USER MOD reduce.3.24.130724 H: found=0, std=0, add=861, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 860 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 25 MET CE :methyl 164:sc= -0.442 (180deg=-1.02) USER MOD Set 1.2: B 137 TYR OH : rot -127:sc= 0.41 USER MOD Set 2.1: A 38 GLN : amide:sc= -0.026 X(o=-0.31,f=-0.68) USER MOD Set 2.2: A 42 GLN : amide:sc= -0.283 X(o=-0.31,f=-0.68) USER MOD Set 3.1: A 37 TYR OH : rot 110:sc= 0 USER MOD Set 3.2: B 125 MET CE :methyl 175:sc= -0.0131 (180deg=-0.0565) USER MOD Single : A 1 GLY N :NH3+ 149:sc= 0.0026 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 178:sc= 0.642 (180deg=0.641) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.178 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 162:sc= 0 (180deg=-0.113) USER MOD Single : A 28 GLN : amide:sc= -0.44 K(o=-0.44,f=-1.3) USER MOD Single : A 35 GLN : amide:sc= -0.0583 X(o=-0.058,f=-0.058) USER MOD Single : A 36 LYS NZ :NH3+ -158:sc= 0.00502 (180deg=-1.08) USER MOD Single : A 39 SER OG : rot -46:sc= 1.23 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 166:sc= -0.208 (180deg=-0.442) USER MOD Single : B 102 SER OG : rot 180:sc= 0 USER MOD Single : B 104 TYR OH : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0522) USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 111 THR OG1 : rot 96:sc= 1.41 USER MOD Single : B 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 128 GLN : amide:sc= -0.116 X(o=-0.12,f=-0.59) USER MOD Single : B 135 GLN : amide:sc= -0.203 X(o=-0.2,f=-0.47) USER MOD Single : B 136 LYS NZ :NH3+ 168:sc= 1.29 (180deg=1.13) USER MOD Single : B 138 GLN : amide:sc= 0.79 K(o=0.79,f=0) USER MOD Single : B 139 SER OG : rot 35:sc= 0.3 USER MOD Single : B 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 142 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.22) USER MOD Single : B 151 LYS NZ :NH3+ -123:sc= -2.31 (180deg=-3.45!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.907 -2.923 14.599 1.00 0.00 N ATOM 2 CA GLY A 1 -17.774 -3.627 13.652 1.00 0.00 C ATOM 3 C GLY A 1 -17.305 -3.344 12.245 1.00 0.00 C ATOM 4 O GLY A 1 -17.150 -2.182 11.865 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.455 -2.661 15.443 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.120 -3.543 14.876 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.529 -2.064 14.151 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.751 -4.699 13.847 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.807 -3.303 13.776 1.00 0.00 H new ATOM 8 N SER A 2 -17.032 -4.401 11.486 1.00 0.00 N ATOM 9 CA SER A 2 -16.561 -4.347 10.105 1.00 0.00 C ATOM 10 C SER A 2 -17.558 -5.064 9.186 1.00 0.00 C ATOM 11 O SER A 2 -17.188 -5.596 8.140 1.00 0.00 O ATOM 12 CB SER A 2 -15.156 -4.952 10.044 1.00 0.00 C ATOM 13 OG SER A 2 -14.266 -4.248 10.898 1.00 0.00 O ATOM 0 H SER A 2 -17.137 -5.356 11.829 1.00 0.00 H new ATOM 0 HA SER A 2 -16.498 -3.317 9.754 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.194 -6.001 10.337 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.786 -4.920 9.019 1.00 0.00 H new ATOM 0 HG SER A 2 -13.374 -4.652 10.846 1.00 0.00 H new ATOM 19 N ASP A 3 -18.815 -5.124 9.612 1.00 0.00 N ATOM 20 CA ASP A 3 -19.933 -5.748 8.936 1.00 0.00 C ATOM 21 C ASP A 3 -20.497 -4.701 7.974 1.00 0.00 C ATOM 22 O ASP A 3 -21.035 -3.686 8.424 1.00 0.00 O ATOM 23 CB ASP A 3 -21.019 -6.173 9.950 1.00 0.00 C ATOM 24 CG ASP A 3 -20.540 -6.959 11.177 1.00 0.00 C ATOM 25 OD1 ASP A 3 -19.719 -6.432 11.966 1.00 0.00 O ATOM 26 OD2 ASP A 3 -21.100 -8.041 11.457 1.00 0.00 O ATOM 0 H ASP A 3 -19.092 -4.707 10.501 1.00 0.00 H new ATOM 0 HA ASP A 3 -19.613 -6.646 8.408 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -21.531 -5.276 10.298 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -21.758 -6.778 9.425 1.00 0.00 H new ATOM 31 N TYR A 4 -20.354 -4.899 6.664 1.00 0.00 N ATOM 32 CA TYR A 4 -20.847 -3.998 5.613 1.00 0.00 C ATOM 33 C TYR A 4 -21.947 -4.679 4.782 1.00 0.00 C ATOM 34 O TYR A 4 -22.453 -4.100 3.825 1.00 0.00 O ATOM 35 CB TYR A 4 -19.686 -3.480 4.745 1.00 0.00 C ATOM 36 CG TYR A 4 -18.781 -2.458 5.415 1.00 0.00 C ATOM 37 CD1 TYR A 4 -17.666 -2.902 6.152 1.00 0.00 C ATOM 38 CD2 TYR A 4 -19.040 -1.072 5.310 1.00 0.00 C ATOM 39 CE1 TYR A 4 -16.832 -1.985 6.815 1.00 0.00 C ATOM 40 CE2 TYR A 4 -18.206 -0.155 5.974 1.00 0.00 C ATOM 41 CZ TYR A 4 -17.107 -0.604 6.738 1.00 0.00 C ATOM 42 OH TYR A 4 -16.312 0.287 7.390 1.00 0.00 O ATOM 0 H TYR A 4 -19.876 -5.718 6.288 1.00 0.00 H new ATOM 0 HA TYR A 4 -21.301 -3.126 6.084 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -19.079 -4.330 4.434 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -20.100 -3.036 3.840 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -17.449 -3.959 6.208 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -19.875 -0.719 4.722 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -15.983 -2.337 7.382 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -18.408 0.903 5.899 1.00 0.00 H new ATOM 0 HH TYR A 4 -16.641 1.196 7.231 1.00 0.00 H new ATOM 52 N GLU A 5 -22.358 -5.897 5.142 1.00 0.00 N ATOM 53 CA GLU A 5 -23.402 -6.645 4.445 1.00 0.00 C ATOM 54 C GLU A 5 -24.718 -5.854 4.394 1.00 0.00 C ATOM 55 O GLU A 5 -25.394 -5.828 3.365 1.00 0.00 O ATOM 56 CB GLU A 5 -23.572 -8.020 5.111 1.00 0.00 C ATOM 57 CG GLU A 5 -23.967 -7.977 6.606 1.00 0.00 C ATOM 58 CD GLU A 5 -23.989 -9.358 7.273 1.00 0.00 C ATOM 59 OE1 GLU A 5 -23.626 -10.363 6.624 1.00 0.00 O ATOM 60 OE2 GLU A 5 -24.361 -9.454 8.464 1.00 0.00 O ATOM 0 H GLU A 5 -21.967 -6.398 5.940 1.00 0.00 H new ATOM 0 HA GLU A 5 -23.103 -6.801 3.408 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -24.332 -8.580 4.566 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -22.638 -8.573 5.013 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -23.266 -7.335 7.140 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -24.953 -7.521 6.700 1.00 0.00 H new ATOM 67 N PHE A 6 -25.022 -5.124 5.468 1.00 0.00 N ATOM 68 CA PHE A 6 -26.195 -4.290 5.701 1.00 0.00 C ATOM 69 C PHE A 6 -26.358 -3.152 4.697 1.00 0.00 C ATOM 70 O PHE A 6 -27.402 -2.499 4.691 1.00 0.00 O ATOM 71 CB PHE A 6 -26.094 -3.719 7.122 1.00 0.00 C ATOM 72 CG PHE A 6 -26.041 -4.797 8.182 1.00 0.00 C ATOM 73 CD1 PHE A 6 -27.179 -5.585 8.441 1.00 0.00 C ATOM 74 CD2 PHE A 6 -24.835 -5.058 8.858 1.00 0.00 C ATOM 75 CE1 PHE A 6 -27.115 -6.629 9.378 1.00 0.00 C ATOM 76 CE2 PHE A 6 -24.774 -6.110 9.784 1.00 0.00 C ATOM 77 CZ PHE A 6 -25.911 -6.892 10.050 1.00 0.00 C ATOM 0 H PHE A 6 -24.392 -5.102 6.270 1.00 0.00 H new ATOM 0 HA PHE A 6 -27.076 -4.920 5.576 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -25.202 -3.097 7.197 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -26.950 -3.071 7.311 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -28.103 -5.386 7.918 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -23.962 -4.452 8.665 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -27.990 -7.228 9.581 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -23.847 -6.320 10.296 1.00 0.00 H new ATOM 0 HZ PHE A 6 -25.858 -7.695 10.771 1.00 0.00 H new ATOM 87 N LEU A 7 -25.347 -2.895 3.862 1.00 0.00 N ATOM 88 CA LEU A 7 -25.385 -1.845 2.856 1.00 0.00 C ATOM 89 C LEU A 7 -26.490 -2.098 1.837 1.00 0.00 C ATOM 90 O LEU A 7 -26.846 -1.171 1.117 1.00 0.00 O ATOM 91 CB LEU A 7 -24.040 -1.747 2.121 1.00 0.00 C ATOM 92 CG LEU A 7 -22.899 -1.128 2.945 1.00 0.00 C ATOM 93 CD1 LEU A 7 -21.611 -1.253 2.127 1.00 0.00 C ATOM 94 CD2 LEU A 7 -23.177 0.332 3.308 1.00 0.00 C ATOM 0 H LEU A 7 -24.472 -3.419 3.871 1.00 0.00 H new ATOM 0 HA LEU A 7 -25.586 -0.907 3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -23.741 -2.746 1.805 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -24.179 -1.155 1.216 1.00 0.00 H new ATOM 0 HG LEU A 7 -22.805 -1.662 3.891 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -20.781 -0.821 2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -21.407 -2.305 1.929 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -21.727 -0.722 1.182 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -22.344 0.727 3.890 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -23.293 0.918 2.396 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -24.092 0.393 3.897 1.00 0.00 H new ATOM 106 N LYS A 8 -27.023 -3.324 1.753 1.00 0.00 N ATOM 107 CA LYS A 8 -28.095 -3.628 0.805 1.00 0.00 C ATOM 108 C LYS A 8 -29.334 -2.757 1.054 1.00 0.00 C ATOM 109 O LYS A 8 -30.041 -2.462 0.097 1.00 0.00 O ATOM 110 CB LYS A 8 -28.437 -5.128 0.830 1.00 0.00 C ATOM 111 CG LYS A 8 -27.316 -6.081 0.380 1.00 0.00 C ATOM 112 CD LYS A 8 -26.771 -5.758 -1.015 1.00 0.00 C ATOM 113 CE LYS A 8 -25.596 -6.628 -1.460 1.00 0.00 C ATOM 114 NZ LYS A 8 -25.875 -8.074 -1.509 1.00 0.00 N ATOM 0 H LYS A 8 -26.730 -4.114 2.327 1.00 0.00 H new ATOM 0 HA LYS A 8 -27.736 -3.386 -0.195 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -28.730 -5.397 1.845 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -29.306 -5.293 0.193 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -26.500 -6.037 1.101 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -27.693 -7.104 0.388 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -27.579 -5.864 -1.739 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -26.460 -4.713 -1.036 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -25.276 -6.301 -2.449 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -24.760 -6.457 -0.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -25.033 -8.579 -1.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -26.117 -8.413 -0.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -26.672 -8.252 -2.153 1.00 0.00 H new ATOM 128 N SER A 9 -29.557 -2.287 2.285 1.00 0.00 N ATOM 129 CA SER A 9 -30.691 -1.438 2.638 1.00 0.00 C ATOM 130 C SER A 9 -30.268 0.027 2.848 1.00 0.00 C ATOM 131 O SER A 9 -30.995 0.793 3.488 1.00 0.00 O ATOM 132 CB SER A 9 -31.410 -2.025 3.857 1.00 0.00 C ATOM 133 OG SER A 9 -31.849 -3.344 3.591 1.00 0.00 O ATOM 0 H SER A 9 -28.943 -2.491 3.074 1.00 0.00 H new ATOM 0 HA SER A 9 -31.394 -1.422 1.805 1.00 0.00 H new ATOM 0 HB2 SER A 9 -30.739 -2.026 4.716 1.00 0.00 H new ATOM 0 HB3 SER A 9 -32.263 -1.398 4.119 1.00 0.00 H new ATOM 0 HG SER A 9 -32.304 -3.703 4.381 1.00 0.00 H new ATOM 139 N TRP A 10 -29.043 0.413 2.468 1.00 0.00 N ATOM 140 CA TRP A 10 -28.578 1.792 2.607 1.00 0.00 C ATOM 141 C TRP A 10 -29.008 2.522 1.331 1.00 0.00 C ATOM 142 O TRP A 10 -29.152 1.909 0.270 1.00 0.00 O ATOM 143 CB TRP A 10 -27.055 1.856 2.813 1.00 0.00 C ATOM 144 CG TRP A 10 -26.525 1.806 4.227 1.00 0.00 C ATOM 145 CD1 TRP A 10 -25.411 2.458 4.634 1.00 0.00 C ATOM 146 CD2 TRP A 10 -27.010 1.103 5.423 1.00 0.00 C ATOM 147 NE1 TRP A 10 -25.173 2.214 5.968 1.00 0.00 N ATOM 148 CE2 TRP A 10 -26.108 1.361 6.499 1.00 0.00 C ATOM 149 CE3 TRP A 10 -28.107 0.271 5.732 1.00 0.00 C ATOM 150 CZ2 TRP A 10 -26.251 0.788 7.773 1.00 0.00 C ATOM 151 CZ3 TRP A 10 -28.281 -0.293 7.009 1.00 0.00 C ATOM 152 CH2 TRP A 10 -27.338 -0.064 8.022 1.00 0.00 C ATOM 0 H TRP A 10 -28.354 -0.219 2.059 1.00 0.00 H new ATOM 0 HA TRP A 10 -29.012 2.264 3.488 1.00 0.00 H new ATOM 0 HB2 TRP A 10 -26.609 1.029 2.260 1.00 0.00 H new ATOM 0 HB3 TRP A 10 -26.695 2.777 2.354 1.00 0.00 H new ATOM 0 HD1 TRP A 10 -24.796 3.081 4.002 1.00 0.00 H new ATOM 0 HE1 TRP A 10 -24.399 2.617 6.496 1.00 0.00 H new ATOM 0 HE3 TRP A 10 -28.836 0.060 4.964 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 -25.533 1.000 8.552 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 -29.147 -0.907 7.211 1.00 0.00 H new ATOM 0 HH2 TRP A 10 -27.448 -0.539 8.986 1.00 0.00 H new ATOM 163 N THR A 11 -29.244 3.831 1.416 1.00 0.00 N ATOM 164 CA THR A 11 -29.643 4.585 0.234 1.00 0.00 C ATOM 165 C THR A 11 -28.474 4.639 -0.744 1.00 0.00 C ATOM 166 O THR A 11 -27.317 4.402 -0.373 1.00 0.00 O ATOM 167 CB THR A 11 -30.055 6.027 0.589 1.00 0.00 C ATOM 168 OG1 THR A 11 -28.964 6.728 1.144 1.00 0.00 O ATOM 169 CG2 THR A 11 -31.254 6.075 1.524 1.00 0.00 C ATOM 0 H THR A 11 -29.167 4.379 2.273 1.00 0.00 H new ATOM 0 HA THR A 11 -30.501 4.081 -0.210 1.00 0.00 H new ATOM 0 HB THR A 11 -30.356 6.513 -0.339 1.00 0.00 H new ATOM 0 HG1 THR A 11 -29.240 7.643 1.363 1.00 0.00 H new ATOM 0 HG21 THR A 11 -31.503 7.113 1.743 1.00 0.00 H new ATOM 0 HG22 THR A 11 -32.106 5.590 1.048 1.00 0.00 H new ATOM 0 HG23 THR A 11 -31.013 5.556 2.452 1.00 0.00 H new ATOM 177 N VAL A 12 -28.767 5.028 -1.988 1.00 0.00 N ATOM 178 CA VAL A 12 -27.725 5.164 -2.986 1.00 0.00 C ATOM 179 C VAL A 12 -26.653 6.145 -2.492 1.00 0.00 C ATOM 180 O VAL A 12 -25.475 5.930 -2.752 1.00 0.00 O ATOM 