 C ATOM 1698 O ASN A 111 27.642 9.723 -0.253 1.00 22.21 O ATOM 1699 CB ASN A 111 28.342 6.861 0.884 1.00 21.96 C ATOM 1700 CG ASN A 111 29.330 5.979 1.621 1.00 22.60 C ATOM 1701 OD1 ASN A 111 30.271 6.469 2.245 1.00 23.32 O ATOM 1702 ND2 ASN A 111 29.121 4.670 1.551 1.00 22.44 N ATOM 0 H ASN A 111 27.483 7.101 3.179 1.00 22.36 H new ATOM 0 HA ASN A 111 29.137 8.723 1.608 1.00 22.40 H new ATOM 0 HB2 ASN A 111 27.376 6.358 0.836 1.00 21.96 H new ATOM 0 HB3 ASN A 111 28.680 7.001 -0.143 1.00 21.96 H new ATOM 0 HD21 ASN A 111 29.754 4.026 2.026 1.00 22.44 H new ATOM 0 HD22 ASN A 111 28.328 4.308 1.022 1.00 22.44 H new ATOM 1709 N LEU A 112 25.958 9.111 1.112 1.00 20.83 N ATOM 1710 CA LEU A 112 24.952 9.893 0.409 1.00 20.19 C ATOM 1711 C LEU A 112 25.097 11.375 0.738 1.00 20.95 C ATOM 1712 O LEU A 112 24.824 12.236 -0.099 1.00 21.07 O ATOM 1713 CB LEU A 112 23.551 9.404 0.779 1.00 19.00 C ATOM 1714 CG LEU A 112 23.318 7.903 0.587 1.00 18.25 C ATOM 1715 CD1 LEU A 112 21.920 7.517 1.035 1.00 17.58 C ATOM 1716 CD2 LEU A 112 23.539 7.503 -0.863 1.00 17.84 C ATOM 0 H LEU A 112 25.603 8.593 1.916 1.00 20.83 H new ATOM 0 HA LEU A 112 25.100 9.762 -0.663 1.00 20.19 H new ATOM 0 HB2 LEU A 112 23.358 9.656 1.822 1.00 19.00 H new ATOM 0 HB3 LEU A 112 22.822 9.949 0.179 1.00 19.00 H new ATOM 0 HG LEU A 112 24.039 7.367 1.204 1.00 18.25 H new ATOM 0 HD11 LEU A 112 21.774 6.447 0.890 1.00 17.58 H new ATOM 0 HD12 LEU A 112 21.796 7.761 2.090 1.00 17.58 H new ATOM 0 HD13 LEU A 112 21.185 8.066 0.447 1.00 17.58 H new ATOM 0 HD21 LEU A 112 23.368 6.432 -0.975 1.00 17.84 H new ATOM 0 HD22 LEU A 112 22.845 8.050 -1.501 1.00 17.84 H new ATOM 0 HD23 LEU A 112 24.563 7.739 -1.154 1.00 17.84 H new ATOM 1728 N GLY A 113 25.531 11.665 1.962 1.00 21.57 N ATOM 1729 CA GLY A 113 25.714 13.043 2.379 1.00 22.41 C ATOM 1730 C GLY A 113 24.890 13.403 3.599 1.00 22.40 C ATOM 1731 O GLY A 113 24.978 14.523 4.104 1.00 23.05 O ATOM 0 H GLY A 113 25.759 10.969 2.672 1.00 21.57 H new ATOM 0 HA2 GLY A 113 26.768 13.215 2.595 1.00 22.41 H new ATOM 0 HA3 GLY A 113 25.445 13.705 1.556 1.00 22.41 H new ATOM 1735 N GLU A 114 24.089 12.456 4.076 1.00 21.76 N ATOM 1736 CA GLU A 114 23.245 12.686 5.241 1.00 21.80 C ATOM 1737 C GLU A 114 23.736 11.893 6.449 1.00 22.59 C ATOM 1738 O GLU A 114 23.848 10.668 6.398 1.00 22.48 O ATOM 1739 CB GLU A 114 21.798 12.314 4.920 1.00 20.80 C ATOM 1740 CG GLU A 114 21.658 10.986 4.197 1.00 20.26 C ATOM 1741 CD GLU A 114 20.237 10.714 3.747 1.00 20.12 C ATOM 1742 OE1 GLU A 114 19.411 10.320 4.595 1.00 20.27 O ATOM 1743 OE2 GLU A 114 19.951 10.895 2.544 1.00 19.96 O ATOM 0 H GLU A 114 24.007 11.522 3.673 1.00 21.76 H new ATOM 0 HA GLU A 114 23.298 13.745 5.492 1.00 21.80 H new ATOM 0 HB2 GLU A 114 21.227 12.275 5.848 1.00 20.80 H new ATOM 0 HB3 GLU A 114 21.357 13.100 4.307 1.00 20.80 H new ATOM 0 HG2 GLU A 114 22.318 10.978 3.329 1.00 20.26 H new ATOM 0 HG3 GLU A 114 21.987 10.182 4.855 1.00 20.26 H new ATOM 1750 N LYS A 115 24.029 12.604 7.536 1.00 23.45 N ATOM 1751 CA LYS A 115 24.502 11.971 8.764 1.00 24.32 C ATOM 1752 C LYS A 115 23.333 11.390 9.553 1.00 23.94 C ATOM 1753 O LYS A 115 22.251 11.977 9.598 1.00 23.86 O ATOM 1754 CB LYS A 115 25.262 12.984 9.623 1.00 25.48 C ATOM 1755 CG LYS A 115 25.804 12.400 10.918 1.00 26.26 C ATOM 1756 CD LYS A 115 26.576 13.439 11.715 1.00 26.75 C ATOM 1757 CE LYS A 115 27.148 12.849 12.995 1.00 27.55 C ATOM 1758 NZ LYS A 115 26.078 12.377 13.918 1.00 27.96 N ATOM 0 H LYS A 115 23.947 13.619 7.591 1.00 23.45 H new ATOM 0 HA LYS A 115 25.177 11.159 8.494 1.00 24.32 H new ATOM 0 HB2 LYS A 115 26.091 13.390 9.043 1.00 25.48 H new ATOM 0 HB3 LYS A 115 24.600 13.817 9.859 1.00 25.48 H new ATOM 0 HG2 LYS A 115 24.979 12.017 11.519 1.00 26.26 H new ATOM 0 HG3 LYS A 115 26.454 11.555 10.693 1.00 26.26 H new ATOM 0 HD2 LYS A 115 27.385 13.839 11.105 1.00 26.75 H new ATOM 0 HD3 LYS A 115 25.919 14.273 11.960 1.00 26.75 H new ATOM 0 HE2 LYS A 115 27.807 12.017 12.748 1.00 27.55 H new ATOM 0 HE3 LYS A 115 27.757 13.599 13.499 1.00 27.55 H new ATOM 0 HZ1 LYS A 115 26.495 12.140 14.841 1.00 27.96 H new ATOM 0 HZ2 LYS A 115 25.369 13.128 14.041 1.00 27.96 H new ATOM 0 HZ3 LYS A 115 25.622 11.533 13.518 1.00 27.96 H new ATOM 