USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1052 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -136:sc= 0.0192 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 45:sc= 0.816 USER MOD Single : A 5 SER OG : rot 72:sc= 0.154 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0.151 K(o=0.15,f=-0.77) USER MOD Single : A 19 TYR OH : rot -19:sc= 0.134 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= 0.0996 K(o=0.1,f=-2.6!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -110:sc= -0.595 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 54:sc= 0.00601 USER MOD Single : A 35 THR OG1 : rot -52:sc= 0.54 USER MOD Single : A 39 SER OG : rot 180:sc= -0.243 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.0259) USER MOD Single : A 64 HIS : no HD1:sc= -7.03! C(o=-7!,f=-12!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -0.157 K(o=-0.16,f=-1.2!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl -163:sc= 0 (180deg=-0.111) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot -71:sc= 0.12 USER MOD Single : A 124 GLN : amide:sc= -0.132 K(o=-0.13,f=-0.93) USER MOD Single : A 127 GLN : amide:sc= -0.315 K(o=-0.31,f=-2.4!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 92:sc= 1.41 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.640 -7.335 -2.161 1.00 54.04 N ATOM 2 CA GLY A 1 21.615 -6.299 -1.876 1.00 73.32 C ATOM 3 C GLY A 1 21.216 -4.953 -2.448 1.00 64.02 C ATOM 4 O GLY A 1 20.033 -4.615 -2.492 1.00 72.51 O ATOM 0 H1 GLY A 1 20.477 -7.903 -1.305 1.00 54.04 H new ATOM 0 H2 GLY A 1 19.746 -6.897 -2.462 1.00 54.04 H new ATOM 0 H3 GLY A 1 20.997 -7.949 -2.921 1.00 54.04 H new ATOM 0 HA2 GLY A 1 21.740 -6.209 -0.797 1.00 73.32 H new ATOM 0 HA3 GLY A 1 22.582 -6.592 -2.285 1.00 73.32 H new ATOM 8 N SER A 2 22.206 -4.181 -2.887 1.00 73.13 N ATOM 9 CA SER A 2 21.952 -2.862 -3.454 1.00 61.40 C ATOM 10 C SER A 2 21.354 -1.926 -2.408 1.00 64.35 C ATOM 11 O SER A 2 21.259 -2.274 -1.231 1.00 13.50 O ATOM 12 CB SER A 2 21.011 -2.972 -4.655 1.00 22.13 C ATOM 13 OG SER A 2 21.739 -3.101 -5.864 1.00 11.31 O ATOM 0 H SER A 2 23.190 -4.447 -2.861 1.00 73.13 H new ATOM 0 HA SER A 2 22.904 -2.447 -3.785 1.00 61.40 H new ATOM 0 HB2 SER A 2 20.354 -3.833 -4.529 1.00 22.13 H new ATOM 0 HB3 SER A 2 20.373 -2.089 -4.703 1.00 22.13 H new ATOM 0 HG SER A 2 21.115 -3.171 -6.616 1.00 11.31 H new ATOM 19 N SER A 3 20.952 -0.739 -2.847 1.00 41.23 N ATOM 20 CA SER A 3 20.366 0.250 -1.950 1.00 20.43 C ATOM 21 C SER A 3 19.750 1.402 -2.738 1.00 21.53 C ATOM 22 O SER A 3 19.941 1.513 -3.948 1.00 3.44 O ATOM 23 CB SER A 3 21.426 0.786 -0.986 1.00 44.31 C ATOM 24 OG SER A 3 21.404 0.077 0.242 1.00 51.44 O ATOM 0 H SER A 3 21.021 -0.438 -3.819 1.00 41.23 H new ATOM 0 HA SER A 3 19.577 -0.238 -1.377 1.00 20.43 H new ATOM 0 HB2 SER A 3 22.413 0.701 -1.441 1.00 44.31 H new ATOM 0 HB3 SER A 3 21.251 1.846 -0.801 1.00 44.31 H new ATOM 0 HG SER A 3 21.348 -0.885 0.063 1.00 51.44 H new ATOM 30 N GLY A 4 19.008 2.258 -2.040 1.00 61.24 N ATOM 31 CA GLY A 4 18.374 3.390 -2.691 1.00 24.42 C ATOM 32 C GLY A 4 18.595 4.688 -1.939 1.00 61.40 C ATOM 33 O GLY A 4 19.334 4.726 -0.955 1.00 65.43 O ATOM 0 H GLY A 4 18.835 2.188 -1.037 1.00 61.24 H new ATOM 0 HA2 GLY A 4 18.765 3.489 -3.704 1.00 24.42 H new ATOM 0 HA3 GLY A 4 17.304 3.202 -2.779 1.00 24.42 H new ATOM 37 N SER A 5 17.953 5.755 -2.403 1.00 42.51 N ATOM 38 CA SER A 5 18.087 7.063 -1.772 1.00 23.34 C ATOM 39 C SER A 5 17.473 8.153 -2.643 1.00 72.12 C ATOM 40 O SER A 5 17.103 7.910 -3.792 1.00 64.14 O ATOM 41 CB SER A 5 19.562 7.376 -1.507 1.00 74.34 C ATOM 42 OG SER A 5 19.836 7.404 -0.116 1.00 41.14 O ATOM 0 H SER A 5 17.335 5.740 -3.214 1.00 42.51 H new ATOM 0 HA SER A 5 17.552 7.037 -0.823 1.00 23.34 H new ATOM 0 HB2 SER A 5 20.189 6.626 -1.989 1.00 74.34 H new ATOM 0 HB3 SER A 5 19.818 8.338 -1.951 1.00 74.34 H new ATOM 0 HG SER A 5 19.805 6.492 0.242 1.00 41.14 H new ATOM 48 N SER A 6 17.368 9.357 -2.089 1.00 34.22 N ATOM 49 CA SER A 6 16.795 10.484 -2.814 1.00 13.35 C ATOM 50 C SER A 6 15.330 10.226 -3.152 1.00 34.43 C ATOM 51 O SER A 6 14.873 9.082 -3.151 1.00 5.20 O ATOM 52 CB SER A 6 17.587 10.750 -4.095 1.00 32.10 C ATOM 53 OG SER A 6 18.946 11.030 -3.806 1.00 14.42 O ATOM 0 H SER A 6 17.672 9.576 -1.141 1.00 34.22 H new ATOM 0 HA SER A 6 16.851 11.363 -2.172 1.00 13.35 H new ATOM 0 HB2 SER A 6 17.523 9.883 -4.752 1.00 32.10 H new ATOM 0 HB3 SER A 6 17.146 11.590 -4.631 1.00 32.10 H new ATOM 0 HG SER A 6 19.431 11.195 -4.642 1.00 14.42 H new ATOM 59 N GLY A 7 14.597 11.296 -3.442 1.00 4.13 N ATOM 60 CA GLY A 7 13.192 11.164 -3.779 1.00 50.31 C ATOM 61 C GLY A 7 12.320 12.151 -3.027 1.00 10.13 C ATOM 62 O GLY A 7 12.516 12.376 -1.832 1.00 43.53 O ATOM 0 H GLY A 7 14.951 12.252 -3.450 1.00 4.13 H new ATOM 0 HA2 GLY A 7 13.063 11.313 -4.851 1.00 50.31 H new ATOM 0 HA3 GLY A 7 12.862 10.149 -3.557 1.00 50.31 H new ATOM 66 N MET A 8 11.357 12.741 -3.727 1.00 21.12 N ATOM 67 CA MET A 8 10.454 13.709 -3.117 1.00 13.32 C ATOM 68 C MET A 8 9.054 13.122 -2.958 1.00 4.02 C ATOM 69 O MET A 8 8.543 13.011 -1.844 1.00 53.41 O ATOM 70 CB MET A 8 10.391 14.983 -3.961 1.00 43.23 C ATOM 71 CG MET A 8 11.135 16.157 -3.346 1.00 2.52 C ATOM 72 SD MET A 8 10.027 17.353 -2.573 1.00 4.12 S ATOM 73 CE MET A 8 11.124 18.755 -2.379 1.00 44.55 C ATOM 0 H MET A 8 11.182 12.566 -4.716 1.00 21.12 H new ATOM 0 HA MET A 8 10.841 13.955 -2.128 1.00 13.32 H new ATOM 0 HB2 MET A 8 10.807 14.777 -4.947 1.00 43.23 H new ATOM 0 HB3 MET A 8 9.347 15.261 -4.107 1.00 43.23 H new ATOM 0 HG2 MET A 8 11.840 15.786 -2.602 1.00 2.52 H new ATOM 0 HG3 MET A 8 11.721 16.656 -4.118 1.00 2.52 H new ATOM 0 HE1 MET A 8 10.583 19.578 -1.913 1.00 44.55 H new ATOM 0 HE2 MET A 8 11.968 18.472 -1.749 1.00 44.55 H new ATOM 0 HE3 MET A 8 11.490 19.069 -3.357 1.00 44.55 H new ATOM 83 N GLU A 9 8.443 12.750 -4.078 1.00 24.44 N ATOM 84 CA GLU A 9 7.103 12.175 -4.060 1.00 43.42 C ATOM 85 C GLU A 9 7.092 10.841 -3.318 1.00 1.34 C ATOM 86 O GLU A 9 8.145 10.281 -3.009 1.00 71.21 O ATOM 87 CB GLU A 9 6.589 11.981 -5.488 1.00 20.30 C ATOM 88 CG GLU A 9 6.258 13.282 -6.199 1.00 22.52 C ATOM 89 CD GLU A 9 5.045 13.976 -5.610 1.00 44.32 C ATOM 90 OE1 GLU A 9 3.997 13.313 -5.462 1.00 4.31 O ATOM 91 OE2 GLU A 9 5.144 15.181 -5.298 1.00 72.24 O ATOM 0 H GLU A 9 8.853 12.836 -5.008 1.00 24.44 H new ATOM 0 HA GLU A 9 6.445 12.868 -3.535 1.00 43.42 H new ATOM 0 HB2 GLU A 9 7.341 11.443 -6.065 1.00 20.30 H new ATOM 0 HB3 GLU A 9 5.698 11.354 -5.462 1.00 20.30 H new ATOM 0 HG2 GLU A 9 7.117 13.951 -6.144 1.00 22.52 H new ATOM 0 HG3 GLU A 9 6.079 13.079 -7.255 1.00 22.52 H new ATOM 98 N LEU A 10 5.895 10.340 -3.034 1.00 60.30 N ATOM 99 CA LEU A 10 5.745 9.072 -2.327 1.00 44.51 C ATOM 100 C LEU A 10 5.152 8.005 -3.241 1.00 55.34 C ATOM 101 O LEU A 10 5.740 6.942 -3.436 1.00 74.43 O ATOM 102 CB LEU A 10 4.859 9.255 -1.094 1.00 1.12 C ATOM 103 CG LEU A 10 5.565 9.164 0.259 1.00 32.32 C ATOM 104 CD1 LEU A 10 4.623 9.571 1.382 1.00 74.24 C ATOM 105 CD2 LEU A 10 6.095 7.757 0.491 1.00 64.41 C ATOM 0 H LEU A 10 5.015 10.792 -3.282 1.00 60.30 H new ATOM 0 HA LEU A 10 6.734 8.742 -2.010 1.00 44.51 H new ATOM 0 HB2 LEU A 10 4.372 10.228 -1.162 1.00 1.12 H new ATOM 0 HB3 LEU A 10 4.072 8.502 -1.122 1.00 1.12 H new ATOM 0 HG LEU A 10 6.410 9.853 0.252 1.00 32.32 H new ATOM 0 HD11 LEU A 10 5.143 9.500 2.337 1.00 74.24 H new ATOM 0 HD12 LEU A 10 4.292 10.597 1.225 1.00 74.24 H new ATOM 0 HD13 LEU A 10 3.758 8.908 1.390 1.00 74.24 H new ATOM 0 HD21 LEU A 10 6.594 7.711 1.459 1.00 64.41 H new ATOM 0 HD22 LEU A 10 5.266 7.049 0.476 1.00 64.41 H new ATOM 0 HD23 LEU A 10 6.805 7.501 -0.296 1.00 64.41 H new ATOM 117 N PHE A 11 3.982 8.299 -3.801 1.00 62.41 N ATOM 118 CA PHE A 11 3.309 7.365 -4.697 1.00 15.25 C ATOM 119 C PHE A 11 3.725 7.605 -6.145 1.00 33.40 C ATOM 120 O PHE A 11 3.064 8.339 -6.880 1.00 43.54 O ATOM 121 CB PHE A 11 1.790 7.502 -4.562 1.00 32.11 C ATOM 122 CG PHE A 11 1.282 7.200 -3.180 1.00 51.35 C ATOM 123 CD1 PHE A 11 1.552 8.057 -2.126 1.00 1.22 C ATOM 124 CD2 PHE A 11 0.534 6.059 -2.937 1.00 52.54 C ATOM 125 CE1 PHE A 11 1.087 7.781 -0.855 1.00 35.21 C ATOM 126 CE2 PHE A 11 0.064 5.779 -1.669 1.00 23.14 C ATOM 127 CZ PHE A 11 0.341 6.641 -0.626 1.00 13.42 C ATOM 0 H PHE A 11 3.481 9.175 -3.650 1.00 62.41 H new ATOM 0 HA PHE A 11 3.603 6.354 -4.416 1.00 15.25 H new ATOM 0 HB2 PHE A 11 1.499 8.517 -4.834 1.00 32.11 H new ATOM 0 HB3 PHE A 11 1.308 6.831 -5.273 1.00 32.11 H new ATOM 0 HD1 PHE A 11 2.133 8.951 -2.300 1.00 1.22 H new ATOM 0 HD2 PHE A 11 0.316 5.381 -3.749 1.00 52.54 H new ATOM 0 HE1 PHE A 11 1.306 8.456 -0.041 1.00 35.21 H new ATOM 0 HE2 PHE A 11 -0.519 4.887 -1.493 1.00 23.14 H new ATOM 0 HZ PHE A 11 -0.025 6.424 0.367 1.00 13.42 H new ATOM 137 N THR A 12 4.825 6.978 -6.549 1.00 45.24 N ATOM 138 CA THR A 12 5.332 7.123 -7.908 1.00 71.21 C ATOM 139 C THR A 12 5.878 5.801 -8.435 1.00 14.23 C ATOM 140 O THR A 12 6.372 4.974 -7.669 1.00 33.31 O ATOM 141 CB THR A 12 6.440 8.189 -7.984 1.00 0.45 C ATOM 142 OG1 THR A 12 7.472 7.892 -7.036 1.00 43.05 O ATOM 143 CG2 THR A 12 5.877 9.576 -7.709 1.00 41.31 C ATOM 0 H THR A 12 5.382 6.365 -5.954 1.00 45.24 H new ATOM 0 HA THR A 12 4.492 7.439 -8.526 1.00 71.21 H new ATOM 0 HB THR A 12 6.857 8.176 -8.991 1.00 0.45 H new ATOM 0 HG1 THR A 12 8.174 8.574 -7.092 1.00 43.05 H new ATOM 0 HG21 THR A 12 6.679 10.312 -7.768 1.00 41.31 H new ATOM 0 HG22 THR A 12 5.112 9.812 -8.449 1.00 41.31 H new ATOM 0 HG23 THR A 12 5.436 9.599 -6.712 1.00 41.31 H new ATOM 151 N GLU A 13 5.786 5.609 -9.747 1.00 43.34 N ATOM 152 CA GLU A 13 6.272 4.386 -10.375 1.00 72.13 C ATOM 153 C GLU A 13 7.538 3.886 -9.686 1.00 43.52 C ATOM 154 O GLU A 13 7.723 2.684 -9.500 1.00 11.23 O ATOM 155 CB GLU A 13 6.548 4.625 -11.862 1.00 75.54 C ATOM 156 CG GLU A 13 6.439 3.368 -12.710 1.00 73.04 C ATOM 157 CD GLU A 13 7.265 3.448 -13.979 1.00 10.23 