181 CB VAL A 12 -28.345 5.574 -4.334 1.00 0.00 C ATOM 182 CG1 VAL A 12 -28.752 7.049 -4.450 1.00 0.00 C ATOM 183 CG2 VAL A 12 -27.381 5.172 -5.449 1.00 0.00 C ATOM 0 H VAL A 12 -29.707 5.250 -2.317 1.00 0.00 H new ATOM 0 HA VAL A 12 -27.226 4.208 -3.145 1.00 0.00 H new ATOM 0 HB VAL A 12 -29.292 5.042 -4.421 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -29.177 7.233 -5.437 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -29.493 7.283 -3.686 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -27.875 7.681 -4.310 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -27.803 5.454 -6.414 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -26.428 5.681 -5.307 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -27.224 4.094 -5.423 1.00 0.00 H new ATOM 193 N GLU A 13 -27.028 7.203 -1.765 1.00 0.00 N ATOM 194 CA GLU A 13 -26.052 8.159 -1.274 1.00 0.00 C ATOM 195 C GLU A 13 -25.229 7.561 -0.139 1.00 0.00 C ATOM 196 O GLU A 13 -24.003 7.629 -0.162 1.00 0.00 O ATOM 197 CB GLU A 13 -26.733 9.438 -0.780 1.00 0.00 C ATOM 198 CG GLU A 13 -27.468 10.200 -1.888 1.00 0.00 C ATOM 199 CD GLU A 13 -27.581 11.677 -1.514 1.00 0.00 C ATOM 200 OE1 GLU A 13 -28.090 11.990 -0.418 1.00 0.00 O ATOM 201 OE2 GLU A 13 -27.039 12.525 -2.262 1.00 0.00 O ATOM 0 H GLU A 13 -27.993 7.411 -1.510 1.00 0.00 H new ATOM 0 HA GLU A 13 -25.393 8.405 -2.107 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -27.442 9.183 0.008 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -25.983 10.092 -0.335 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -26.932 10.094 -2.831 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -28.461 9.776 -2.036 1.00 0.00 H new ATOM 208 N ASP A 14 -25.901 6.975 0.855 1.00 0.00 N ATOM 209 CA ASP A 14 -25.255 6.387 2.032 1.00 0.00 C ATOM 210 C ASP A 14 -24.237 5.332 1.631 1.00 0.00 C ATOM 211 O ASP A 14 -23.165 5.214 2.236 1.00 0.00 O ATOM 212 CB ASP A 14 -26.291 5.754 2.982 1.00 0.00 C ATOM 213 CG ASP A 14 -26.569 6.570 4.240 1.00 0.00 C ATOM 214 OD1 ASP A 14 -26.908 7.774 4.151 1.00 0.00 O ATOM 215 OD2 ASP A 14 -26.445 6.003 5.348 1.00 0.00 O ATOM 0 H ASP A 14 -26.918 6.894 0.866 1.00 0.00 H new ATOM 0 HA ASP A 14 -24.744 7.198 2.551 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -27.226 5.614 2.440 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -25.941 4.764 3.275 1.00 0.00 H new ATOM 220 N LEU A 15 -24.579 4.534 0.620 1.00 0.00 N ATOM 221 CA LEU A 15 -23.693 3.501 0.140 1.00 0.00 C ATOM 222 C LEU A 15 -22.600 4.120 -0.749 1.00 0.00 C ATOM 223 O LEU A 15 -21.423 3.802 -0.556 1.00 0.00 O ATOM 224 CB LEU A 15 -24.494 2.340 -0.500 1.00 0.00 C ATOM 225 CG LEU A 15 -24.844 2.534 -1.986 1.00 0.00 C ATOM 226 CD1 LEU A 15 -23.655 2.149 -2.875 1.00 0.00 C ATOM 227 CD2 LEU A 15 -26.076 1.737 -2.418 1.00 0.00 C ATOM 0 H LEU A 15 -25.468 4.592 0.123 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.162 3.036 0.971 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -23.919 1.420 -0.395 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -25.419 2.204 0.061 1.00 0.00 H new ATOM 0 HG LEU A 15 -25.076 3.592 -2.108 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.922 2.293 -3.922 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -22.799 2.777 -2.629 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -23.398 1.103 -2.706 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -26.272 1.915 -3.475 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -25.897 0.674 -2.256 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -26.938 2.053 -1.831 1.00 0.00 H new ATOM 239 N GLN A 16 -22.941 5.005 -1.697 1.00 0.00 N ATOM 240 CA GLN A 16 -21.978 5.606 -2.614 1.00 0.00 C ATOM 241 C GLN A 16 -20.926 6.453 -1.898 1.00 0.00 C ATOM 242 O GLN A 16 -19.771 6.453 -2.316 1.00 0.00 O ATOM 243 CB GLN A 16 -22.689 6.385 -3.725 1.00 0.00 C ATOM 244 CG GLN A 16 -21.681 6.809 -4.792 1.00 0.00 C ATOM 245 CD GLN A 16 -22.361 7.523 -5.947 1.00 0.00 C ATOM 246 OE1 GLN A 16 -22.510 8.740 -5.910 1.00 0.00 O ATOM 247 NE2 GLN A 16 -22.790 6.820 -6.983 1.00 0.00 N ATOM 0 H GLN A 16 -23.899 5.322 -1.845 1.00 0.00 H new ATOM 0 HA GLN A 16 -21.430 4.788 -3.081 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -23.467 5.767 -4.173 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -23.180 7.264 -3.307 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -20.933 7.465 -4.347 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -21.154 5.931 -5.165 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -22.660 5.808 -7.002 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -23.250 7.290 -7.763 1.00 0.00 H new ATOM 256 N LYS A 17 -21.265 7.131 -0.799 1.00 0.00 N ATOM 257 CA LYS A 17 -20.293 7.941 -0.053 1.00 0.00 C ATOM 258 C LYS A 17 -19.077 7.075 0.287 1.00 0.00 C ATOM 259 O LYS A 17 -17.937 7.510 0.132 1.00 0.00 O ATOM 260 CB LYS A 17 -20.963 8.551 1.199 1.00 0.00 C ATOM 261 CG LYS A 17 -21.446 9.998 0.991 1.00 0.00 C ATOM 262 CD LYS A 17 -22.484 10.223 -0.125 1.00 0.00 C ATOM 263 CE LYS A 17 -22.389 11.626 -0.727 1.00 0.00 C ATOM 264 NZ LYS A 17 -22.686 12.688 0.251 1.00 0.00 N ATOM 0 H LYS A 17 -22.205 7.137 -0.404 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.945 8.777 -0.660 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -21.812 7.930 1.486 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -20.256 8.528 2.028 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -21.872 10.354 1.929 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -20.577 10.621 0.779 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -22.337 9.482 -0.910 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -23.486 10.068 0.276 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -21.387 11.777 -1.128 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -23.082 11.705 -1.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -22.607 13.617 -0.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -23.652 12.564 0.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -22.009 12.634 1.039 1.00 0.00 H new ATOM 278 N ARG A 18 -19.298 5.824 0.711 1.00 0.00 N ATOM 279 CA ARG A 18 -18.197 4.922 1.032 1.00 0.00 C ATOM 280 C ARG A 18 -17.463 4.492 -0.243 1.00 0.00 C ATOM 281 O ARG A 18 -16.255 4.303 -0.172 1.00 0.00 O ATOM 282 CB ARG A 18 -18.693 3.684 1.788 1.00 0.00 C ATOM 283 CG ARG A 18 -19.289 3.974 3.171 1.00 0.00 C ATOM 284 CD ARG A 18 -19.882 2.708 3.789 1.00 0.00 C ATOM 285 NE ARG A 18 -20.293 2.925 5.180 1.00 0.00 N ATOM 286 CZ ARG A 18 -21.361 3.602 5.614 1.00 0.00 C ATOM 287 NH1 ARG A 18 -22.232 4.197 4.800 1.00 0.00 N ATOM 288 NH2 ARG A 18 -21.549 3.659 6.922 1.00 0.00 N ATOM 0 H ARG A 18 -20.226 5.420 0.838 1.00 0.00 H new ATOM 0 HA ARG A 18 -17.505 5.464 1.677 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -19.446 3.182 1.181 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -17.862 2.989 1.904 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -18.516 4.375 3.827 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -20.062 4.737 3.085 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -20.741 2.384 3.202 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -19.147 1.904 3.748 1.00 0.00 H new ATOM 0 HE ARG A 18 -19.697 2.513 5.897 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -22.101 4.149 3.790 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -23.030 4.701 5.187 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -20.893 3.198 7.552 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -22.350 4.164 7.301 1.00 0.00 H new ATOM 302 N LEU A 19 -18.148 4.315 -1.383 1.00 0.00 N ATOM 303 CA LEU A 19 -17.561 3.905 -2.673 1.00 0.00 C ATOM 304 C LEU A 19 -16.422 4.844 -3.050 1.00 0.00 C ATOM 305 O LEU A 19 -15.309 4.404 -3.357 1.00 0.00 O ATOM 306 CB LEU A 19 -18.638 3.907 -3.791 1.00 0.00 C ATOM 307 CG LEU A 19 -18.251 3.334 -5.170 1.00 0.00 C ATOM 308 CD1 LEU A 19 -17.562 4.360 -6.075 1.00 0.00 C ATOM 309 CD2 LEU A 19 -17.393 2.075 -5.066 1.00 0.00 C ATOM 0 H LEU A 19 -19.157 4.457 -1.437 1.00 0.00 H new ATOM 0 HA LEU A 19 -17.172 2.892 -2.567 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -19.499 3.347 -3.426 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -18.966 4.936 -3.937 1.00 0.00 H new ATOM 0 HG LEU A 19 -19.200 3.064 -5.633 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -17.315 3.895 -7.030 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -18.231 5.203 -6.244 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -16.648 4.712 -5.596 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -17.151 1.716 -6.066 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -16.472 2.306 -4.530 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -17.943 1.304 -4.527 1.00 0.00 H new ATOM 321 N LEU A 20 -16.741 6.136 -3.003 1.00 0.00 N ATOM 322 CA LEU A 20 -15.858 7.238 -3.301 1.00 0.00 C ATOM 323 C LEU A 20 -14.774 7.298 -2.237 1.00 0.00 C ATOM 324 O LEU A 20 -13.604 7.250 -2.580 1.00 0.00 O ATOM 325 CB LEU A 20 -16.680 8.534 -3.392 1.00 0.00 C ATOM 326 CG LEU A 20 -15.809 9.800 -3.358 1.00 0.00 C ATOM 327 CD1 LEU A 20 -14.786 9.866 -4.502 1.00 0.00 C ATOM 328 CD2 LEU A 20 -16.705 11.037 -3.435 1.00 0.00 C ATOM 0 H LEU A 20 -17.676 6.448 -2.741 1.00 0.00 H new ATOM 0 HA LEU A 20 -15.365 7.103 -4.264 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -17.262 8.525 -4.313 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -17.391 8.566 -2.566 1.00 0.00 H new ATOM 0 HG LEU A 20 -15.252 9.768 -2.422 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -14.205 10.784 -4.418 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -14.118 9.007 -4.442 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.309 9.854 -5.459 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -16.088 11.935 -3.411 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -17.277 11.015 -4.362 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -17.389 11.044 -2.587 1.00 0.00 H new ATOM 340 N ALA A 21 -15.140 7.338 -0.954 1.00 0.00 N ATOM 341 CA ALA A 21 -14.198 7.402 0.165 1.00 0.00 C ATOM 342 C ALA A 21 -13.160 6.278 0.114 1.00 0.00 C ATOM 343 O ALA A 21 -12.047 6.427 0.614 1.00 0.00 O ATOM 344 CB ALA A 21 -14.966 7.319 1.486 1.00 0.00 C ATOM 0 H ALA A 21 -16.116 7.327 -0.659 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.666 8.350 0.090 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.264 7.367 2.319 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -15.666 8.152 1.553 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -15.516 6.379 1.529 1.00 0.00 H new ATOM 350 N LEU A 22 -13.536 5.140 -0.469 1.00 0.00 N ATOM 351 CA LEU A 22 -12.686 3.967 -0.626 1.00 0.00 C ATOM 352 C LEU A 22 -11.465 4.319 -1.480 1.00 0.00 C ATOM 353 O LEU A 22 -10.444 3.646 -1.344 1.00 0.00 O ATOM 354 CB LEU A 22 -13.472 2.766 -1.200 1.00 0.00 C ATOM 355 CG LEU A 22 -13.581 1.522 -0.297 1.00 0.00 C ATOM 356 CD1 LEU A 22 -12.223 0.874 -0.063 1.00 0.00 C ATOM 357 CD2 LEU A 22 -14.243 1.788 1.058 1.00 0.00 C ATOM 0 H LEU A 22 -14.470 5.008 -0.856 1.00 0.00 H new ATOM 0 HA LEU A 22 -12.333 3.658 0.358 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -14.480 3.102 -1.441 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -13.003 2.467 -2.137 1.00 0.00 H new ATOM 0 HG LEU A 22 -14.229 0.843 -0.850 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -12.342 0.001 0.578 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -11.797 0.567 -1.018 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -11.557 1.589 0.419 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -14.281 0.862 1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -13.664 2.532 1.606 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -15.256 2.160 0.901 1.00 0.00 H new ATOM 369 N ASP A 23 -11.561 5.292 -2.394 1.00 0.00 N ATOM 370 CA ASP A 23 -10.440 5.713 -3.245 1.00 0.00 C ATOM 371 C ASP A 23 -9.311 6.357 -2.422 1.00 0.00 C ATOM 372 O ASP A 23 -8.244 5.744 -2.356 1.00 0.00 O ATOM 373 CB ASP A 23 -10.893 6.620 -4.408 1.00 0.00 C ATOM 374 CG ASP A 23 -11.277 5.833 -5.661 1.00 0.00 C ATOM 375 OD1 ASP A 23 -10.623 4.804 -5.968 1.00 0.00 O ATOM 376 OD2 ASP A 23 -12.303 6.165 -6.296 1.00 0.00 O ATOM 0 H ASP A 23 -12.422 5.812 -2.565 1.00 0.00 H new ATOM 0 HA ASP A 23 -10.034 4.808 -3.698 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -11.745 7.218 -4.085 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -10.090 7.316 -4.654 1.00 0.00 H new ATOM 381 N PRO A 24 -9.495 7.497 -1.720 1.00 0.00 N ATOM 382 CA PRO A 24 -8.413 8.102 -0.946 1.00 0.00 C ATOM 383 C PRO A 24 -7.975 7.216 0.221 1.00 0.00 C ATOM 384 O PRO A 24 -6.855 7.359 0.709 1.00 0.00 O ATOM 385 CB PRO A 24 -8.922 9.463 -0.472 1.00 0.00 C ATOM 386 CG PRO A 24 -10.429 9.269 -0.453 1.00 0.00 C ATOM 387 CD PRO A 24 -10.664 8.357 -1.657 1.00 0.00 C ATOM 0 HA PRO A 24 -7.521 8.219 -1.562 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -8.534 9.719 0.514 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -8.626 10.264 -1.149 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.767 8.809 0.476 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -10.961 10.215 -0.552 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -11.576 7.773 -1.536 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -10.776 8.936 -2.573 1.00 0.00 H new ATOM 395 N MET A 25 -8.847 6.304 0.670 1.00 0.00 N ATOM 396 CA MET A 25 -8.556 5.385 1.755 1.00 0.00 C ATOM 397 C MET A 25 -7.359 4.527 1.368 1.00 0.00 C ATOM 398 O MET A 25 -6.502 4.275 2.212 1.00 0.00 O ATOM 399 CB MET A 25 -9.770 4.488 2.029 1.00 0.00 C ATOM 400 CG MET A 25 -10.816 5.094 2.962 1.00 0.00 C ATOM 401 SD MET A 25 -10.657 4.607 4.697 1.00 0.00 S ATOM 402 CE MET A 25 -9.148 5.503 5.148 1.00 0.00 C ATOM 0 H MET A 25 -9.782 6.190 0.279 1.00 0.00 H new ATOM 0 HA MET A 25 -8.330 5.951 2.659 1.00 0.00 H new ATOM 0 HB2 MET A 25 -10.247 4.246 1.079 1.00 0.00 H new ATOM 0 HB3 MET A 25 -9.421 3.549 2.459 1.00 0.00 H new ATOM 0 HG2 MET A 25 -10.755 6.180 2.897 1.00 0.00 H new ATOM 0 HG3 MET A 25 -11.807 4.809 2.608 1.00 0.00 H new ATOM 0 HE1 MET A 25 -9.062 5.548 6.234 1.00 0.00 H new ATOM 0 HE2 MET A 25 -8.281 4.986 4.736 1.00 0.00 H new ATOM 0 HE3 MET A 25 -9.192 6.515 4.746 1.00 0.00 H new ATOM 412 N MET A 26 -7.370 3.941 0.165 1.00 0.00 N ATOM 413 CA MET A 26 -6.257 3.136 -0.292 1.00 0.00 C ATOM 414 C MET A 26 -5.093 4.022 -0.731 1.00 0.00 C ATOM 415 O MET A 26 -3.943 3.693 -0.459 1.00 0.00 O ATOM 416 CB MET A 26 -6.704 2.173 -1.394 1.00 0.00 C ATOM 417 CG MET A 26 -7.351 2.845 -2.601 1.00 0.00 C ATOM 418 SD MET A 26 -7.405 1.841 -4.099 1.00 0.00 S ATOM 419 CE MET A 26 -5.806 2.391 -4.719 1.00 0.00 C ATOM 0 H MET A 26 -8.140 4.015 -0.500 1.00 0.00 H new ATOM 0 HA MET A 26 -5.898 2.528 0.538 1.00 0.00 H new ATOM 0 HB2 MET A 26 -5.839 1.603 -1.733 1.00 0.00 H new ATOM 0 HB3 MET A 26 -7.410 1.459 -0.970 1.00 0.00 H new ATOM 0 HG2 MET A 26 -8.369 3.130 -2.336 1.00 0.00 H new ATOM 0 HG3 MET A 26 -6.809 3.765 -2.819 1.00 0.00 H new ATOM 0 HE1 MET A 26 -5.448 1.691 -5.474 1.00 0.00 H new ATOM 0 HE2 MET A 26 -5.909 3.382 -5.162 1.00 0.00 H new ATOM 0 HE3 MET A 26 -5.092 2.434 -3.897 1.00 0.00 H new ATOM 429 N GLU A 27 -5.381 5.140 -1.399 1.00 0.00 N ATOM 430 CA GLU A 27 -4.382 6.061 -1.913 1.00 0.00 C ATOM 431 C GLU A 27 -3.412 6.539 -0.845 1.00 0.00 C ATOM 432 O GLU A 27 -2.207 6.471 -1.082 1.00 0.00 O ATOM 433 CB GLU A 27 -5.079 7.237 -2.591 1.00 0.00 C ATOM 434 CG GLU A 27 -4.105 8.112 -3.384 1.00 0.00 C ATOM 435 CD GLU A 27 -4.886 8.885 -4.439 1.00 0.00 C ATOM 436 OE1 GLU A 27 -5.539 9.895 -4.084 1.00 0.00 O ATOM 437 OE2 GLU A 27 -4.944 8.386 -5.591 1.00 0.00 O ATOM 0 H GLU A 27 -6.338 5.431 -1.599 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.778 5.523 -2.643 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -5.853 6.861 -3.260 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -5.578 7.845 -1.836 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.588 8.802 -2.717 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.342 7.494 -3.857 1.00 0.00 H new ATOM 444 N GLN A 28 -3.931 6.985 0.303 1.00 0.00 N ATOM 445 CA GLN A 28 -3.122 7.481 1.402 1.00 0.00 C ATOM 446 C GLN A 28 -2.192 6.390 1.922 1.00 0.00 C ATOM 447 O GLN A 28 -0.987 6.599 2.036 1.00 0.00 O ATOM 448 CB GLN A 28 -4.062 7.968 2.525 1.00 0.00 C ATOM 449 CG GLN A 28 -3.350 8.614 3.727 1.00 0.00 C ATOM 450 CD GLN A 28 -2.671 7.622 4.669 1.00 0.00 C ATOM 451 OE1 GLN A 28 -3.309 6.701 5.167 1.00 0.00 O ATOM 452 NE2 GLN A 28 -1.384 7.785 4.921 1.00 0.00 N ATOM 0 H GLN A 28 -4.934 7.009 0.489 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.502 8.307 1.055 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.763 8.689 2.105 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.650 7.122 2.880 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.601 9.314 3.356 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -4.077 9.195 4.294 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -0.875 8.559 4.495 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -0.900 7.137 5.542 1.00 0.00 H new ATOM 461 N GLU A 29 -2.759 5.224 2.226 1.00 0.00 N ATOM 462 CA GLU A 29 -2.027 4.095 2.774 1.00 0.00 C ATOM 463 C GLU A 29 -0.917 3.650 1.812 1.00 0.00 C ATOM 464 O GLU A 29 0.229 3.479 2.239 1.00 0.00 O ATOM 465 CB GLU A 29 -3.023 2.970 3.111 1.00 0.00 C ATOM 466 CG GLU A 29 -4.162 3.370 4.079 1.00 0.00 C ATOM 467 CD GLU A 29 -3.865 3.255 5.578 1.00 0.00 C ATOM 468 OE1 GLU A 29 -3.169 2.308 6.004 1.00 0.00 O ATOM 469 OE2 GLU A 29 -4.466 4.013 6.377 1.00 0.00 O ATOM 0 H GLU A 29 -3.754 5.039 2.095 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.524 4.381 3.698 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.466 2.608 2.183 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.472 2.137 3.547 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.443 4.402 3.866 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -5.031 2.751 3.856 1.00 0.00 H new ATOM 476 N ILE A 30 -1.239 3.473 0.522 1.00 0.00 N ATOM 477 CA ILE A 30 -0.282 3.054 -0.493 1.00 0.00 C ATOM 478 C ILE A 30 0.759 4.142 -0.732 1.00 0.00 C ATOM 479 O ILE A 30 1.937 3.793 -0.786 1.00 0.00 O ATOM 480 CB ILE A 30 -0.985 2.603 -1.805 1.00 0.00 C ATOM 481 CG1 ILE A 30 -1.495 1.141 -1.704 1.00 0.00 C ATOM 482 CG2 ILE A 30 -0.045 2.665 -3.031 1.00 0.00 C ATOM 483 CD1 ILE A 30 -3.009 0.984 -1.785 1.00 0.00 C ATOM 0 H ILE A 30 -2.181 3.620 0.159 1.00 0.00 H new ATOM 0 HA ILE A 30 0.244 2.176 -0.118 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.815 3.298 -1.936 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.040 0.557 -2.504 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -1.150 0.715 -0.762 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.585 2.340 -3.920 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.303 3.688 -3.171 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.811 2.010 -2.867 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -3.270 -0.071 -1.705 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -3.476 1.536 -0.969 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.365 1.375 -2.738 1.00 0.00 H new ATOM 495 N GLU A 31 0.385 5.415 -0.925 1.00 0.00 N ATOM 496 CA GLU A 31 1.392 6.446 -1.174 1.00 0.00 C ATOM 497 C GLU A 31 2.360 6.527 -0.006 1.00 0.00 C ATOM 498 O GLU A 31 3.567 6.617 -0.223 1.00 0.00 O ATOM 499 CB GLU A 31 0.833 7.819 -1.593 1.00 0.00 C ATOM 500 CG GLU A 31 0.392 8.800 -0.494 1.00 0.00 C ATOM 501 CD GLU A 31 0.071 10.195 -1.054 1.00 0.00 C ATOM 502 OE1 GLU A 31 0.100 10.407 -2.291 1.00 0.00 O ATOM 503 OE2 GLU A 31 -0.183 11.124 -0.253 1.00 0.00 O ATOM 0 H GLU A 31 -0.580 5.745 -0.914 1.00 0.00 H new ATOM 0 HA GLU A 31 1.942 6.128 -2.060 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.593 8.316 -2.195 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.024 7.643 -2.243 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.487 8.403 0.013 1.00 0.00 H new ATOM 0 HG3 GLU A 31 1.181 8.883 0.254 1.00 0.00 H new ATOM 510 N GLU A 32 1.850 6.413 1.217 1.00 0.00 N ATOM 511 CA GLU A 32 2.670 6.462 2.404 1.00 0.00 C ATOM 512 C GLU A 32 3.651 5.272 2.390 1.00 0.00 C ATOM 513 O GLU A 32 4.771 5.419 2.870 1.00 0.00 O ATOM 514 CB GLU A 32 1.744 6.592 3.621 1.00 0.00 C ATOM 515 CG GLU A 32 2.504 6.885 4.915 1.00 0.00 C ATOM 516 CD GLU A 32 1.573 7.165 6.098 1.00 0.00 C ATOM 517 OE1 GLU A 32 0.626 6.388 6.355 1.00 0.00 O ATOM 518 OE2 GLU A 32 1.823 8.152 6.828 1.00 0.00 O ATOM 0 H GLU A 32 0.856 6.284 1.404 1.00 0.00 H new ATOM 0 HA GLU A 32 3.319 7.336 2.451 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.023 7.389 3.440 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.176 5.669 3.740 1.00 0.00 H new ATOM 0 HG2 GLU A 32 3.144 6.036 5.155 1.00 0.00 H new ATOM 0 HG3 GLU A 32 3.157 7.744 4.761 1.00 0.00 H new ATOM 525 N ILE A 33 3.304 4.105 1.825 1.00 0.00 N ATOM 526 CA ILE A 33 4.204 2.944 1.731 1.00 0.00 C ATOM 527 C ILE A 33 5.254 3.226 0.660 1.00 0.00 C ATOM 528 O ILE A 33 6.453 3.018 0.863 1.00 0.00 O ATOM 529 CB ILE A 33 3.456 1.636 1.351 1.00 0.00 C ATOM 530 CG1 ILE A 33 2.622 1.131 2.528 1.00 0.00 C ATOM 531 CG2 ILE A 33 4.446 0.514 0.975 1.00 0.00 C ATOM 532 CD1 ILE A 33 1.516 0.178 2.097 1.00 0.00 C ATOM 0 H ILE A 33 2.384 3.939 1.417 1.00 0.00 H new ATOM 0 HA ILE A 33 4.654 2.797 2.713 1.00 0.00 H new ATOM 0 HB ILE A 33 2.818 1.874 0.500 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.274 0.626 3.240 1.00 0.00 H new ATOM 0 HG13 ILE A 33 2.181 1.982 3.047 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.892 -0.388 0.714 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.047 0.830 0.122 1.00 0.00 H new ATOM 0 HG23 ILE A 33 5.099 0.306 1.822 1.00 0.00 H new ATOM 0 HD11 ILE A 33 0.956 -0.149 2.973 1.00 0.00 H new ATOM 0 HD12 ILE A 33 0.845 0.688 1.407 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.955 -0.689 1.602 1.00 0.00 H new ATOM 544 N ARG A 34 4.793 3.666 -0.509 1.00 0.00 N ATOM 545 CA ARG A 34 5.623 3.963 -1.663 1.00 0.00 C ATOM 546 C ARG A 34 6.725 4.916 -1.257 1.00 0.00 C ATOM 547 O ARG A 34 7.897 4.660 -1.536 1.00 0.00 O ATOM 548 CB ARG A 34 4.746 4.553 -2.777 1.00 0.00 C ATOM 549 CG ARG A 34 3.661 3.566 -3.253 1.00 0.00 C ATOM 550 CD ARG A 34 3.836 3.267 -4.729 1.00 0.00 C ATOM 551 NE ARG A 34 3.165 2.028 -5.144 1.00 0.00 N ATOM 552 CZ ARG A 34 3.553 1.288 -6.189 1.00 0.00 C ATOM 553 NH1 ARG A 34 4.442 1.775 -7.055 1.00 0.00 N ATOM 554 NH2 ARG A 34 3.036 0.074 -6.351 1.00 0.00 N ATOM 0 H ARG A 34 3.801 3.829 -0.679 1.00 0.00 H new ATOM 0 HA ARG A 34 6.088 3.053 -2.042 1.00 0.00 H new ATOM 0 HB2 ARG A 34 4.271 5.466 -2.417 1.00 0.00 H new ATOM 0 HB3 ARG A 34 5.375 4.833 -3.622 1.00 0.00 H new ATOM 0 HG2 ARG A 34 3.722 2.642 -2.678 1.00 0.00 H new ATOM 0 HG3 ARG A 34 2.672 3.988 -3.075 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.444 4.100 -5.312 1.00 0.00 H new ATOM 0 HD3 ARG A 34 4.899 3.192 -4.956 1.00 0.00 H new ATOM 0 HE ARG A 34 2.358 1.714 -4.605 1.00 0.00 H new ATOM 0 HH11 ARG A 34 4.825 2.711 -6.920 1.00 0.00 H new ATOM 0 HH12 ARG A 34 4.739 1.212 -7.852 1.00 0.00 H new ATOM 0 HH21 ARG A 34 2.352 -0.283 -5.683 1.00 0.00 H new ATOM 0 HH22 ARG A 34 3.323 -0.501 -7.143 1.00 0.00 H new ATOM 568 N GLN A 35 6.349 5.973 -0.552 1.00 0.00 N ATOM 569 CA GLN A 35 7.251 6.997 -0.073 1.00 0.00 C ATOM 570 C GLN A 35 8.210 6.434 0.978 1.00 0.00 C ATOM 571 O GLN A 35 9.427 6.595 0.843 1.00 0.00 O ATOM 572 CB GLN A 35 6.418 8.156 0.480 1.00 0.00 C ATOM 573 CG GLN A 35 5.673 8.875 -0.654 1.00 0.00 C ATOM 574 CD GLN A 35 6.611 9.697 -1.525 1.00 0.00 C ATOM 575 OE1 GLN A 35 7.324 10.574 -1.043 1.00 0.00 O ATOM 576 NE2 GLN A 35 6.670 9.442 -2.821 1.00 0.00 N ATOM 0 H GLN A 35 5.377 6.142 -0.292 1.00 0.00 H new ATOM 0 HA GLN A 35 7.870 7.362 -0.893 1.00 0.00 H new ATOM 0 HB2 GLN A 35 5.703 7.780 1.212 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.066 8.861 1.001 1.00 0.00 H new ATOM 0 HG2 GLN A 35 5.157 8.140 -1.271 1.00 0.00 H new ATOM 0 HG3 GLN A 35 4.909 9.527 -0.229 1.00 0.00 H new ATOM 0 HE21 GLN A 35 6.080 8.715 -3.225 1.00 0.00 H new ATOM 0 HE22 GLN A 35 7.306 9.972 -3.417 1.00 0.00 H new ATOM 585 N LYS A 36 7.688 5.727 1.992 1.00 0.00 N ATOM 586 CA LYS A 36 8.505 5.164 3.066 1.00 0.00 C ATOM 587 C LYS A 36 9.611 4.274 2.527 1.00 0.00 C ATOM 588 O LYS A 36 10.794 4.534 2.765 1.00 0.00 O ATOM 589 CB LYS A 36 7.618 4.495 4.137 1.00 0.00 C ATOM 590 CG LYS A 36 7.399 2.977 4.128 1.00 0.00 C ATOM 591 CD LYS A 36 6.629 2.475 5.355 1.00 0.00 C ATOM 592 CE LYS A 36 5.104 2.662 5.384 1.00 0.00 C ATOM 593 NZ LYS A 36 4.641 4.061 5.470 1.00 0.00 N ATOM 0 H LYS A 36 6.691 5.533 2.086 1.00 0.00 H new ATOM 0 HA LYS A 36 9.024 5.977 3.573 1.00 0.00 H new ATOM 0 HB2 LYS A 36 8.037 4.754 5.109 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.635 4.962 4.079 1.00 0.00 H new ATOM 0 HG2 LYS A 36 6.854 2.700 3.226 1.00 0.00 H new ATOM 0 HG3 LYS A 36 8.366 2.476 4.083 1.00 0.00 H new ATOM 0 HD2 LYS A 36 6.836 1.410 5.465 1.00 0.00 H new ATOM 0 HD3 LYS A 36 7.042 2.972 6.233 1.00 0.00 H new ATOM 0 HE2 LYS A 36 4.682 2.212 4.485 1.00 0.00 H new ATOM 0 HE3 LYS A 36 4.703 2.111 6.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 3.674 4.084 5.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 5.273 4.598 6.