1772 N VAL A 116 23.556 10.236 10.174 1.00 23.78 N ATOM 1773 CA VAL A 116 22.517 9.574 10.956 1.00 23.53 C ATOM 1774 C VAL A 116 23.104 8.760 12.102 1.00 24.38 C ATOM 1775 O VAL A 116 24.259 8.336 12.054 1.00 24.75 O ATOM 1776 CB VAL A 116 21.666 8.634 10.084 1.00 22.24 C ATOM 1777 CG1 VAL A 116 20.602 9.413 9.329 1.00 21.40 C ATOM 1778 CG2 VAL A 116 22.553 7.855 9.122 1.00 21.91 C ATOM 0 H VAL A 116 24.447 9.740 10.151 1.00 23.78 H new ATOM 0 HA VAL A 116 21.891 10.370 11.359 1.00 23.53 H new ATOM 0 HB VAL A 116 21.160 7.923 10.737 1.00 22.24 H new ATOM 0 HG11 VAL A 116 20.013 8.728 8.720 1.00 21.40 H new ATOM 0 HG12 VAL A 116 19.949 9.919 10.040 1.00 21.40 H new ATOM 0 HG13 VAL A 116 21.080 10.152 8.685 1.00 21.40 H new ATOM 0 HG21 VAL A 116 21.936 7.195 8.512 1.00 21.91 H new ATOM 0 HG22 VAL A 116 23.088 8.551 8.476 1.00 21.91 H new ATOM 0 HG23 VAL A 116 23.270 7.261 9.688 1.00 21.91 H new ATOM 1788 N THR A 117 22.293 8.549 13.134 1.00 24.76 N ATOM 1789 CA THR A 117 22.707 7.774 14.294 1.00 25.62 C ATOM 1790 C THR A 117 22.157 6.358 14.202 1.00 25.03 C ATOM 1791 O THR A 117 21.044 6.147 13.720 1.00 24.12 O ATOM 1792 CB THR A 117 22.221 8.420 15.605 1.00 26.54 C ATOM 1793 OG1 THR A 117 20.797 8.574 15.578 1.00 25.98 O ATOM 1794 CG2 THR A 117 22.879 9.776 15.817 1.00 27.24 C ATOM 0 H THR A 117 21.340 8.907 13.188 1.00 24.76 H new ATOM 0 HA THR A 117 23.797 7.750 14.301 1.00 25.62 H new ATOM 0 HB THR A 117 22.499 7.766 16.431 1.00 26.54 H new ATOM 0 HG1 THR A 117 20.496 8.984 16.416 1.00 25.98 H new ATOM 0 HG21 THR A 117 22.520 10.213 16.749 1.00 27.24 H new ATOM 0 HG22 THR A 117 23.961 9.652 15.867 1.00 27.24 H new ATOM 0 HG23 THR A 117 22.628 10.436 14.987 1.00 27.24 H new ATOM 1802 N ASP A 118 22.941 5.391 14.668 1.00 25.62 N ATOM 1803 CA ASP A 118 22.541 3.986 14.630 1.00 25.26 C ATOM 1804 C ASP A 118 21.155 3.777 15.236 1.00 25.12 C ATOM 1805 O ASP A 118 20.510 2.762 14.984 1.00 24.60 O ATOM 1806 CB ASP A 118 23.564 3.122 15.370 1.00 26.22 C ATOM 1807 CG ASP A 118 24.946 3.203 14.752 1.00 26.44 C ATOM 1808 OD1 ASP A 118 25.239 2.400 13.842 1.00 26.63 O ATOM 1809 OD2 ASP A 118 25.735 4.073 15.177 1.00 26.51 O ATOM 0 H ASP A 118 23.861 5.554 15.078 1.00 25.62 H new ATOM 0 HA ASP A 118 22.501 3.686 13.583 1.00 25.26 H new ATOM 0 HB2 ASP A 118 23.616 3.438 16.412 1.00 26.22 H new ATOM 0 HB3 ASP A 118 23.229 2.085 15.368 1.00 26.22 H new ATOM 1814 N GLU A 119 20.701 4.742 16.028 1.00 25.66 N ATOM 1815 CA GLU A 119 19.395 4.652 16.672 1.00 25.70 C ATOM 1816 C GLU A 119 18.264 4.984 15.701 1.00 24.54 C ATOM 1817 O GLU A 119 17.332 4.196 15.533 1.00 24.02 O ATOM 1818 CB GLU A 119 19.336 5.586 17.881 1.00 26.79 C ATOM 1819 CG GLU A 119 20.410 5.302 18.918 1.00 27.99 C ATOM 1820 CD GLU A 119 20.314 6.216 20.124 1.00 28.61 C ATOM 1821 OE1 GLU A 119 19.591 5.864 21.081 1.00 29.14 O ATOM 1822 OE2 GLU A 119 20.961 7.284 20.113 1.00 28.61 O ATOM 0 H GLU A 119 21.218 5.596 16.240 1.00 25.66 H new ATOM 0 HA GLU A 119 19.261 3.622 17.003 1.00 25.70 H new ATOM 0 HB2 GLU A 119 19.435 6.616 17.540 1.00 26.79 H new ATOM 0 HB3 GLU A 119 18.356 5.498 18.351 1.00 26.79 H new ATOM 0 HG2 GLU A 119 20.329 4.265 19.245 1.00 27.99 H new ATOM 0 HG3 GLU A 119 21.392 5.415 18.459 1.00 27.99 H new ATOM 1829 N GLU A 120 18.347 6.148 15.063 1.00 24.19 N ATOM 1830 CA GLU A 120 17.315 6.580 14.125 1.00 23.13 C ATOM 1831 C GLU A 120 17.225 5.654 12.915 1.00 21.97 C ATOM 1832 O GLU A 120 16.129 5.341 12.448 1.00 21.17 O ATOM 1833 CB GLU A 120 17.573 8.016 13.669 1.00 23.10 C ATOM 1834 CG GLU A 120 18.867 8.198 12.894 1.00 22.97 C ATOM 1835 CD GLU A 120 19.056 9.623 12.413 1.00 23.00 C ATOM 1836 OE1 GLU A 120 18.323 10.041 11.493 1.00 23.55 O ATOM 1837 OE2 GLU A 120 19.936 10.323 12.958 1.00 22.54 O ATOM 0 H GLU A 120 19.116 6.808 15.178 1.00 24.19 H new ATOM 0 HA GLU A 120 16.360 6.537 14.649 1.00 23.13 H new ATOM 0 HB2 GLU A 120 16.740 8.343 13.047 1.00 23.10 H new ATOM 0 HB3 GLU A 120 17.592 8.666 14.544 1.00 23.10 H new ATOM 0 HG2 GLU A 120 19.709 7.916 13.526 1.00 22.97 H new ATOM 0 HG3 GLU A 120 18.872 7.524 12.037 1.00 22.97 H new ATOM 1844 N ILE A 121 18.372 5.213 12.407 1.00 21.93 N ATOM 1845 CA ILE A 121 18.390 4.333 11.246 1.00 20.94 C ATOM 1846 C ILE A 121 