C ATOM 158 OE1 GLU A 13 8.499 3.274 -13.894 1.00 74.13 O ATOM 159 OE2 GLU A 13 6.678 3.683 -15.056 1.00 51.32 O ATOM 0 H GLU A 13 5.380 6.284 -10.395 1.00 43.34 H new ATOM 0 HA GLU A 13 5.499 3.624 -10.274 1.00 72.13 H new ATOM 0 HB2 GLU A 13 5.846 5.369 -12.238 1.00 75.54 H new ATOM 0 HB3 GLU A 13 7.548 5.044 -11.975 1.00 75.54 H new ATOM 0 HG2 GLU A 13 6.764 2.509 -12.123 1.00 73.04 H new ATOM 0 HG3 GLU A 13 5.394 3.199 -12.971 1.00 73.04 H new ATOM 166 N ALA A 14 8.408 4.818 -9.311 1.00 52.21 N ATOM 167 CA ALA A 14 9.657 4.474 -8.641 1.00 54.55 C ATOM 168 C ALA A 14 9.392 3.803 -7.298 1.00 33.13 C ATOM 169 O ALA A 14 9.867 2.697 -7.042 1.00 72.21 O ATOM 170 CB ALA A 14 10.515 5.717 -8.453 1.00 33.50 C ATOM 0 H ALA A 14 8.271 5.818 -9.460 1.00 52.21 H new ATOM 0 HA ALA A 14 10.196 3.766 -9.271 1.00 54.55 H new ATOM 0 HB1 ALA A 14 11.444 5.445 -7.952 1.00 33.50 H new ATOM 0 HB2 ALA A 14 10.742 6.153 -9.426 1.00 33.50 H new ATOM 0 HB3 ALA A 14 9.975 6.444 -7.847 1.00 33.50 H new ATOM 176 N TRP A 15 8.632 4.480 -6.444 1.00 71.44 N ATOM 177 CA TRP A 15 8.304 3.948 -5.125 1.00 42.13 C ATOM 178 C TRP A 15 7.505 2.656 -5.243 1.00 72.11 C ATOM 179 O TRP A 15 7.705 1.719 -4.470 1.00 72.30 O ATOM 180 CB TRP A 15 7.514 4.980 -4.320 1.00 0.25 C ATOM 181 CG TRP A 15 7.251 4.556 -2.906 1.00 63.50 C ATOM 182 CD1 TRP A 15 7.959 4.917 -1.796 1.00 5.11 C ATOM 183 CD2 TRP A 15 6.207 3.686 -2.453 1.00 25.12 C ATOM 184 NE1 TRP A 15 7.419 4.326 -0.680 1.00 61.33 N ATOM 185 CE2 TRP A 15 6.343 3.565 -1.056 1.00 10.33 C ATOM 186 CE3 TRP A 15 5.171 2.999 -3.090 1.00 62.25 C ATOM 187 CZ2 TRP A 15 5.481 2.786 -0.289 1.00 72.44 C ATOM 188 CZ3 TRP A 15 4.318 2.225 -2.328 1.00 54.23 C ATOM 189 CH2 TRP A 15 4.475 2.124 -0.940 1.00 2.23 C ATOM 0 H TRP A 15 8.232 5.397 -6.641 1.00 71.44 H new ATOM 0 HA TRP A 15 9.237 3.729 -4.606 1.00 42.13 H new ATOM 0 HB2 TRP A 15 8.062 5.922 -4.313 1.00 0.25 H new ATOM 0 HB3 TRP A 15 6.563 5.168 -4.818 1.00 0.25 H new ATOM 0 HD1 TRP A 15 8.818 5.572 -1.796 1.00 5.11 H new ATOM 0 HE1 TRP A 15 7.763 4.436 0.274 1.00 61.33 H new ATOM 0 HE3 TRP A 15 5.039 3.072 -4.159 1.00 62.25 H new ATOM 0 HZ2 TRP A 15 5.602 2.707 0.781 1.00 72.44 H new ATOM 0 HZ3 TRP A 15 3.515 1.688 -2.811 1.00 54.23 H new ATOM 0 HH2 TRP A 15 3.789 1.512 -0.372 1.00 2.23 H new ATOM 200 N ALA A 16 6.598 2.611 -6.213 1.00 42.22 N ATOM 201 CA ALA A 16 5.769 1.432 -6.433 1.00 5.25 C ATOM 202 C ALA A 16 6.622 0.226 -6.810 1.00 64.25 C ATOM 203 O ALA A 16 6.369 -0.890 -6.357 1.00 31.30 O ATOM 204 CB ALA A 16 4.733 1.708 -7.511 1.00 44.14 C ATOM 0 H ALA A 16 6.418 3.379 -6.860 1.00 42.22 H new ATOM 0 HA ALA A 16 5.252 1.202 -5.501 1.00 5.25 H new ATOM 0 HB1 ALA A 16 4.122 0.819 -7.664 1.00 44.14 H new ATOM 0 HB2 ALA A 16 4.097 2.537 -7.200 1.00 44.14 H new ATOM 0 HB3 ALA A 16 5.237 1.967 -8.442 1.00 44.14 H new ATOM 210 N GLN A 17 7.632 0.457 -7.644 1.00 14.44 N ATOM 211 CA GLN A 17 8.519 -0.613 -8.083 1.00 43.53 C ATOM 212 C GLN A 17 9.524 -0.968 -6.992 1.00 31.22 C ATOM 213 O GLN A 17 9.609 -2.119 -6.565 1.00 10.21 O ATOM 214 CB GLN A 17 9.258 -0.200 -9.358 1.00 70.11 C ATOM 215 CG GLN A 17 8.340 0.005 -10.553 1.00 41.50 C ATOM 216 CD GLN A 17 8.707 -0.880 -11.728 1.00 13.42 C ATOM 217 OE1 GLN A 17 9.878 -1.189 -11.945 1.00 64.00 O ATOM 218 NE2 GLN A 17 7.704 -1.291 -12.495 1.00 11.32 N ATOM 0 H GLN A 17 7.856 1.375 -8.028 1.00 14.44 H new ATOM 0 HA GLN A 17 7.911 -1.493 -8.292 1.00 43.53 H new ATOM 0 HB2 GLN A 17 9.805 0.723 -9.168 1.00 70.11 H new ATOM 0 HB3 GLN A 17 9.996 -0.963 -9.604 1.00 70.11 H new ATOM 0 HG2 GLN A 17 7.311 -0.200 -10.256 1.00 41.50 H new ATOM 0 HG3 GLN A 17 8.380 1.049 -10.863 1.00 41.50 H new ATOM 0 HE21 GLN A 17 6.748 -1.010 -12.278 1.00 11.32 H new ATOM 0 HE22 GLN A 17 7.890 -1.887 -13.301 1.00 11.32 H new ATOM 227 N ALA A 18 10.284 0.027 -6.547 1.00 25.45 N ATOM 228 CA ALA A 18 11.282 -0.181 -5.505 1.00 2.50 C ATOM 229 C ALA A 18 10.667 -0.853 -4.282 1.00 75.13 C ATOM 230 O ALA A 18 11.223 -1.808 -3.741 1.00 24.33 O ATOM 231 CB ALA A 18 11.923 1.143 -5.116 1.00 14.30 C ATOM 0 H ALA A 18 10.228 0.985 -6.892 1.00 25.45 H new ATOM 0 HA ALA A 18 12.053 -0.842 -5.901 1.00 2.50 H new ATOM 0 HB1 ALA A 18 12.666 0.972 -4.337 1.00 14.30 H new ATOM 0 HB2 ALA A 18 12.406 1.584 -5.988 1.00 14.30 H new ATOM 0 HB3 ALA A 18 11.157 1.823 -4.744 1.00 14.30 H new ATOM 237 N TYR A 19 9.517 -0.347 -3.850 1.00 74.44 N ATOM 238 CA TYR A 19 8.827 -0.898 -2.689 1.00 2.41 C ATOM 239 C TYR A 19 8.463 -2.361 -2.915 1.00 33.12 C ATOM 240 O TYR A 19 8.411 -3.153 -1.973 1.00 14.03 O ATOM 241 CB TYR A 19 7.566 -0.087 -2.388 1.00 22.12 C ATOM 242 CG TYR A 19 6.706 -0.687 -1.298 1.00 44.11 C ATOM 243 CD1 TYR A 19 7.277 -1.205 -0.142 1.00 63.13 C ATOM 244 CD2 TYR A 19 5.324 -0.738 -1.426 1.00 15.34 C ATOM 245 CE1 TYR A 19 6.497 -1.756 0.855 1.00 54.42 C ATOM 246 CE2 TYR A 19 4.535 -1.285 -0.432 1.00 61.24 C ATOM 247 CZ TYR A 19 5.125 -1.793 0.706 1.00 3.13 C ATOM 248 OH TYR A 19 4.344 -2.340 1.697 1.00 74.24 O ATOM 0 H TYR A 19 9.043 0.444 -4.286 1.00 74.44 H new ATOM 0 HA TYR A 19 9.502 -0.839 -1.835 1.00 2.41 H new ATOM 0 HB2 TYR A 19 7.855 0.923 -2.097 1.00 22.12 H new ATOM 0 HB3 TYR A 19 6.974 0.001 -3.299 1.00 22.12 H new ATOM 0 HD1 TYR A 19 8.350 -1.176 -0.021 1.00 63.13 H new ATOM 0 HD2 TYR A 19 4.858 -0.344 -2.317 1.00 15.34 H new ATOM 0 HE1 TYR A 19 6.957 -2.156 1.746 1.00 54.42 H new ATOM 0 HE2 TYR A 19 3.461 -1.314 -0.546 1.00 61.24 H new ATOM 0 HH TYR A 19 4.897 -2.908 2.274 1.00 74.24 H new ATOM 258 N CYS A 20 8.213 -2.715 -4.171 1.00 21.01 N ATOM 259 CA CYS A 20 7.854 -4.084 -4.523 1.00 70.20 C ATOM 260 C CYS A 20 9.038 -5.026 -4.323 1.00 41.15 C ATOM 261 O CYS A 20 8.911 -6.073 -3.687 1.00 51.44 O ATOM 262 CB CYS A 20 7.375 -4.150 -5.975 1.00 11.14 C ATOM 263 SG CYS A 20 6.655 -5.755 -6.448 1.00 11.33 S ATOM 0 H CYS A 20 8.252 -2.073 -4.962 1.00 21.01 H new ATOM 0 HA CYS A 20 7.045 -4.402 -3.865 1.00 70.20 H new ATOM 0 HB2 CYS A 20 6.632 -3.369 -6.137 1.00 11.14 H new ATOM 0 HB3 CYS A 20 8.216 -3.933 -6.634 1.00 11.14 H new ATOM 268 N ARG A 21 10.188 -4.646 -4.869 1.00 42.34 N ATOM 269 CA ARG A 21 11.394 -5.456 -4.752 1.00 44.04 C ATOM 270 C ARG A 21 11.901 -5.472 -3.313 1.00 42.34 C ATOM 271 O ARG A 21 12.460 -6.467 -2.851 1.00 41.32 O ATOM 272 CB ARG A 21 12.485 -4.922 -5.683 1.00 61.51 C ATOM 273 CG ARG A 21 12.961 -3.524 -5.324 1.00 31.13 C ATOM 274 CD ARG A 21 14.323 -3.226 -5.932 1.00 4.04 C ATOM 275 NE ARG A 21 15.327 -2.937 -4.911 1.00 51.31 N ATOM 276 CZ ARG A 21 15.399 -1.781 -4.258 1.00 31.51 C ATOM 277 NH1 ARG A 21 14.530 -0.814 -4.517 1.00 41.13 N ATOM 278 NH2 ARG A 21 16.340 -1.594 -3.343 1.00 3.54 N ATOM 0 H ARG A 21 10.310 -3.782 -5.397 1.00 42.34 H new ATOM 0 HA ARG A 21 11.145 -6.477 -5.043 1.00 44.04 H new ATOM 0 HB2 ARG A 21 13.336 -5.603 -5.660 1.00 61.51 H new ATOM 0 HB3 ARG A 21 12.108 -4.917 -6.706 1.00 61.51 H new ATOM 0 HG2 ARG A 21 12.236 -2.790 -5.676 1.00 31.13 H new ATOM 0 HG3 ARG A 21 13.015 -3.424 -4.240 1.00 31.13 H new ATOM 0 HD2 ARG A 21 14.648 -4.078 -6.529 1.00 4.04 H new ATOM 0 HD3 ARG A 21 14.240 -2.376 -6.609 1.00 4.04 H new ATOM 0 HE ARG A 21 16.010 -3.661 -4.687 1.00 51.31 H new ATOM 0 HH11 ARG A 21 13.804 -0.956 -5.219 1.00 41.13 H new ATOM 0 HH12 ARG A 21 14.588 0.072 -4.014 1.00 41.13 H new ATOM 0 HH21 ARG A 21 17.009 -2.337 -3.140 1.00 3.54 H new ATOM 0 HH22 ARG A 21 16.395 -0.707 -2.842 1.00 3.54 H new ATOM 292 N LYS A 22 11.703 -4.363 -2.609 1.00 54.24 N ATOM 293 CA LYS A 22 12.138 -4.247 -1.222 1.00 73.55 C ATOM 294 C LYS A 22 11.505 -5.336 -0.362 1.00 30.23 C ATOM 295 O LYS A 22 12.122 -5.832 0.582 1.00 32.22 O ATOM 296 CB LYS A 22 11.776 -2.868 -0.666 1.00 5.02 C ATOM 297 CG LYS A 22 12.638 -2.443 0.510 1.00 10.52 C ATOM 298 CD LYS A 22 14.021 -2.002 0.059 1.00 31.11 C ATOM 299 CE LYS A 22 14.672 -1.079 1.076 1.00 22.55 C ATOM 300 NZ LYS A 22 16.158 -1.165 1.031 1.00 22.14 N ATOM 0 H LYS A 22 11.243 -3.530 -2.977 1.00 54.24 H new ATOM 0 HA LYS A 22 13.221 -4.370 -1.195 1.00 73.55 H new ATOM 0 HB2 LYS A 22 11.870 -2.128 -1.461 1.00 5.02 H new ATOM 0 HB3 LYS A 22 10.731 -2.873 -0.357 1.00 5.02 H new ATOM 0 HG2 LYS A 22 12.151 -1.626 1.043 1.00 10.52 H new ATOM 0 HG3 LYS A 22 12.731 -3.271 1.212 1.00 10.52 H new ATOM 0 HD2 LYS A 22 14.651 -2.878 -0.094 1.00 31.11 H new ATOM 0 HD3 LYS A 22 13.946 -1.492 -0.901 1.00 31.11 H new ATOM 0 HE2 LYS A 22 14.362 -0.052 0.885 1.00 22.55 H new ATOM 0 HE3 LYS A 22 14.323 -1.337 2.076 1.00 22.55 H new ATOM 0 HZ1 LYS A 22 16.565 -0.521 1.739 1.00 22.14 H new ATOM 0 HZ2 LYS A 22 16.456 -2.140 1.238 1.00 22.14 H new ATOM 0 HZ3 LYS A 22 16.493 -0.894 0.084 1.00 22.14 H new ATOM 314 N LEU A 23 10.273 -5.706 -0.694 1.00 2.21 N ATOM 315 CA LEU A 23 9.557 -6.738 0.048 1.00 21.15 C ATOM 316 C LEU A 23 10.220 -8.099 -0.135 1.00 4.34 C ATOM 317 O LEU A 23 10.455 -8.821 0.832 1.00 12.15 O ATOM 318 CB LEU A 23 8.099 -6.803 -0.408 1.00 62.11 C ATOM 319 CG LEU A 23 7.254 -5.559 -0.133 1.00 55.22 C ATOM 320 CD1 LEU A 23 5.903 -5.668 -0.823 1.00 20.10 C ATOM 321 CD2 LEU A 23 7.075 -5.355 1.364 1.00 35.32 C ATOM 0 H LEU A 23 9.749 -5.307 -1.473 1.00 2.21 H new ATOM 0 HA LEU A 23 9.589 -6.478 1.106 1.00 21.15 H new ATOM 0 HB2 LEU A 23 8.083 -6.999 -1.480 1.00 62.11 H new ATOM 0 HB3 LEU A 23 7.625 -7.655 0.079 1.00 62.11 H new ATOM 0 HG LEU A 23 7.777 -4.692 -0.537 1.00 55.22 H new ATOM 0 HD11 LEU A 23 5.315 -4.774 -0.616 1.00 20.10 H new ATOM 0 HD12 LEU A 23 6.051 -5.764 -1.899 1.00 20.10 H new ATOM 0 HD13 LEU A 23 5.373 -6.544 -0.450 1.00 20.10 H new ATOM 0 HD21 LEU A 23 6.471 -4.465 1.540 1.00 35.32 H new ATOM 0 HD22 LEU A 23 6.575 -6.224 1.792 1.00 35.32 H new ATOM 0 HD23 LEU A 23 8.051 -5.230 1.833 1.00 35.32 H new ATOM 333 N ASN A 24 10.523 -8.440 -1.383 1.00 74.52 N ATOM 334 CA ASN A 24 11.161 -9.715 -1.694 1.00 25.13 C ATOM 335 C ASN A 24 12.370 -9.952 -0.792 1.00 14.41 C ATOM 