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 4.650 4.489 4.522 1.00 0.00 H new ATOM 607 N TYR A 37 9.244 3.259 1.751 1.00 0.00 N ATOM 608 CA TYR A 37 10.202 2.331 1.193 1.00 0.00 C ATOM 609 C TYR A 37 11.145 3.014 0.217 1.00 0.00 C ATOM 610 O TYR A 37 12.341 2.712 0.233 1.00 0.00 O ATOM 611 CB TYR A 37 9.455 1.145 0.580 1.00 0.00 C ATOM 612 CG TYR A 37 8.893 0.157 1.595 1.00 0.00 C ATOM 613 CD1 TYR A 37 9.615 -0.221 2.747 1.00 0.00 C ATOM 614 CD2 TYR A 37 7.627 -0.406 1.374 1.00 0.00 C ATOM 615 CE1 TYR A 37 9.078 -1.142 3.661 1.00 0.00 C ATOM 616 CE2 TYR A 37 7.079 -1.328 2.285 1.00 0.00 C ATOM 617 CZ TYR A 37 7.802 -1.701 3.435 1.00 0.00 C ATOM 618 OH TYR A 37 7.309 -2.619 4.308 1.00 0.00 O ATOM 0 H TYR A 37 8.276 3.063 1.496 1.00 0.00 H new ATOM 0 HA TYR A 37 10.843 1.949 1.987 1.00 0.00 H new ATOM 0 HB2 TYR A 37 8.636 1.525 -0.030 1.00 0.00 H new ATOM 0 HB3 TYR A 37 10.131 0.613 -0.089 1.00 0.00 H new ATOM 0 HD1 TYR A 37 10.592 0.203 2.928 1.00 0.00 H new ATOM 0 HD2 TYR A 37 7.066 -0.128 0.494 1.00 0.00 H new ATOM 0 HE1 TYR A 37 9.642 -1.423 4.538 1.00 0.00 H new ATOM 0 HE2 TYR A 37 6.102 -1.751 2.102 1.00 0.00 H new ATOM 0 HH TYR A 37 6.566 -2.226 4.811 1.00 0.00 H new ATOM 628 N GLN A 38 10.658 3.968 -0.581 1.00 0.00 N ATOM 629 CA GLN A 38 11.516 4.662 -1.525 1.00 0.00 C ATOM 630 C GLN A 38 12.627 5.402 -0.773 1.00 0.00 C ATOM 631 O GLN A 38 13.770 5.348 -1.221 1.00 0.00 O ATOM 632 CB GLN A 38 10.674 5.596 -2.411 1.00 0.00 C ATOM 633 CG GLN A 38 11.490 6.460 -3.376 1.00 0.00 C ATOM 634 CD GLN A 38 12.409 5.640 -4.281 1.00 0.00 C ATOM 635 OE1 GLN A 38 12.074 4.556 -4.754 1.00 0.00 O ATOM 636 NE2 GLN A 38 13.609 6.124 -4.519 1.00 0.00 N ATOM 0 H GLN A 38 9.684 4.270 -0.588 1.00 0.00 H new ATOM 0 HA GLN A 38 12.000 3.944 -2.187 1.00 0.00 H new ATOM 0 HB2 GLN A 38 9.972 4.994 -2.987 1.00 0.00 H new ATOM 0 HB3 GLN A 38 10.082 6.249 -1.770 1.00 0.00 H new ATOM 0 HG2 GLN A 38 10.810 7.046 -3.994 1.00 0.00 H new ATOM 0 HG3 GLN A 38 12.090 7.167 -2.803 1.00 0.00 H new ATOM 0 HE21 GLN A 38 13.883 7.024 -4.125 1.00 0.00 H new ATOM 0 HE22 GLN A 38 14.265 5.599 -5.098 1.00 0.00 H new ATOM 645 N SER A 39 12.341 6.015 0.385 1.00 0.00 N ATOM 646 CA SER A 39 13.359 6.724 1.168 1.00 0.00 C ATOM 647 C SER A 39 14.537 5.802 1.466 1.00 0.00 C ATOM 648 O SER A 39 15.692 6.216 1.392 1.00 0.00 O ATOM 649 CB SER A 39 12.724 7.335 2.436 1.00 0.00 C ATOM 650 OG SER A 39 12.464 6.414 3.492 1.00 0.00 O ATOM 0 H SER A 39 11.409 6.033 0.800 1.00 0.00 H new ATOM 0 HA SER A 39 13.759 7.556 0.588 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.384 8.117 2.812 1.00 0.00 H new ATOM 0 HB3 SER A 39 11.787 7.816 2.157 1.00 0.00 H new ATOM 0 HG SER A 39 12.038 5.610 3.127 1.00 0.00 H new ATOM 656 N LYS A 40 14.234 4.553 1.827 1.00 0.00 N ATOM 657 CA LYS A 40 15.231 3.543 2.126 1.00 0.00 C ATOM 658 C LYS A 40 15.886 2.983 0.857 1.00 0.00 C ATOM 659 O LYS A 40 17.045 2.572 0.909 1.00 0.00 O ATOM 660 CB LYS A 40 14.626 2.452 3.009 1.00 0.00 C ATOM 661 CG LYS A 40 13.937 2.935 4.293 1.00 0.00 C ATOM 662 CD LYS A 40 13.788 1.786 5.304 1.00 0.00 C ATOM 663 CE LYS A 40 13.164 0.543 4.652 1.00 0.00 C ATOM 664 NZ LYS A 40 12.766 -0.475 5.640 1.00 0.00 N ATOM 0 H LYS A 40 13.275 4.218 1.919 1.00 0.00 H new ATOM 0 HA LYS A 40 16.039 4.014 2.687 1.00 0.00 H new ATOM 0 HB2 LYS A 40 13.900 1.894 2.418 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.417 1.754 3.284 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.516 3.744 4.739 1.00 0.00 H new ATOM 0 HG3 LYS A 40 12.955 3.342 4.052 1.00 0.00 H new ATOM 0 HD2 LYS A 40 14.765 1.532 5.714 1.00 0.00 H new ATOM 0 HD3 LYS A 40 13.167 2.112 6.138 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.291 0.841 4.071 1.00 0.00 H new ATOM 0 HE3 LYS A 40 13.878 0.107 3.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.351 -1.292 5.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 13.601 -0.782 6.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.064 -0.070 6.292 1.00 0.00 H new ATOM 678 N ARG A 41 15.170 2.904 -0.273 1.00 0.00 N ATOM 679 CA ARG A 41 15.692 2.397 -1.546 1.00 0.00 C ATOM 680 C ARG A 41 16.713 3.369 -2.129 1.00 0.00 C ATOM 681 O ARG A 41 17.765 2.932 -2.578 1.00 0.00 O ATOM 682 CB ARG A 41 14.553 2.169 -2.566 1.00 0.00 C ATOM 683 CG ARG A 41 15.079 1.461 -3.822 1.00 0.00 C ATOM 684 CD ARG A 41 14.051 1.287 -4.944 1.00 0.00 C ATOM 685 NE ARG A 41 13.029 0.276 -4.631 1.00 0.00 N ATOM 686 CZ ARG A 41 12.601 -0.704 -5.444 1.00 0.00 C ATOM 687 NH1 ARG A 41 13.205 -1.013 -6.582 1.00 0.00 N ATOM 688 NH2 ARG A 41 11.526 -1.404 -5.120 1.00 0.00 N ATOM 0 H ARG A 41 14.194 3.196 -0.327 1.00 0.00 H new ATOM 0 HA ARG A 41 16.177 1.441 -1.347 1.00 0.00 H new ATOM 0 HB2 ARG A 41 13.764 1.571 -2.109 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.109 3.125 -2.841 1.00 0.00 H new ATOM 0 HG2 ARG A 41 15.927 2.025 -4.211 1.00 0.00 H new ATOM 0 HG3 ARG A 41 15.454 0.478 -3.537 1.00 0.00 H new ATOM 0 HD2 ARG A 41 13.563 2.243 -5.135 1.00 0.00 H new ATOM 0 HD3 ARG A 41 14.566 1.004 -5.862 1.00 0.00 H new ATOM 0 HE ARG A 41 12.603 0.324 -3.705 1.00 0.00 H new ATOM 0 HH11 ARG A 41 14.035 -0.497 -6.875 1.00 0.00 H new ATOM 0 HH12 ARG A 41 12.840 -1.767 -7.165 1.00 0.00 H new ATOM 0 HH21 ARG A 41 11.025 -1.199 -4.255 1.00 0.00 H new ATOM 0 HH22 ARG A 41 11.198 -2.149 -5.735 1.00 0.00 H new ATOM 702 N GLN A 42 16.412 4.662 -2.099 1.00 0.00 N ATOM 703 CA GLN A 42 17.233 5.748 -2.616 1.00 0.00 C ATOM 704 C GLN A 42 18.736 5.568 -2.333 1.00 0.00 C ATOM 705 O GLN A 42 19.498 5.423 -3.290 1.00 0.00 O ATOM 706 CB GLN A 42 16.632 7.102 -2.166 1.00 0.00 C ATOM 707 CG GLN A 42 17.242 8.306 -2.898 1.00 0.00 C ATOM 708 CD GLN A 42 17.052 8.167 -4.403 1.00 0.00 C ATOM 709 OE1 GLN A 42 15.929 8.004 -4.880 1.00 0.00 O ATOM 710 NE2 GLN A 42 18.123 8.090 -5.165 1.00 0.00 N ATOM 0 H GLN A 42 15.540 4.998 -1.690 1.00 0.00 H new ATOM 0 HA GLN A 42 17.201 5.732 -3.705 1.00 0.00 H new ATOM 0 HB2 GLN A 42 15.555 7.089 -2.336 1.00 0.00 H new ATOM 0 HB3 GLN A 42 16.784 7.222 -1.093 1.00 0.00 H new ATOM 0 HG2 GLN A 42 16.773 9.226 -2.550 1.00 0.00 H new ATOM 0 HG3 GLN A 42 18.304 8.381 -2.665 1.00 0.00 H new ATOM 0 HE21 GLN A 42 19.049 8.227 -4.759 1.00 0.00 H new ATOM 0 HE22 GLN A 42 18.027 7.894 -6.161 1.00 0.00 H new ATOM 719 N PRO A 43 19.189 5.498 -1.069 1.00 0.00 N ATOM 720 CA PRO A 43 20.601 5.333 -0.742 1.00 0.00 C ATOM 721 C PRO A 43 21.182 3.985 -1.186 1.00 0.00 C ATOM 722 O PRO A 43 22.400 3.872 -1.278 1.00 0.00 O ATOM 723 CB PRO A 43 20.692 5.489 0.779 1.00 0.00 C ATOM 724 CG PRO A 43 19.302 5.065 1.239 1.00 0.00 C ATOM 725 CD PRO A 43 18.423 5.641 0.152 1.00 0.00 C ATOM 0 HA PRO A 43 21.193 6.075 -1.278 1.00 0.00 H new ATOM 0 HB2 PRO A 43 21.471 4.857 1.206 1.00 0.00 H new ATOM 0 HB3 PRO A 43 20.920 6.515 1.069 1.00 0.00 H new ATOM 0 HG2 PRO A 43 19.208 3.981 1.309 1.00 0.00 H new ATOM 0 HG3 PRO A 43 19.056 5.470 2.221 1.00 0.00 H new ATOM 0 HD2 PRO A 43 17.475 5.107 0.087 1.00 0.00 H new ATOM 0 HD3 PRO A 43 18.187 6.687 0.349 1.00 0.00 H new ATOM 733 N ILE A 44 20.360 2.954 -1.407 1.00 0.00 N ATOM 734 CA ILE A 44 20.819 1.637 -1.838 1.00 0.00 C ATOM 735 C ILE A 44 21.245 1.730 -3.302 1.00 0.00 C ATOM 736 O ILE A 44 22.339 1.279 -3.634 1.00 0.00 O ATOM 737 CB ILE A 44 19.729 0.560 -1.613 1.00 0.00 C ATOM 738 CG1 ILE A 44 19.441 0.365 -0.113 1.00 0.00 C ATOM 739 CG2 ILE A 44 20.175 -0.794 -2.175 1.00 0.00 C ATOM 740 CD1 ILE A 44 18.237 -0.537 0.167 1.00 0.00 C ATOM 0 H ILE A 44 19.349 3.015 -1.290 1.00 0.00 H new ATOM 0 HA ILE A 44 21.675 1.327 -1.238 1.00 0.00 H new ATOM 0 HB ILE A 44 18.833 0.909 -2.126 1.00 0.00 H new ATOM 0 HG12 ILE A 44 20.323 -0.061 0.365 1.00 0.00 H new ATOM 0 HG13 ILE A 44 19.269 1.339 0.345 1.00 0.00 H new ATOM 0 HG21 ILE A 44 19.393 -1.534 -2.005 1.00 0.00 H new ATOM 0 HG22 ILE A 44 20.360 -0.701 -3.245 1.00 0.00 H new ATOM 0 HG23 ILE A 44 21.090 -1.112 -1.675 1.00 0.00 H new ATOM 0 HD11 ILE A 44 18.094 -0.629 1.244 1.00 0.00 H new ATOM 0 HD12 ILE A 44 17.344 -0.102 -0.282 1.00 0.00 H new ATOM 0 HD13 ILE A 44 18.414 -1.524 -0.261 1.00 0.00 H new ATOM 752 N LEU A 45 20.398 2.293 -4.173 1.00 0.00 N ATOM 753 CA LEU A 45 20.743 2.413 -5.595 1.00 0.00 C ATOM 754 C LEU A 45 21.947 3.326 -5.683 1.00 0.00 C ATOM 755 O LEU A 45 22.899 3.052 -6.407 1.00 0.00 O ATOM 756 CB LEU A 45 19.643 2.972 -6.518 1.00 0.00 C ATOM 757 CG LEU A 45 18.200 2.706 -6.101 1.00 0.00 C ATOM 758 CD1 LEU A 45 17.237 3.045 -7.241 1.00 0.00 C ATOM 759 CD2 LEU A 45 17.935 1.250 -5.685 1.00 0.00 C ATOM 0 H LEU A 45 19.483 2.667 -3.924 1.00 0.00 H new ATOM 0 HA LEU A 45 20.919 1.398 -5.952 1.00 0.00 H new ATOM 0 HB2 LEU A 45 19.781 4.050 -6.598 1.00 0.00 H new ATOM 0 HB3 LEU A 45 19.791 2.557 -7.515 1.00 0.00 H new ATOM 0 HG LEU A 45 18.033 3.345 -5.234 1.00 0.00 H new ATOM 0 HD11 LEU A 45 16.213 2.848 -6.923 1.00 0.00 H new ATOM 0 HD12 LEU A 45 17.340 4.098 -7.503 1.00 0.00 H new ATOM 0 HD13 LEU A 45 17.471 2.430 -8.110 1.00 0.00 H new ATOM 0 HD21 LEU A 45 16.888 1.137 -5.402 1.00 0.00 H new ATOM 0 HD22 LEU A 45 18.158 0.586 -6.520 1.00 0.00 H new ATOM 0 HD23 LEU A 45 18.570 0.992 -4.837 1.00 0.00 H new ATOM 771 N ASP A 46 21.914 4.397 -4.888 1.00 0.00 N ATOM 772 CA ASP A 46 22.998 5.350 -4.855 1.00 0.00 C ATOM 773 C ASP A 46 24.313 4.649 -4.473 1.00 0.00 C ATOM 774 O ASP A 46 25.366 4.930 -5.038 1.00 0.00 O ATOM 775 CB ASP A 46 22.641 6.470 -3.880 1.00 0.00 C ATOM 776 CG ASP A 46 23.706 7.553 -3.776 1.00 0.00 C ATOM 777 OD1 ASP A 46 24.348 7.903 -4.793 1.00 0.00 O ATOM 778 OD2 ASP A 46 23.844 8.105 -2.666 1.00 0.00 O ATOM 0 H ASP A 46 21.141 4.617 -4.260 1.00 0.00 H new ATOM 0 HA ASP A 46 23.146 5.787 -5.842 1.00 0.00 H new ATOM 0 HB2 ASP A 46 21.701 6.926 -4.192 1.00 0.00 H new ATOM 0 HB3 ASP A 46 22.474 6.040 -2.892 1.00 0.00 H new ATOM 783 N ALA A 47 24.259 3.695 -3.537 1.00 0.00 N ATOM 784 CA ALA A 47 25.416 2.944 -3.079 1.00 0.00 C ATOM 785 C ALA A 47 25.924 1.928 -4.103 1.00 0.00 C ATOM 786 O ALA A 47 27.137 1.835 -4.263 1.00 0.00 O ATOM 787 CB ALA A 47 25.106 2.273 -1.751 1.00 0.00 C ATOM 0 H ALA A 47 23.392 3.424 -3.073 1.00 0.00 H new ATOM 0 HA ALA A 47 26.227 3.660 -2.944 1.00 0.00 H new ATOM 0 HB1 ALA A 47 25.978 1.712 -1.414 1.00 0.00 H new ATOM 0 HB2 ALA A 47 24.854 3.032 -1.010 1.00 0.00 H new ATOM 0 HB3 ALA A 47 24.263 1.593 -1.875 1.00 0.00 H new ATOM 793 N ILE A 48 25.073 1.140 -4.773 1.00 0.00 N ATOM 794 CA ILE A 48 25.593 0.200 -5.774 1.00 0.00 C ATOM 795 C ILE A 48 26.231 0.984 -6.910 1.00 0.00 C ATOM 796 O ILE A 48 27.217 0.527 -7.480 1.00 0.00 O ATOM 797 CB ILE A 48 24.538 -0.800 -6.276 1.00 0.00 C ATOM 798 CG1 ILE A 48 25.166 -1.894 -7.158 1.00 0.00 C ATOM 799 CG2 ILE A 48 23.339 -0.150 -6.967 1.00 0.00 C ATOM 800 CD1 ILE A 48 24.354 -3.195 -7.140 1.00 0.00 C ATOM 0 H ILE A 48 24.061 1.132 -4.648 1.00 0.00 H new ATOM 0 HA ILE A 48 26.352 -0.418 -5.295 1.00 0.00 H new ATOM 0 HB ILE A 48 24.139 -1.269 -5.377 1.00 0.00 H new ATOM 0 HG12 ILE A 48 25.243 -1.531 -8.183 1.00 0.00 H new ATOM 0 HG13 ILE A 48 26.180 -2.097 -6.814 1.00 0.00 H new ATOM 0 HG21 ILE A 48 22.642 -0.923 -7.291 1.00 0.00 H new ATOM 0 HG22 ILE A 48 22.837 0.521 -6.270 1.00 0.00 H new ATOM 0 HG23 ILE A 48 23.681 0.416 -7.833 1.00 0.00 H new ATOM 0 HD11 ILE A 48 24.838 -3.935 -7.777 1.00 0.00 H new ATOM 0 HD12 ILE A 48 24.299 -3.575 -6.120 1.00 0.00 H new ATOM 0 HD13 ILE A 48 23.347 -3.001 -7.510 1.00 0.00 H new ATOM 812 N GLU A 49 25.692 2.157 -7.240 1.00 0.00 N ATOM 813 CA GLU A 49 26.254 2.974 -8.299 1.00 0.00 C ATOM 814 C GLU A 49 27.585 3.604 -7.866 1.00 0.00 C ATOM 815 O GLU A 49 28.294 4.173 -8.689 1.00 0.00 O ATOM 816 CB GLU A 49 25.237 3.997 -8.822 1.00 0.00 C ATOM 817 CG GLU A 49 24.095 3.316 -9.598 1.00 0.00 C ATOM 818 CD GLU A 49 24.589 2.352 -10.684 1.00 0.00 C ATOM 819 OE1 GLU A 49 25.577 2.638 -11.398 1.00 0.00 O ATOM 820 OE2 GLU A 49 24.011 1.251 -10.831 1.00 0.00 O ATOM 0 H GLU A 49 24.870 2.556 -6.787 1.00 0.00 H new ATOM 0 HA GLU A 49 26.485 2.326 -9.145 1.00 0.00 H new ATOM 0 HB2 GLU A 49 24.824 4.560 -7.985 1.00 0.00 H new ATOM 0 HB3 GLU A 49 25.741 4.713 -9.470 1.00 0.00 H new ATOM 0 HG2 GLU A 49 23.464 2.770 -8.897 1.00 0.00 H new ATOM 0 HG3 GLU A 49 23.471 4.082 -10.058 1.00 0.00 H new ATOM 827 N ALA A 50 27.911 3.574 -6.569 1.00 0.00 N ATOM 828 CA ALA A 50 29.158 4.105 -6.034 1.00 0.00 C ATOM 829 C ALA A 50 30.316 3.106 -6.231 1.00 0.00 C ATOM 830 O ALA A 50 31.443 3.393 -5.821 1.00 0.00 O ATOM 831 CB ALA A 50 28.975 4.462 -4.554 1.00 0.00 C ATOM 0 H ALA A 50 27.303 3.173 -5.855 1.00 0.00 H new ATOM 0 HA ALA A 50 29.419 5.011 -6.581 1.00 0.00 H new ATOM 0 HB1 ALA A 50 29.909 4.859 -4.157 1.00 0.00 H new ATOM 0 HB2 ALA A 50 28.191 5.213 -4.455 1.00 0.00 H new ATOM 0 HB3 ALA A 50 28.694 3.569 -3.996 1.00 0.00 H new ATOM 837 N LYS A 51 30.048 1.906 -6.763 1.00 0.00 N ATOM 838 CA LYS A 51 31.047 0.882 -7.013 1.00 0.00 C ATOM 839 C LYS A 51 31.719 1.087 -8.356 1.00 0.00 C ATOM 840 O LYS A 51 32.811 0.482 -8.455 1.00 0.00 O ATOM 841 CB LYS A 51 30.384 -0.502 -6.964 1.00 0.00 C ATOM 842 CG LYS A 51 30.263 -1.020 -5.536 1.00 0.00 C ATOM 843 CD LYS A 51 31.610 -1.368 -4.872 1.00 0.00 C ATOM 844 CE LYS A 51 32.567 -2.209 -5.739 1.00 0.00 C ATOM 845 NZ LYS A 51 33.390 -1.395 -6.671 1.00 0.00 N ATOM 0 H LYS A 51 29.106 1.623 -7.034 1.00 0.00 H new ATOM 0 HA LYS A 51 31.813 0.951 -6.241 1.00 0.00 H new ATOM 0 HB2 LYS A 51 29.394 -0.447 -7.416 1.00 0.00 H new ATOM 0 HB3 LYS A 51 30.967 -1.206 -7.558 1.00 0.00 H new ATOM 0 HG2 LYS A 51 29.756 -0.268 -4.931 1.00 0.00 H new ATOM 0 HG3 LYS A 51 29.631 -1.908 -5.536 1.00 0.00 H new ATOM 0 HD2 LYS A 51 32.113 -0.441 -4.598 1.00 0.00 H new ATOM 0 HD3 LYS A 51 31.412 -1.909 -3.947 1.00 0.00 H new ATOM 0 HE2 LYS A 51 33.228 -2.781 -5.087 1.00 0.00 H new ATOM 0 HE3 LYS A 51 31.986 -2.929 -6.