17.875 2.940 11.590 1.00 20.97 C ATOM 1847 O ILE A 121 17.127 2.343 10.815 1.00 20.10 O ATOM 1848 CB ILE A 121 19.796 4.218 10.628 1.00 21.05 C ATOM 1849 CG1 ILE A 121 20.811 3.750 11.666 1.00 22.23 C ATOM 1850 CG2 ILE A 121 20.219 5.549 10.030 1.00 20.98 C ATOM 1851 CD1 ILE A 121 22.017 3.073 11.058 1.00 22.33 C ATOM 0 H ILE A 121 19.293 5.449 12.778 1.00 21.93 H new ATOM 0 HA ILE A 121 17.725 4.787 10.512 1.00 20.94 H new ATOM 0 HB ILE A 121 19.760 3.474 9.833 1.00 21.05 H new ATOM 0 HG12 ILE A 121 21.141 4.607 12.253 1.00 22.23 H new ATOM 0 HG13 ILE A 121 20.324 3.060 12.355 1.00 22.23 H new ATOM 0 HG21 ILE A 121 21.215 5.453 9.597 1.00 20.98 H new ATOM 0 HG22 ILE A 121 19.512 5.840 9.253 1.00 20.98 H new ATOM 0 HG23 ILE A 121 20.235 6.310 10.810 1.00 20.98 H new ATOM 0 HD11 ILE A 121 22.699 2.765 11.850 1.00 22.33 H new ATOM 0 HD12 ILE A 121 21.697 2.197 10.494 1.00 22.33 H new ATOM 0 HD13 ILE A 121 22.527 3.768 10.391 1.00 22.33 H new ATOM 1863 N ASP A 122 18.275 2.420 12.748 1.00 22.05 N ATOM 1864 CA ASP A 122 17.830 1.096 13.173 1.00 22.30 C ATOM 1865 C ASP A 122 16.311 1.056 13.260 1.00 21.86 C ATOM 1866 O ASP A 122 15.683 0.049 12.928 1.00 21.46 O ATOM 1867 CB ASP A 122 18.442 0.727 14.525 1.00 23.63 C ATOM 1868 CG ASP A 122 18.018 -0.651 14.993 1.00 24.02 C ATOM 1869 OD1 ASP A 122 18.672 -1.640 14.598 1.00 24.14 O ATOM 1870 OD2 ASP A 122 17.031 -0.742 15.754 1.00 24.29 O ATOM 0 H ASP A 122 18.900 2.890 13.403 1.00 22.05 H new ATOM 0 HA ASP A 122 18.164 0.368 12.433 1.00 22.30 H new ATOM 0 HB2 ASP A 122 19.529 0.765 14.451 1.00 23.63 H new ATOM 0 HB3 ASP A 122 18.147 1.467 15.269 1.00 23.63 H new ATOM 1875 N GLU A 123 15.724 2.161 13.712 1.00 22.03 N ATOM 1876 CA GLU A 123 14.275 2.261 13.830 1.00 21.74 C ATOM 1877 C GLU A 123 13.634 2.213 12.450 1.00 20.39 C ATOM 1878 O GLU A 123 12.609 1.560 12.254 1.00 20.02 O ATOM 1879 CB GLU A 123 13.884 3.553 14.549 1.00 22.27 C ATOM 1880 CG GLU A 123 14.235 3.553 16.029 1.00 23.66 C ATOM 1881 CD GLU A 123 13.476 2.496 16.807 1.00 24.40 C ATOM 1882 OE1 GLU A 123 12.361 2.794 17.281 1.00 24.74 O ATOM 1883 OE2 GLU A 123 13.998 1.368 16.940 1.00 24.71 O ATOM 0 H GLU A 123 16.230 2.998 14.002 1.00 22.03 H new ATOM 0 HA GLU A 123 13.915 1.416 14.417 1.00 21.74 H new ATOM 0 HB2 GLU A 123 14.382 4.394 14.066 1.00 22.27 H new ATOM 0 HB3 GLU A 123 12.811 3.711 14.438 1.00 22.27 H new ATOM 0 HG2 GLU A 123 15.306 3.386 16.145 1.00 23.66 H new ATOM 0 HG3 GLU A 123 14.018 4.535 16.450 1.00 23.66 H new ATOM 1890 N MET A 124 14.244 2.914 11.497 1.00 19.71 N ATOM 1891 CA MET A 124 13.746 2.934 10.130 1.00 18.41 C ATOM 1892 C MET A 124 13.690 1.518 9.574 1.00 17.96 C ATOM 1893 O MET A 124 12.781 1.167 8.821 1.00 17.13 O ATOM 1894 CB MET A 124 14.636 3.809 9.247 1.00 17.97 C ATOM 1895 CG MET A 124 14.178 3.866 7.800 1.00 16.63 C ATOM 1896 SD MET A 124 15.205 4.942 6.781 1.00 16.29 S ATOM 1897 CE MET A 124 16.711 3.981 6.693 1.00 17.07 C ATOM 0 H MET A 124 15.083 3.474 11.649 1.00 19.71 H new ATOM 0 HA MET A 124 12.741 3.355 10.134 1.00 18.41 H new ATOM 0 HB2 MET A 124 14.658 4.820 9.654 1.00 17.97 H new ATOM 0 HB3 MET A 124 15.657 3.429 9.283 1.00 17.97 H new ATOM 0 HG2 MET A 124 14.188 2.860 7.381 1.00 16.63 H new ATOM 0 HG3 MET A 124 13.146 4.216 7.764 1.00 16.63 H new ATOM 0 HE1 MET A 124 17.523 4.534 7.165 1.00 17.07 H new ATOM 0 HE2 MET A 124 16.568 3.033 7.211 1.00 17.07 H new ATOM 0 HE3 MET A 124 16.960 3.790 5.649 1.00 17.07 H new ATOM 1907 N ILE A 125 14.673 0.708 9.954 1.00 18.60 N ATOM 1908 CA ILE A 125 14.739 -0.677 9.515 1.00 18.41 C ATOM 1909 C ILE A 125 13.535 -1.441 10.038 1.00 18.72 C ATOM 1910 O ILE A 125 12.925 -2.231 9.321 1.00 18.18 O ATOM 1911 CB ILE A 125 16.032 -1.355 10.007 1.00 19.25 C ATOM 1912 CG1 ILE A 125 17.249 -0.666 9.387 1.00 19.04 C ATOM 1913 CG2 ILE A 125 16.023 -2.842 9.674 1.00 19.27 C ATOM 1914 CD1 ILE A 125 18.574 -1.199 9.888 1.00 19.95 C ATOM 0 H ILE A 125 15.437 0.991 10.568 1.00 18.60 H new ATOM 0 HA ILE A 125 14.738 -0.687 8.425 1.00 18.41 H new ATOM 0 HB ILE A 125 16.089 -1.257 11.091 1.00 19.25 H new ATOM 0 HG12 ILE A 125 17.208 -0.782 8.304 1.00 19.04 H new ATOM 0 HG13 ILE A 125 17.195 0.402 9.596 1.00 19.04 H new ATOM 0 HG21 ILE A 125 16.945 -3.300 10.031 