336 O ASN A 24 12.718 -11.093 -0.493 1.00 23.24 O ATOM 337 CB ASN A 24 11.592 -9.750 -3.161 1.00 74.14 C ATOM 338 CG ASN A 24 10.501 -10.282 -4.071 1.00 35.11 C ATOM 339 OD1 ASN A 24 10.178 -11.470 -4.042 1.00 1.30 O ATOM 340 ND2 ASN A 24 9.928 -9.403 -4.884 1.00 54.12 N ATOM 0 H ASN A 24 10.337 -7.852 -2.195 1.00 74.52 H new ATOM 0 HA ASN A 24 10.435 -10.509 -1.517 1.00 25.13 H new ATOM 0 HB2 ASN A 24 11.869 -8.745 -3.480 1.00 74.14 H new ATOM 0 HB3 ASN A 24 12.481 -10.373 -3.261 1.00 74.14 H new ATOM 0 HD21 ASN A 24 9.188 -9.702 -5.519 1.00 54.12 H new ATOM 0 HD22 ASN A 24 10.228 -8.428 -4.874 1.00 54.12 H new ATOM 347 N GLU A 25 13.003 -8.865 -0.362 1.00 52.34 N ATOM 348 CA GLU A 25 14.171 -8.955 0.505 1.00 45.44 C ATOM 349 C GLU A 25 13.788 -9.491 1.880 1.00 1.23 C ATOM 350 O GLU A 25 14.527 -10.270 2.484 1.00 52.31 O ATOM 351 CB GLU A 25 14.836 -7.584 0.646 1.00 42.21 C ATOM 352 CG GLU A 25 15.181 -6.935 -0.684 1.00 13.35 C ATOM 353 CD GLU A 25 16.599 -6.398 -0.720 1.00 53.42 C ATOM 354 OE1 GLU A 25 17.519 -7.122 -0.289 1.00 41.03 O ATOM 355 OE2 GLU A 25 16.787 -5.252 -1.182 1.00 31.34 O ATOM 0 H GLU A 25 12.726 -7.913 -0.600 1.00 52.34 H new ATOM 0 HA GLU A 25 14.878 -9.648 0.049 1.00 45.44 H new ATOM 0 HB2 GLU A 25 14.171 -6.923 1.202 1.00 42.21 H new ATOM 0 HB3 GLU A 25 15.746 -7.690 1.236 1.00 42.21 H new ATOM 0 HG2 GLU A 25 15.052 -7.664 -1.484 1.00 13.35 H new ATOM 0 HG3 GLU A 25 14.483 -6.121 -0.879 1.00 13.35 H new ATOM 362 N SER A 26 12.627 -9.069 2.372 1.00 1.43 N ATOM 363 CA SER A 26 12.147 -9.501 3.679 1.00 74.31 C ATOM 364 C SER A 26 11.554 -10.905 3.601 1.00 53.32 C ATOM 365 O SER A 26 10.430 -11.090 3.135 1.00 43.42 O ATOM 366 CB SER A 26 11.100 -8.521 4.212 1.00 62.54 C ATOM 367 OG SER A 26 11.162 -8.426 5.624 1.00 63.31 O ATOM 0 H SER A 26 12.001 -8.428 1.884 1.00 1.43 H new ATOM 0 HA SER A 26 12.996 -9.520 4.363 1.00 74.31 H new ATOM 0 HB2 SER A 26 11.260 -7.537 3.771 1.00 62.54 H new ATOM 0 HB3 SER A 26 10.105 -8.847 3.910 1.00 62.54 H new ATOM 0 HG SER A 26 10.484 -7.792 5.939 1.00 63.31 H new ATOM 373 N GLU A 27 12.318 -11.890 4.062 1.00 52.10 N ATOM 374 CA GLU A 27 11.868 -13.277 4.044 1.00 12.33 C ATOM 375 C GLU A 27 10.619 -13.455 4.902 1.00 53.01 C ATOM 376 O GLU A 27 9.751 -14.270 4.591 1.00 55.02 O ATOM 377 CB GLU A 27 12.979 -14.204 4.544 1.00 3.50 C ATOM 378 CG GLU A 27 12.927 -15.597 3.940 1.00 70.13 C ATOM 379 CD GLU A 27 14.023 -16.503 4.468 1.00 53.51 C ATOM 380 OE1 GLU A 27 15.167 -16.023 4.617 1.00 34.04 O ATOM 381 OE2 GLU A 27 13.737 -17.689 4.731 1.00 60.23 O ATOM 0 H GLU A 27 13.251 -11.754 4.452 1.00 52.10 H new ATOM 0 HA GLU A 27 11.622 -13.538 3.015 1.00 12.33 H new ATOM 0 HB2 GLU A 27 13.946 -13.754 4.317 1.00 3.50 H new ATOM 0 HB3 GLU A 27 12.912 -14.285 5.629 1.00 3.50 H new ATOM 0 HG2 GLU A 27 11.956 -16.045 4.153 1.00 70.13 H new ATOM 0 HG3 GLU A 27 13.013 -15.522 2.856 1.00 70.13 H new ATOM 388 N ALA A 28 10.536 -12.686 5.983 1.00 60.32 N ATOM 389 CA ALA A 28 9.394 -12.757 6.885 1.00 34.34 C ATOM 390 C ALA A 28 8.093 -12.458 6.148 1.00 33.23 C ATOM 391 O ALA A 28 7.128 -13.218 6.237 1.00 71.42 O ATOM 392 CB ALA A 28 9.578 -11.793 8.047 1.00 15.11 C ATOM 0 H ALA A 28 11.247 -12.007 6.255 1.00 60.32 H new ATOM 0 HA ALA A 28 9.334 -13.773 7.276 1.00 34.34 H new ATOM 0 HB1 ALA A 28 8.717 -11.857 8.713 1.00 15.11 H new ATOM 0 HB2 ALA A 28 10.482 -12.054 8.597 1.00 15.11 H new ATOM 0 HB3 ALA A 28 9.667 -10.776 7.665 1.00 15.11 H new ATOM 398 N TYR A 29 8.072 -11.346 5.422 1.00 44.13 N ATOM 399 CA TYR A 29 6.888 -10.945 4.672 1.00 54.51 C ATOM 400 C TYR A 29 6.389 -12.085 3.790 1.00 32.11 C ATOM 401 O TYR A 29 5.234 -12.503 3.891 1.00 65.24 O ATOM 402 CB TYR A 29 7.195 -9.717 3.811 1.00 34.52 C ATOM 403 CG TYR A 29 6.189 -9.486 2.706 1.00 1.12 C ATOM 404 CD1 TYR A 29 4.834 -9.362 2.988 1.00 4.45 C ATOM 405 CD2 TYR A 29 6.594 -9.392 1.381 1.00 72.14 C ATOM 406 CE1 TYR A 29 3.912 -9.150 1.983 1.00 61.53 C ATOM 407 CE2 TYR A 29 5.678 -9.179 0.368 1.00 70.51 C ATOM 408 CZ TYR A 29 4.339 -9.059 0.673 1.00 33.05 C ATOM 409 OH TYR A 29 3.423 -8.849 -0.332 1.00 11.44 O ATOM 0 H TYR A 29 8.862 -10.706 5.337 1.00 44.13 H new ATOM 0 HA TYR A 29 6.105 -10.693 5.387 1.00 54.51 H new ATOM 0 HB2 TYR A 29 7.229 -8.835 4.450 1.00 34.52 H new ATOM 0 HB3 TYR A 29 8.186 -9.830 3.371 1.00 34.52 H new ATOM 0 HD1 TYR A 29 4.496 -9.433 4.011 1.00 4.45 H new ATOM 0 HD2 TYR A 29 7.642 -9.487 1.138 1.00 72.14 H new ATOM 0 HE1 TYR A 29 2.863 -9.056 2.220 1.00 61.53 H new ATOM 0 HE2 TYR A 29 6.010 -9.107 -0.657 1.00 70.51 H new ATOM 0 HH TYR A 29 3.342 -9.660 -0.876 1.00 11.44 H new ATOM 419 N ARG A 30 7.267 -12.585 2.927 1.00 73.10 N ATOM 420 CA ARG A 30 6.917 -13.678 2.027 1.00 33.13 C ATOM 421 C ARG A 30 6.208 -14.799 2.783 1.00 45.11 C ATOM 422 O ARG A 30 5.276 -15.416 2.268 1.00 35.24 O ATOM 423 CB ARG A 30 8.170 -14.223 1.341 1.00 61.04 C ATOM 424 CG ARG A 30 7.978 -14.508 -0.140 1.00 34.32 C ATOM 425 CD ARG A 30 7.623 -15.967 -0.385 1.00 14.41 C ATOM 426 NE ARG A 30 7.956 -16.392 -1.741 1.00 44.43 N ATOM 427 CZ ARG A 30 9.201 -16.525 -2.185 1.00 23.05 C ATOM 428 NH1 ARG A 30 10.225 -16.270 -1.382 1.00 13.13 N ATOM 429 NH2 ARG A 30 9.424 -16.916 -3.433 1.00 64.01 N ATOM 0 H ARG A 30 8.226 -12.251 2.832 1.00 73.10 H new ATOM 0 HA ARG A 30 6.237 -13.288 1.269 1.00 33.13 H new ATOM 0 HB2 ARG A 30 8.982 -13.505 1.462 1.00 61.04 H new ATOM 0 HB3 ARG A 30 8.478 -15.141 1.842 1.00 61.04 H new ATOM 0 HG2 ARG A 30 7.188 -13.869 -0.535 1.00 34.32 H new ATOM 0 HG3 ARG A 30 8.891 -14.259 -0.681 1.00 34.32 H new ATOM 0 HD2 ARG A 30 8.153 -16.594 0.332 1.00 14.41 H new ATOM 0 HD3 ARG A 30 6.557 -16.115 -0.210 1.00 14.41 H new ATOM 0 HE ARG A 30 7.191 -16.598 -2.383 1.00 44.43 H new ATOM 0 HH11 ARG A 30 10.058 -15.971 -0.421 1.00 13.13 H new ATOM 0 HH12 ARG A 30 11.180 -16.373 -1.725 1.00 13.13 H new ATOM 0 HH21 ARG A 30 8.639 -17.115 -4.053 1.00 64.01 H new ATOM 0 HH22 ARG A 30 10.380 -17.018 -3.772 1.00 64.01 H new ATOM 443 N LYS A 31 6.658 -15.057 4.006 1.00 2.14 N ATOM 444 CA LYS A 31 6.069 -16.103 4.834 1.00 52.42 C ATOM 445 C LYS A 31 4.707 -15.670 5.369 1.00 73.14 C ATOM 446 O LYS A 31 3.785 -16.479 5.472 1.00 10.23 O ATOM 447 CB LYS A 31 7.000 -16.445 5.999 1.00 12.03 C ATOM 448 CG LYS A 31 8.330 -17.035 5.562 1.00 55.01 C ATOM 449 CD LYS A 31 9.048 -17.709 6.719 1.00 51.41 C ATOM 450 CE LYS A 31 9.243 -19.195 6.464 1.00 61.53 C ATOM 451 NZ LYS A 31 8.999 -20.005 7.690 1.00 44.03 N ATOM 0 H LYS A 31 7.429 -14.556 4.446 1.00 2.14 H new ATOM 0 HA LYS A 31 5.932 -16.989 4.214 1.00 52.42 H new ATOM 0 HB2 LYS A 31 7.186 -15.543 6.581 1.00 12.03 H new ATOM 0 HB3 LYS A 31 6.498 -17.152 6.659 1.00 12.03 H new ATOM 0 HG2 LYS A 31 8.163 -17.759 4.765 1.00 55.01 H new ATOM 0 HG3 LYS A 31 8.961 -16.247 5.150 1.00 55.01 H new ATOM 0 HD2 LYS A 31 10.017 -17.235 6.873 1.00 51.41 H new ATOM 0 HD3 LYS A 31 8.475 -17.568 7.636 1.00 51.41 H new ATOM 0 HE2 LYS A 31 8.566 -19.520 5.674 1.00 61.53 H new ATOM 0 HE3 LYS A 31 10.258 -19.372 6.108 1.00 61.53 H new ATOM 0 HZ1 LYS A 31 9.142 -21.012 7.475 1.00 44.03 H new ATOM 0 HZ2 LYS A 31 9.662 -19.713 8.437 1.00 44.03 H new ATOM 0 HZ3 LYS A 31 8.023 -19.856 8.016 1.00 44.03 H new ATOM 465 N ALA A 32 4.587 -14.390 5.704 1.00 12.34 N ATOM 466 CA ALA A 32 3.337 -13.851 6.224 1.00 54.53 C ATOM 467 C ALA A 32 2.240 -13.889 5.165 1.00 54.31 C ATOM 468 O ALA A 32 1.204 -14.526 5.353 1.00 11.14 O ATOM 469 CB ALA A 32 3.542 -12.427 6.722 1.00 64.11 C ATOM 0 H ALA A 32 5.340 -13.707 5.625 1.00 12.34 H new ATOM 0 HA ALA A 32 3.022 -14.475 7.060 1.00 54.53 H new ATOM 0 HB1 ALA A 32 2.600 -12.037 7.108 1.00 64.11 H new ATOM 0 HB2 ALA A 32 4.288 -12.423 7.516 1.00 64.11 H new ATOM 0 HB3 ALA A 32 3.885 -11.800 5.899 1.00 64.11 H new ATOM 475 N ALA A 33 2.474 -13.201 4.052 1.00 61.31 N ATOM 476 CA ALA A 33 1.507 -13.159 2.963 1.00 54.35 C ATOM 477 C ALA A 33 1.704 -14.330 2.006 1.00 12.24 C ATOM 478 O ALA A 33 1.533 -14.190 0.796 1.00 72.54 O ATOM 479 CB ALA A 33 1.613 -11.839 2.214 1.00 64.11 C ATOM 0 H ALA A 33 3.325 -12.665 3.881 1.00 61.31 H new ATOM 0 HA ALA A 33 0.509 -13.241 3.394 1.00 54.35 H new ATOM 0 HB1 ALA A 33 0.885 -11.821 1.403 1.00 64.11 H new ATOM 0 HB2 ALA A 33 1.413 -11.015 2.899 1.00 64.11 H new ATOM 0 HB3 ALA A 33 2.617 -11.734 1.803 1.00 64.11 H new ATOM 485 N SER A 34 2.066 -15.483 2.558 1.00 72.14 N ATOM 486 CA SER A 34 2.292 -16.678 1.753 1.00 60.41 C ATOM 487 C SER A 34 1.023 -17.075 1.003 1.00 21.24 C ATOM 488 O SER A 34 -0.087 -16.736 1.413 1.00 30.34 O ATOM 489 CB SER A 34 2.758 -17.835 2.638 1.00 3.02 C ATOM 490 OG SER A 34 3.972 -18.386 2.159 1.00 22.33 O ATOM 0 H SER A 34 2.209 -15.615 3.559 1.00 72.14 H new ATOM 0 HA SER A 34 3.070 -16.453 1.023 1.00 60.41 H new ATOM 0 HB2 SER A 34 2.893 -17.483 3.661 1.00 3.02 H new ATOM 0 HB3 SER A 34 1.990 -18.608 2.666 1.00 3.02 H new ATOM 0 HG SER A 34 4.641 -17.676 2.071 1.00 22.33 H new ATOM 496 N THR A 35 1.197 -17.797 -0.100 1.00 22.41 N ATOM 497 CA THR A 35 0.068 -18.241 -0.909 1.00 1.35 C ATOM 498 C THR A 35 -1.001 -17.158 -1.001 1.00 25.22 C ATOM 499 O THR A 35 -2.178 -17.451 -1.208 1.00 71.44 O ATOM 500 CB THR A 35 -0.564 -19.522 -0.335 1.00 21.31 C ATOM 501 OG1 THR A 35 -1.471 -20.090 -1.287 1.00 41.42 O ATOM 502 CG2 THR A 35 -1.302 -19.229 0.962 1.00 33.43 C ATOM 0 H THR A 35 2.109 -18.087 -0.453 1.00 22.41 H new ATOM 0 HA THR A 35 0.456 -18.451 -1.906 1.00 1.35 H new ATOM 0 HB THR A 35 0.236 -20.232 -0.126 1.00 21.31 H new ATOM 0 HG1 THR A 35 -2.110 -19.406 -1.579 1.00 41.42 H new ATOM 0 HG21 THR A 35 -1.740 -20.150 1.348 1.00 33.43 H new ATOM 0 HG22 THR A 35 -0.604 -18.825 1.695 1.00 33.43 H new ATOM 0 HG23 THR A 35 -2.092 -18.502 0.775 1.00 33.43 H new ATOM 510 N TRP A 36 -0.584 -15.907 -0.846 1.00 20.15 N ATOM 511 CA TRP A 36 -1.507 -14.779 -0.913 1.00 21.14 C ATOM 512 C TRP A 36 -2.208 -14.730 -2.266 1.00 14.15 C ATOM 