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 34.166 -1.976 -7.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 32.796 -1.060 -7.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 33.785 -0.578 -6.163 1.00 0.00 H new TER 859 LYS A 51 ATOM 860 N GLY B 101 16.800 1.588 14.351 1.00 0.00 N ATOM 861 CA GLY B 101 17.488 2.706 13.706 1.00 0.00 C ATOM 862 C GLY B 101 16.927 2.959 12.319 1.00 0.00 C ATOM 863 O GLY B 101 16.342 2.065 11.702 1.00 0.00 O ATOM 0 HA2 GLY B 101 17.382 3.604 14.315 1.00 0.00 H new ATOM 0 HA3 GLY B 101 18.554 2.491 13.638 1.00 0.00 H new ATOM 867 N SER B 102 17.130 4.170 11.810 1.00 0.00 N ATOM 868 CA SER B 102 16.673 4.628 10.508 1.00 0.00 C ATOM 869 C SER B 102 17.809 5.165 9.633 1.00 0.00 C ATOM 870 O SER B 102 17.536 5.544 8.495 1.00 0.00 O ATOM 871 CB SER B 102 15.554 5.654 10.730 1.00 0.00 C ATOM 872 OG SER B 102 14.372 4.950 11.076 1.00 0.00 O ATOM 0 H SER B 102 17.642 4.890 12.320 1.00 0.00 H new ATOM 0 HA SER B 102 16.280 3.782 9.945 1.00 0.00 H new ATOM 0 HB2 SER B 102 15.828 6.350 11.523 1.00 0.00 H new ATOM 0 HB3 SER B 102 15.395 6.245 9.828 1.00 0.00 H new ATOM 0 HG SER B 102 13.643 5.588 11.224 1.00 0.00 H new ATOM 878 N ASP B 103 19.050 5.180 10.127 1.00 0.00 N ATOM 879 CA ASP B 103 20.217 5.655 9.391 1.00 0.00 C ATOM 880 C ASP B 103 20.687 4.562 8.430 1.00 0.00 C ATOM 881 O ASP B 103 20.910 3.426 8.857 1.00 0.00 O ATOM 882 CB ASP B 103 21.391 5.937 10.345 1.00 0.00 C ATOM 883 CG ASP B 103 21.174 7.109 11.295 1.00 0.00 C ATOM 884 OD1 ASP B 103 20.672 6.898 12.419 1.00 0.00 O ATOM 885 OD2 ASP B 103 21.602 8.246 10.983 1.00 0.00 O ATOM 0 H ASP B 103 19.272 4.855 11.068 1.00 0.00 H new ATOM 0 HA ASP B 103 19.930 6.565 8.864 1.00 0.00 H new ATOM 0 HB2 ASP B 103 21.586 5.041 10.934 1.00 0.00 H new ATOM 0 HB3 ASP B 103 22.285 6.129 9.752 1.00 0.00 H new ATOM 890 N TYR B 104 20.906 4.893 7.156 1.00 0.00 N ATOM 891 CA TYR B 104 21.385 3.958 6.133 1.00 0.00 C ATOM 892 C TYR B 104 22.527 4.557 5.298 1.00 0.00 C ATOM 893 O TYR B 104 23.029 3.866 4.420 1.00 0.00 O ATOM 894 CB TYR B 104 20.238 3.458 5.236 1.00 0.00 C ATOM 895 CG TYR B 104 19.253 2.503 5.889 1.00 0.00 C ATOM 896 CD1 TYR B 104 19.451 1.104 5.848 1.00 0.00 C ATOM 897 CD2 TYR B 104 18.111 3.023 6.525 1.00 0.00 C ATOM 898 CE1 TYR B 104 18.548 0.261 6.510 1.00 0.00 C ATOM 899 CE2 TYR B 104 17.186 2.174 7.159 1.00 0.00 C ATOM 900 CZ TYR B 104 17.408 0.779 7.158 1.00 0.00 C ATOM 901 OH TYR B 104 16.504 -0.073 7.722 1.00 0.00 O ATOM 0 H TYR B 104 20.753 5.836 6.798 1.00 0.00 H new ATOM 0 HA TYR B 104 21.789 3.094 6.660 1.00 0.00 H new ATOM 0 HB2 TYR B 104 19.686 4.323 4.869 1.00 0.00 H new ATOM 0 HB3 TYR B 104 20.672 2.964 4.367 1.00 0.00 H new ATOM 0 HD1 TYR B 104 20.291 0.688 5.311 1.00 0.00 H new ATOM 0 HD2 TYR B 104 17.942 4.090 6.526 1.00 0.00 H new ATOM 0 HE1 TYR B 104 18.729 -0.804 6.524 1.00 0.00 H new ATOM 0 HE2 TYR B 104 16.313 2.586 7.643 1.00 0.00 H new ATOM 0 HH TYR B 104 15.777 0.444 8.129 1.00 0.00 H new ATOM 911 N GLU B 105 23.026 5.762 5.602 1.00 0.00 N ATOM 912 CA GLU B 105 24.106 6.427 4.851 1.00 0.00 C ATOM 913 C GLU B 105 25.362 5.565 4.701 1.00 0.00 C ATOM 914 O GLU B 105 26.079 5.681 3.708 1.00 0.00 O ATOM 915 CB GLU B 105 24.485 7.756 5.533 1.00 0.00 C ATOM 916 CG GLU B 105 23.343 8.773 5.688 1.00 0.00 C ATOM 917 CD GLU B 105 22.923 9.453 4.381 1.00 0.00 C ATOM 918 OE1 GLU B 105 22.840 8.785 3.320 1.00 0.00 O ATOM 919 OE2 GLU B 105 22.601 10.663 4.439 1.00 0.00 O ATOM 0 H GLU B 105 22.687 6.314 6.390 1.00 0.00 H new ATOM 0 HA GLU B 105 23.715 6.605 3.849 1.00 0.00 H new ATOM 0 HB2 GLU B 105 24.887 7.534 6.522 1.00 0.00 H new ATOM 0 HB3 GLU B 105 25.287 8.222 4.960 1.00 0.00 H new ATOM 0 HG2 GLU B 105 22.477 8.267 6.115 1.00 0.00 H new ATOM 0 HG3 GLU B 105 23.649 9.539 6.401 1.00 0.00 H new ATOM 926 N PHE B 106 25.605 4.673 5.665 1.00 0.00 N ATOM 927 CA PHE B 106 26.734 3.750 5.698 1.00 0.00 C ATOM 928 C PHE B 106 26.711 2.781 4.519 1.00 0.00 C ATOM 929 O PHE B 106 27.696 2.078 4.304 1.00 0.00 O ATOM 930 CB PHE B 106 26.756 2.990 7.026 1.00 0.00 C ATOM 931 CG PHE B 106 26.955 3.911 8.207 1.00 0.00 C ATOM 932 CD1 PHE B 106 28.256 4.310 8.570 1.00 0.00 C ATOM 933 CD2 PHE B 106 25.843 4.432 8.892 1.00 0.00 C ATOM 934 CE1 PHE B 106 28.445 5.233 9.612 1.00 0.00 C ATOM 935 CE2 PHE B 106 26.037 5.354 9.930 1.00 0.00 C ATOM 936 CZ PHE B 106 27.333 5.761 10.289 1.00 0.00 C ATOM 0 H PHE B 106 24.993 4.573 6.475 1.00 0.00 H new ATOM 0 HA PHE B 106 27.648 4.338 5.612 1.00 0.00 H new ATOM 0 HB2 PHE B 106 25.820 2.445 7.146 1.00 0.00 H new ATOM 0 HB3 PHE B 106 27.556 2.250 7.006 1.00 0.00 H new ATOM 0 HD1 PHE B 106 29.110 3.906 8.046 1.00 0.00 H new ATOM 0 HD2 PHE B 106 24.844 4.123 8.620 1.00 0.00 H new ATOM 0 HE1 PHE B 106 29.443 5.536 9.892 1.00 0.00 H new ATOM 0 HE2 PHE B 106 25.184 5.754 10.458 1.00 0.00 H new ATOM 0 HZ PHE B 106 27.474 6.478 11.084 1.00 0.00 H new ATOM 946 N LEU B 107 25.612 2.731 3.756 1.00 0.00 N ATOM 947 CA LEU B 107 25.470 1.889 2.580 1.00 0.00 C ATOM 948 C LEU B 107 26.635 2.204 1.637 1.00 0.00 C ATOM 949 O LEU B 107 27.131 1.293 0.978 1.00 0.00 O ATOM 950 CB LEU B 107 24.105 2.140 1.909 1.00 0.00 C ATOM 951 CG LEU B 107 22.938 1.355 2.537 1.00 0.00 C ATOM 952 CD1 LEU B 107 21.612 1.948 2.059 1.00 0.00 C ATOM 953 CD2 LEU B 107 22.939 -0.130 2.162 1.00 0.00 C ATOM 0 H LEU B 107 24.782 3.291 3.951 1.00 0.00 H new ATOM 0 HA LEU B 107 25.500 0.833 2.849 1.00 0.00 H new ATOM 0 HB2 LEU B 107 23.879 3.205 1.958 1.00 0.00 H new ATOM 0 HB3 LEU B 107 24.178 1.878 0.854 1.00 0.00 H new ATOM 0 HG LEU B 107 23.060 1.436 3.617 1.00 0.00 H new ATOM 0 HD11 LEU B 107 20.785 1.394 2.502 1.00 0.00 H new ATOM 0 HD12 LEU B 107 21.551 2.994 2.361 1.00 0.00 H new ATOM 0 HD13 LEU B 107 21.554 1.880 0.973 1.00 0.00 H new ATOM 0 HD21 LEU B 107 22.092 -0.626 2.636 1.00 0.00 H new ATOM 0 HD22 LEU B 107 22.859 -0.232 1.080 1.00 0.00 H new ATOM 0 HD23 LEU B 107 23.866 -0.591 2.503 1.00 0.00 H new ATOM 965 N LYS B 108 27.148 3.443 1.604 1.00 0.00 N ATOM 966 CA LYS B 108 28.286 3.778 0.737 1.00 0.00 C ATOM 967 C LYS B 108 29.534 2.938 1.043 1.00 0.00 C ATOM 968 O LYS B 108 30.438 2.888 0.217 1.00 0.00 O ATOM 969 CB LYS B 108 28.635 5.271 0.852 1.00 0.00 C ATOM 970 CG LYS B 108 27.554 6.225 0.331 1.00 0.00 C ATOM 971 CD LYS B 108 27.129 5.898 -1.109 1.00 0.00 C ATOM 972 CE LYS B 108 26.316 6.995 -1.798 1.00 0.00 C ATOM 973 NZ LYS B 108 27.054 8.257 -1.998 1.00 0.00 N ATOM 0 H LYS B 108 26.797 4.222 2.162 1.00 0.00 H new ATOM 0 HA LYS B 108 27.973 3.547 -0.281 1.00 0.00 H new ATOM 0 HB2 LYS B 108 28.832 5.504 1.898 1.00 0.00 H new ATOM 0 HB3 LYS B 108 29.559 5.457 0.304 1.00 0.00 H new ATOM 0 HG2 LYS B 108 26.683 6.174 0.984 1.00 0.00 H new ATOM 0 HG3 LYS B 108 27.925 7.249 0.374 1.00 0.00 H new ATOM 0 HD2 LYS B 108 28.022 5.700 -1.701 1.00 0.00 H new ATOM 0 HD3 LYS B 108 26.542 4.980 -1.101 1.00 0.00 H new ATOM 0 HE2 LYS B 108 25.978 6.627 -2.767 1.00 0.00 H new ATOM 0 HE3 LYS B 108 25.424 7.198 -1.205 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 26.495 8.894 -2.601 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 27.222 8.711 -1.077 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 27.966 8.057 -2.457 1.00 0.00 H new ATOM 987 N SER B 109 29.602 2.312 2.218 1.00 0.00 N ATOM 988 CA SER B 109 30.704 1.470 2.661 1.00 0.00 C ATOM 989 C SER B 109 30.335 -0.023 2.672 1.00 0.00 C ATOM 990 O SER B 109 31.197 -0.845 2.978 1.00 0.00 O ATOM 991 CB SER B 109 31.129 1.926 4.061 1.00 0.00 C ATOM 992 OG SER B 109 31.410 3.315 4.072 1.00 0.00 O ATOM 0 H SER B 109 28.858 2.383 2.913 1.00 0.00 H new ATOM 0 HA SER B 109 31.528 1.579 1.955 1.00 0.00 H new ATOM 0 HB2 SER B 109 30.337 1.704 4.777 1.00 0.00 H new ATOM 0 HB3 SER B 109 32.011 1.369 4.378 1.00 0.00 H new ATOM 0 HG SER B 109 31.678 3.587 4.974 1.00 0.00 H new ATOM 998 N TRP B 110 29.072 -0.395 2.427 1.00 0.00 N ATOM 999 CA TRP B 110 28.661 -1.797 2.411 1.00 0.00 C ATOM 1000 C TRP B 110 29.050 -2.420 1.077 1.00 0.00 C ATOM 1001 O TRP B 110 29.183 -1.732 0.063 1.00 0.00 O ATOM 1002 CB TRP B 110 27.146 -1.938 2.582 1.00 0.00 C ATOM 1003 CG TRP B 110 26.546 -1.759 3.947 1.00 0.00 C ATOM 1004 CD1 TRP B 110 25.257 -2.061 4.196 1.00 0.00 C ATOM 1005 CD2 TRP B 110 27.096 -1.282 5.225 1.00 0.00 C ATOM 1006 NE1 TRP B 110 24.931 -1.707 5.485 1.00 0.00 N ATOM 1007 CE2 TRP B 110 26.031 -1.254 6.179 1.00 0.00 C ATOM 1008 CE3 TRP B 110 28.362 -0.872 5.703 1.00 0.00 C ATOM 1009 CZ2 TRP B 110 26.204 -0.820 7.503 1.00 0.00 C ATOM 1010 CZ3 TRP B 110 28.551 -0.432 7.027 1.00 0.00 C ATOM 1011 CH2 TRP B 110 27.475 -0.405 7.931 1.00 0.00 C ATOM 0 H TRP B 110 28.316 0.263 2.237 1.00 0.00 H new ATOM 0 HA TRP B 110 29.159 -2.301 3.239 1.00 0.00 H new ATOM 0 HB2 TRP B 110 26.672 -1.216 1.917 1.00 0.00 H new ATOM 0 HB3 TRP B 110 26.866 -2.930 2.227 1.00 0.00 H new ATOM 0 HD1 TRP B 110 24.579 -2.514 3.488 1.00 0.00 H new ATOM 0 HE1 TRP B 110 23.992 -1.772 5.878 1.00 0.00 H new ATOM 0 HE3 TRP B 110 29.209 -0.897 5.033 1.00 0.00 H new ATOM 0 HZ2 TRP B 110 25.367 -0.806 8.186 1.00 0.00 H new ATOM 0 HZ3 TRP B 110 29.531 -0.113 7.351 1.00 0.00 H new ATOM 0 HH2 TRP B 110 27.625 -0.068 8.946 1.00 0.00 H new ATOM 1022 N THR B 111 29.162 -3.744 1.055 1.00 0.00 N ATOM 1023 CA THR B 111 29.513 -4.505 -0.122 1.00 0.00 C ATOM 1024 C THR B 111 28.336 -4.557 -1.099 1.00 0.00 C ATOM 1025 O THR B 111 27.175 -4.542 -0.679 1.00 0.00 O ATOM 1026 CB THR B 111 29.937 -5.924 0.335 1.00 0.00 C ATOM 1027 OG1 THR B 111 29.875 -6.129 1.741 1.00 0.00 O ATOM 1028 CG2 THR B 111 31.412 -6.089 0.021 1.00 0.00 C ATOM 0 H THR B 111 29.006 -4.325 1.879 1.00 0.00 H new ATOM 0 HA THR B 111 30.341 -4.031 -0.650 1.00 0.00 H new ATOM 0 HB THR B 111 29.258 -6.611 -0.170 1.00 0.00 H new ATOM 0 HG1 THR B 111 29.022 -6.552 1.973 1.00 0.00 H new ATOM 0 HG21 THR B 111 31.741 -7.080 0.332 1.00 0.00 H new ATOM 0 HG22 THR B 111 31.571 -5.973 -1.051 1.00 0.00 H new ATOM 0 HG23 THR B 111 31.985 -5.332 0.556 1.00 0.00 H new ATOM 1036 N VAL B 112 28.642 -4.754 -2.386 1.00 0.00 N ATOM 1037 CA VAL B 112 27.660 -4.837 -3.456 1.00 0.00 C ATOM 1038 C VAL B 112 26.668 -5.969 -3.205 1.00 0.00 C ATOM 1039 O VAL B 112 25.473 -5.785 -3.403 1.00 0.00 O ATOM 1040 CB VAL B 112 28.376 -4.932 -4.824 1.00 0.00 C ATOM 1041 CG1 VAL B 112 29.346 -6.120 -4.957 1.00 0.00 C ATOM 1042 CG2 VAL B 112 27.371 -4.963 -5.979 1.00 0.00 C ATOM 0 H VAL B 112 29.602 -4.862 -2.713 1.00 0.00 H new ATOM 0 HA VAL B 112 27.064 -3.925 -3.475 1.00 0.00 H new ATOM 0 HB VAL B 112 28.982 -4.027 -4.878 1.00 0.00 H new ATOM 0 HG11 VAL B 112 29.802 -6.108 -5.947 1.00 0.00 H new ATOM 0 HG12 VAL B 112 30.124 -6.041 -4.198 1.00 0.00 H new ATOM 0 HG13 VAL B 112 28.799 -7.053 -4.821 1.00 0.00 H new ATOM 0 HG21 VAL B 112 27.907 -5.030 -6.926 1.00 0.00 H new ATOM 0 HG22 VAL B 112 26.718 -5.829 -5.870 1.00 0.00 H new ATOM 0 HG23 VAL B 112 26.772 -4.052 -5.965 1.00 0.00 H new ATOM 1052 N GLU B 113 27.131 -7.121 -2.716 1.00 0.00 N ATOM 1053 CA GLU B 113 26.238 -8.236 -2.468 1.00 0.00 C ATOM 1054 C GLU B 113 25.251 -7.890 -1.358 1.00 0.00 C ATOM 1055 O GLU B 113 24.041 -7.947 -1.548 1.00 0.00 O ATOM 1056 CB GLU B 113 27.031 -9.480 -2.057 1.00 0.00 C ATOM 1057 CG GLU B 113 28.068 -9.931 -3.092 1.00 0.00 C ATOM 1058 CD GLU B 113 28.515 -11.379 -2.860 1.00 0.00 C ATOM 1059 OE1 GLU B 113 28.540 -11.836 -1.694 1.00 0.00 O ATOM 1060 OE2 GLU B 113 28.778 -12.074 -3.863 1.00 0.00 O ATOM 0 H GLU B 113 28.109 -7.298 -2.488 1.00 0.00 H new ATOM 0 HA GLU B 113 25.694 -8.441 -3.390 1.00 0.00 H new ATOM 0 HB2 GLU B 113 27.539 -9.279 -1.114 1.00 0.00 H new ATOM 0 