1.00 19.27 H new ATOM 0 HG22 ILE A 125 15.170 -3.318 10.158 1.00 19.27 H new ATOM 0 HG23 ILE A 125 15.947 -2.973 8.595 1.00 19.27 H new ATOM 0 HD11 ILE A 125 19.389 -0.662 9.403 1.00 19.95 H new ATOM 0 HD12 ILE A 125 18.638 -1.059 10.967 1.00 19.95 H new ATOM 0 HD13 ILE A 125 18.650 -2.261 9.655 1.00 19.95 H new ATOM 1926 N ARG A 126 13.201 -1.189 11.299 1.00 19.67 N ATOM 1927 CA ARG A 126 12.064 -1.832 11.940 1.00 20.18 C ATOM 1928 C ARG A 126 10.786 -1.542 11.165 1.00 19.36 C ATOM 1929 O ARG A 126 10.032 -2.449 10.811 1.00 19.42 O ATOM 1930 CB ARG A 126 11.922 -1.318 13.372 1.00 21.37 C ATOM 1931 CG ARG A 126 11.301 -2.320 14.334 1.00 22.05 C ATOM 1932 CD ARG A 126 9.827 -2.546 14.035 1.00 22.88 C ATOM 1933 NE ARG A 126 9.067 -1.298 14.058 1.00 23.53 N ATOM 1934 CZ ARG A 126 7.806 -1.192 13.646 1.00 24.32 C ATOM 1935 NH1 ARG A 126 7.162 -2.257 13.187 1.00 24.55 N ATOM 1936 NH2 ARG A 126 7.188 -0.019 13.694 1.00 24.95 N ATOM 0 H ARG A 126 13.707 -0.539 11.900 1.00 19.67 H new ATOM 0 HA ARG A 126 12.232 -2.909 11.954 1.00 20.18 H new ATOM 0 HB2 ARG A 126 12.907 -1.036 13.744 1.00 21.37 H new ATOM 0 HB3 ARG A 126 11.313 -0.414 13.363 1.00 21.37 H new ATOM 0 HG2 ARG A 126 11.835 -3.268 14.268 1.00 22.05 H new ATOM 0 HG3 ARG A 126 11.414 -1.961 15.357 1.00 22.05 H new ATOM 0 HD2 ARG A 126 9.723 -3.016 13.057 1.00 22.88 H new ATOM 0 HD3 ARG A 126 9.410 -3.238 14.767 1.00 22.88 H new ATOM 0 HE ARG A 126 9.530 -0.460 14.410 1.00 23.53 H new ATOM 0 HH11 ARG A 126 7.633 -3.161 13.149 1.00 24.55 H new ATOM 0 HH12 ARG A 126 6.196 -2.172 12.872 1.00 24.55 H new ATOM 0 HH21 ARG A 126 7.679 0.802 14.047 1.00 24.95 H new ATOM 0 HH22 ARG A 126 6.222 0.062 13.378 1.00 24.95 H new ATOM 1950 N GLU A 127 10.557 -0.259 10.916 1.00 18.69 N ATOM 1951 CA GLU A 127 9.378 0.195 10.187 1.00 17.91 C ATOM 1952 C GLU A 127 9.249 -0.496 8.832 1.00 16.85 C ATOM 1953 O GLU A 127 8.155 -0.585 8.275 1.00 16.48 O ATOM 1954 CB GLU A 127 9.441 1.710 9.995 1.00 17.50 C ATOM 1955 CG GLU A 127 9.538 2.478 11.301 1.00 18.61 C ATOM 1956 CD GLU A 127 9.443 3.978 11.107 1.00 18.51 C ATOM 1957 OE1 GLU A 127 10.471 4.599 10.760 1.00 18.54 O ATOM 1958 OE2 GLU A 127 8.341 4.534 11.301 1.00 18.51 O ATOM 0 H GLU A 127 11.179 0.493 11.212 1.00 18.69 H new ATOM 0 HA GLU A 127 8.499 -0.066 10.777 1.00 17.91 H new ATOM 0 HB2 GLU A 127 10.302 1.955 9.373 1.00 17.50 H new ATOM 0 HB3 GLU A 127 8.553 2.038 9.454 1.00 17.50 H new ATOM 0 HG2 GLU A 127 8.742 2.151 11.970 1.00 18.61 H new ATOM 0 HG3 GLU A 127 10.483 2.238 11.789 1.00 18.61 H new ATOM 1965 N ALA A 128 10.368 -0.982 8.303 1.00 16.47 N ATOM 1966 CA ALA A 128 10.365 -1.658 7.010 1.00 15.57 C ATOM 1967 C ALA A 128 10.564 -3.160 7.165 1.00 16.23 C ATOM 1968 O ALA A 128 10.397 -3.920 6.212 1.00 15.78 O ATOM 1969 CB ALA A 128 11.446 -1.078 6.112 1.00 14.84 C ATOM 0 H ALA A 128 11.284 -0.921 8.747 1.00 16.47 H new ATOM 0 HA ALA A 128 9.390 -1.495 6.551 1.00 15.57 H new ATOM 0 HB1 ALA A 128 11.434 -1.591 5.150 1.00 14.84 H new ATOM 0 HB2 ALA A 128 11.260 -0.015 5.959 1.00 14.84 H new ATOM 0 HB3 ALA A 128 12.420 -1.212 6.582 1.00 14.84 H new ATOM 1975 N ASP A 129 10.920 -3.583 8.372 1.00 17.37 N ATOM 1976 CA ASP A 129 11.151 -4.995 8.647 1.00 18.16 C ATOM 1977 C ASP A 129 9.925 -5.632 9.293 1.00 18.88 C ATOM 1978 O ASP A 129 9.637 -5.401 10.469 1.00 19.74 O ATOM 1979 CB ASP A 129 12.377 -5.161 9.545 1.00 19.04 C ATOM 1980 CG ASP A 129 12.698 -6.614 9.831 1.00 19.91 C ATOM 1981 OD1 ASP A 129 12.427 -7.463 8.956 1.00 20.17 O ATOM 1982 OD2 ASP A 129 13.213 -6.905 10.931 1.00 20.40 O ATOM 0 H ASP A 129 11.055 -2.969 9.175 1.00 17.37 H new ATOM 0 HA ASP A 129 11.336 -5.504 7.701 1.00 18.16 H new ATOM 0 HB2 ASP A 129 13.237 -4.690 9.070 1.00 19.04 H new ATOM 0 HB3 ASP A 129 12.207 -4.638 10.486 1.00 19.04 H new ATOM 1987 N PHE A 130 9.210 -6.435 8.512 1.00 18.61 N ATOM 1988 CA PHE A 130 8.007 -7.106 8.992 1.00 19.35 C ATOM 1989 C PHE A 130 8.347 -8.417 9.695 1.00 20.46 C ATOM 1990 O PHE A 130 7.865 -8.685 10.796 1.00 21.43 O ATOM 1991 CB PHE A 130 7.060 -7.379 7.823 1.00 18.69 C ATOM 1992 CG PHE A 130 6.836 -6.185 6.940 1.00 17.66 C ATOM 1993 CD1 PHE A 130 5.925 -5.204 7.300 1.00 17.35 C ATOM 1994 CD2 PHE A 130 7.533 -6.044 5.751 1.00 17.07 C