513 O TRP A 36 -3.431 -14.612 -2.336 1.00 53.12 O ATOM 514 CB TRP A 36 -0.762 -13.467 -0.662 1.00 25.10 C ATOM 515 CG TRP A 36 -1.490 -12.263 -1.176 1.00 33.13 C ATOM 516 CD1 TRP A 36 -1.486 -11.787 -2.455 1.00 41.24 C ATOM 517 CD2 TRP A 36 -2.328 -11.381 -0.420 1.00 22.52 C ATOM 518 NE1 TRP A 36 -2.271 -10.662 -2.541 1.00 43.42 N ATOM 519 CE2 TRP A 36 -2.799 -10.393 -1.306 1.00 2.31 C ATOM 520 CE3 TRP A 36 -2.727 -11.332 0.918 1.00 11.45 C ATOM 521 CZ2 TRP A 36 -3.648 -9.368 -0.894 1.00 63.35 C ATOM 522 CZ3 TRP A 36 -3.569 -10.314 1.325 1.00 51.14 C ATOM 523 CH2 TRP A 36 -4.022 -9.344 0.422 1.00 71.34 C ATOM 0 H TRP A 36 0.387 -15.647 -0.673 1.00 20.15 H new ATOM 0 HA TRP A 36 -2.262 -14.913 -0.138 1.00 21.14 H new ATOM 0 HB2 TRP A 36 -0.595 -13.352 0.409 1.00 25.10 H new ATOM 0 HB3 TRP A 36 0.219 -13.519 -1.134 1.00 25.10 H new ATOM 0 HD1 TRP A 36 -0.945 -12.229 -3.279 1.00 41.24 H new ATOM 0 HE1 TRP A 36 -2.434 -10.116 -3.387 1.00 43.42 H new ATOM 0 HE3 TRP A 36 -2.384 -12.076 1.622 1.00 11.45 H new ATOM 0 HZ2 TRP A 36 -3.998 -8.619 -1.589 1.00 63.35 H new ATOM 0 HZ3 TRP A 36 -3.883 -10.266 2.357 1.00 51.14 H new ATOM 0 HH2 TRP A 36 -4.679 -8.562 0.771 1.00 71.34 H new ATOM 534 N GLU A 37 -1.426 -14.821 -3.336 1.00 20.11 N ATOM 535 CA GLU A 37 -1.975 -14.785 -4.687 1.00 64.12 C ATOM 536 C GLU A 37 -2.969 -13.637 -4.841 1.00 62.41 C ATOM 537 O GLU A 37 -4.143 -13.769 -4.500 1.00 42.15 O ATOM 538 CB GLU A 37 -2.658 -16.114 -5.019 1.00 4.22 C ATOM 539 CG GLU A 37 -2.704 -16.419 -6.507 1.00 61.31 C ATOM 540 CD GLU A 37 -4.078 -16.194 -7.106 1.00 64.04 C ATOM 541 OE1 GLU A 37 -5.002 -16.966 -6.776 1.00 13.13 O ATOM 542 OE2 GLU A 37 -4.230 -15.246 -7.905 1.00 24.21 O ATOM 0 H GLU A 37 -0.412 -14.920 -3.295 1.00 20.11 H new ATOM 0 HA GLU A 37 -1.151 -14.624 -5.382 1.00 64.12 H new ATOM 0 HB2 GLU A 37 -2.133 -16.921 -4.507 1.00 4.22 H new ATOM 0 HB3 GLU A 37 -3.675 -16.098 -4.628 1.00 4.22 H new ATOM 0 HG2 GLU A 37 -1.979 -15.792 -7.025 1.00 61.31 H new ATOM 0 HG3 GLU A 37 -2.405 -17.454 -6.671 1.00 61.31 H new ATOM 549 N GLY A 38 -2.487 -12.511 -5.357 1.00 2.35 N ATOM 550 CA GLY A 38 -3.345 -11.355 -5.546 1.00 20.25 C ATOM 551 C GLY A 38 -2.565 -10.056 -5.599 1.00 63.33 C ATOM 552 O GLY A 38 -1.442 -9.978 -5.102 1.00 33.14 O ATOM 0 H GLY A 38 -1.518 -12.378 -5.648 1.00 2.35 H new ATOM 0 HA2 GLY A 38 -3.911 -11.473 -6.470 1.00 20.25 H new ATOM 0 HA3 GLY A 38 -4.069 -11.307 -4.733 1.00 20.25 H new ATOM 556 N SER A 39 -3.161 -9.036 -6.208 1.00 4.33 N ATOM 557 CA SER A 39 -2.512 -7.735 -6.330 1.00 64.32 C ATOM 558 C SER A 39 -3.233 -6.687 -5.488 1.00 74.21 C ATOM 559 O SER A 39 -4.462 -6.593 -5.512 1.00 40.10 O ATOM 560 CB SER A 39 -2.477 -7.294 -7.794 1.00 32.11 C ATOM 561 OG SER A 39 -2.031 -8.346 -8.633 1.00 30.23 O ATOM 0 H SER A 39 -4.091 -9.085 -6.624 1.00 4.33 H new ATOM 0 HA SER A 39 -1.490 -7.831 -5.963 1.00 64.32 H new ATOM 0 HB2 SER A 39 -3.472 -6.974 -8.104 1.00 32.11 H new ATOM 0 HB3 SER A 39 -1.817 -6.433 -7.902 1.00 32.11 H new ATOM 0 HG SER A 39 -2.019 -8.039 -9.564 1.00 30.23 H new ATOM 567 N LEU A 40 -2.463 -5.901 -4.746 1.00 3.42 N ATOM 568 CA LEU A 40 -3.027 -4.858 -3.895 1.00 53.34 C ATOM 569 C LEU A 40 -2.713 -3.473 -4.452 1.00 10.41 C ATOM 570 O LEU A 40 -1.568 -3.172 -4.786 1.00 22.31 O ATOM 571 CB LEU A 40 -2.483 -4.984 -2.471 1.00 54.42 C ATOM 572 CG LEU A 40 -2.972 -3.935 -1.471 1.00 0.22 C ATOM 573 CD1 LEU A 40 -4.460 -4.105 -1.204 1.00 64.22 C ATOM 574 CD2 LEU A 40 -2.181 -4.026 -0.174 1.00 12.34 C ATOM 0 H LEU A 40 -1.445 -5.965 -4.716 1.00 3.42 H new ATOM 0 HA LEU A 40 -4.109 -4.985 -3.875 1.00 53.34 H new ATOM 0 HB2 LEU A 40 -2.745 -5.971 -2.089 1.00 54.42 H new ATOM 0 HB3 LEU A 40 -1.395 -4.937 -2.514 1.00 54.42 H new ATOM 0 HG LEU A 40 -2.812 -2.947 -1.902 1.00 0.22 H new ATOM 0 HD11 LEU A 40 -4.790 -3.350 -0.490 1.00 64.22 H new ATOM 0 HD12 LEU A 40 -5.013 -3.989 -2.136 1.00 64.22 H new ATOM 0 HD13 LEU A 40 -4.645 -5.098 -0.794 1.00 64.22 H new ATOM 0 HD21 LEU A 40 -2.542 -3.273 0.526 1.00 12.34 H new ATOM 0 HD22 LEU A 40 -2.309 -5.017 0.262 1.00 12.34 H new ATOM 0 HD23 LEU A 40 -1.124 -3.854 -0.379 1.00 12.34 H new ATOM 586 N ALA A 41 -3.738 -2.632 -4.545 1.00 62.21 N ATOM 587 CA ALA A 41 -3.570 -1.277 -5.056 1.00 73.25 C ATOM 588 C ALA A 41 -4.063 -0.246 -4.047 1.00 52.44 C ATOM 589 O ALA A 41 -5.198 -0.317 -3.573 1.00 40.45 O ATOM 590 CB ALA A 41 -4.306 -1.118 -6.379 1.00 41.33 C ATOM 0 H ALA A 41 -4.693 -2.865 -4.273 1.00 62.21 H new ATOM 0 HA ALA A 41 -2.506 -1.105 -5.221 1.00 73.25 H new ATOM 0 HB1 ALA A 41 -4.173 -0.102 -6.750 1.00 41.33 H new ATOM 0 HB2 ALA A 41 -3.905 -1.825 -7.106 1.00 41.33 H new ATOM 0 HB3 ALA A 41 -5.368 -1.313 -6.230 1.00 41.33 H new ATOM 596 N LEU A 42 -3.203 0.714 -3.722 1.00 1.21 N ATOM 597 CA LEU A 42 -3.550 1.762 -2.769 1.00 32.23 C ATOM 598 C LEU A 42 -3.984 3.034 -3.490 1.00 20.42 C ATOM 599 O LEU A 42 -3.156 3.762 -4.036 1.00 21.14 O ATOM 600 CB LEU A 42 -2.361 2.061 -1.854 1.00 21.00 C ATOM 601 CG LEU A 42 -1.675 0.847 -1.227 1.00 25.24 C ATOM 602 CD1 LEU A 42 -0.206 1.140 -0.963 1.00 40.33 C ATOM 603 CD2 LEU A 42 -2.379 0.443 0.061 1.00 2.23 C ATOM 0 H LEU A 42 -2.260 0.788 -4.105 1.00 1.21 H new ATOM 0 HA LEU A 42 -4.385 1.407 -2.165 1.00 32.23 H new ATOM 0 HB2 LEU A 42 -1.619 2.617 -2.426 1.00 21.00 H new ATOM 0 HB3 LEU A 42 -2.701 2.716 -1.052 1.00 21.00 H new ATOM 0 HG LEU A 42 -1.738 0.016 -1.929 1.00 25.24 H new ATOM 0 HD11 LEU A 42 0.265 0.264 -0.517 1.00 40.33 H new ATOM 0 HD12 LEU A 42 0.292 1.381 -1.902 1.00 40.33 H new ATOM 0 HD13 LEU A 42 -0.121 1.985 -0.280 1.00 40.33 H new ATOM 0 HD21 LEU A 42 -1.877 -0.423 0.494 1.00 2.23 H new ATOM 0 HD22 LEU A 42 -2.347 1.272 0.768 1.00 2.23 H new ATOM 0 HD23 LEU A 42 -3.417 0.190 -0.156 1.00 2.23 H new ATOM 615 N ALA A 43 -5.287 3.294 -3.487 1.00 10.33 N ATOM 616 CA ALA A 43 -5.830 4.480 -4.138 1.00 14.43 C ATOM 617 C ALA A 43 -5.966 5.634 -3.150 1.00 43.12 C ATOM 618 O ALA A 43 -6.427 5.450 -2.023 1.00 65.32 O ATOM 619 CB ALA A 43 -7.177 4.164 -4.772 1.00 31.15 C ATOM 0 H ALA A 43 -5.986 2.700 -3.041 1.00 10.33 H new ATOM 0 HA ALA A 43 -5.135 4.785 -4.920 1.00 14.43 H new ATOM 0 HB1 ALA A 43 -7.571 5.059 -5.254 1.00 31.15 H new ATOM 0 HB2 ALA A 43 -7.054 3.376 -5.515 1.00 31.15 H new ATOM 0 HB3 ALA A 43 -7.873 3.831 -4.002 1.00 31.15 H new ATOM 625 N VAL A 44 -5.562 6.826 -3.580 1.00 24.34 N ATOM 626 CA VAL A 44 -5.639 8.010 -2.734 1.00 0.42 C ATOM 627 C VAL A 44 -6.588 9.046 -3.325 1.00 13.34 C ATOM 628 O VAL A 44 -6.406 9.496 -4.456 1.00 32.22 O ATOM 629 CB VAL A 44 -4.252 8.652 -2.539 1.00 64.12 C ATOM 630 CG1 VAL A 44 -4.377 9.986 -1.820 1.00 1.22 C ATOM 631 CG2 VAL A 44 -3.332 7.710 -1.777 1.00 72.02 C ATOM 0 H VAL A 44 -5.178 6.996 -4.510 1.00 24.34 H new ATOM 0 HA VAL A 44 -6.019 7.684 -1.766 1.00 0.42 H new ATOM 0 HB VAL A 44 -3.815 8.836 -3.520 1.00 64.12 H new ATOM 0 HG11 VAL A 44 -3.387 10.424 -1.691 1.00 1.22 H new ATOM 0 HG12 VAL A 44 -4.999 10.660 -2.409 1.00 1.22 H new ATOM 0 HG13 VAL A 44 -4.835 9.831 -0.843 1.00 1.22 H new ATOM 0 HG21 VAL A 44 -2.357 8.179 -1.648 1.00 72.02 H new ATOM 0 HG22 VAL A 44 -3.762 7.493 -0.799 1.00 72.02 H new ATOM 0 HG23 VAL A 44 -3.217 6.782 -2.337 1.00 72.02 H new ATOM 641 N ARG A 45 -7.600 9.423 -2.550 1.00 54.22 N ATOM 642 CA ARG A 45 -8.579 10.407 -2.997 1.00 73.42 C ATOM 643 C ARG A 45 -7.892 11.591 -3.668 1.00 52.54 C ATOM 644 O ARG A 45 -6.820 12.035 -3.255 1.00 22.13 O ATOM 645 CB ARG A 45 -9.420 10.893 -1.815 1.00 42.24 C ATOM 646 CG ARG A 45 -10.682 10.077 -1.588 1.00 44.04 C ATOM 647 CD ARG A 45 -11.695 10.839 -0.746 1.00 65.32 C ATOM 648 NE ARG A 45 -12.741 9.964 -0.226 1.00 11.32 N ATOM 649 CZ ARG A 45 -13.786 10.402 0.468 1.00 0.32 C ATOM 650 NH1 ARG A 45 -13.922 11.696 0.724 1.00 61.44 N ATOM 651 NH2 ARG A 45 -14.698 9.544 0.909 1.00 60.23 N ATOM 0 H ARG A 45 -7.763 9.062 -1.610 1.00 54.22 H new ATOM 0 HA ARG A 45 -9.232 9.928 -3.726 1.00 73.42 H new ATOM 0 HB2 ARG A 45 -8.812 10.864 -0.911 1.00 42.24 H new ATOM 0 HB3 ARG A 45 -9.696 11.934 -1.980 1.00 42.24 H new ATOM 0 HG2 ARG A 45 -11.127 9.818 -2.549 1.00 44.04 H new ATOM 0 HG3 ARG A 45 -10.427 9.140 -1.093 1.00 44.04 H new ATOM 0 HD2 ARG A 45 -11.183 11.326 0.084 1.00 65.32 H new ATOM 0 HD3 ARG A 45 -12.147 11.627 -1.348 1.00 65.32 H new ATOM 0 HE ARG A 45 -12.666 8.963 -0.405 1.00 11.32 H new ATOM 0 HH11 ARG A 45 -13.223 12.359 0.388 1.00 61.44 H new ATOM 0 HH12 ARG A 45 -14.725 12.029 1.257 1.00 61.44 H new ATOM 0 HH21 ARG A 45 -14.597 8.548 0.715 1.00 60.23 H new ATOM 0 HH22 ARG A 45 -15.500 9.881 1.442 1.00 60.23 H new ATOM 665 N PRO A 46 -8.521 12.117 -4.731 1.00 0.34 N ATOM 666 CA PRO A 46 -7.988 13.257 -5.482 1.00 31.24 C ATOM 667 C PRO A 46 -8.044 14.555 -4.683 1.00 62.43 C ATOM 668 O PRO A 46 -9.087 14.914 -4.137 1.00 42.34 O ATOM 669 CB PRO A 46 -8.908 13.339 -6.702 1.00 13.21 C ATOM 670 CG PRO A 46 -10.186 12.716 -6.256 1.00 21.15 C ATOM 671 CD PRO A 46 -9.801 11.638 -5.278 1.00 44.42 C ATOM 0 HA PRO A 46 -6.936 13.124 -5.733 1.00 31.24 H new ATOM 0 HB2 PRO A 46 -9.059 14.372 -7.015 1.00 13.21 H new ATOM 0 HB3 PRO A 46 -8.484 12.807 -7.554 1.00 13.21 H new ATOM 0 HG2 PRO A 46 -10.837 13.454 -5.787 1.00 21.15 H new ATOM 0 HG3 PRO A 46 -10.733 12.299 -7.102 1.00 21.15 H new ATOM 0 HD2 PRO A 46 -10.552 11.517 -4.497 1.00 44.42 H new ATOM 0 HD3 PRO A 46 -9.692 10.671 -5.768 1.00 44.42 H new ATOM 679 N ASP A 47 -6.916 15.253 -4.619 1.00 44.21 N ATOM 680 CA ASP A 47 -6.837 16.513 -3.888 1.00 72.05 C ATOM 681 C ASP A 47 -5.695 17.376 -4.415 1.00 41.52 C ATOM 682 O ASP A 47 -4.605 16.891 -4.717 1.00 23.02 O ATOM 683 CB ASP A 47 -6.646 16.249 -2.394 1.00 4.01 C ATOM 684 CG ASP A 47 -7.192 17.371 -1.533 1.00 41.15 C ATOM 685 OD1 ASP A 47 -8.388 17.701 -1.678 1.00 42.44 O ATOM 686 OD2 ASP A 47 -6.425 17.917 -0.713 1.00 54.00 O ATOM 0 H ASP A 47 -6.044 14.968 -5.064 1.00 44.21 H new ATOM 0 HA ASP