HB3 GLU B 113 26.334 -10.299 -1.876 1.00 0.00 H new ATOM 0 HG2 GLU B 113 27.647 -9.837 -4.093 1.00 0.00 H new ATOM 0 HG3 GLU B 113 28.935 -9.272 -3.048 1.00 0.00 H new ATOM 1067 N ASP B 114 25.763 -7.465 -0.207 1.00 0.00 N ATOM 1068 CA ASP B 114 24.949 -7.128 0.957 1.00 0.00 C ATOM 1069 C ASP B 114 23.925 -6.053 0.629 1.00 0.00 C ATOM 1070 O ASP B 114 22.753 -6.165 0.994 1.00 0.00 O ATOM 1071 CB ASP B 114 25.845 -6.670 2.102 1.00 0.00 C ATOM 1072 CG ASP B 114 26.803 -7.753 2.583 1.00 0.00 C ATOM 1073 OD1 ASP B 114 26.495 -8.966 2.538 1.00 0.00 O ATOM 1074 OD2 ASP B 114 27.928 -7.352 2.953 1.00 0.00 O ATOM 0 H ASP B 114 26.764 -7.344 -0.054 1.00 0.00 H new ATOM 0 HA ASP B 114 24.405 -8.023 1.259 1.00 0.00 H new ATOM 0 HB2 ASP B 114 26.420 -5.802 1.780 1.00 0.00 H new ATOM 0 HB3 ASP B 114 25.222 -6.348 2.936 1.00 0.00 H new ATOM 1079 N LEU B 115 24.335 -4.980 -0.047 1.00 0.00 N ATOM 1080 CA LEU B 115 23.390 -3.924 -0.400 1.00 0.00 C ATOM 1081 C LEU B 115 22.323 -4.476 -1.344 1.00 0.00 C ATOM 1082 O LEU B 115 21.139 -4.186 -1.164 1.00 0.00 O ATOM 1083 CB LEU B 115 24.128 -2.687 -0.908 1.00 0.00 C ATOM 1084 CG LEU B 115 24.454 -2.627 -2.404 1.00 0.00 C ATOM 1085 CD1 LEU B 115 23.241 -2.157 -3.206 1.00 0.00 C ATOM 1086 CD2 LEU B 115 25.660 -1.737 -2.706 1.00 0.00 C ATOM 0 H LEU B 115 25.294 -4.821 -0.355 1.00 0.00 H new ATOM 0 HA LEU B 115 22.851 -3.582 0.484 1.00 0.00 H new ATOM 0 HB2 LEU B 115 23.529 -1.811 -0.658 1.00 0.00 H new ATOM 0 HB3 LEU B 115 25.064 -2.602 -0.355 1.00 0.00 H new ATOM 0 HG LEU B 115 24.714 -3.641 -2.707 1.00 0.00 H new ATOM 0 HD11 LEU B 115 23.496 -2.122 -4.265 1.00 0.00 H new ATOM 0 HD12 LEU B 115 22.414 -2.851 -3.055 1.00 0.00 H new ATOM 0 HD13 LEU B 115 22.946 -1.162 -2.871 1.00 0.00 H new ATOM 0 HD21 LEU B 115 25.847 -1.730 -3.780 1.00 0.00 H new ATOM 0 HD22 LEU B 115 25.457 -0.721 -2.366 1.00 0.00 H new ATOM 0 HD23 LEU B 115 26.537 -2.124 -2.187 1.00 0.00 H new ATOM 1098 N GLN B 116 22.722 -5.302 -2.314 1.00 0.00 N ATOM 1099 CA GLN B 116 21.832 -5.924 -3.281 1.00 0.00 C ATOM 1100 C GLN B 116 20.802 -6.785 -2.533 1.00 0.00 C ATOM 1101 O GLN B 116 19.646 -6.874 -2.948 1.00 0.00 O ATOM 1102 CB GLN B 116 22.709 -6.653 -4.301 1.00 0.00 C ATOM 1103 CG GLN B 116 21.974 -7.370 -5.419 1.00 0.00 C ATOM 1104 CD GLN B 116 22.949 -7.610 -6.570 1.00 0.00 C ATOM 1105 OE1 GLN B 116 23.606 -8.649 -6.624 1.00 0.00 O ATOM 1106 NE2 GLN B 116 23.107 -6.638 -7.460 1.00 0.00 N ATOM 0 H GLN B 116 23.700 -5.560 -2.447 1.00 0.00 H new ATOM 0 HA GLN B 116 21.231 -5.213 -3.847 1.00 0.00 H new ATOM 0 HB2 GLN B 116 23.391 -5.929 -4.747 1.00 0.00 H new ATOM 0 HB3 GLN B 116 23.321 -7.382 -3.769 1.00 0.00 H new ATOM 0 HG2 GLN B 116 21.572 -8.318 -5.060 1.00 0.00 H new ATOM 0 HG3 GLN B 116 21.128 -6.773 -5.759 1.00 0.00 H new ATOM 0 HE21 GLN B 116 22.548 -5.787 -7.391 1.00 0.00 H new ATOM 0 HE22 GLN B 116 23.787 -6.742 -8.213 1.00 0.00 H new ATOM 1115 N LYS B 117 21.171 -7.379 -1.391 1.00 0.00 N ATOM 1116 CA LYS B 117 20.247 -8.168 -0.574 1.00 0.00 C ATOM 1117 C LYS B 117 19.181 -7.222 -0.018 1.00 0.00 C ATOM 1118 O LYS B 117 18.006 -7.598 -0.010 1.00 0.00 O ATOM 1119 CB LYS B 117 20.963 -8.959 0.539 1.00 0.00 C ATOM 1120 CG LYS B 117 21.358 -10.382 0.118 1.00 0.00 C ATOM 1121 CD LYS B 117 22.547 -10.384 -0.849 1.00 0.00 C ATOM 1122 CE LYS B 117 22.959 -11.750 -1.386 1.00 0.00 C ATOM 1123 NZ LYS B 117 23.389 -12.673 -0.322 1.00 0.00 N ATOM 0 H LYS B 117 22.116 -7.325 -1.010 1.00 0.00 H new ATOM 0 HA LYS B 117 19.776 -8.929 -1.197 1.00 0.00 H new ATOM 0 HB2 LYS B 117 21.858 -8.416 0.842 1.00 0.00 H new ATOM 0 HB3 LYS B 117 20.312 -9.014 1.412 1.00 0.00 H new ATOM 0 HG2 LYS B 117 21.610 -10.966 1.004 1.00 0.00 H new ATOM 0 HG3 LYS B 117 20.506 -10.870 -0.354 1.00 0.00 H new ATOM 0 HD2 LYS B 117 22.306 -9.739 -1.694 1.00 0.00 H new ATOM 0 HD3 LYS B 117 23.404 -9.939 -0.343 1.00 0.00 H new ATOM 0 HE2 LYS B 117 22.122 -12.191 -1.927 1.00 0.00 H new ATOM 0 HE3 LYS B 117 23.771 -11.624 -2.102 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 23.658 -13.586 -0.742 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 24.206 -12.269 0.179 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 22.608 -12.817 0.349 1.00 0.00 H new ATOM 1137 N ARG B 118 19.546 -6.025 0.466 1.00 0.00 N ATOM 1138 CA ARG B 118 18.557 -5.069 0.975 1.00 0.00 C ATOM 1139 C ARG B 118 17.666 -4.637 -0.193 1.00 0.00 C ATOM 1140 O ARG B 118 16.457 -4.537 0.005 1.00 0.00 O ATOM 1141 CB ARG B 118 19.187 -3.832 1.661 1.00 0.00 C ATOM 1142 CG ARG B 118 19.383 -3.966 3.181 1.00 0.00 C ATOM 1143 CD ARG B 118 19.790 -2.637 3.821 1.00 0.00 C ATOM 1144 NE ARG B 118 19.865 -2.755 5.287 1.00 0.00 N ATOM 1145 CZ ARG B 118 20.953 -3.035 6.019 1.00 0.00 C ATOM 1146 NH1 ARG B 118 22.096 -3.426 5.473 1.00 0.00 N ATOM 1147 NH2 ARG B 118 20.905 -2.944 7.338 1.00 0.00 N ATOM 0 H ARG B 118 20.512 -5.700 0.515 1.00 0.00 H new ATOM 0 HA ARG B 118 17.976 -5.568 1.751 1.00 0.00 H new ATOM 0 HB2 ARG B 118 20.155 -3.632 1.200 1.00 0.00 H new ATOM 0 HB3 ARG B 118 18.556 -2.965 1.465 1.00 0.00 H new ATOM 0 HG2 ARG B 118 18.459 -4.321 3.637 1.00 0.00 H new ATOM 0 HG3 ARG B 118 20.147 -4.716 3.384 1.00 0.00 H new ATOM 0 HD2 ARG B 118 20.757 -2.322 3.429 1.00 0.00 H new ATOM 0 HD3 ARG B 118 19.070 -1.865 3.552 1.00 0.00 H new ATOM 0 HE ARG B 118 18.996 -2.608 5.801 1.00 0.00 H new ATOM 0 HH11 ARG B 118 22.170 -3.523 4.460 1.00 0.00 H new ATOM 0 HH12 ARG B 118 22.901 -3.629 6.066 1.00 0.00 H new ATOM 0 HH21 ARG B 118 20.040 -2.661 7.799 1.00 0.00 H new ATOM 0 HH22 ARG B 118 21.733 -3.157 7.894 1.00 0.00 H new ATOM 1161 N LEU B 119 18.224 -4.399 -1.390 1.00 0.00 N ATOM 1162 CA LEU B 119 17.440 -3.987 -2.559 1.00 0.00 C ATOM 1163 C LEU B 119 16.375 -5.037 -2.857 1.00 0.00 C ATOM 1164 O LEU B 119 15.194 -4.711 -2.914 1.00 0.00 O ATOM 1165 CB LEU B 119 18.330 -3.707 -3.800 1.00 0.00 C ATOM 1166 CG LEU B 119 17.617 -3.042 -5.002 1.00 0.00 C ATOM 1167 CD1 LEU B 119 16.732 -3.983 -5.828 1.00 0.00 C ATOM 1168 CD2 LEU B 119 16.793 -1.817 -4.587 1.00 0.00 C ATOM 0 H LEU B 119 19.224 -4.487 -1.572 1.00 0.00 H new ATOM 0 HA LEU B 119 16.950 -3.043 -2.322 1.00 0.00 H new ATOM 0 HB2 LEU B 119 19.158 -3.068 -3.493 1.00 0.00 H new ATOM 0 HB3 LEU B 119 18.762 -4.650 -4.134 1.00 0.00 H new ATOM 0 HG LEU B 119 18.442 -2.733 -5.644 1.00 0.00 H new ATOM 0 HD11 LEU B 119 16.275 -3.427 -6.647 1.00 0.00 H new ATOM 0 HD12 LEU B 119 17.340 -4.792 -6.233 1.00 0.00 H new ATOM 0 HD13 LEU B 119 15.951 -4.400 -5.192 1.00 0.00 H new ATOM 0 HD21 LEU B 119 16.313 -1.387 -5.466 1.00 0.00 H new ATOM 0 HD22 LEU B 119 16.031 -2.118 -3.868 1.00 0.00 H new ATOM 0 HD23 LEU B 119 17.449 -1.075 -4.132 1.00 0.00 H new ATOM 1180 N LEU B 120 16.775 -6.305 -2.961 1.00 0.00 N ATOM 1181 CA LEU B 120 15.876 -7.409 -3.247 1.00 0.00 C ATOM 1182 C LEU B 120 14.784 -7.523 -2.180 1.00 0.00 C ATOM 1183 O LEU B 120 13.631 -7.793 -2.510 1.00 0.00 O ATOM 1184 CB LEU B 120 16.695 -8.709 -3.370 1.00 0.00 C ATOM 1185 CG LEU B 120 15.796 -9.955 -3.346 1.00 0.00 C ATOM 1186 CD1 LEU B 120 14.856 -10.031 -4.557 1.00 0.00 C ATOM 1187 CD2 LEU B 120 16.583 -11.257 -3.218 1.00 0.00 C ATOM 0 H LEU B 120 17.747 -6.591 -2.846 1.00 0.00 H new ATOM 0 HA LEU B 120 15.368 -7.226 -4.194 1.00 0.00 H new ATOM 0 HB2 LEU B 120 17.267 -8.692 -4.298 1.00 0.00 H new ATOM 0 HB3 LEU B 120 17.414 -8.764 -2.553 1.00 0.00 H new ATOM 0 HG LEU B 120 15.188 -9.841 -2.448 1.00 0.00 H new ATOM 0 HD11 LEU B 120 14.245 -10.931 -4.487 1.00 0.00 H new ATOM 0 HD12 LEU B 120 14.209 -9.154 -4.571 1.00 0.00 H new ATOM 0 HD13 LEU B 120 15.445 -10.063 -5.474 1.00 0.00 H new ATOM 0 HD21 LEU B 120 15.892 -12.100 -3.207 1.00 0.00 H new ATOM 0 HD22 LEU B 120 17.263 -11.356 -4.064 1.00 0.00 H new ATOM 0 HD23 LEU B 120 17.157 -11.246 -2.291 1.00 0.00 H new ATOM 1199 N ALA B 121 15.122 -7.387 -0.896 1.00 0.00 N ATOM 1200 CA ALA B 121 14.131 -7.487 0.176 1.00 0.00 C ATOM 1201 C ALA B 121 13.083 -6.381 0.061 1.00 0.00 C ATOM 1202 O ALA B 121 11.946 -6.547 0.495 1.00 0.00 O ATOM 1203 CB ALA B 121 14.815 -7.432 1.545 1.00 0.00 C ATOM 0 H ALA B 121 16.073 -7.208 -0.574 1.00 0.00 H new ATOM 0 HA ALA B 121 13.623 -8.446 0.076 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.063 -7.508 2.331 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.518 -8.260 1.634 1.00 0.00 H new ATOM 0 HB3 ALA B 121 15.352 -6.489 1.646 1.00 0.00 H new ATOM 1209 N LEU B 122 13.468 -5.246 -0.520 1.00 0.00 N ATOM 1210 CA LEU B 122 12.601 -4.094 -0.708 1.00 0.00 C ATOM 1211 C LEU B 122 11.471 -4.385 -1.689 1.00 0.00 C ATOM 1212 O LEU B 122 10.427 -3.733 -1.599 1.00 0.00 O ATOM 1213 CB LEU B 122 13.394 -2.813 -1.046 1.00 0.00 C ATOM 1214 CG LEU B 122 13.402 -1.798 0.113 1.00 0.00 C ATOM 1215 CD1 LEU B 122 12.009 -1.256 0.417 1.00 0.00 C ATOM 1216 CD2 LEU B 122 14.009 -2.407 1.390 1.00 0.00 C ATOM 0 H LEU B 122 14.412 -5.103 -0.879 1.00 0.00 H new ATOM 0 HA LEU B 122 12.120 -3.894 0.249 1.00 0.00 H new ATOM 0 HB2 LEU B 122 14.420 -3.081 -1.296 1.00 0.00 H new ATOM 0 HB3 LEU B 122 12.962 -2.345 -1.931 1.00 0.00 H new ATOM 0 HG LEU B 122 14.025 -0.967 -0.216 1.00 0.00 H new ATOM 0 HD11 LEU B 122 12.067 -0.545 1.241 1.00 0.00 H new ATOM 0 HD12 LEU B 122 11.612 -0.756 -0.467 1.00 0.00 H new ATOM 0 HD13 LEU B 122 11.351 -2.079 0.694 1.00 0.00 H new ATOM 0 HD21 LEU B 122 13.999 -1.664 2.188 1.00 0.00 H new ATOM 0 HD22 LEU B 122 13.422 -3.274 1.694 1.00 0.00 H new ATOM 0 HD23 LEU B 122 15.036 -2.715 1.194 1.00 0.00 H new ATOM 1228 N ASP B 123 11.675 -5.299 -2.636 1.00 0.00 N ATOM 1229 CA ASP B 123 10.677 -5.684 -3.632 1.00 0.00 C ATOM 1230 C ASP B 123 9.428 -6.285 -2.961 1.00 0.00 C ATOM 1231 O ASP B 123 8.371 -5.660 -3.053 1.00 0.00 O ATOM 1232 CB ASP B 123 11.282 -6.636 -4.680 1.00 0.00 C ATOM 1233 CG ASP B 123 12.211 -5.942 -5.674 1.00 0.00 C ATOM 1234 OD1 ASP B 123 11.748 -5.062 -6.439 1.00 0.00 O ATOM 1235 OD2 ASP B 123 13.405 -6.299 -5.734 1.00 0.00 O ATOM 0 H ASP B 123 12.556 -5.803 -2.734 1.00 0.00 H new ATOM 0 HA ASP B 123 10.358 -4.785 -4.159 1.00 0.00 H new ATOM 0 HB2 ASP B 123 11.835 -7.423 -4.167 1.00 0.00 H new ATOM 0 HB3 ASP B 123 10.474 -7.120 -5.228 1.00 0.00 H new ATOM 1240 N PRO B 124 9.479 -7.425 -2.235 1.00 0.00 N ATOM 1241 CA PRO B 124 8.285 -7.975 -1.612 1.00 0.00 C ATOM 1242 C PRO B 124 7.831 -7.136 -0.419 1.00 0.00 C ATOM 1243 O PRO B 124 6.680 -7.274 -0.028 1.00 0.00 O ATOM 1244 CB PRO B 124 8.631 -9.401 -1.189 1.00 0.00 C ATOM 1245 CG PRO B 124 10.111 -9.278 -0.873 1.00 0.00 C ATOM 1246 CD PRO B 124 10.589 -8.324 -1.971 1.00 0.00 C ATOM 0 HA PRO B 124 7.450 -7.968 -2.313 1.00 0.00 H new ATOM 0 HB2 PRO B 124 8.053 -9.723 -0.323 1.00 0.00 H new ATOM 0 HB3 PRO B 124 8.441 -10.121 -1.985 1.00 0.00 H new ATOM 0 HG2 PRO B 124 10.284 -8.873 0.124 1.00 0.00 H new ATOM 0 HG3 PRO B 124 10.620 -10.241 -0.918 1.00 0.00 H new ATOM 0 HD2 PRO B 124 11.471 -7.770 -1.649 1.00 0.00 H new ATOM 0 HD3 PRO B 124 10.868 -8.873 -2.870 1.00 0.00 H new ATOM 1254 N MET B 125 8.687 -6.281 0.161 1.00 0.00 N ATOM 1255 CA MET B 125 8.298 -5.440 1.289 1.00 0.00 C ATOM 1256 C MET B 125 7.143 -4.540 0.855 1.00 0.00 C ATOM 1257 O MET B 125 6.208 -4.343 1.625 1.00 0.00 O ATOM 1258 CB MET B 125 9.469 -4.567 1.767 1.00 0.00 C ATOM 1259 CG MET B 125 10.458 -5.255 2.714 1.00 0.00 C ATOM 1260 SD MET B 125 10.261 -4.878 4.483 1.00 0.00 S ATOM 1261 CE MET B 125 8.670 -5.683 4.838 1.00 0.00 C ATOM 0 H MET B 125 9.654 -6.158 -0.138 1.00 0.00 H new ATOM 0 HA MET B 125 7.997 -6.084 2.115 1.00 0.00 H new ATOM 0 HB2 MET B 125 10.016 -4.212 0.893 1.00 0.00 H new ATOM 0 HB3 MET B 125 9.064 -3.688 2.268 1.00 0.00 H new ATOM 0 HG2 MET B 125 10.369 -6.333 2.580 1.00 0.00 H new ATOM 0 HG3 MET B 125 11.469 -4.979 2.414 1.00 0.00 H new ATOM 0 HE1 MET B 125 8.458 -5.615 5.905 1.00 0.00 H new ATOM 0 HE2 MET B 125 7.878 -5.186 4.278 1.00 0.00 H new ATOM 0 HE3 MET B 125 8.719 -6.732 4.544 1.00 0.00 H new ATOM 1271 N MET B 126 7.244 -3.906 -0.321 1.00 0.00 N ATOM 1272 CA MET B 126 6.177 -3.052 -0.806 1.00 0.00 C ATOM 1273 C MET B 126 5.013 -3.889 -1.328 1.00 0.00 C ATOM 1274 O MET B 126 3.869 -3.515 -1.124 1.00 0.00 O ATOM 1275 CB MET B 126 6.702 -2.075 -1.866 1.00 0.00 C ATOM 1276 CG MET B 126 7.387 -2.764 -3.043 1.00 0.00 C ATOM 1277 SD MET B 126 7.592 -1.735 -4.510 1.00 0.00 S ATOM 1278 CE MET B 126 6.032 -2.251 -5.264 1.00 0.00 C ATOM 0 H MET B 126 8.050 -3.974 -0.942 1.00 0.00 H new ATOM 0 HA MET B 126 5.802 -2.456 0.026 1.00 0.00 H new ATOM 0 HB2 MET B 126 5.872 -1.476 -2.239 1.00 0.00 H new ATOM 0 HB3 MET B 126 7.406 -1.387 -1.398 1.00 0.00 H new ATOM 0 HG2 MET B 126 8.369 -3.112 -2.721 1.00 0.00 H new ATOM 0 HG3 MET B 126 6.809 -3.648 -3.314 1.00 0.00 H new