ATOM 1995 CE1 PHE A 130 5.715 -4.105 6.491 1.00 16.46 C ATOM 1996 CE2 PHE A 130 7.326 -4.946 4.938 1.00 16.17 C ATOM 1997 CZ PHE A 130 6.428 -3.976 5.304 1.00 15.86 C ATOM 0 H PHE A 130 9.444 -6.638 7.540 1.00 18.61 H new ATOM 0 HA PHE A 130 7.520 -6.449 9.712 1.00 19.35 H new ATOM 0 HB2 PHE A 130 7.463 -8.194 7.222 1.00 18.69 H new ATOM 0 HB3 PHE A 130 6.100 -7.716 8.215 1.00 18.69 H new ATOM 0 HD1 PHE A 130 5.373 -5.300 8.224 1.00 17.35 H new ATOM 0 HD2 PHE A 130 8.246 -6.800 5.456 1.00 17.07 H new ATOM 0 HE1 PHE A 130 5.000 -3.349 6.779 1.00 16.46 H new ATOM 0 HE2 PHE A 130 7.873 -4.851 4.012 1.00 16.17 H new ATOM 0 HZ PHE A 130 6.275 -3.114 4.672 1.00 15.86 H new ATOM 2007 N ASP A 131 9.179 -9.230 9.050 1.00 20.37 N ATOM 2008 CA ASP A 131 9.582 -10.519 9.605 1.00 21.43 C ATOM 2009 C ASP A 131 10.294 -10.350 10.944 1.00 22.32 C ATOM 2010 O ASP A 131 10.347 -11.282 11.747 1.00 23.37 O ATOM 2011 CB ASP A 131 10.489 -11.256 8.619 1.00 21.16 C ATOM 2012 CG ASP A 131 11.583 -10.366 8.061 1.00 20.32 C ATOM 2013 OD1 ASP A 131 11.340 -9.697 7.034 1.00 20.09 O ATOM 2014 OD2 ASP A 131 12.684 -10.338 8.649 1.00 19.96 O ATOM 0 H ASP A 131 9.588 -9.018 8.140 1.00 20.37 H new ATOM 0 HA ASP A 131 8.680 -11.108 9.775 1.00 21.43 H new ATOM 0 HB2 ASP A 131 10.941 -12.114 9.117 1.00 21.16 H new ATOM 0 HB3 ASP A 131 9.887 -11.645 7.798 1.00 21.16 H new ATOM 2019 N GLY A 132 10.834 -9.161 11.183 1.00 21.94 N ATOM 2020 CA GLY A 132 11.531 -8.902 12.429 1.00 22.81 C ATOM 2021 C GLY A 132 12.729 -9.811 12.627 1.00 23.39 C ATOM 2022 O GLY A 132 12.669 -10.771 13.396 1.00 24.32 O ATOM 0 H GLY A 132 10.802 -8.372 10.537 1.00 21.94 H new ATOM 0 HA2 GLY A 132 11.861 -7.863 12.447 1.00 22.81 H new ATOM 0 HA3 GLY A 132 10.840 -9.032 13.262 1.00 22.81 H new ATOM 2026 N ASP A 133 13.819 -9.507 11.929 1.00 22.90 N ATOM 2027 CA ASP A 133 15.040 -10.299 12.028 1.00 23.47 C ATOM 2028 C ASP A 133 16.260 -9.396 12.184 1.00 23.33 C ATOM 2029 O ASP A 133 17.337 -9.851 12.570 1.00 23.88 O ATOM 2030 CB ASP A 133 15.200 -11.183 10.790 1.00 23.07 C ATOM 2031 CG ASP A 133 15.521 -10.382 9.543 1.00 21.88 C ATOM 2032 OD1 ASP A 133 14.931 -9.295 9.368 1.00 21.56 O ATOM 2033 OD2 ASP A 133 16.362 -10.841 8.741 1.00 21.33 O ATOM 0 H ASP A 133 13.881 -8.716 11.288 1.00 22.90 H new ATOM 0 HA ASP A 133 14.963 -10.933 12.911 1.00 23.47 H new ATOM 0 HB2 ASP A 133 15.994 -11.909 10.966 1.00 23.07 H new ATOM 0 HB3 ASP A 133 14.281 -11.747 10.629 1.00 23.07 H new ATOM 2038 N GLY A 134 16.081 -8.113 11.881 1.00 22.67 N ATOM 2039 CA GLY A 134 17.173 -7.163 11.990 1.00 22.60 C ATOM 2040 C GLY A 134 17.921 -6.992 10.685 1.00 21.81 C ATOM 2041 O GLY A 134 18.986 -6.373 10.649 1.00 21.94 O ATOM 0 H GLY A 134 15.198 -7.715 11.562 1.00 22.67 H new ATOM 0 HA2 GLY A 134 16.781 -6.198 12.310 1.00 22.60 H new ATOM 0 HA3 GLY A 134 17.866 -7.497 12.762 1.00 22.60 H new ATOM 2045 N MET A 135 17.364 -7.540 9.611 1.00 21.09 N ATOM 2046 CA MET A 135 17.982 -7.447 8.294 1.00 20.37 C ATOM 2047 C MET A 135 16.961 -6.997 7.254 1.00 19.18 C ATOM 2048 O MET A 135 15.758 -7.210 7.422 1.00 19.03 O ATOM 2049 CB MET A 135 18.589 -8.794 7.896 1.00 20.92 C ATOM 2050 CG MET A 135 19.415 -9.436 9.002 1.00 22.12 C ATOM 2051 SD MET A 135 20.420 -10.811 8.413 1.00 22.91 S ATOM 2052 CE MET A 135 21.620 -9.942 7.407 1.00 22.22 C ATOM 0 H MET A 135 16.483 -8.054 9.627 1.00 21.09 H new ATOM 0 HA MET A 135 18.779 -6.705 8.338 1.00 20.37 H new ATOM 0 HB2 MET A 135 17.787 -9.475 7.610 1.00 20.92 H new ATOM 0 HB3 MET A 135 19.218 -8.655 7.017 1.00 20.92 H new ATOM 0 HG2 MET A 135 20.064 -8.683 9.449 1.00 22.12 H new ATOM 0 HG3 MET A 135 18.748 -9.790 9.789 1.00 22.12 H new ATOM 0 HE1 MET A 135 21.583 -10.322 6.386 1.00 22.22 H new ATOM 0 HE2 MET A 135 21.391 -8.876 7.406 1.00 22.22 H new ATOM 0 HE3 MET A 135 22.618 -10.098 7.816 1.00 22.22 H new ATOM 2062 N ILE A 136 17.444 -6.379 6.180 1.00 18.41 N ATOM 2063 CA ILE A 136 16.565 -5.888 5.124 1.00 17.25 C ATOM 2064 C ILE A 136 16.790 -6.620 3.809 1.00 16.93 C ATOM 2065 O ILE A 136 17.912 -6.986 3.465 1.00 17.36 O ATOM 2066 CB ILE A 136 16.761 -4.374 4.883 1.00 16.55 C ATOM 2067 CG1 ILE A 136 16.316 -3.571 6.109 1.00 16.94 C ATOM 2068 CG2 ILE A 136 16.003 -3.922 3.637 1.00 15.33 C ATOM 