A 47 -7.773 17.051 -4.037 1.00 72.05 H new ATOM 0 HB2 ASP A 47 -7.142 15.316 -2.127 1.00 4.01 H new ATOM 0 HB3 ASP A 47 -5.585 16.118 -2.184 1.00 4.01 H new ATOM 691 N PRO A 48 -5.949 18.688 -4.530 1.00 12.43 N ATOM 692 CA PRO A 48 -4.955 19.647 -5.022 1.00 10.54 C ATOM 693 C PRO A 48 -3.813 19.856 -4.033 1.00 63.14 C ATOM 694 O PRO A 48 -2.654 19.987 -4.427 1.00 11.53 O ATOM 695 CB PRO A 48 -5.760 20.938 -5.188 1.00 41.43 C ATOM 696 CG PRO A 48 -6.896 20.803 -4.233 1.00 40.13 C ATOM 697 CD PRO A 48 -7.226 19.337 -4.188 1.00 72.14 C ATOM 0 HA PRO A 48 -4.478 19.305 -5.940 1.00 10.54 H new ATOM 0 HB2 PRO A 48 -5.154 21.815 -4.960 1.00 41.43 H new ATOM 0 HB3 PRO A 48 -6.115 21.054 -6.212 1.00 41.43 H new ATOM 0 HG2 PRO A 48 -6.621 21.172 -3.245 1.00 40.13 H new ATOM 0 HG3 PRO A 48 -7.755 21.387 -4.563 1.00 40.13 H new ATOM 0 HD2 PRO A 48 -7.579 19.035 -3.202 1.00 72.14 H new ATOM 0 HD3 PRO A 48 -8.011 19.080 -4.900 1.00 72.14 H new ATOM 705 N LYS A 49 -4.147 19.884 -2.748 1.00 30.12 N ATOM 706 CA LYS A 49 -3.148 20.075 -1.702 1.00 13.03 C ATOM 707 C LYS A 49 -1.879 19.290 -2.012 1.00 61.25 C ATOM 708 O LYS A 49 -0.769 19.767 -1.776 1.00 31.34 O ATOM 709 CB LYS A 49 -3.712 19.640 -0.346 1.00 62.41 C ATOM 710 CG LYS A 49 -3.348 20.578 0.792 1.00 32.02 C ATOM 711 CD LYS A 49 -3.011 19.812 2.060 1.00 72.32 C ATOM 712 CE LYS A 49 -3.067 20.711 3.286 1.00 60.34 C ATOM 713 NZ LYS A 49 -1.875 20.532 4.160 1.00 25.32 N ATOM 0 H LYS A 49 -5.102 19.777 -2.405 1.00 30.12 H new ATOM 0 HA LYS A 49 -2.897 21.135 -1.662 1.00 13.03 H new ATOM 0 HB2 LYS A 49 -4.798 19.573 -0.418 1.00 62.41 H new ATOM 0 HB3 LYS A 49 -3.346 18.640 -0.113 1.00 62.41 H new ATOM 0 HG2 LYS A 49 -2.496 21.192 0.500 1.00 32.02 H new ATOM 0 HG3 LYS A 49 -4.179 21.256 0.986 1.00 32.02 H new ATOM 0 HD2 LYS A 49 -3.709 18.984 2.183 1.00 72.32 H new ATOM 0 HD3 LYS A 49 -2.015 19.378 1.971 1.00 72.32 H new ATOM 0 HE2 LYS A 49 -3.133 21.752 2.970 1.00 60.34 H new ATOM 0 HE3 LYS A 49 -3.971 20.493 3.855 1.00 60.34 H new ATOM 0 HZ1 LYS A 49 -1.951 21.162 4.984 1.00 25.32 H new ATOM 0 HZ2 LYS A 49 -1.826 19.544 4.482 1.00 25.32 H new ATOM 0 HZ3 LYS A 49 -1.014 20.765 3.625 1.00 25.32 H new ATOM 727 N ALA A 50 -2.049 18.084 -2.544 1.00 71.34 N ATOM 728 CA ALA A 50 -0.916 17.235 -2.890 1.00 32.50 C ATOM 729 C ALA A 50 -0.565 17.363 -4.368 1.00 43.03 C ATOM 730 O ALA A 50 0.567 17.100 -4.773 1.00 11.11 O ATOM 731 CB ALA A 50 -1.217 15.784 -2.541 1.00 20.31 C ATOM 0 H ALA A 50 -2.961 17.673 -2.745 1.00 71.34 H new ATOM 0 HA ALA A 50 -0.055 17.566 -2.309 1.00 32.50 H new ATOM 0 HB1 ALA A 50 -0.362 15.161 -2.805 1.00 20.31 H new ATOM 0 HB2 ALA A 50 -1.411 15.700 -1.472 1.00 20.31 H new ATOM 0 HB3 ALA A 50 -2.094 15.451 -3.096 1.00 20.31 H new ATOM 737 N GLY A 51 -1.544 17.768 -5.172 1.00 4.22 N ATOM 738 CA GLY A 51 -1.318 17.923 -6.596 1.00 41.23 C ATOM 739 C GLY A 51 -1.842 16.749 -7.398 1.00 60.44 C ATOM 740 O GLY A 51 -1.178 16.268 -8.317 1.00 41.43 O ATOM 0 H GLY A 51 -2.490 17.991 -4.862 1.00 4.22 H new ATOM 0 HA2 GLY A 51 -1.801 18.838 -6.940 1.00 41.23 H new ATOM 0 HA3 GLY A 51 -0.250 18.037 -6.781 1.00 41.23 H new ATOM 744 N PHE A 52 -3.036 16.282 -7.049 1.00 72.10 N ATOM 745 CA PHE A 52 -3.649 15.154 -7.742 1.00 25.34 C ATOM 746 C PHE A 52 -5.168 15.288 -7.764 1.00 14.41 C ATOM 747 O PHE A 52 -5.879 14.733 -6.925 1.00 40.54 O ATOM 748 CB PHE A 52 -3.253 13.839 -7.067 1.00 24.31 C ATOM 749 CG PHE A 52 -1.767 13.637 -6.970 1.00 42.51 C ATOM 750 CD1 PHE A 52 -1.067 13.038 -8.005 1.00 20.11 C ATOM 751 CD2 PHE A 52 -1.071 14.049 -5.845 1.00 21.52 C ATOM 752 CE1 PHE A 52 0.300 12.852 -7.919 1.00 52.11 C ATOM 753 CE2 PHE A 52 0.296 13.866 -5.755 1.00 25.24 C ATOM 754 CZ PHE A 52 0.983 13.266 -6.792 1.00 75.34 C ATOM 0 H PHE A 52 -3.599 16.667 -6.290 1.00 72.10 H new ATOM 0 HA PHE A 52 -3.287 15.152 -8.770 1.00 25.34 H new ATOM 0 HB2 PHE A 52 -3.681 13.811 -6.065 1.00 24.31 H new ATOM 0 HB3 PHE A 52 -3.689 13.009 -7.623 1.00 24.31 H new ATOM 0 HD1 PHE A 52 -1.595 12.713 -8.889 1.00 20.11 H new ATOM 0 HD2 PHE A 52 -1.602 14.518 -5.030 1.00 21.52 H new ATOM 0 HE1 PHE A 52 0.834 12.383 -8.733 1.00 52.11 H new ATOM 0 HE2 PHE A 52 0.827 14.192 -4.873 1.00 25.24 H new ATOM 0 HZ PHE A 52 2.051 13.121 -6.722 1.00 75.34 H new ATOM 764 N PRO A 53 -5.680 16.045 -8.746 1.00 44.33 N ATOM 765 CA PRO A 53 -7.119 16.272 -8.903 1.00 1.24 C ATOM 766 C PRO A 53 -7.859 15.016 -9.352 1.00 43.41 C ATOM 767 O PRO A 53 -9.087 15.004 -9.439 1.00 24.43 O ATOM 768 CB PRO A 53 -7.193 17.352 -9.985 1.00 43.30 C ATOM 769 CG PRO A 53 -5.933 17.194 -10.765 1.00 22.25 C ATOM 770 CD PRO A 53 -4.891 16.737 -9.780 1.00 55.30 C ATOM 0 HA PRO A 53 -7.591 16.559 -7.963 1.00 1.24 H new ATOM 0 HB2 PRO A 53 -8.070 17.218 -10.618 1.00 43.30 H new ATOM 0 HB3 PRO A 53 -7.265 18.347 -9.547 1.00 43.30 H new ATOM 0 HG2 PRO A 53 -6.059 16.466 -11.566 1.00 22.25 H new ATOM 0 HG3 PRO A 53 -5.642 18.135 -11.232 1.00 22.25 H new ATOM 0 HD2 PRO A 53 -4.164 16.070 -10.244 1.00 55.30 H new ATOM 0 HD3 PRO A 53 -4.334 17.577 -9.365 1.00 55.30 H new ATOM 778 N LYS A 54 -7.104 13.961 -9.636 1.00 64.41 N ATOM 779 CA LYS A 54 -7.687 12.698 -10.075 1.00 4.34 C ATOM 780 C LYS A 54 -7.290 11.562 -9.138 1.00 73.21 C ATOM 781 O LYS A 54 -7.770 10.437 -9.274 1.00 22.20 O ATOM 782 CB LYS A 54 -7.240 12.376 -11.503 1.00 31.03 C ATOM 783 CG LYS A 54 -5.739 12.196 -11.644 1.00 43.52 C ATOM 784 CD LYS A 54 -5.068 13.470 -12.131 1.00 61.52 C ATOM 785 CE LYS A 54 -3.555 13.386 -12.005 1.00 4.14 C ATOM 786 NZ LYS A 54 -2.884 14.602 -12.544 1.00 54.15 N ATOM 0 H LYS A 54 -6.086 13.955 -9.570 1.00 64.41 H new ATOM 0 HA LYS A 54 -8.772 12.800 -10.055 1.00 4.34 H new ATOM 0 HB2 LYS A 54 -7.739 11.466 -11.835 1.00 31.03 H new ATOM 0 HB3 LYS A 54 -7.565 13.178 -12.166 1.00 31.03 H new ATOM 0 HG2 LYS A 54 -5.315 11.905 -10.683 1.00 43.52 H new ATOM 0 HG3 LYS A 54 -5.533 11.385 -12.343 1.00 43.52 H new ATOM 0 HD2 LYS A 54 -5.338 13.650 -13.172 1.00 61.52 H new ATOM 0 HD3 LYS A 54 -5.436 14.319 -11.555 1.00 61.52 H new ATOM 0 HE2 LYS A 54 -3.285 13.257 -10.957 1.00 4.14 H new ATOM 0 HE3 LYS A 54 -3.195 12.506 -12.538 1.00 4.14 H new ATOM 0 HZ1 LYS A 54 -1.920 14.360 -12.851 1.00 54.15 H new ATOM 0 HZ2 LYS A 54 -3.424 14.966 -13.355 1.00 54.15 H new ATOM 0 HZ3 LYS A 54 -2.839 15.331 -11.803 1.00 54.15 H new ATOM 800 N GLY A 55 -6.414 11.864 -8.185 1.00 23.20 N ATOM 801 CA GLY A 55 -5.969 10.857 -7.239 1.00 54.20 C ATOM 802 C GLY A 55 -4.972 9.891 -7.847 1.00 24.25 C ATOM 803 O GLY A 55 -4.982 9.654 -9.054 1.00 73.04 O ATOM 0 H GLY A 55 -6.004 12.788 -8.051 1.00 23.20 H new ATOM 0 HA2 GLY A 55 -5.516 11.347 -6.377 1.00 54.20 H new ATOM 0 HA3 GLY A 55 -6.832 10.301 -6.872 1.00 54.20 H new ATOM 807 N VAL A 56 -4.106 9.332 -7.008 1.00 22.11 N ATOM 808 CA VAL A 56 -3.097 8.386 -7.469 1.00 5.31 C ATOM 809 C VAL A 56 -3.426 6.967 -7.019 1.00 35.41 C ATOM 810 O VAL A 56 -4.109 6.767 -6.015 1.00 31.32 O ATOM 811 CB VAL A 56 -1.695 8.764 -6.952 1.00 51.31 C ATOM 812 CG1 VAL A 56 -1.528 8.339 -5.501 1.00 13.13 C ATOM 813 CG2 VAL A 56 -0.619 8.139 -7.826 1.00 70.20 C ATOM 0 H VAL A 56 -4.083 9.518 -6.005 1.00 22.11 H new ATOM 0 HA VAL A 56 -3.099 8.428 -8.558 1.00 5.31 H new ATOM 0 HB VAL A 56 -1.588 9.848 -7.003 1.00 51.31 H new ATOM 0 HG11 VAL A 56 -0.532 8.614 -5.154 1.00 13.13 H new ATOM 0 HG12 VAL A 56 -2.277 8.838 -4.887 1.00 13.13 H new ATOM 0 HG13 VAL A 56 -1.655 7.259 -5.421 1.00 13.13 H new ATOM 0 HG21 VAL A 56 0.364 8.416 -7.447 1.00 70.20 H new ATOM 0 HG22 VAL A 56 -0.722 7.054 -7.809 1.00 70.20 H new ATOM 0 HG23 VAL A 56 -0.727 8.498 -8.849 1.00 70.20 H new ATOM 823 N ALA A 57 -2.936 5.986 -7.769 1.00 32.13 N ATOM 824 CA ALA A 57 -3.176 4.584 -7.445 1.00 41.20 C ATOM 825 C ALA A 57 -1.921 3.748 -7.663 1.00 65.43 C ATOM 826 O ALA A 57 -1.470 3.568 -8.794 1.00 73.12 O ATOM 827 CB ALA A 57 -4.326 4.041 -8.280 1.00 35.53 C ATOM 0 H ALA A 57 -2.371 6.135 -8.605 1.00 32.13 H new ATOM 0 HA ALA A 57 -3.444 4.520 -6.390 1.00 41.20 H new ATOM 0 HB1 ALA A 57 -4.495 2.994 -8.029 1.00 35.53 H new ATOM 0 HB2 ALA A 57 -5.229 4.615 -8.072 1.00 35.53 H new ATOM 0 HB3 ALA A 57 -4.079 4.125 -9.338 1.00 35.53 H new ATOM 833 N VAL A 58 -1.358 3.238 -6.571 1.00 42.44 N ATOM 834 CA VAL A 58 -0.153 2.420 -6.643 1.00 74.12 C ATOM 835 C VAL A 58 -0.493 0.935 -6.573 1.00 1.21 C ATOM 836 O VAL A 58 -1.011 0.453 -5.566 1.00 61.32 O ATOM 837 CB VAL A 58 0.828 2.765 -5.508 1.00 63.21 C ATOM 838 CG1 VAL A 58 1.998 1.792 -5.499 1.00 15.13 C ATOM 839 CG2 VAL A 58 1.317 4.199 -5.644 1.00 62.54 C ATOM 0 H VAL A 58 -1.717 3.377 -5.627 1.00 42.44 H new ATOM 0 HA VAL A 58 0.321 2.637 -7.600 1.00 74.12 H new ATOM 0 HB VAL A 58 0.303 2.673 -4.557 1.00 63.21 H new ATOM 0 HG11 VAL A 58 2.681 2.052 -4.690 1.00 15.13 H new ATOM 0 HG12 VAL A 58 1.627 0.778 -5.349 1.00 15.13 H new ATOM 0 HG13 VAL A 58 2.525 1.848 -6.451 1.00 15.13 H new ATOM 0 HG21 VAL A 58 2.010 4.426 -4.833 1.00 62.54 H new ATOM 0 HG22 VAL A 58 1.825 4.321 -6.600 1.00 62.54 H new ATOM 0 HG23 VAL A 58 0.467 4.879 -5.596 1.00 62.54 H new ATOM 849 N VAL A 59 -0.197 0.214 -7.650 1.00 70.31 N ATOM 850 CA VAL A 59 -0.469 -1.217 -7.711 1.00 41.11 C ATOM 851 C VAL A 59 0.671 -2.020 -7.094 1.00 72.20 C ATOM 852 O VAL A 59 1.799 -1.537 -6.987 1.00 14.11 O ATOM 853 CB VAL A 59 -0.685 -1.686 -9.162 1.00 24.11 C ATOM 854 CG1 VAL A 59 -1.119 -3.143 -9.194 1.00 25.33 C ATOM 855 CG2 VAL A 59 -1.707 -0.802 -9.860 1.00 54.34 C ATOM 0 H VAL A 59 0.231 0.598 -8.492 1.00 70.31 H new ATOM 0 HA VAL A 59 -1.382 -1.390 -7.141 1.00 41.11 H new ATOM 0 HB VAL A 59 0.261 -1.602 -9.697 1.00 24.11 H new ATOM 0 HG11 VAL A 59 -1.267 -3.456 -10.228 1.00 25.33 H new ATOM 0 HG12 VAL A 59 -0.349 -3.762 -8.734 1.00 25.33 H new ATOM 0 HG13 VAL A 59 -2.053 -3.257 -8.644 1.00 25.33 H new ATOM 0 HG21 VAL A 59 -1.848 -1.147 -10.884 1.00 54.34 H new ATOM 0 HG22 VAL A 59 -2.656 -0.852 -9.327 