ATOM 0 HE1 MET B 126 5.905 -1.744 -6.220 1.00 0.00 H new ATOM 0 HE2 MET B 126 6.044 -3.329 -5.424 1.00 0.00 H new ATOM 0 HE3 MET B 126 5.205 -1.992 -4.603 1.00 0.00 H new ATOM 1288 N GLU B 127 5.287 -5.005 -2.004 1.00 0.00 N ATOM 1289 CA GLU B 127 4.245 -5.844 -2.573 1.00 0.00 C ATOM 1290 C GLU B 127 3.318 -6.405 -1.508 1.00 0.00 C ATOM 1291 O GLU B 127 2.109 -6.280 -1.655 1.00 0.00 O ATOM 1292 CB GLU B 127 4.864 -6.946 -3.436 1.00 0.00 C ATOM 1293 CG GLU B 127 3.777 -7.674 -4.245 1.00 0.00 C ATOM 1294 CD GLU B 127 4.331 -8.477 -5.421 1.00 0.00 C ATOM 1295 OE1 GLU B 127 5.557 -8.706 -5.497 1.00 0.00 O ATOM 1296 OE2 GLU B 127 3.526 -8.845 -6.309 1.00 0.00 O ATOM 0 H GLU B 127 6.234 -5.347 -2.169 1.00 0.00 H new ATOM 0 HA GLU B 127 3.623 -5.221 -3.216 1.00 0.00 H new ATOM 0 HB2 GLU B 127 5.601 -6.514 -4.113 1.00 0.00 H new ATOM 0 HB3 GLU B 127 5.392 -7.659 -2.802 1.00 0.00 H new ATOM 0 HG2 GLU B 127 3.230 -8.345 -3.583 1.00 0.00 H new ATOM 0 HG3 GLU B 127 3.062 -6.942 -4.620 1.00 0.00 H new ATOM 1303 N GLN B 128 3.880 -6.988 -0.451 1.00 0.00 N ATOM 1304 CA GLN B 128 3.142 -7.582 0.650 1.00 0.00 C ATOM 1305 C GLN B 128 2.238 -6.548 1.322 1.00 0.00 C ATOM 1306 O GLN B 128 1.099 -6.849 1.672 1.00 0.00 O ATOM 1307 CB GLN B 128 4.168 -8.195 1.613 1.00 0.00 C ATOM 1308 CG GLN B 128 3.589 -8.737 2.923 1.00 0.00 C ATOM 1309 CD GLN B 128 3.494 -7.644 3.986 1.00 0.00 C ATOM 1310 OE1 GLN B 128 4.503 -7.190 4.517 1.00 0.00 O ATOM 1311 NE2 GLN B 128 2.293 -7.206 4.328 1.00 0.00 N ATOM 0 H GLN B 128 4.891 -7.060 -0.338 1.00 0.00 H new ATOM 0 HA GLN B 128 2.473 -8.366 0.297 1.00 0.00 H new ATOM 0 HB2 GLN B 128 4.685 -9.006 1.100 1.00 0.00 H new ATOM 0 HB3 GLN B 128 4.917 -7.439 1.850 1.00 0.00 H new ATOM 0 HG2 GLN B 128 2.599 -9.155 2.739 1.00 0.00 H new ATOM 0 HG3 GLN B 128 4.215 -9.550 3.290 1.00 0.00 H new ATOM 0 HE21 GLN B 128 1.462 -7.592 3.879 1.00 0.00 H new ATOM 0 HE22 GLN B 128 2.198 -6.483 5.041 1.00 0.00 H new ATOM 1320 N GLU B 129 2.746 -5.338 1.542 1.00 0.00 N ATOM 1321 CA GLU B 129 1.976 -4.282 2.183 1.00 0.00 C ATOM 1322 C GLU B 129 0.868 -3.797 1.247 1.00 0.00 C ATOM 1323 O GLU B 129 -0.272 -3.635 1.679 1.00 0.00 O ATOM 1324 CB GLU B 129 2.915 -3.146 2.602 1.00 0.00 C ATOM 1325 CG GLU B 129 3.877 -3.556 3.725 1.00 0.00 C ATOM 1326 CD GLU B 129 3.185 -3.612 5.091 1.00 0.00 C ATOM 1327 OE1 GLU B 129 2.648 -4.672 5.489 1.00 0.00 O ATOM 1328 OE2 GLU B 129 3.226 -2.589 5.811 1.00 0.00 O ATOM 0 H GLU B 129 3.694 -5.066 1.283 1.00 0.00 H new ATOM 0 HA GLU B 129 1.494 -4.666 3.082 1.00 0.00 H new ATOM 0 HB2 GLU B 129 3.492 -2.819 1.737 1.00 0.00 H new ATOM 0 HB3 GLU B 129 2.322 -2.293 2.931 1.00 0.00 H new ATOM 0 HG2 GLU B 129 4.304 -4.532 3.496 1.00 0.00 H new ATOM 0 HG3 GLU B 129 4.705 -2.848 3.768 1.00 0.00 H new ATOM 1335 N ILE B 130 1.175 -3.556 -0.035 1.00 0.00 N ATOM 1336 CA ILE B 130 0.186 -3.101 -0.987 1.00 0.00 C ATOM 1337 C ILE B 130 -0.881 -4.186 -1.121 1.00 0.00 C ATOM 1338 O ILE B 130 -2.047 -3.851 -0.975 1.00 0.00 O ATOM 1339 CB ILE B 130 0.833 -2.651 -2.334 1.00 0.00 C ATOM 1340 CG1 ILE B 130 1.263 -1.159 -2.290 1.00 0.00 C ATOM 1341 CG2 ILE B 130 -0.131 -2.781 -3.530 1.00 0.00 C ATOM 1342 CD1 ILE B 130 2.654 -0.873 -1.739 1.00 0.00 C ATOM 0 H ILE B 130 2.110 -3.673 -0.426 1.00 0.00 H new ATOM 0 HA ILE B 130 -0.305 -2.197 -0.628 1.00 0.00 H new ATOM 0 HB ILE B 130 1.690 -3.311 -2.464 1.00 0.00 H new ATOM 0 HG12 ILE B 130 1.206 -0.757 -3.302 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.538 -0.612 -1.688 1.00 0.00 H new ATOM 0 HG21 ILE B 130 0.372 -2.454 -4.440 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -0.438 -3.821 -3.639 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -1.010 -2.160 -3.358 1.00 0.00 H new ATOM 0 HD11 ILE B 130 2.839 0.201 -1.759 1.00 0.00 H new ATOM 0 HD12 ILE B 130 2.720 -1.234 -0.713 1.00 0.00 H new ATOM 0 HD13 ILE B 130 3.399 -1.381 -2.351 1.00 0.00 H new ATOM 1354 N GLU B 131 -0.542 -5.452 -1.385 1.00 0.00 N ATOM 1355 CA GLU B 131 -1.534 -6.513 -1.555 1.00 0.00 C ATOM 1356 C GLU B 131 -2.455 -6.650 -0.350 1.00 0.00 C ATOM 1357 O GLU B 131 -3.641 -6.906 -0.544 1.00 0.00 O ATOM 1358 CB GLU B 131 -0.919 -7.859 -1.979 1.00 0.00 C ATOM 1359 CG GLU B 131 -0.285 -8.675 -0.841 1.00 0.00 C ATOM 1360 CD GLU B 131 0.200 -10.056 -1.281 1.00 0.00 C ATOM 1361 OE1 GLU B 131 0.671 -10.198 -2.433 1.00 0.00 O ATOM 1362 OE2 GLU B 131 0.081 -11.009 -0.474 1.00 0.00 O ATOM 0 H GLU B 131 0.423 -5.767 -1.486 1.00 0.00 H new ATOM 0 HA GLU B 131 -2.159 -6.197 -2.390 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -1.695 -8.463 -2.449 1.00 0.00 H new ATOM 0 HB3 GLU B 131 -0.159 -7.670 -2.737 1.00 0.00 H new ATOM 0 HG2 GLU B 131 0.556 -8.117 -0.429 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -1.013 -8.793 -0.039 1.00 0.00 H new ATOM 1369 N GLU B 132 -1.944 -6.442 0.866 1.00 0.00 N ATOM 1370 CA GLU B 132 -2.745 -6.538 2.080 1.00 0.00 C ATOM 1371 C GLU B 132 -3.820 -5.449 1.997 1.00 0.00 C ATOM 1372 O GLU B 132 -5.004 -5.688 2.213 1.00 0.00 O ATOM 1373 CB GLU B 132 -1.854 -6.383 3.329 1.00 0.00 C ATOM 1374 CG GLU B 132 -2.599 -6.769 4.615 1.00 0.00 C ATOM 1375 CD GLU B 132 -1.873 -6.291 5.879 1.00 0.00 C ATOM 1376 OE1 GLU B 132 -0.959 -6.981 6.393 1.00 0.00 O ATOM 1377 OE2 GLU B 132 -2.272 -5.229 6.410 1.00 0.00 O ATOM 0 H GLU B 132 -0.966 -6.203 1.032 1.00 0.00 H new ATOM 0 HA GLU B 132 -3.220 -7.515 2.166 1.00 0.00 H new ATOM 0 HB2 GLU B 132 -0.967 -7.007 3.222 1.00 0.00 H new ATOM 0 HB3 GLU B 132 -1.510 -5.351 3.404 1.00 0.00 H new ATOM 0 HG2 GLU B 132 -3.602 -6.342 4.592 1.00 0.00 H new ATOM 0 HG3 GLU B 132 -2.714 -7.852 4.653 1.00 0.00 H new ATOM 1384 N ILE B 133 -3.415 -4.232 1.637 1.00 0.00 N ATOM 1385 CA ILE B 133 -4.290 -3.077 1.496 1.00 0.00 C ATOM 1386 C ILE B 133 -5.238 -3.266 0.308 1.00 0.00 C ATOM 1387 O ILE B 133 -6.386 -2.812 0.356 1.00 0.00 O ATOM 1388 CB ILE B 133 -3.425 -1.802 1.424 1.00 0.00 C ATOM 1389 CG1 ILE B 133 -2.701 -1.607 2.777 1.00 0.00 C ATOM 1390 CG2 ILE B 133 -4.281 -0.558 1.159 1.00 0.00 C ATOM 1391 CD1 ILE B 133 -1.539 -0.632 2.667 1.00 0.00 C ATOM 0 H ILE B 133 -2.439 -4.020 1.430 1.00 0.00 H new ATOM 0 HA ILE B 133 -4.940 -2.969 2.364 1.00 0.00 H new ATOM 0 HB ILE B 133 -2.714 -1.923 0.607 1.00 0.00 H new ATOM 0 HG12 ILE B 133 -3.411 -1.242 3.519 1.00 0.00 H new ATOM 0 HG13 ILE B 133 -2.334 -2.569 3.134 1.00 0.00 H new ATOM 0 HG21 ILE B 133 -3.640 0.322 1.114 1.00 0.00 H new ATOM 0 HG22 ILE B 133 -4.806 -0.673 0.211 1.00 0.00 H new ATOM 0 HG23 ILE B 133 -5.007 -0.438 1.963 1.00 0.00 H new ATOM 0 HD11 ILE B 133 -1.060 -0.526 3.640 1.00 0.00 H new ATOM 0 HD12 ILE B 133 -0.815 -1.009 1.945 1.00 0.00 H new ATOM 0 HD13 ILE B 133 -1.909 0.339 2.336 1.00 0.00 H new ATOM 1403 N ARG B 134 -4.797 -3.889 -0.786 1.00 0.00 N ATOM 1404 CA ARG B 134 -5.644 -4.124 -1.954 1.00 0.00 C ATOM 1405 C ARG B 134 -6.732 -5.100 -1.551 1.00 0.00 C ATOM 1406 O ARG B 134 -7.906 -4.813 -1.763 1.00 0.00 O ATOM 1407 CB ARG B 134 -4.827 -4.588 -3.166 1.00 0.00 C ATOM 1408 CG ARG B 134 -3.887 -3.461 -3.625 1.00 0.00 C ATOM 1409 CD ARG B 134 -3.299 -3.688 -5.022 1.00 0.00 C ATOM 1410 NE ARG B 134 -2.759 -2.446 -5.603 1.00 0.00 N ATOM 1411 CZ ARG B 134 -3.471 -1.460 -6.172 1.00 0.00 C ATOM 1412 NH1 ARG B 134 -4.794 -1.544 -6.313 1.00 0.00 N ATOM 1413 NH2 ARG B 134 -2.836 -0.373 -6.585 1.00 0.00 N ATOM 0 H ARG B 134 -3.846 -4.243 -0.886 1.00 0.00 H new ATOM 0 HA ARG B 134 -6.111 -3.194 -2.279 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -4.247 -5.474 -2.907 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -5.495 -4.870 -3.980 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -4.433 -2.518 -3.618 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -3.072 -3.363 -2.908 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -2.508 -4.435 -4.965 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -4.070 -4.090 -5.679 1.00 0.00 H new ATOM 0 HE ARG B 134 -1.747 -2.324 -5.570 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -5.290 -2.372 -5.985 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -5.310 -0.780 -6.749 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -1.826 -0.297 -6.468 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -3.358 0.388 -7.020 1.00 0.00 H new ATOM 1427 N GLN B 135 -6.357 -6.191 -0.892 1.00 0.00 N ATOM 1428 CA GLN B 135 -7.293 -7.199 -0.433 1.00 0.00 C ATOM 1429 C GLN B 135 -8.282 -6.618 0.576 1.00 0.00 C ATOM 1430 O GLN B 135 -9.487 -6.706 0.342 1.00 0.00 O ATOM 1431 CB GLN B 135 -6.518 -8.362 0.207 1.00 0.00 C ATOM 1432 CG GLN B 135 -6.062 -9.381 -0.841 1.00 0.00 C ATOM 1433 CD GLN B 135 -7.259 -10.131 -1.429 1.00 0.00 C ATOM 1434 OE1 GLN B 135 -8.175 -10.528 -0.716 1.00 0.00 O ATOM 1435 NE2 GLN B 135 -7.356 -10.272 -2.739 1.00 0.00 N ATOM 0 H GLN B 135 -5.385 -6.398 -0.662 1.00 0.00 H new ATOM 0 HA GLN B 135 -7.860 -7.559 -1.291 1.00 0.00 H new ATOM 0 HB2 GLN B 135 -5.650 -7.972 0.738 1.00 0.00 H new ATOM 0 HB3 GLN B 135 -7.148 -8.857 0.946 1.00 0.00 H new ATOM 0 HG2 GLN B 135 -5.520 -8.872 -1.638 1.00 0.00 H new ATOM 0 HG3 GLN B 135 -5.370 -10.091 -0.387 1.00 0.00 H new ATOM 0 HE21 GLN B 135 -6.602 -9.947 -3.344 1.00 0.00 H new ATOM 0 HE22 GLN B 135 -8.185 -10.706 -3.145 1.00 0.00 H new ATOM 1444 N LYS B 136 -7.794 -5.964 1.635 1.00 0.00 N ATOM 1445 CA LYS B 136 -8.629 -5.386 2.692 1.00 0.00 C ATOM 1446 C LYS B 136 -9.636 -4.370 2.174 1.00 0.00 C ATOM 1447 O LYS B 136 -10.814 -4.413 2.530 1.00 0.00 O ATOM 1448 CB LYS B 136 -7.750 -4.862 3.850 1.00 0.00 C ATOM 1449 CG LYS B 136 -7.457 -3.353 3.927 1.00 0.00 C ATOM 1450 CD LYS B 136 -6.562 -3.022 5.132 1.00 0.00 C ATOM 1451 CE LYS B 136 -5.122 -3.561 5.005 1.00 0.00 C ATOM 1452 NZ LYS B 136 -4.350 -3.461 6.259 1.00 0.00 N ATOM 0 H LYS B 136 -6.795 -5.820 1.784 1.00 0.00 H new ATOM 0 HA LYS B 136 -9.250 -6.184 3.099 1.00 0.00 H new ATOM 0 HB2 LYS B 136 -8.226 -5.155 4.786 1.00 0.00 H new ATOM 0 HB3 LYS B 136 -6.794 -5.383 3.802 1.00 0.00 H new ATOM 0 HG2 LYS B 136 -6.970 -3.027 3.008 1.00 0.00 H new ATOM 0 HG3 LYS B 136 -8.394 -2.801 4.004 1.00 0.00 H new ATOM 0 HD2 LYS B 136 -6.525 -1.940 5.259 1.00 0.00 H new ATOM 0 HD3 LYS B 136 -7.016 -3.433 6.034 1.00 0.00 H new ATOM 0 HE2 LYS B 136 -5.158 -4.604 4.691 1.00 0.00 H new ATOM 0 HE3 LYS B 136 -4.603 -3.010 4.221 1.00 0.00 H new ATOM 0 HZ1 LYS B 136 -3.474 -4.015 6.173 1.00 0.00 H new ATOM 0 HZ2 LYS B 136 -4.113 -2.465 6.442 1.00 0.00 H new ATOM 0 HZ3 LYS B 136 -4.918 -3.832 7.047 1.00 0.00 H new ATOM 1466 N TYR B 137 -9.196 -3.420 1.348 1.00 0.00 N ATOM 1467 CA TYR B 137 -10.129 -2.431 0.839 1.00 0.00 C ATOM 1468 C TYR B 137 -11.040 -3.049 -0.210 1.00 0.00 C ATOM 1469 O TYR B 137 -12.206 -2.665 -0.260 1.00 0.00 O ATOM 1470 CB TYR B 137 -9.404 -1.185 0.355 1.00 0.00 C ATOM 1471 CG TYR B 137 -8.952 -0.266 1.478 1.00 0.00 C ATOM 1472 CD1 TYR B 137 -9.844 0.210 2.464 1.00 0.00 C ATOM 1473 CD2 TYR B 137 -7.616 0.142 1.515 1.00 0.00 C ATOM 1474 CE1 TYR B 137 -9.398 1.102 3.461 1.00 0.00 C ATOM 1475 CE2 TYR B 137 -7.172 1.068 2.469 1.00 0.00 C ATOM 1476 CZ TYR B 137 -8.058 1.556 3.447 1.00 0.00 C ATOM 1477 OH TYR B 137 -7.634 2.507 4.324 1.00 0.00 O ATOM 0 H TYR B 137 -8.232 -3.320 1.029 1.00 0.00 H new ATOM 0 HA TYR B 137 -10.773 -2.099 1.653 1.00 0.00 H new ATOM 0 HB2 TYR B 137 -8.534 -1.485 -0.229 1.00 0.00 H new ATOM 0 HB3 TYR B 137 -10.061 -0.630 -0.314 1.00 0.00 H new ATOM 0 HD1 TYR B 137 -10.875 -0.111 2.454 1.00 0.00 H new ATOM 0 HD2 TYR B 137 -6.916 -0.262 0.799 1.00 0.00 H new ATOM 0 HE1 TYR B 137 -10.076 1.437 4.232 1.00 0.00 H new ATOM 0 HE2 TYR B 137 -6.147 1.408 2.453 1.00 0.00 H new ATOM 0 HH TYR B 137 -7.201 3.236 3.832 1.00 0.00 H new ATOM 1487 N GLN B 138 -10.575 -4.017 -1.006 1.00 0.00 N ATOM 1488 CA GLN B 138 -11.422 -4.662 -2.003 1.00 0.00 C ATOM 1489 C GLN B 138 -12.607 -5.316 -1.287 1.00 0.00 C ATOM 1490 O GLN B 138 -13.744 -5.058 -1.688 1.00 0.00 O ATOM 1491 CB GLN B 138 -10.625 -5.680 -2.841 1.00 0.00 C ATOM 1492 CG GLN B 138 -11.480 -6.671 -3.647 1.00 0.00 C ATOM 1493 CD GLN B 138 -12.259 -6.058 -4.800 1.00 0.00 C ATOM 1494 OE1 GLN B 138 -11.863 -6.172 -5.957 1.00 0.00 O ATOM 1495 NE2 GLN B 138 -13.399 -5.456 -4.517 1.00 0.00 N ATOM 0 H GLN B 138 -9.618 -4.368 -0.976 1.00 0.00 H new ATOM 0 HA GLN B 138 -11.796 -3.916 -2.704 1.00 0.00 H new ATOM 0 HB2 GLN B 138 -9.981 -5.135 -3.531 1.00 0.00 H new ATOM 0 HB3 GLN B 138 -9.973 -6.245 -2.175 1.00 0.00 H new ATOM 0 HG2 GLN B 138 -10.829 -7.451 -4.042 1.00 0.00 H new ATOM 0 HG3 GLN B 138 -12.184 -7.155 -2.970 1.00 0.00 H new ATOM 0 HE21 GLN B 138 -13.706 -5.374 -3.548 1.00 0.00 H new ATOM 0 HE22 GLN B 138 -13.973 -5.073 -5.268 1.00 0.00 H new ATOM 1504 N SER B 139 -12.383 -6.129 -0.248 1.00 0.00 N ATOM 1505 CA SER B 139 -13.470 -6.777 0.486 1.00 0.00 C ATOM 1506 C SER B 139 -14.420 -5.728 1.069 1.00 0.00 C ATOM 1507 O SER B 139 -15.627 -5.960 1.126 1.00 0.00 O ATOM 1508 CB SER B 139 -12.913 -7.738 1.544 1.00 0.00 C ATOM 1509 OG SER B 139 -11.715 -7.252 2.113 1.00 0.00 O ATOM 0 H SER B 139 -11.452 -6.353 0.103 1.00 0.00 H new ATOM 0 HA SER B 139 -14.058 -7.384 -0.202 1.00 0.00 H new ATOM 0 HB2 SER B 139 -13.655 -7.885 2.329 1.00 0.00 H new ATOM 0 HB3 SER B 139 -12.731 -8.712 1.091 1.00 0.00 H new ATOM 0 HG SER B 139 -11.756 -6.275 2.177 1.00 0.00 H new ATOM 1515 N LYS B 140 -13.909 -4.557 1.471 1.00 0.00 N ATOM 1516 CA LYS B 140 -14.744 -3.478 1.996 1.00 0.00 C ATOM 1517 C LYS B 140 -15.509 -2.777 0.867 1.00 0.00 C ATOM 1518 O LYS B 140 -16.607 -2.283 1.127 1.00 0.00 O ATOM 1519 CB LYS B 140 -13.916 -2.490 2.841 1.00 0.00 C ATOM 1520 CG LYS B 140 -13.655 -3.086 4.234 1.00 0.00 C ATOM 1521 CD LYS B 140 -13.103 -2.089 5.262 1.00 0.00 C ATOM 1522 CE LYS B 140 -11.586 -1.890 5.134 1.00 0.00 C ATOM 1523 NZ LYS B 140 -11.019 -1.279 6.357 1.00 0.00 N ATOM 0 H LYS B 140 -12.914 -4.336 1.441 1.00 0.00 H new ATOM 0 HA LYS B 140 -15.487 -3.917 2.663 1.00 0.00 H new ATOM 0 HB2 LYS B 140 -12.970 -2.277 2.344 1.00 0.00 H new ATOM 0 HB3 LYS B 140 -14.448 -1.543 2.935 1.00 0.00 H new ATOM 0 HG2 LYS B 140 -14.586 -3.504 4.616 1.00 0.00 H new ATOM 0 HG3 LYS B 140 -12.952 -3.913 4.135 1.00 0.00 H new ATOM 0 HD2 LYS B 140 -13.604 -1.129 5.137 1.00 0.00 H new ATOM 0 HD3 LYS B 140 -13.336 -2.442 6.267 1.00 0.00 H new ATOM 0 HE2 LYS B 140 -11.105 -2.851 4.948 1.00 0.00 H new ATOM 0 HE3 LYS B 140 -11.372 -1.255 4.275 1.00 0.00 H new ATOM 0 HZ1 LYS B 140 -9.993 -1.157 6.240 1.00 0.00 H new ATOM 0 HZ2 LYS B 140 -11.462 -0.352 6.519 1.00 0.00 H new ATOM 0 HZ3 LYS B 140 -11.204 -1.898 7.172 1.00 0.00 H new ATOM 1537 N ARG B 141 -14.966 -2.668 -0.357 1.00 0.00 N ATOM 1538 CA ARG B 141 -15.634 -2.027 -1.500 1.00 0.00 C ATOM 1539 C ARG B 141 -16.668 -2.942 -2.144 1.00 0.00 C ATOM 1540 O ARG B 141 -17.697 -2.480 -2.613 1.00 0.00 O ATOM 1541 CB ARG B 141 -14.625 -1.549 -2.561 1.00 0.00 C ATOM 1542 CG ARG B 141 -15.304 -0.593 -3.565 1.00 0.00 C ATOM 1543 CD ARG B 141 -14.364 -0.059 -4.651 1.00 0.00 C ATOM 1544 NE ARG B 141 -13.984 1.352 -4.452 1.00 0.00 N ATOM 1545 CZ ARG B 141 -12.962 1.966 -5.055 1.00 0.00 C ATOM 1546 NH1 ARG B 141 -12.088 1.264 -5.772 1.00 0.00 N ATOM 1547 NH2 ARG B 141 -12.832 3.282 -4.925 1.00 0.00 N ATOM 0 H ARG B 141 -14.039 -3.028 -0.582 1.00 0.00 H new ATOM 0 HA ARG B 141 -16.151 -1.155 -1.098 1.00 0.00 H new ATOM 0 HB2 ARG B 141 -13.791 -1.042 -2.075 1.00 0.00 H new ATOM 0 HB3 ARG B 141 -14.212 -2.407 -3.090 1.00 0.00 H new ATOM 0 HG2 ARG B 141 -16.135 -1.114 -4.042 1.00 0.00 H new ATOM 0 HG3 ARG B 141 -15.727 0.250 -3.019 1.00 0.00 H new ATOM 0 HD2 ARG B 141 -13.462 -0.671 -4.674 1.00 0.00 H new ATOM 0 HD3 ARG B 141 -14.846 -0.165 -5.623 1.00 0.00 H new ATOM 0 HE ARG B 141 -14.546 1.903 -3.803 1.00 0.00 H new ATOM 0 HH11 ARG B 141 -12.197 0.254 -5.863 1.00 0.00 H new ATOM 0 HH12 ARG B 141 -11.309 1.736 -6.231 1.00 0.00 H new ATOM 0 HH21 ARG B 141 -13.507 3.809 -4.371 1.00 0.00 H new ATOM 0 HH22 ARG B 141 -12.057 3.765 -5.379 1.00 0.00 H new ATOM 1561 N GLN B 142 -16.408 -4.236 -2.170 1.00 0.00 N ATOM 1562 CA GLN B 142 -17.267 -5.258 -2.745 1.00 0.00 C ATOM 1563 C GLN B 142 -18.749 -5.093 -2.353 1.00 0.00 C ATOM 1564 O GLN B 142 -19.563 -4.941 -3.259 1.00 0.00 O ATOM 1565 CB GLN B 142 -16.678 -6.643 -2.427 1.00 0.00 C ATOM 1566 CG GLN B 142 -17.511 -7.789 -3.013 1.00 0.00 C ATOM 1567 CD GLN B 142 -17.750 -7.635 -4.506 1.00 0.00 C ATOM 1568 OE1 GLN B 142 -16.814 -7.346 -5.252 1.00 0.00 O ATOM 1569 NE2 GLN B 142 -18.979 -7.796 -4.946 1.00 0.00 N ATOM 0 H GLN B 142 -15.552 -4.623 -1.772 1.00 0.00 H new ATOM 0 HA GLN B 142 -17.283 -5.144 -3.829 1.00 0.00 H new ATOM 0 HB2 GLN B 142 -15.663 -6.700 -2.819 1.00 0.00 H new ATOM 0 HB3 GLN B 142 -16.610 -6.765 -1.346 1.00 0.00 H new ATOM 0 HG2 GLN B 142 -17.003 -8.735 -2.826 1.00 0.00 H new ATOM 0 HG3 GLN B 142 -18.471 -7.836 -2.498 1.00 0.00 H new ATOM 0 HE21 GLN B 142 -19.727 -8.035 -4.295 1.00 0.00 H new ATOM 0 HE22 GLN B 142 -19.184 -7.682 -5.939 1.00 0.00 H new ATOM 1578 N PRO B 143 -19.131 -5.049 -1.062 1.00 0.00 N ATOM 1579 CA PRO B 143 -20.524 -4.901 -0.638 1.00 0.00 C ATOM 1580 C PRO B 143 -21.140 -3.570 -1.069 1.00 0.00 C ATOM 1581 O PRO B 143 -22.356 -3.410 -1.009 1.00 0.00 O ATOM 1582 CB PRO B 143 -20.505 -5.000 0.891 1.00 0.00 C ATOM 1583 CG PRO B 143 -19.096 -4.558 1.239 1.00 0.00 C ATOM 1584 CD PRO B 143 -18.301 -5.195 0.114 1.00 0.00 C ATOM 0 HA PRO B 143 -21.138 -5.672 -1.104 1.00 0.00 H new ATOM 0 HB2 PRO B 143 -21.256 -4.355 1.347 1.00 0.00 H new ATOM 0 HB3 PRO B 143 -20.707 -6.015 1.233 1.00 0.00 H new ATOM 0 HG2 PRO B 143 -18.996 -3.473 1.250 1.00 0.00 H new ATOM 0 HG3 PRO B 143 -18.782 -4.917 2.219 1.00 0.00 H new ATOM 0 HD2 PRO B 143 -17.339 -4.700 -0.018 1.00 0.00 H new ATOM 0 HD3 PRO B 143 -18.094 -6.245 0.323 1.00 0.00 H new ATOM 1592 N ILE B 144 -20.310 -2.587 -1.420 1.00 0.00 N ATOM 1593 CA ILE B 144 -20.726 -1.273 -1.860 1.00 0.00 C ATOM 1594 C ILE B 144 -21.256 -1.405 -3.283 1.00 0.00 C ATOM 1595 O ILE B 144 -22.366 -0.952 -3.557 1.00 0.00 O ATOM 1596 CB ILE B 144 -19.565 -0.257 -1.757 1.00 0.00 C ATOM 1597 CG1 ILE B 144 -18.871 -0.316 -0.379 1.00 0.00 C ATOM 1598 CG2 ILE B 144 -20.128 1.130 -2.065 1.00 0.00 C ATOM 1599 CD1 ILE B 144 -17.755 0.714 -0.194 1.00 0.00 C ATOM 0 H ILE B 144 -19.296 -2.697 -1.402 1.00 0.00 H new ATOM 0 HA ILE B 144 -21.516 -0.887 -1.216 1.00 0.00 H new ATOM 0 HB ILE B 144 -18.788 -0.503 -2.481 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -19.620 -0.167 0.399 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -18.456 -1.314 -0.236 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -19.330 1.869 -2.000 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -20.548 1.137 -3.071 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -20.908 1.374 -1.344 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -17.320 0.605 0.800 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -16.984 0.554 -0.947 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -18.165 1.718 -0.302 1.00 0.00 H new ATOM 1611 N LEU B 145 -20.469 -1.998 -4.190 1.00 0.00 N ATOM 1612 CA LEU B 145 -20.914 -2.167 -5.576 1.00 0.00 C ATOM 1613 C LEU B 145 -22.112 -3.090 -5.562 1.00 0.00 C ATOM 1614 O LEU B 145 -23.122 -2.822 -6.202 1.00 0.00 O ATOM 1615 CB LEU B 145 -19.903 -2.811 -6.541 1.00 0.00 C ATOM 1616 CG LEU B 145 -18.418 -2.556 -6.339 1.00 0.00 C ATOM 1617 CD1 LEU B 145 -17.673 -3.099 -7.559 1.00 0.00 C ATOM 1618 CD2 LEU B 145 -18.069 -1.072 -6.193 1.00 0.00 C ATOM 0 H LEU B 145 -19.537 -2.363 -3.993 1.00 0.00 H new ATOM 0 HA LEU B 145 -21.100 -1.156 -5.939 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -20.058 -3.889 -6.507 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -20.158 -2.484 -7.549 1.00 0.00 H new ATOM 0 HG LEU B 145 -18.128 -3.051 -5.412 1.00 0.00 H new ATOM 0 HD11 LEU B 145 -16.603 -2.928 -7.438 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -17.861 -4.169 -7.654 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -18.023 -2.588 -8.456 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -16.994 -0.963 -6.052 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -18.373 -0.537 -7.092 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -18.592 -0.658 -5.331 1.00 0.00 H new ATOM 1630 N ASP B 146 -21.996 -4.158 -4.776 1.00 0.00 N ATOM 1631 CA ASP B 146 -23.023 -5.167 -4.647 1.00 0.00 C ATOM 1632 C ASP B 146 -24.353 -4.557 -4.188 1.00 0.00 C ATOM 1633 O ASP B 146 -25.416 -5.096 -4.475 1.00 0.00 O ATOM 1634 CB ASP B 146 -22.486 -6.231 -3.685 1.00 0.00 C ATOM 1635 CG ASP B 146 -23.312 -7.502 -3.542 1.00 0.00 C ATOM 1636 OD1 ASP B 146 -23.963 -7.971 -4.494 1.00 0.00 O ATOM 1637 OD2 ASP B 146 -23.245 -8.114 -2.454 1.00 0.00 O ATOM 0 H ASP B 146 -21.170 -4.342 -4.206 1.00 0.00 H new ATOM 0 HA ASP B 146 -23.246 -5.628 -5.609 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -21.484 -6.511 -4.012 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -22.385 -5.778 -2.699 1.00 0.00 H new ATOM 1642 N ALA B 147 -24.309 -3.448 -3.442 1.00 0.00 N ATOM 1643 CA ALA B 147 -25.482 -2.742 -2.957 1.00 0.00 C ATOM 1644 C ALA B 147 -26.082 -1.823 -4.026 1.00 0.00 C ATOM 1645 O ALA B 147 -27.289 -1.862 -4.245 1.00 0.00 O ATOM 1646 CB ALA B 147 -25.124 -1.964 -1.688 1.00 0.00 C ATOM 0 H ALA B 147 -23.432 -3.012 -3.156 1.00 0.00 H new ATOM 0 HA ALA B 147 -26.250 -3.477 -2.717 1.00 0.00 H new ATOM 0 HB1 ALA B 147 -26.005 -1.435 -1.325 1.00 0.00 H new ATOM 0 HB2 ALA B 147 -24.776 -2.657 -0.922 1.00 0.00 H new ATOM 0 HB3 ALA B 147 -24.336 -1.245 -1.912 1.00 0.00 H new ATOM 1652 N ILE B 148 -25.283 -0.971 -4.678 1.00 0.00 N ATOM 1653 CA ILE B 148 -25.817 -0.058 -5.697 1.00 0.00 C ATOM 1654 C ILE B 148 -26.321 -0.806 -6.920 1.00 0.00 C ATOM 1655 O ILE B 148 -27.324 -0.400 -7.502 1.00 0.00 O ATOM 1656 CB ILE B 148 -24.794 1.032 -6.073 1.00 0.00 C ATOM 1657 CG1 ILE B 148 -25.374 2.171 -6.928 1.00 0.00 C ATOM 1658 CG2 ILE B 148 -23.509 0.472 -6.689 1.00 0.00 C ATOM 1659 CD1 ILE B 148 -24.662 3.492 -6.595 1.00 0.00 C ATOM 0 H ILE B 148 -24.278 -0.894 -4.522 1.00 0.00 H new ATOM 0 HA ILE B 148 -26.678 0.446 -5.258 1.00 0.00 H new ATOM 0 HB ILE B 148 -24.524 1.477 -5.115 1.00 0.00 H new ATOM 0 HG12 ILE B 148 -25.254 1.940 -7.986 1.00 0.00 H new ATOM 0 HG13 ILE B 148 -26.444 2.268 -6.742 1.00 0.00 H new ATOM 0 HG21 ILE B 148 -22.833 1.293 -6.930 1.00 0.00 H new ATOM 0 HG22 ILE B 148 -23.027 -0.198 -5.978 1.00 0.00 H new ATOM 0 HG23 ILE B 148 -23.751 -0.078 -7.599 1.00 0.00 H new ATOM 0 HD11 ILE B 148 -25.079 4.294 -7.205 1.00 0.00 H new ATOM 0 HD12 ILE B 148 -24.805 3.727 -5.540 1.00 0.00 H new ATOM 0 HD13 ILE B 148 -23.597 3.394 -6.804 1.00 0.00 H new ATOM 1671 N GLU B 149 -25.656 -1.900 -7.292 1.00 0.00 N ATOM 1672 CA GLU B 149 -26.037 -2.684 -8.451 1.00 0.00 C ATOM 1673 C GLU B 149 -27.336 -3.452 -8.224 1.00 0.00 C ATOM 1674 O GLU B 149 -27.879 -3.988 -9.190 1.00 0.00 O ATOM 1675 CB GLU B 149 -24.865 -3.573 -8.897 1.00 0.00 C ATOM 1676 CG GLU B 149 -23.682 -2.746 -9.439 1.00 0.00 C ATOM 1677 CD GLU B 149 -24.090 -1.692 -10.467 1.00 0.00 C ATOM 1678 OE1 GLU B 149 -24.882 -1.996 -11.388 1.00 0.00 O ATOM 1679 OE2 GLU B 149 -23.638 -0.526 -10.357 1.00 0.00 O ATOM 0 H GLU B 149 -24.841 -2.261 -6.795 1.00 0.00 H new ATOM 0 HA GLU B 149 -26.255 -2.006 -9.276 1.00 0.00 H new ATOM 0 HB2 GLU B 149 -24.528 -4.177 -8.055 1.00 0.00 H new ATOM 0 HB3 GLU B 149 -25.207 -4.263 -9.668 1.00 0.00 H new ATOM 0 HG2 GLU B 149 -23.182 -2.253 -8.605 1.00 0.00 H new ATOM 0 HG3 GLU B 149 -22.956 -3.421 -9.892 1.00 0.00 H new ATOM 1686 N ALA B 150 -27.794 -3.542 -6.970 1.00 0.00 N ATOM 1687 CA ALA B 150 -29.019 -4.221 -6.589 1.00 0.00 C ATOM 1688 C ALA B 150 -30.246 -3.295 -6.625 1.00 0.00 C ATOM 1689 O ALA B 150 -31.346 -3.800 -6.404 1.00 0.00 O ATOM 1690 CB ALA B 150 -28.849 -4.805 -5.180 1.00 0.00 C ATOM 0 H ALA B 150 -27.303 -3.130 -6.177 1.00 0.00 H new ATOM 0 HA ALA B 150 -29.199 -5.013 -7.316 1.00 0.00 H new ATOM 0 HB1 ALA B 150 -29.765 -5.317 -4.885 1.00 0.00 H new ATOM 0 HB2 ALA B 150 -28.020 -5.513 -5.177 1.00 0.00 H new ATOM 0 HB3 ALA B 150 -28.641 -4.000 -4.475 1.00 0.00 H new ATOM 1696 N LYS B 151 -30.095 -1.975 -6.827 1.00 0.00 N ATOM 1697 CA LYS B 151 -31.227 -1.056 -6.873 1.00 0.00 C ATOM 1698 C LYS B 151 -31.579 -0.767 -8.322 1.00 0.00 C ATOM 1699 O LYS B 151 -32.780 -0.769 -8.637 1.00 0.00 O ATOM 1700 CB LYS B 151 -30.839 0.249 -6.189 1.00 0.00 C ATOM 1701 CG LYS B 151 -30.441 0.158 -4.714 1.00 0.00 C ATOM 1702 CD LYS B 151 -30.184 1.561 -4.153 1.00 0.00 C ATOM 1703 CE LYS B 151 -29.074 2.284 -4.931 1.00 0.00 C ATOM 1704 NZ LYS B 151 -29.541 2.966 -6.170 1.00 0.00 N ATOM 0 H LYS B 151 -29.189 -1.525 -6.961 1.00 0.00 H new ATOM 0 HA LYS B 151 -32.082 -1.502 -6.366 1.00 0.00 H new ATOM 0 HB2 LYS B 151 -30.007 0.688 -6.740 1.00 0.00 H new ATOM 0 HB3 LYS B 151 -31.677 0.940 -6.274 1.00 0.00 H new ATOM 0 HG2 LYS B 151 -31.232 -0.331 -4.145 1.00 0.00 H new ATOM 0 HG3 LYS B 151 -29.546 -0.455 -4.607 1.00 0.00 H new ATOM 0 HD2 LYS B 151 -31.102 2.146 -4.199 1.00 0.00 H new ATOM 0 HD3 LYS B 151 -29.905 1.488 -3.102 1.00 0.00 H new ATOM 0 HE2 LYS B 151 -28.609 3.022 -4.277 1.00 0.00 H new ATOM 0 HE3 LYS B 151 -28.302 1.562 -5.196 1.00 0.00 H new ATOM 0 HZ1 LYS B 151 -29.008 2.605 -6.987 1.00 0.00 H new ATOM 0 HZ2 LYS B 151 -30.555 2.779 -6.308 1.00 0.00 H new ATOM 0 HZ3 LYS B 151 -29.387 3.991 -6.081 1.00 0.00 H new TER 1718 LYS B 151