2069 CD1 ILE A 136 14.845 -3.721 6.440 1.00 16.79 C ATOM 0 H ILE A 136 18.436 -6.207 6.018 1.00 18.41 H new ATOM 0 HA ILE A 136 15.548 -6.076 5.468 1.00 17.25 H new ATOM 0 HB ILE A 136 17.823 -4.189 4.720 1.00 16.55 H new ATOM 0 HG12 ILE A 136 16.906 -3.884 6.970 1.00 16.94 H new ATOM 0 HG13 ILE A 136 16.535 -2.517 5.940 1.00 16.94 H new ATOM 0 HG21 ILE A 136 16.155 -2.853 3.486 1.00 15.33 H new ATOM 0 HG22 ILE A 136 16.373 -4.467 2.768 1.00 15.33 H new ATOM 0 HG23 ILE A 136 14.939 -4.123 3.765 1.00 15.33 H new ATOM 0 HD11 ILE A 136 14.607 -3.123 7.320 1.00 16.79 H new ATOM 0 HD12 ILE A 136 14.246 -3.380 5.596 1.00 16.79 H new ATOM 0 HD13 ILE A 136 14.623 -4.769 6.643 1.00 16.79 H new ATOM 2081 N ASN A 137 15.700 -6.822 3.086 1.00 16.28 N ATOM 2082 CA ASN A 137 15.734 -7.473 1.789 1.00 16.03 C ATOM 2083 C ASN A 137 15.315 -6.471 0.722 1.00 14.85 C ATOM 2084 O ASN A 137 14.653 -5.484 1.040 1.00 14.21 O ATOM 2085 CB ASN A 137 14.806 -8.689 1.773 1.00 16.50 C ATOM 2086 CG ASN A 137 14.842 -9.429 0.450 1.00 16.54 C ATOM 2087 OD1 ASN A 137 15.868 -9.466 -0.228 1.00 16.44 O ATOM 2088 ND2 ASN A 137 13.716 -10.024 0.075 1.00 16.82 N ATOM 0 H ASN A 137 14.766 -6.538 3.383 1.00 16.28 H new ATOM 0 HA ASN A 137 16.746 -7.822 1.585 1.00 16.03 H new ATOM 0 HB2 ASN A 137 15.091 -9.370 2.575 1.00 16.50 H new ATOM 0 HB3 ASN A 137 13.785 -8.366 1.977 1.00 16.50 H new ATOM 0 HD21 ASN A 137 13.679 -10.537 -0.806 1.00 16.82 H new ATOM 0 HD22 ASN A 137 12.888 -9.968 0.668 1.00 16.82 H new ATOM 2095 N TYR A 138 15.714 -6.700 -0.524 1.00 14.65 N ATOM 2096 CA TYR A 138 15.362 -5.793 -1.620 1.00 13.62 C ATOM 2097 C TYR A 138 13.904 -5.326 -1.518 1.00 12.81 C ATOM 2098 O TYR A 138 13.546 -4.269 -2.036 1.00 11.86 O ATOM 2099 CB TYR A 138 15.622 -6.472 -2.971 1.00 13.81 C ATOM 2100 CG TYR A 138 14.787 -5.923 -4.111 1.00 12.91 C ATOM 2101 CD1 TYR A 138 15.127 -4.725 -4.728 1.00 12.17 C ATOM 2102 CD2 TYR A 138 13.668 -6.605 -4.576 1.00 12.92 C ATOM 2103 CE1 TYR A 138 14.377 -4.221 -5.772 1.00 11.46 C ATOM 2104 CE2 TYR A 138 12.912 -6.105 -5.622 1.00 12.20 C ATOM 2105 CZ TYR A 138 13.236 -4.915 -6.190 1.00 11.46 C ATOM 2106 OH TYR A 138 12.524 -4.415 -7.256 1.00 10.87 O ATOM 0 H TYR A 138 16.279 -7.502 -0.804 1.00 14.65 H new ATOM 0 HA TYR A 138 15.994 -4.908 -1.543 1.00 13.62 H new ATOM 0 HB2 TYR A 138 16.677 -6.364 -3.223 1.00 13.81 H new ATOM 0 HB3 TYR A 138 15.426 -7.540 -2.873 1.00 13.81 H new ATOM 0 HD1 TYR A 138 15.993 -4.179 -4.385 1.00 12.17 H new ATOM 0 HD2 TYR A 138 13.384 -7.539 -4.114 1.00 12.92 H new ATOM 0 HE1 TYR A 138 14.667 -3.302 -6.260 1.00 11.46 H new ATOM 0 HE2 TYR A 138 12.062 -6.663 -5.987 1.00 12.20 H new ATOM 0 HH TYR A 138 11.757 -4.997 -7.439 1.00 10.87 H new ATOM 2116 N GLU A 139 13.074 -6.106 -0.829 1.00 13.28 N ATOM 2117 CA GLU A 139 11.663 -5.764 -0.669 1.00 12.75 C ATOM 2118 C GLU A 139 11.475 -4.724 0.433 1.00 12.57 C ATOM 2119 O GLU A 139 10.907 -3.655 0.199 1.00 11.70 O ATOM 2120 CB GLU A 139 10.848 -7.018 -0.346 1.00 13.59 C ATOM 2121 CG GLU A 139 10.836 -8.040 -1.470 1.00 13.94 C ATOM 2122 CD GLU A 139 9.969 -9.243 -1.154 1.00 14.48 C ATOM 2123 OE1 GLU A 139 8.748 -9.180 -1.413 1.00 14.82 O ATOM 2124 OE2 GLU A 139 10.510 -10.248 -0.647 1.00 14.68 O ATOM 0 H GLU A 139 13.353 -6.976 -0.374 1.00 13.28 H new ATOM 0 HA GLU A 139 11.309 -5.339 -1.608 1.00 12.75 H new ATOM 0 HB2 GLU A 139 11.253 -7.483 0.553 1.00 13.59 H new ATOM 0 HB3 GLU A 139 9.822 -6.727 -0.120 1.00 13.59 H new ATOM 0 HG2 GLU A 139 10.475 -7.566 -2.383 1.00 13.94 H new ATOM 0 HG3 GLU A 139 11.856 -8.373 -1.665 1.00 13.94 H new ATOM 2131 N GLU A 140 11.961 -5.040 1.631 1.00 13.49 N ATOM 2132 CA GLU A 140 11.853 -4.129 2.766 1.00 13.65 C ATOM 2133 C GLU A 140 12.545 -2.807 2.449 1.00 13.01 C ATOM 2134 O GLU A 140 12.141 -1.746 2.926 1.00 12.80 O ATOM 2135 CB GLU A 140 12.475 -4.759 4.016 1.00 14.90 C ATOM 2136 CG GLU A 140 11.836 -6.077 4.427 1.00 15.69 C ATOM 2137 CD GLU A 140 12.684 -6.848 5.421 1.00 16.90 C ATOM 2138 OE1 GLU A 140 12.962 -6.306 6.512 1.00 17.46 O ATOM 2139 OE2 GLU A 140 13.064 -7.997 5.113 1.00 17.35 O ATOM 0 H GLU A 140 12.433 -5.920 1.840 1.00 13.49 H new ATOM 0 HA GLU A 140 10.797 -3.938 2.958 1.00 13.65 H new ATOM 0 HB2 GLU A 140 13.538 -4.922 