1.00 54.34 H new ATOM 0 HG23 VAL A 59 -1.351 0.228 -9.870 1.00 54.34 H new ATOM 865 N LEU A 60 0.369 -3.249 -6.689 1.00 5.51 N ATOM 866 CA LEU A 60 1.369 -4.121 -6.082 1.00 1.05 C ATOM 867 C LEU A 60 1.031 -5.588 -6.324 1.00 70.23 C ATOM 868 O LEU A 60 0.458 -6.254 -5.462 1.00 60.45 O ATOM 869 CB LEU A 60 1.466 -3.850 -4.579 1.00 70.21 C ATOM 870 CG LEU A 60 1.836 -2.422 -4.177 1.00 5.01 C ATOM 871 CD1 LEU A 60 1.557 -2.194 -2.699 1.00 11.34 C ATOM 872 CD2 LEU A 60 3.298 -2.141 -4.495 1.00 71.31 C ATOM 0 H LEU A 60 -0.559 -3.664 -6.770 1.00 5.51 H new ATOM 0 HA LEU A 60 2.331 -3.907 -6.547 1.00 1.05 H new ATOM 0 HB2 LEU A 60 0.508 -4.098 -4.123 1.00 70.21 H new ATOM 0 HB3 LEU A 60 2.206 -4.529 -4.155 1.00 70.21 H new ATOM 0 HG LEU A 60 1.220 -1.731 -4.753 1.00 5.01 H new ATOM 0 HD11 LEU A 60 1.826 -1.172 -2.431 1.00 11.34 H new ATOM 0 HD12 LEU A 60 0.497 -2.354 -2.500 1.00 11.34 H new ATOM 0 HD13 LEU A 60 2.147 -2.892 -2.105 1.00 11.34 H new ATOM 0 HD21 LEU A 60 3.544 -1.120 -4.202 1.00 71.31 H new ATOM 0 HD22 LEU A 60 3.930 -2.839 -3.946 1.00 71.31 H new ATOM 0 HD23 LEU A 60 3.468 -2.263 -5.565 1.00 71.31 H new ATOM 884 N ASP A 61 1.392 -6.086 -7.502 1.00 51.50 N ATOM 885 CA ASP A 61 1.130 -7.475 -7.859 1.00 32.35 C ATOM 886 C ASP A 61 1.923 -8.423 -6.965 1.00 64.52 C ATOM 887 O ASP A 61 3.143 -8.541 -7.094 1.00 2.40 O ATOM 888 CB ASP A 61 1.482 -7.723 -9.326 1.00 31.22 C ATOM 889 CG ASP A 61 1.538 -9.199 -9.666 1.00 51.25 C ATOM 890 OD1 ASP A 61 1.028 -10.013 -8.867 1.00 11.23 O ATOM 891 OD2 ASP A 61 2.090 -9.542 -10.733 1.00 14.51 O ATOM 0 H ASP A 61 1.867 -5.547 -8.226 1.00 51.50 H new ATOM 0 HA ASP A 61 0.067 -7.668 -7.712 1.00 32.35 H new ATOM 0 HB2 ASP A 61 0.743 -7.234 -9.961 1.00 31.22 H new ATOM 0 HB3 ASP A 61 2.446 -7.265 -9.548 1.00 31.22 H new ATOM 896 N LEU A 62 1.225 -9.098 -6.058 1.00 41.22 N ATOM 897 CA LEU A 62 1.864 -10.036 -5.142 1.00 44.43 C ATOM 898 C LEU A 62 1.712 -11.470 -5.637 1.00 41.33 C ATOM 899 O LEU A 62 0.791 -11.782 -6.394 1.00 3.15 O ATOM 900 CB LEU A 62 1.263 -9.900 -3.742 1.00 24.30 C ATOM 901 CG LEU A 62 1.003 -8.474 -3.258 1.00 24.22 C ATOM 902 CD1 LEU A 62 0.516 -8.480 -1.816 1.00 44.24 C ATOM 903 CD2 LEU A 62 2.260 -7.627 -3.394 1.00 31.12 C ATOM 0 H LEU A 62 0.216 -9.013 -5.937 1.00 41.22 H new ATOM 0 HA LEU A 62 2.927 -9.798 -5.099 1.00 44.43 H new ATOM 0 HB2 LEU A 62 0.321 -10.448 -3.718 1.00 24.30 H new ATOM 0 HB3 LEU A 62 1.932 -10.387 -3.032 1.00 24.30 H new ATOM 0 HG LEU A 62 0.224 -8.036 -3.882 1.00 24.22 H new ATOM 0 HD11 LEU A 62 0.336 -7.456 -1.488 1.00 44.24 H new ATOM 0 HD12 LEU A 62 -0.410 -9.051 -1.747 1.00 44.24 H new ATOM 0 HD13 LEU A 62 1.273 -8.937 -1.178 1.00 44.24 H new ATOM 0 HD21 LEU A 62 2.056 -6.615 -3.045 1.00 31.12 H new ATOM 0 HD22 LEU A 62 3.059 -8.063 -2.795 1.00 31.12 H new ATOM 0 HD23 LEU A 62 2.566 -7.595 -4.440 1.00 31.12 H new ATOM 915 N TRP A 63 2.618 -12.339 -5.204 1.00 40.32 N ATOM 916 CA TRP A 63 2.583 -13.742 -5.602 1.00 62.14 C ATOM 917 C TRP A 63 3.074 -14.640 -4.473 1.00 65.51 C ATOM 918 O TRP A 63 4.262 -14.648 -4.145 1.00 34.51 O ATOM 919 CB TRP A 63 3.437 -13.960 -6.853 1.00 72.01 C ATOM 920 CG TRP A 63 3.552 -15.401 -7.250 1.00 33.35 C ATOM 921 CD1 TRP A 63 4.685 -16.161 -7.255 1.00 42.14 C ATOM 922 CD2 TRP A 63 2.493 -16.253 -7.700 1.00 54.21 C ATOM 923 NE1 TRP A 63 4.396 -17.435 -7.682 1.00 34.31 N ATOM 924 CE2 TRP A 63 3.057 -17.517 -7.961 1.00 4.32 C ATOM 925 CE3 TRP A 63 1.122 -16.071 -7.908 1.00 30.44 C ATOM 926 CZ2 TRP A 63 2.298 -18.591 -8.417 1.00 75.21 C ATOM 927 CZ3 TRP A 63 0.371 -17.139 -8.362 1.00 11.44 C ATOM 928 CH2 TRP A 63 0.959 -18.386 -8.612 1.00 10.44 C ATOM 0 H TRP A 63 3.386 -12.097 -4.577 1.00 40.32 H new ATOM 0 HA TRP A 63 1.549 -14.005 -5.826 1.00 62.14 H new ATOM 0 HB2 TRP A 63 3.007 -13.396 -7.681 1.00 72.01 H new ATOM 0 HB3 TRP A 63 4.435 -13.558 -6.678 1.00 72.01 H new ATOM 0 HD1 TRP A 63 5.665 -15.813 -6.966 1.00 42.14 H new ATOM 0 HE1 TRP A 63 5.069 -18.196 -7.776 1.00 34.31 H new ATOM 0 HE3 TRP A 63 0.659 -15.114 -7.718 1.00 30.44 H new ATOM 0 HZ2 TRP A 63 2.750 -19.553 -8.610 1.00 75.21 H new ATOM 0 HZ3 TRP A 63 -0.688 -17.010 -8.527 1.00 11.44 H new ATOM 0 HH2 TRP A 63 0.344 -19.201 -8.965 1.00 10.44 H new ATOM 939 N HIS A 64 2.156 -15.397 -3.881 1.00 71.34 N ATOM 940 CA HIS A 64 2.497 -16.301 -2.789 1.00 12.23 C ATOM 941 C HIS A 64 3.354 -15.592 -1.745 1.00 14.52 C ATOM 942 O HIS A 64 4.174 -16.215 -1.073 1.00 44.12 O ATOM 943 CB HIS A 64 3.236 -17.527 -3.325 1.00 40.20 C ATOM 944 CG HIS A 64 2.461 -18.293 -4.352 1.00 53.33 C ATOM 945 ND1 HIS A 64 2.619 -19.646 -4.560 1.00 22.35 N ATOM 946 CD2 HIS A 64 1.515 -17.887 -5.231 1.00 44.35 C ATOM 947 CE1 HIS A 64 1.805 -20.040 -5.523 1.00 64.44 C ATOM 948 NE2 HIS A 64 1.124 -18.992 -5.947 1.00 44.22 N ATOM 0 H HIS A 64 1.169 -15.402 -4.140 1.00 71.34 H new ATOM 0 HA HIS A 64 1.570 -16.624 -2.315 1.00 12.23 H new ATOM 0 HB2 HIS A 64 4.183 -17.208 -3.760 1.00 40.20 H new ATOM 0 HB3 HIS A 64 3.474 -18.190 -2.493 1.00 40.20 H new ATOM 0 HD2 HIS A 64 1.138 -16.882 -5.348 1.00 44.35 H new ATOM 0 HE1 HIS A 64 1.713 -21.048 -5.899 1.00 64.44 H new ATOM 0 HE2 HIS A 64 0.421 -19.001 -6.686 1.00 44.22 H new ATOM 957 N GLY A 65 3.159 -14.282 -1.616 1.00 31.10 N ATOM 958 CA GLY A 65 3.922 -13.510 -0.653 1.00 72.13 C ATOM 959 C GLY A 65 4.976 -12.642 -1.310 1.00 62.14 C ATOM 960 O GLY A 65 5.267 -11.543 -0.840 1.00 11.13 O ATOM 0 H GLY A 65 2.486 -13.743 -2.161 1.00 31.10 H new ATOM 0 HA2 GLY A 65 3.244 -12.880 -0.078 1.00 72.13 H new ATOM 0 HA3 GLY A 65 4.402 -14.188 0.053 1.00 72.13 H new ATOM 964 N ALA A 66 5.551 -13.137 -2.402 1.00 34.42 N ATOM 965 CA ALA A 66 6.579 -12.399 -3.126 1.00 12.01 C ATOM 966 C ALA A 66 5.959 -11.353 -4.045 1.00 73.52 C ATOM 967 O ALA A 66 5.072 -11.660 -4.843 1.00 23.51 O ATOM 968 CB ALA A 66 7.452 -13.356 -3.923 1.00 60.35 C ATOM 0 H ALA A 66 5.322 -14.046 -2.804 1.00 34.42 H new ATOM 0 HA ALA A 66 7.201 -11.880 -2.397 1.00 12.01 H new ATOM 0 HB1 ALA A 66 8.215 -12.792 -4.459 1.00 60.35 H new ATOM 0 HB2 ALA A 66 7.932 -14.062 -3.245 1.00 60.35 H new ATOM 0 HB3 ALA A 66 6.836 -13.901 -4.638 1.00 60.35 H new ATOM 974 N CYS A 67 6.430 -10.117 -3.929 1.00 53.52 N ATOM 975 CA CYS A 67 5.921 -9.024 -4.749 1.00 51.34 C ATOM 976 C CYS A 67 6.420 -9.144 -6.186 1.00 23.11 C ATOM 977 O CYS A 67 7.571 -8.822 -6.483 1.00 73.45 O ATOM 978 CB CYS A 67 6.346 -7.676 -4.161 1.00 63.21 C ATOM 979 SG CYS A 67 5.424 -6.252 -4.824 1.00 61.21 S ATOM 0 H CYS A 67 7.164 -9.846 -3.275 1.00 53.52 H new ATOM 0 HA CYS A 67 4.833 -9.084 -4.754 1.00 51.34 H new ATOM 0 HB2 CYS A 67 6.217 -7.707 -3.079 1.00 63.21 H new ATOM 0 HB3 CYS A 67 7.409 -7.528 -4.351 1.00 63.21 H new ATOM 984 N ARG A 68 5.546 -9.608 -7.073 1.00 63.12 N ATOM 985 CA ARG A 68 5.898 -9.773 -8.479 1.00 11.43 C ATOM 986 C ARG A 68 6.329 -8.442 -9.089 1.00 72.53 C ATOM 987 O ARG A 68 7.493 -8.256 -9.439 1.00 41.34 O ATOM 988 CB ARG A 68 4.713 -10.345 -9.259 1.00 25.41 C ATOM 989 CG ARG A 68 5.123 -11.186 -10.457 1.00 30.42 C ATOM 990 CD ARG A 68 4.928 -10.429 -11.761 1.00 4.31 C ATOM 991 NE ARG A 68 5.282 -11.240 -12.923 1.00 31.12 N ATOM 992 CZ ARG A 68 6.534 -11.521 -13.270 1.00 73.23 C ATOM 993 NH1 ARG A 68 7.545 -11.058 -12.548 1.00 71.14 N ATOM 994 NH2 ARG A 68 6.775 -12.266 -14.342 1.00 21.34 N ATOM 0 H ARG A 68 4.589 -9.876 -6.843 1.00 63.12 H new ATOM 0 HA ARG A 68 6.734 -10.470 -8.541 1.00 11.43 H new ATOM 0 HB2 ARG A 68 4.107 -10.954 -8.588 1.00 25.41 H new ATOM 0 HB3 ARG A 68 4.083 -9.524 -9.601 1.00 25.41 H new ATOM 0 HG2 ARG A 68 6.168 -11.478 -10.357 1.00 30.42 H new ATOM 0 HG3 ARG A 68 4.536 -12.104 -10.477 1.00 30.42 H new ATOM 0 HD2 ARG A 68 3.889 -10.111 -11.844 1.00 4.31 H new ATOM 0 HD3 ARG A 68 5.538 -9.525 -11.750 1.00 4.31 H new ATOM 0 HE ARG A 68 4.527 -11.611 -13.500 1.00 31.12 H new ATOM 0 HH11 ARG A 68 7.363 -10.485 -11.724 1.00 71.14 H new ATOM 0 HH12 ARG A 68 8.505 -11.275 -12.816 1.00 71.14 H new ATOM 0 HH21 ARG A 68 5.999 -12.623 -14.900 1.00 21.34 H new ATOM 0 HH22 ARG A 68 7.736 -12.481 -14.608 1.00 21.34 H new ATOM 1008 N GLY A 69 5.379 -7.520 -9.217 1.00 22.21 N ATOM 1009 CA GLY A 69 5.679 -6.219 -9.786 1.00 71.21 C ATOM 1010 C GLY A 69 4.783 -5.126 -9.241 1.00 33.13 C ATOM 1011 O GLY A 69 3.980 -5.365 -8.338 1.00 13.00 O ATOM 0 H GLY A 69 4.407 -7.651 -8.937 1.00 22.21 H new ATOM 0 HA2 GLY A 69 6.719 -5.967 -9.580 1.00 71.21 H new ATOM 0 HA3 GLY A 69 5.571 -6.266 -10.870 1.00 71.21 H new ATOM 1015 N ALA A 70 4.919 -3.923 -9.787 1.00 61.21 N ATOM 1016 CA ALA A 70 4.115 -2.789 -9.350 1.00 74.33 C ATOM 1017 C ALA A 70 4.095 -1.690 -10.407 1.00 15.51 C ATOM 1018 O ALA A 70 5.062 -1.507 -11.145 1.00 41.32 O ATOM 1019 CB ALA A 70 4.642 -2.245 -8.030 1.00 70.24 C ATOM 0 H ALA A 70 5.579 -3.708 -10.534 1.00 61.21 H new ATOM 0 HA ALA A 70 3.092 -3.136 -9.205 1.00 74.33 H new ATOM 0 HB1 ALA A 70 4.032 -1.398 -7.716 1.00 70.24 H new ATOM 0 HB2 ALA A 70 4.597 -3.026 -7.271 1.00 70.24 H new ATOM 0 HB3 ALA A 70 5.675 -1.921 -8.157 1.00 70.24 H new ATOM 1025 N LYS A 71 2.986 -0.960 -10.474 1.00 23.23 N ATOM 1026 CA LYS A 71 2.839 0.122 -11.440 1.00 30.43 C ATOM 1027 C LYS A 71 1.971 1.242 -10.875 1.00 24.32 C ATOM 1028 O LYS A 71 0.914 0.989 -10.296 1.00 41.00 O ATOM 1029 CB LYS A 71 2.226 -0.407 -12.740 1.00 3.22 C ATOM 1030 CG LYS A 71 0.916 -1.148 -12.537 1.00 3.24 C ATOM 1031 CD LYS A 71 0.228 -1.436 -13.861 1.00 24.22 C ATOM 1032 CE LYS A 71 -0.192 -2.895 -13.964 1.00 31.04 C ATOM 1033 NZ LYS A 71 -0.538 -3.274 -15.362 1.00 61.11 N ATOM 0 H LYS A 71 2.176 -1.099 -9.870 1.00 23.23 H new ATOM 0 HA LYS A 71 3.830 0.525 -11.650 1.00 30.43 H new ATOM 0 HB2 LYS A 71 2.060 0.429 -13.420 1.00 3.22 H new ATOM 0 HB3 LYS A 71 2.940 -1.074 -13.223 1.00 3.22 H new ATOM 0 HG2 LYS A 71 1.104 -2.085 -12.012 1.00 3.24 H new ATOM 0 HG3 LYS A 71 0.256 -0.555 -11.904 1.00 3.24 H new ATOM 0 HD2 LYS A 71 -0.648 -0.796 -13.964 1.00 24.22 H new ATOM 0 HD3 LYS A 71 0.901 -1.191 -14.683 1.00 24.22 H new ATOM 0 HE2 LYS A 71 0.616 -3.532 -13.604 1.00 31.04 H new ATOM 0 HE3 LYS A 71 -1.050 -3.073 -13.316 1.00 31.04 H new ATOM 0 HZ1 LYS A 71 -0.819 -4.275 -15.391 1.00 61.11 H new ATOM 0 HZ2 LYS A 71 -1.326 -2.683 -15.697 1.00 61.11 H new ATOM 0 HZ3 LYS A 71 0.289 -3.129 -15.976 1.00 61.11 H new ATOM 1047 N ALA A 72 2.424 2.479 -11.047 1.00 52.34 N ATOM 1048 CA ALA A 72 1.686 3.637 -10.558 1.00 21.14 C ATOM 1049 C ALA A 72 0.783 4.213 -11.643 1.00 61.22 C ATOM 1050 O ALA A 72 1.210 4.408 -12.781 1.00 10.13 O ATOM 1051 CB ALA A 72 2.649 4.700 -10.051 1.00 43.42 C ATOM 0 H ALA A 72 3.298 2.705 -11.521 1.00 52.34 H new ATOM 0 HA ALA A 72 1.053 3.311 -9.732 1.00 21.14 H new ATOM 0 HB1 ALA A 72 2.085 5.559 -9.689 1.00 43.42 H new ATOM 0 HB2 ALA A 72 3.248 4.290 -9.238 1.00 43.42 H new ATOM 0 HB3 ALA A 72 3.305 5.013 -10.863 1.00 43.42 H new ATOM 1057 N VAL A 73 -0.468 4.481 -11.284 1.00 74.52 N ATOM 1058 CA VAL A 73 -1.433 5.033 -12.228 1.00 72.03 C ATOM 1059 C VAL A 73 -2.323 6.074 -11.558 1.00 72.30 C ATOM 1060 O VAL A 73 -2.865 5.838 -10.478 1.00 44.30 O ATOM 1061 CB VAL A 73 -2.320 3.930 -12.837 1.00 25.02 C ATOM 1062 CG1 VAL A 73 -2.687 2.899 -11.781 1.00 74.43 C ATOM 1063 CG2 VAL A 73 -3.568 4.535 -13.461 1.00 63.45 C ATOM 0 H VAL A 73 -0.837 4.325 -10.346 1.00 74.52 H new ATOM 0 HA VAL A 73 -0.860 5.507 -13.025 1.00 72.03 H new ATOM 0 HB VAL A 73 -1.757 3.426 -13.623 1.00 25.02 H new ATOM 0 HG11 VAL A 73 -3.314 2.127 -12.228 1.00 74.43 H new ATOM 0 HG12 VAL A 73 -1.779 2.445 -11.385 1.00 74.43 H new ATOM 0 HG13 VAL A 73 -3.232 3.385 -10.972 1.00 74.43 H new ATOM 0 HG21 VAL A 73 -4.183 3.742 -13.886 1.00 63.45 H new ATOM 0 HG22 VAL A 73 -4.137 5.065 -12.697 1.00 63.45 H new ATOM 0 HG23 VAL A 73 -3.280 5.232 -14.248 1.00 63.45 H new ATOM 1073 N GLU A 74 -2.471 7.225 -12.206 1.00 64.04 N ATOM 1074 CA GLU A 74 -3.297 8.302 -11.672 1.00 64.14 C ATOM 1075 C GLU A 74 -4.647 8.354 -12.379 1.00 40.13 C ATOM 1076 O GLU A 74 -4.723 8.622 -13.577 1.00 72.55 O ATOM 1077 CB GLU A 74 -2.579 9.645 -11.819 1.00 65.33 C ATOM 1078 CG GLU A 74 -1.234 9.697 -11.115 1.00 31.21 C ATOM 1079 CD GLU A 74 -0.177 10.420 -11.927 1.00 20.31 C ATOM 1080 OE1 GLU A 74 -0.344 10.524 -13.160 1.00 53.13 O ATOM 1081 OE2 GLU A 74 0.818 10.881 -11.329 1.00 71.03 O ATOM 0 H GLU A 74 -2.030 7.436 -13.101 1.00 64.04 H new ATOM 0 HA GLU A 74 -3.469 8.104 -10.614 1.00 64.14 H new ATOM 0 HB2 GLU A 74 -2.433 9.855 -12.879 1.00 65.33 H new ATOM 0 HB3 GLU A 74 -3.218 10.434 -11.422 1.00 65.33 H new ATOM 0 HG2 GLU A 74 -1.351 10.195 -10.153 1.00 31.21 H new ATOM 0 HG3 GLU A 74 -0.897 8.681 -10.909 1.00 31.21 H new ATOM 1088 N GLY A 75 -5.713 8.095 -11.627 1.00 44.33 N ATOM 1089 CA GLY A 75 -7.047 8.117 -12.198 1.00 42.13 C ATOM 1090 C GLY A 75 -7.796 6.820 -11.972 1.00 21.40 C ATOM 1091 O GLY A 75 -8.700 6.755 -11.139 1.00 71.12 O ATOM 0 H GLY A 75 -5.676 7.870 -10.633 1.00 44.33 H new ATOM 0 HA2 GLY A 75 -7.612 8.940 -11.761 1.00 42.13 H new ATOM 0 HA3 GLY A 75 -6.977 8.311 -13.268 1.00 42.13 H new ATOM 1095 N GLU A 76 -7.420 5.783 -12.715 1.00 35.05 N ATOM 1096 CA GLU A 76 -8.067 4.481 -12.591 1.00 44.34 C ATOM 1097 C GLU A 76 -7.037 3.356 -12.645 1.00 64.21 C ATOM 1098 O GLU A 76 -6.176 3.330 -13.525 1.00 0.12 O ATOM 1099 CB GLU A 76 -9.102 4.294 -13.701 1.00 61.32 C ATOM 1100 CG GLU A 76 -10.402 5.042 -13.454 1.00 45.40 C ATOM 1101 CD GLU A 76 -11.619 4.270 -13.924 1.00 65.02 C ATOM 1102 OE1 GLU A 76 -12.089 3.389 -13.175 1.00 62.23 O ATOM 1103 OE2 GLU A 76 -12.100 4.547 -15.043 1.00 55.32 O ATOM 0 H GLU A 76 -6.672 5.819 -13.408 1.00 35.05 H new ATOM 0 HA GLU A 76 -8.571 4.443 -11.625 1.00 44.34 H new ATOM 0 HB2 GLU A 76 -8.674 4.629 -14.646 1.00 61.32 H new ATOM 0 HB3 GLU A 76 -9.319 3.231 -13.809 1.00 61.32 H new ATOM 0 HG2 GLU A 76 -10.499 5.252 -12.389 1.00 45.40 H new ATOM 0 HG3 GLU A 76 -10.366 6.003 -13.966 1.00 45.40 H new ATOM 1110 N ALA A 77 -7.132 2.429 -11.698 1.00 62.41 N ATOM 1111 CA ALA A 77 -6.211 1.301 -11.638 1.00 61.52 C ATOM 1112 C ALA A 77 -6.956 -0.024 -11.769 1.00 33.15 C ATOM 1113 O ALA A 77 -8.179 -0.048 -11.900 1.00 34.05 O ATOM 1114 CB ALA A 77 -5.416 1.336 -10.342 1.00 14.22 C ATOM 0 H ALA A 77 -7.838 2.437 -10.962 1.00 62.41 H new ATOM 0 HA ALA A 77 -5.520 1.384 -12.477 1.00 61.52 H new ATOM 0 HB1 ALA A 77 -4.732 0.487 -10.311 1.00 14.22 H new ATOM 0 HB2 ALA A 77 -4.846 2.263 -10.290 1.00 14.22 H new ATOM 0 HB3 ALA A 77 -6.099 1.282 -9.494 1.00 14.22 H new ATOM 1120 N GLU A 78 -6.211 -1.123 -11.733 1.00 25.33 N ATOM 1121 CA GLU A 78 -6.801 -2.451 -11.848 1.00 71.42 C ATOM 1122 C GLU A 78 -6.062 -3.455 -10.968 1.00 0.12 C ATOM 1123 O GLU A 78 -4.858 -3.661 -11.119 1.00 71.22 O ATOM 1124 CB GLU A 78 -6.778 -2.920 -13.305 1.00 2.14 C ATOM 1125 CG GLU A 78 -7.859 -3.934 -13.635 1.00 53.14 C ATOM 1126 CD GLU A 78 -7.820 -4.377 -15.085 1.00 51.14 C ATOM 1127 OE1 GLU A 78 -8.139 -3.551 -15.966 1.00 24.31 O ATOM 1128 OE2 GLU A 78 -7.471 -5.549 -15.339 1.00 45.42 O ATOM 0 H GLU A 78 -5.197 -1.120 -11.625 1.00 25.33 H new ATOM 0 HA GLU A 78 -7.835 -2.390 -11.509 1.00 71.42 H new ATOM 0 HB2 GLU A 78 -6.892 -2.055 -13.958 1.00 2.14 H new ATOM 0 HB3 GLU A 78 -5.803 -3.357 -13.522 1.00 2.14 H new ATOM 0 HG2 GLU A 78 -7.744 -4.805 -12.990 1.00 53.14 H new ATOM 0 HG3 GLU A 78 -8.836 -3.502 -13.417 1.00 53.14 H new ATOM 1135 N ALA A 79 -6.792 -4.077 -10.047 1.00 40.52 N ATOM 1136 CA ALA A 79 -6.207 -5.059 -9.144 1.00 34.12 C ATOM 1137 C ALA A 79 -7.290 -5.840 -8.406 1.00 1.51 C ATOM 1138 O ALA A 79 -8.410 -5.358 -8.239 1.00 70.22 O ATOM 1139 CB ALA A 79 -5.278 -4.375 -8.151 1.00 42.03 C ATOM 0 H ALA A 79 -7.790 -3.917 -9.907 1.00 40.52 H new ATOM 0 HA ALA A 79 -5.629 -5.765 -9.740 1.00 34.12 H new ATOM 0 HB1 ALA A 79 -4.848 -5.121 -7.482 1.00 42.03 H new ATOM 0 HB2 ALA A 79 -4.479 -3.867 -8.691 1.00 42.03 H new ATOM 0 HB3 ALA A 79 -5.841 -3.647 -7.568 1.00 42.03 H new ATOM 1145 N ASP A 80 -6.947 -7.045 -7.968 1.00 74.53 N ATOM 1146 CA ASP A 80 -7.890 -7.894 -7.247 1.00 55.04 C ATOM 1147 C ASP A 80 -8.308 -7.245 -5.932 1.00 20.35 C ATOM 1148 O ASP A 80 -9.368 -7.552 -5.385 1.00 33.14 O ATOM 1149 CB ASP A 80 -7.274 -9.268 -6.981 1.00 1.32 C ATOM 1150 CG ASP A 80 -8.003 -10.380 -7.708 1.00 34.25 C ATOM 1151 OD1 ASP A 80 -9.100 -10.767 -7.251 1.00 42.11 O ATOM 1152 OD2 ASP A 80 -7.477 -10.866 -8.730 1.00 41.45 O ATOM 0 H ASP A 80 -6.023 -7.457 -8.099 1.00 74.53 H new ATOM 0 HA ASP A 80 -8.777 -8.019 -7.868 1.00 55.04 H new ATOM 0 HB2 ASP A 80 -6.229 -9.260 -7.290 1.00 1.32 H new ATOM 0 HB3 ASP A 80 -7.288 -9.468 -5.910 1.00 1.32 H new ATOM 1157 N PHE A 81 -7.468 -6.349 -5.426 1.00 22.12 N ATOM 1158 CA PHE A 81 -7.748 -5.659 -4.172 1.00 62.12 C ATOM 1159 C PHE A 81 -7.416 -4.174 -4.283 1.00 73.04 C ATOM 1160 O PHE A 81 -6.248 -3.789 -4.326 1.00 0.55 O ATOM 1161 CB PHE A 81 -6.949 -6.288 -3.029 1.00 41.53 C ATOM 1162 CG PHE A 81 -7.309 -7.722 -2.763 1.00 41.53 C ATOM 1163 CD1 PHE A 81 -8.464 -8.041 -2.067 1.00 44.33 C ATOM 1164 CD2 PHE A 81 -6.495 -8.749 -3.210 1.00 60.14 C ATOM 1165 CE1 PHE A 81 -8.798 -9.359 -1.820 1.00 51.02 C ATOM 1166 CE2 PHE A 81 -6.823 -10.069 -2.966 1.00 74.44 C ATOM 1167 CZ PHE A 81 -7.978 -10.375 -2.272 1.00 24.12 C ATOM 0 H PHE A 81 -6.587 -6.083 -5.865 1.00 22.12 H new ATOM 0 HA PHE A 81 -8.812 -5.761 -3.960 1.00 62.12 H new ATOM 0 HB2 PHE A 81 -5.886 -6.226 -3.262 1.00 41.53 H new ATOM 0 HB3 PHE A 81 -7.110 -5.707 -2.121 1.00 41.53 H new ATOM 0 HD1 PHE A 81 -9.110 -7.251 -1.714 1.00 44.33 H new ATOM 0 HD2 PHE A 81 -5.593 -8.516 -3.756 1.00 60.14 H new ATOM 0 HE1 PHE A 81 -9.699 -9.595 -1.274 1.00 51.02 H new ATOM 0 HE2 PHE A 81 -6.177 -10.860 -3.317 1.00 74.44 H new ATOM 0 HZ PHE A 81 -8.239 -11.406 -2.083 1.00 24.12 H new ATOM 1177 N VAL A 82 -8.454 -3.343 -4.331 1.00 30.33 N ATOM 1178 CA VAL A 82 -8.274 -1.901 -4.436 1.00 3.44 C ATOM 1179 C VAL A 82 -8.908 -1.180 -3.251 1.00 24.40 C ATOM 1180 O VAL A 82 -10.031 -1.488 -2.854 1.00 34.42 O ATOM 1181 CB VAL A 82 -8.881 -1.353 -5.741 1.00 74.51 C ATOM 1182 CG1 VAL A 82 -8.848 0.167 -5.749 1.00 42.53 C ATOM 1183 CG2 VAL A 82 -8.146 -1.917 -6.948 1.00 34.30 C ATOM 0 H VAL A 82 -9.428 -3.645 -4.299 1.00 30.33 H new ATOM 0 HA VAL A 82 -7.200 -1.716 -4.438 1.00 3.44 H new ATOM 0 HB VAL A 82 -9.922 -1.670 -5.798 1.00 74.51 H new ATOM 0 HG11 VAL A 82 -9.281 0.535 -6.679 1.00 42.53 H new ATOM 0 HG12 VAL A 82 -9.423 0.548 -4.905 1.00 42.53 H new ATOM 0 HG13 VAL A 82 -7.816 0.509 -5.669 1.00 42.53 H new ATOM 0 HG21 VAL A 82 -8.588 -1.519 -7.862 1.00 34.30 H new ATOM 0 HG22 VAL A 82 -7.095 -1.632 -6.900 1.00 34.30 H new ATOM 0 HG23 VAL A 82 -8.228 -3.004 -6.949 1.00 34.30 H new ATOM 1193 N ILE A 83 -8.180 -0.218 -2.693 1.00 34.43 N ATOM 1194 CA ILE A 83 -8.673 0.548 -1.555 1.00 23.33 C ATOM 1195 C ILE A 83 -8.569 2.046 -1.815 1.00 13.04 C ATOM 1196 O ILE A 83 -7.549 2.533 -2.298 1.00 5.33 O ATOM 1197 CB ILE A 83 -7.898 0.206 -0.269 1.00 5.15 C ATOM 1198 CG1 ILE A 83 -7.916 -1.303 -0.021 1.00 33.52 C ATOM 1199 CG2 ILE A 83 -8.489 0.951 0.919 1.00 30.55 C ATOM 1200 CD1 ILE A 83 -6.939 -1.754 1.041 1.00 22.23 C ATOM 0 H ILE A 83 -7.248 0.049 -3.010 1.00 34.43 H new ATOM 0 HA ILE A 83 -9.720 0.277 -1.421 1.00 23.33 H new ATOM 0 HB ILE A 83 -6.862 0.521 -0.393 1.00 5.15 H new ATOM 0 HG12 ILE A 83 -8.922 -1.602 0.272 1.00 33.52 H new ATOM 0 HG13 ILE A 83 -7.689 -1.819 -0.954 1.00 33.52 H new ATOM 0 HG21 ILE A 83 -7.931 0.699 1.821 1.00 30.55 H new ATOM 0 HG22 ILE A 83 -8.428 2.025 0.742 1.00 30.55 H new ATOM 0 HG23 ILE A 83 -9.533 0.663 1.046 1.00 30.55 H new ATOM 0 HD11 ILE A 83 -7.007 -2.835 1.163 1.00 22.23 H new ATOM 0 HD12 ILE A 83 -5.926 -1.486 0.741 1.00 22.23 H new ATOM 0 HD13 ILE A 83 -7.178 -1.267 1.986 1.00 22.23 H new ATOM 1212 N GLU A 84 -9.633 2.773 -1.488 1.00 75.11 N ATOM 1213 CA GLU A 84 -9.662 