3.838 1.00 14.90 H new ATOM 0 HB3 GLU A 140 12.395 -4.054 4.844 1.00 14.90 H new ATOM 0 HG2 GLU A 140 10.857 -5.882 4.864 1.00 15.69 H new ATOM 0 HG3 GLU A 140 11.673 -6.690 3.541 1.00 15.69 H new ATOM 2146 N PHE A 141 13.592 -2.890 1.634 1.00 12.87 N ATOM 2147 CA PHE A 141 14.355 -1.716 1.227 1.00 12.46 C ATOM 2148 C PHE A 141 13.519 -0.837 0.301 1.00 11.27 C ATOM 2149 O PHE A 141 13.326 0.350 0.564 1.00 11.00 O ATOM 2150 CB PHE A 141 15.644 -2.162 0.525 1.00 12.80 C ATOM 2151 CG PHE A 141 16.463 -1.034 -0.028 1.00 12.57 C ATOM 2152 CD1 PHE A 141 17.279 -0.279 0.799 1.00 12.17 C ATOM 2153 CD2 PHE A 141 16.419 -0.726 -1.378 1.00 12.93 C ATOM 2154 CE1 PHE A 141 18.033 0.757 0.291 1.00 12.17 C ATOM 2155 CE2 PHE A 141 17.171 0.308 -1.893 1.00 12.93 C ATOM 2156 CZ PHE A 141 17.980 1.058 -1.045 1.00 12.56 C ATOM 0 H PHE A 141 13.933 -3.767 1.240 1.00 12.87 H new ATOM 0 HA PHE A 141 14.614 -1.132 2.110 1.00 12.46 H new ATOM 0 HB2 PHE A 141 16.253 -2.726 1.231 1.00 12.80 H new ATOM 0 HB3 PHE A 141 15.386 -2.841 -0.287 1.00 12.80 H new ATOM 0 HD1 PHE A 141 17.325 -0.505 1.854 1.00 12.17 H new ATOM 0 HD2 PHE A 141 15.787 -1.304 -2.036 1.00 12.93 H new ATOM 0 HE1 PHE A 141 18.668 1.333 0.948 1.00 12.17 H new ATOM 0 HE2 PHE A 141 17.133 0.535 -2.948 1.00 12.93 H new ATOM 0 HZ PHE A 141 18.565 1.876 -1.439 1.00 12.56 H new ATOM 2166 N VAL A 142 13.034 -1.440 -0.778 1.00 10.70 N ATOM 2167 CA VAL A 142 12.198 -0.752 -1.758 1.00 9.58 C ATOM 2168 C VAL A 142 11.124 0.113 -1.091 1.00 9.23 C ATOM 2169 O VAL A 142 10.868 1.247 -1.510 1.00 8.50 O ATOM 2170 CB VAL A 142 11.519 -1.776 -2.698 1.00 9.36 C ATOM 2171 CG1 VAL A 142 10.203 -1.242 -3.245 1.00 8.32 C ATOM 2172 CG2 VAL A 142 12.452 -2.155 -3.835 1.00 9.69 C ATOM 0 H VAL A 142 13.209 -2.420 -0.999 1.00 10.70 H new ATOM 0 HA VAL A 142 12.852 -0.097 -2.333 1.00 9.58 H new ATOM 0 HB VAL A 142 11.299 -2.669 -2.113 1.00 9.36 H new ATOM 0 HG11 VAL A 142 9.753 -1.987 -3.901 1.00 8.32 H new ATOM 0 HG12 VAL A 142 9.525 -1.030 -2.418 1.00 8.32 H new ATOM 0 HG13 VAL A 142 10.387 -0.327 -3.807 1.00 8.32 H new ATOM 0 HG21 VAL A 142 11.958 -2.876 -4.486 1.00 9.69 H new ATOM 0 HG22 VAL A 142 12.708 -1.264 -4.408 1.00 9.69 H new ATOM 0 HG23 VAL A 142 13.361 -2.597 -3.428 1.00 9.69 H new ATOM 2182 N TRP A 143 10.500 -0.422 -0.051 1.00 9.94 N ATOM 2183 CA TRP A 143 9.445 0.304 0.641 1.00 9.97 C ATOM 2184 C TRP A 143 9.982 1.499 1.427 1.00 10.29 C ATOM 2185 O TRP A 143 9.553 2.629 1.208 1.00 9.82 O ATOM 2186 CB TRP A 143 8.685 -0.626 1.587 1.00 10.95 C ATOM 2187 CG TRP A 143 7.550 0.054 2.284 1.00 11.20 C ATOM 2188 CD1 TRP A 143 6.264 0.186 1.845 1.00 10.93 C ATOM 2189 CD2 TRP A 143 7.614 0.708 3.547 1.00 11.97 C ATOM 2190 NE1 TRP A 143 5.525 0.889 2.768 1.00 11.51 N ATOM 2191 CE2 TRP A 143 6.335 1.221 3.823 1.00 12.15 C ATOM 2192 CE3 TRP A 143 8.638 0.906 4.467 1.00 12.67 C ATOM 2193 CZ2 TRP A 143 6.056 1.926 4.992 1.00 13.01 C ATOM 2194 CZ3 TRP A 143 8.365 1.605 5.626 1.00 13.49 C ATOM 2195 CH2 TRP A 143 7.082 2.108 5.881 1.00 13.66 C ATOM 0 H TRP A 143 10.703 -1.347 0.329 1.00 9.94 H new ATOM 0 HA TRP A 143 8.770 0.683 -0.126 1.00 9.97 H new ATOM 0 HB2 TRP A 143 8.301 -1.476 1.022 1.00 10.95 H new ATOM 0 HB3 TRP A 143 9.376 -1.023 2.331 1.00 10.95 H new ATOM 0 HD1 TRP A 143 5.884 -0.203 0.912 1.00 10.93 H new ATOM 0 HE1 TRP A 143 4.536 1.125 2.682 1.00 11.51 H new ATOM 0 HE3 TRP A 143 9.629 0.520 4.278 1.00 12.67 H new ATOM 0 HZ2 TRP A 143 5.068 2.314 5.190 1.00 13.01 H new ATOM 0 HZ3 TRP A 143 9.152 1.767 6.347 1.00 13.49 H new ATOM 0 HH2 TRP A 143 6.899 2.650 6.797 1.00 13.66 H new ATOM 2206 N MET A 144 10.930 1.256 2.327 1.00 11.22 N ATOM 2207 CA MET A 144 11.474 2.325 3.165 1.00 11.83 C ATOM 2208 C MET A 144 12.161 3.431 2.363 1.00 11.29 C ATOM 2209 O MET A 144 12.310 4.545 2.860 1.00 11.65 O ATOM 2210 CB MET A 144 12.431 1.760 4.215 1.00 13.01 C ATOM 2211 CG MET A 144 13.709 1.172 3.648 1.00 13.05 C ATOM 2212 SD MET A 144 14.902 0.770 4.942 1.00 14.50 S ATOM 2213 CE MET A 144 16.141 -0.130 4.015 1.00 14.50 C ATOM 0 H MET A 144 11.337 0.336 2.496 1.00 11.22 H new ATOM 0 HA MET A 144 10.620 2.783 3.664 1.00 11.83 H new ATOM 0 HB2 MET A 144 12.691 2.553 4.916 1.00 13.01 H new ATOM 0 HB3 MET A 144 11.912 0.989 4.784 1.00 13.01 H new ATOM 0 HG2 MET A 144 13.473 0.272 3.080 1.00 13.05 H new ATOM 0 HG3 MET A 144 14.156 1.881 2.951 1.00 13.05 H new ATOM 0 HE1 MET A 144 16.847 -0.593 4.705 1.00 14.50 H new ATOM 0 HE2 MET A 144 15.658 -0.903 3.417 1.00 14.50 H new ATOM 0 HE3 MET A 144 16.674 0.557 3.357 1.00 14.50 H new ATOM 2223 N ILE A 145 12.576 3.138 1.134 1.00 10.61 N ATOM 2224 CA ILE A 145 13.242 4.148 0.312 1.00 10.28 C ATOM 2225 C ILE A 145 12.242 5.088 -0.351 1.00 9.33 C ATOM 2226 O ILE A 145 12.448 6.301 -0.374 1.00 9.45 O ATOM 2227 CB ILE A 145 14.132 3.522 -0.769 1.00 10.17 C ATOM 2228 CG1 ILE A 145 13.319 2.575 -1.643 1.00 9.32 C ATOM 2229 CG2 ILE A 145 15.301 2.801 -0.124 1.00 11.25 C ATOM 2230 CD1 ILE A 145 14.091 2.022 -2.822 1.00 9.30 C ATOM 0 H ILE A 145 12.467 2.226 0.690 1.00 10.61 H new ATOM 0 HA ILE A 145 13.871 4.718 0.996 1.00 10.28 H new ATOM 0 HB ILE A 145 14.526 4.312 -1.408 1.00 10.17 H new ATOM 0 HG12 ILE A 145 12.963 1.746 -1.032 1.00 9.32 H new ATOM 0 HG13 ILE A 145 12.438 3.101 -2.011 1.00 9.32 H new ATOM 0 HG21 ILE A 145 15.928 2.359 -0.898 1.00 11.25 H new ATOM 0 HG22 ILE A 145 15.889 3.510 0.459 1.00 11.25 H new ATOM 0 HG23 ILE A 145 14.927 2.015 0.532 1.00 11.25 H new ATOM 0 HD11 ILE A 145 13.448 1.356 -3.398 1.00 9.30 H new ATOM 0 HD12 ILE A 145 14.424 2.843 -3.456 1.00 9.30 H new ATOM 0 HD13 ILE A 145 14.957 1.467 -2.462 1.00 9.30 H new ATOM 2242 N SER A 146 11.160 4.534 -0.896 1.00 8.54 N ATOM 2243 CA SER A 146 10.144 5.356 -1.545 1.00 7.66 C ATOM 2244 C SER A 146 9.510 6.292 -0.531 1.00 8.22 C ATOM 2245 O SER A 146 8.830 7.255 -0.887 1.00 7.89 O ATOM 2246 CB SER A 146 9.068 4.480 -2.184 1.00 6.98 C ATOM 2247 OG SER A 146 8.003 5.266 -2.689 1.00 6.80 O ATOM 0 H SER A 146 10.967 3.532 -0.901 1.00 8.54 H new ATOM 0 HA SER A 146 10.624 5.943 -2.328 1.00 7.66 H new ATOM 0 HB2 SER A 146 9.505 3.893 -2.992 1.00 6.98 H new ATOM 0 HB3 SER A 146 8.685 3.774 -1.447 1.00 6.98 H new ATOM 0 HG SER A 146 7.367 5.457 -1.968 1.00 6.80 H new ATOM 2253 N GLN A 147 9.748 5.993 0.738 1.00 9.26 N ATOM 2254 CA GLN A 147 9.203 6.776 1.832 1.00 10.11 C ATOM 2255 C GLN A 147 10.328 7.365 2.680 1.00 11.05 C ATOM 2256 O GLN A 147 10.083 8.021 3.693 1.00 11.87 O ATOM 2257 CB GLN A 147 8.306 5.884 2.689 1.00 10.77 C ATOM 2258 CG GLN A 147 7.680 4.733 1.909 1.00 10.15 C ATOM 2259 CD GLN A 147 6.440 5.136 1.132 1.00 9.47 C ATOM 2260 OE1 GLN A 147 6.618 5.424 -0.154 1.00 10.00 O flip ATOM 2261 NE2 GLN A 147 5.334 5.168 1.675 1.00 8.44 N flip ATOM 0 H GLN A 147 10.322 5.204 1.035 1.00 9.26 H new ATOM 0 HA GLN A 147 8.616 7.600 1.427 1.00 10.11 H new ATOM 0 HB2 GLN A 147 8.891 5.479 3.515 1.00 10.77 H new ATOM 0 HB3 GLN A 147 7.513 6.491 3.127 1.00 10.77 H new ATOM 0 HG2 GLN A 147 8.418 4.329 1.216 1.00 10.15 H new ATOM 0 HG3 GLN A 147 7.421 3.932 2.602 1.00 10.15 H new ATOM 0 HE21 GLN A 147 5.245 4.939 2.665 1.00 8.44 H new ATOM 0 HE22 GLN A 147 4.508 5.423 1.134 1.00 8.44 H new ATOM 2270 N LYS A 148 11.564 7.118 2.251 1.00 11.08 N ATOM 2271 CA LYS A 148 12.746 7.608 2.954 1.00 12.08 C ATOM 2272 C LYS A 148 12.823 9.131 2.898 1.00 12.24 C ATOM 2273 O LYS A 148 13.420 9.658 1.935 1.00 12.44 O ATOM 2274 CB LYS A 148 14.010 6.993 2.342 1.00 12.12 C ATOM 2275 CG LYS A 148 15.258 7.157 3.195 1.00 12.94 C ATOM 2276 CD LYS A 148 16.422 6.337 2.648 1.00 13.10 C ATOM 2277 CE LYS A 148 16.893 6.859 1.300 1.00 13.06 C ATOM 2278 NZ LYS A 148 17.334 8.279 1.376 1.00 13.68 N ATOM 2279 OXT LYS A 148 12.284 9.784 3.816 1.00 12.34 O ATOM 0 H LYS A 148 11.773 6.576 1.412 1.00 11.08 H new ATOM 0 HA LYS A 148 12.672 7.310 4.000 1.00 12.08 H new ATOM 0 HB2 LYS A 148 13.837 5.930 2.171 1.00 12.12 H new ATOM 0 HB3 LYS A 148 14.187 7.448 1.368 1.00 12.12 H new ATOM 0 HG2 LYS A 148 15.539 8.210 3.232 1.00 12.94 H new ATOM 0 HG3 LYS A 148 15.044 6.848 4.218 1.00 12.94 H new ATOM 0 HD2 LYS A 148 17.249 6.362 3.357 1.00 13.10 H new ATOM 0 HD3 LYS A 148 16.118 5.295 2.549 1.00 13.10 H new ATOM 0 HE2 LYS A 148 17.716 6.242 0.940 1.00 13.06 H new ATOM 0 HE3 LYS A 148 16.085 6.768 0.574 1.00 13.06 H new ATOM 0 HZ1 LYS A 148 18.110 8.438 0.702 1.00 13.68 H new ATOM 0 HZ2 LYS A 148 16.537 8.903 1.139 1.00 13.68 H new ATOM 0 HZ3 LYS A 148 17.664 8.489 2.340 1.00 13.68 H new