4.217 -1.686 1.00 3.42 C ATOM 1214 C GLU A 84 -9.961 4.940 -0.376 1.00 0.25 C ATOM 1215 O GLU A 84 -10.903 4.594 0.335 1.00 30.44 O ATOM 1216 CB GLU A 84 -10.709 4.591 -2.737 1.00 24.31 C ATOM 1217 CG GLU A 84 -10.996 6.082 -2.808 1.00 33.44 C ATOM 1218 CD GLU A 84 -11.319 6.547 -4.214 1.00 53.20 C ATOM 1219 OE1 GLU A 84 -10.798 5.943 -5.174 1.00 74.23 O ATOM 1220 OE2 GLU A 84 -12.093 7.516 -4.354 1.00 14.53 O ATOM 0 H GLU A 84 -10.486 2.385 -1.085 1.00 75.11 H new ATOM 0 HA GLU A 84 -8.678 4.528 -2.037 1.00 3.42 H new ATOM 0 HB2 GLU A 84 -10.369 4.248 -3.714 1.00 24.31 H new ATOM 0 HB3 GLU A 84 -11.636 4.061 -2.518 1.00 24.31 H new ATOM 0 HG2 GLU A 84 -11.832 6.319 -2.150 1.00 33.44 H new ATOM 0 HG3 GLU A 84 -10.132 6.633 -2.437 1.00 33.44 H new ATOM 1227 N ALA A 85 -9.150 5.946 -0.064 1.00 14.15 N ATOM 1228 CA ALA A 85 -9.328 6.719 1.160 1.00 20.22 C ATOM 1229 C ALA A 85 -8.595 8.053 1.078 1.00 42.43 C ATOM 1230 O ALA A 85 -7.742 8.252 0.212 1.00 53.14 O ATOM 1231 CB ALA A 85 -8.845 5.923 2.363 1.00 63.42 C ATOM 0 H ALA A 85 -8.364 6.245 -0.641 1.00 14.15 H new ATOM 0 HA ALA A 85 -10.392 6.925 1.278 1.00 20.22 H new ATOM 0 HB1 ALA A 85 -8.984 6.513 3.269 1.00 63.42 H new ATOM 0 HB2 ALA A 85 -9.417 4.998 2.441 1.00 63.42 H new ATOM 0 HB3 ALA A 85 -7.788 5.687 2.242 1.00 63.42 H new ATOM 1237 N ASP A 86 -8.933 8.965 1.982 1.00 3.32 N ATOM 1238 CA ASP A 86 -8.306 10.282 2.012 1.00 11.25 C ATOM 1239 C ASP A 86 -6.801 10.162 2.235 1.00 50.43 C ATOM 1240 O ASP A 86 -6.342 9.320 3.006 1.00 14.11 O ATOM 1241 CB ASP A 86 -8.930 11.143 3.112 1.00 51.32 C ATOM 1242 CG ASP A 86 -10.278 11.708 2.710 1.00 52.24 C ATOM 1243 OD1 ASP A 86 -10.317 12.549 1.787 1.00 53.04 O ATOM 1244 OD2 ASP A 86 -11.294 11.309 3.317 1.00 43.21 O ATOM 0 H ASP A 86 -9.638 8.817 2.704 1.00 3.32 H new ATOM 0 HA ASP A 86 -8.476 10.760 1.047 1.00 11.25 H new ATOM 0 HB2 ASP A 86 -9.045 10.545 4.016 1.00 51.32 H new ATOM 0 HB3 ASP A 86 -8.254 11.962 3.356 1.00 51.32 H new ATOM 1249 N LEU A 87 -6.039 11.011 1.553 1.00 21.31 N ATOM 1250 CA LEU A 87 -4.586 11.000 1.675 1.00 4.03 C ATOM 1251 C LEU A 87 -4.160 11.114 3.136 1.00 32.45 C ATOM 1252 O LEU A 87 -3.269 10.397 3.591 1.00 11.31 O ATOM 1253 CB LEU A 87 -3.978 12.147 0.866 1.00 44.10 C ATOM 1254 CG LEU A 87 -2.584 12.608 1.296 1.00 72.52 C ATOM 1255 CD1 LEU A 87 -1.560 11.511 1.053 1.00 21.31 C ATOM 1256 CD2 LEU A 87 -2.192 13.880 0.559 1.00 63.33 C ATOM 0 H LEU A 87 -6.403 11.715 0.911 1.00 21.31 H new ATOM 0 HA LEU A 87 -4.221 10.051 1.282 1.00 4.03 H new ATOM 0 HB2 LEU A 87 -3.931 11.843 -0.180 1.00 44.10 H new ATOM 0 HB3 LEU A 87 -4.654 13.001 0.920 1.00 44.10 H new ATOM 0 HG LEU A 87 -2.607 12.824 2.364 1.00 72.52 H new ATOM 0 HD11 LEU A 87 -0.575 11.857 1.365 1.00 21.31 H new ATOM 0 HD12 LEU A 87 -1.832 10.626 1.628 1.00 21.31 H new ATOM 0 HD13 LEU A 87 -1.538 11.262 -0.008 1.00 21.31 H new ATOM 0 HD21 LEU A 87 -1.198 14.193 0.877 1.00 63.33 H new ATOM 0 HD22 LEU A 87 -2.187 13.692 -0.515 1.00 63.33 H new ATOM 0 HD23 LEU A 87 -2.910 14.668 0.785 1.00 63.33 H new ATOM 1268 N ALA A 88 -4.807 12.016 3.867 1.00 51.10 N ATOM 1269 CA ALA A 88 -4.499 12.220 5.276 1.00 33.43 C ATOM 1270 C ALA A 88 -4.511 10.898 6.037 1.00 12.34 C ATOM 1271 O ALA A 88 -3.636 10.636 6.863 1.00 4.22 O ATOM 1272 CB ALA A 88 -5.488 13.197 5.897 1.00 65.22 C ATOM 0 H ALA A 88 -5.548 12.617 3.506 1.00 51.10 H new ATOM 0 HA ALA A 88 -3.496 12.641 5.346 1.00 33.43 H new ATOM 0 HB1 ALA A 88 -5.246 13.340 6.950 1.00 65.22 H new ATOM 0 HB2 ALA A 88 -5.429 14.154 5.378 1.00 65.22 H new ATOM 0 HB3 ALA A 88 -6.498 12.798 5.808 1.00 65.22 H new ATOM 1278 N THR A 89 -5.509 10.066 5.755 1.00 10.32 N ATOM 1279 CA THR A 89 -5.636 8.773 6.414 1.00 31.15 C ATOM 1280 C THR A 89 -4.525 7.824 5.979 1.00 23.34 C ATOM 1281 O THR A 89 -3.931 7.129 6.805 1.00 41.22 O ATOM 1282 CB THR A 89 -6.999 8.121 6.115 1.00 15.12 C ATOM 1283 OG1 THR A 89 -8.055 8.923 6.655 1.00 4.11 O ATOM 1284 CG2 THR A 89 -7.069 6.720 6.702 1.00 71.31 C ATOM 0 H THR A 89 -6.241 10.266 5.074 1.00 10.32 H new ATOM 0 HA THR A 89 -5.557 8.955 7.486 1.00 31.15 H new ATOM 0 HB THR A 89 -7.114 8.051 5.033 1.00 15.12 H new ATOM 0 HG1 THR A 89 -8.918 8.502 6.459 1.00 4.11 H new ATOM 0 HG21 THR A 89 -8.041 6.280 6.478 1.00 71.31 H new ATOM 0 HG22 THR A 89 -6.282 6.104 6.267 1.00 71.31 H new ATOM 0 HG23 THR A 89 -6.934 6.771 7.782 1.00 71.31 H new ATOM 1292 N TRP A 90 -4.249 7.798 4.681 1.00 4.34 N ATOM 1293 CA TRP A 90 -3.208 6.934 4.138 1.00 63.31 C ATOM 1294 C TRP A 90 -1.864 7.218 4.799 1.00 32.24 C ATOM 1295 O TRP A 90 -1.213 6.311 5.318 1.00 71.34 O ATOM 1296 CB TRP A 90 -3.096 7.125 2.624 1.00 32.41 C ATOM 1297 CG TRP A 90 -4.130 6.364 1.851 1.00 32.41 C ATOM 1298 CD1 TRP A 90 -5.027 6.876 0.958 1.00 61.54 C ATOM 1299 CD2 TRP A 90 -4.376 4.954 1.907 1.00 64.35 C ATOM 1300 NE1 TRP A 90 -5.814 5.869 0.453 1.00 30.34 N ATOM 1301 CE2 TRP A 90 -5.434 4.680 1.018 1.00 13.45 C ATOM 1302 CE3 TRP A 90 -3.803 3.896 2.617 1.00 44.41 C ATOM 1303 CZ2 TRP A 90 -5.930 3.394 0.826 1.00 53.05 C ATOM 1304 CZ3 TRP A 90 -4.296 2.619 2.424 1.00 15.45 C ATOM 1305 CH2 TRP A 90 -5.351 2.377 1.534 1.00 34.11 C ATOM 0 H TRP A 90 -4.732 8.366 3.984 1.00 4.34 H new ATOM 0 HA TRP A 90 -3.483 5.900 4.348 1.00 63.31 H new ATOM 0 HB2 TRP A 90 -3.187 8.186 2.391 1.00 32.41 H new ATOM 0 HB3 TRP A 90 -2.105 6.811 2.298 1.00 32.41 H new ATOM 0 HD1 TRP A 90 -5.106 7.919 0.688 1.00 61.54 H new ATOM 0 HE1 TRP A 90 -6.561 5.988 -0.232 1.00 30.34 H new ATOM 0 HE3 TRP A 90 -2.989 4.073 3.305 1.00 44.41 H new ATOM 0 HZ2 TRP A 90 -6.744 3.206 0.142 1.00 53.05 H new ATOM 0 HZ3 TRP A 90 -3.861 1.794 2.968 1.00 15.45 H new ATOM 0 HH2 TRP A 90 -5.714 1.368 1.405 1.00 34.11 H new ATOM 1316 N GLN A 91 -1.454 8.483 4.778 1.00 74.12 N ATOM 1317 CA GLN A 91 -0.187 8.885 5.375 1.00 21.31 C ATOM 1318 C GLN A 91 0.020 8.202 6.724 1.00 64.01 C ATOM 1319 O GLN A 91 1.032 7.538 6.944 1.00 24.44 O ATOM 1320 CB GLN A 91 -0.138 10.404 5.547 1.00 72.43 C ATOM 1321 CG GLN A 91 -0.068 11.162 4.232 1.00 53.44 C ATOM 1322 CD GLN A 91 0.692 12.469 4.351 1.00 2.24 C ATOM 1323 OE1 GLN A 91 1.679 12.562 5.082 1.00 71.55 O ATOM 1324 NE2 GLN A 91 0.236 13.488 3.633 1.00 72.32 N ATOM 0 H GLN A 91 -1.981 9.246 4.354 1.00 74.12 H new ATOM 0 HA GLN A 91 0.615 8.577 4.704 1.00 21.31 H new ATOM 0 HB2 GLN A 91 -1.022 10.728 6.097 1.00 72.43 H new ATOM 0 HB3 GLN A 91 0.729 10.665 6.154 1.00 72.43 H new ATOM 0 HG2 GLN A 91 0.411 10.535 3.481 1.00 53.44 H new ATOM 0 HG3 GLN A 91 -1.079 11.365 3.880 1.00 53.44 H new ATOM 0 HE21 GLN A 91 -0.585 13.367 3.040 1.00 72.32 H new ATOM 0 HE22 GLN A 91 0.707 14.392 3.674 1.00 72.32 H new ATOM 1333 N GLU A 92 -0.946 8.372 7.622 1.00 60.51 N ATOM 1334 CA GLU A 92 -0.868 7.772 8.949 1.00 51.22 C ATOM 1335 C GLU A 92 -0.361 6.335 8.868 1.00 43.21 C ATOM 1336 O GLU A 92 0.633 5.979 9.500 1.00 24.32 O ATOM 1337 CB GLU A 92 -2.238 7.804 9.628 1.00 70.42 C ATOM 1338 CG GLU A 92 -2.999 9.099 9.404 1.00 13.22 C ATOM 1339 CD GLU A 92 -3.613 9.643 10.680 1.00 72.01 C ATOM 1340 OE1 GLU A 92 -2.866 10.220 11.498 1.00 24.22 O ATOM 1341 OE2 GLU A 92 -4.838 9.491 10.861 1.00 54.12 O ATOM 0 H GLU A 92 -1.790 8.919 7.455 1.00 60.51 H new ATOM 0 HA GLU A 92 -0.163 8.354 9.542 1.00 51.22 H new ATOM 0 HB2 GLU A 92 -2.837 6.972 9.258 1.00 70.42 H new ATOM 0 HB3 GLU A 92 -2.107 7.650 10.699 1.00 70.42 H new ATOM 0 HG2 GLU A 92 -2.324 9.845 8.983 1.00 13.22 H new ATOM 0 HG3 GLU A 92 -3.786 8.931 8.669 1.00 13.22 H new ATOM 1348 N VAL A 93 -1.053 5.513 8.084 1.00 3.12 N ATOM 1349 CA VAL A 93 -0.673 4.115 7.920 1.00 52.02 C ATOM 1350 C VAL A 93 0.807 3.984 7.579 1.00 61.44 C ATOM 1351 O VAL A 93 1.562 3.315 8.288 1.00 12.10 O ATOM 1352 CB VAL A 93 -1.505 3.434 6.816 1.00 22.34 C ATOM 1353 CG1 VAL A 93 -1.159 1.955 6.722 1.00 51.22 C ATOM 1354 CG2 VAL A 93 -2.991 3.627 7.075 1.00 14.00 C ATOM 0 H VAL A 93 -1.879 5.791 7.553 1.00 3.12 H new ATOM 0 HA VAL A 93 -0.869 3.620 8.871 1.00 52.02 H new ATOM 0 HB VAL A 93 -1.262 3.900 5.861 1.00 22.34 H new ATOM 0 HG11 VAL A 93 -1.756 1.491 5.937 1.00 51.22 H new ATOM 0 HG12 VAL A 93 -0.101 1.843 6.487 1.00 51.22 H new ATOM 0 HG13 VAL A 93 -1.372 1.470 7.675 1.00 51.22 H new ATOM 0 HG21 VAL A 93 -3.564 3.140 6.286 1.00 14.00 H new ATOM 0 HG22 VAL A 93 -3.253 3.188 8.038 1.00 14.00 H new ATOM 0 HG23 VAL A 93 -3.223 4.692 7.087 1.00 14.00 H new ATOM 1364 N LEU A 94 1.217 4.625 6.491 1.00 41.12 N ATOM 1365 CA LEU A 94 2.609 4.581 6.054 1.00 21.45 C ATOM 1366 C LEU A 94 3.543 5.042 7.169 1.00 31.23 C ATOM 1367 O LEU A 94 4.633 4.497 7.344 1.00 35.32 O ATOM 1368 CB LEU A 94 2.804 5.455 4.816 1.00 51.45 C ATOM 1369 CG LEU A 94 3.575 4.819 3.659 1.00 71.31 C ATOM 1370 CD1 LEU A 94 5.028 4.593 4.046 1.00 21.13 C ATOM 1371 CD2 LEU A 94 2.923 3.508 3.241 1.00 43.43 C ATOM 0 H LEU A 94 0.606 5.182 5.894 1.00 41.12 H new ATOM 0 HA LEU A 94 2.853 3.549 5.803 1.00 21.45 H new ATOM 0 HB2 LEU A 94 1.822 5.756 4.450 1.00 51.45 H new ATOM 0 HB3 LEU A 94 3.324 6.364 5.116 1.00 51.45 H new ATOM 0 HG LEU A 94 3.548 5.503 2.810 1.00 71.31 H new ATOM 0 HD11 LEU A 94 5.561 4.140 3.210 1.00 21.13 H new ATOM 0 HD12 LEU A 94 5.491 5.548 4.296 1.00 21.13 H new ATOM 0 HD13 LEU A 94 5.076 3.929 4.909 1.00 21.13 H new ATOM 0 HD21 LEU A 94 3.485 3.069 2.416 1.00 43.43 H new ATOM 0 HD22 LEU A 94 2.919 2.818 4.085 1.00 43.43 H new ATOM 0 HD23 LEU A 94 1.898 3.697 2.922 1.00 43.43 H new ATOM 1383 N GLU A 95 3.108 6.048 7.921 1.00 14.12 N ATOM 1384 CA GLU A 95 3.905 6.581 9.019 1.00 1.01 C ATOM 1385 C GLU A 95 4.094 5.533 10.113 1.00 43.24 C ATOM 1386 O GLU A 95 4.936 5.688 10.997 1.00 72.01 O ATOM 1387 CB GLU A 95 3.239 7.828 9.604 1.00 42.24 C ATOM 1388 CG GLU A 95 3.503 9.092 8.801 1.00 71.11 C ATOM 1389 CD GLU A 95 3.604 10.327 9.675 1.00 72.02 C ATOM 1390 OE1 GLU A 95 2.618 10.643 10.372 1.00 34.24 O ATOM 1391 OE2 GLU A 95 4.669 10.978 9.660 1.00 2.00 O ATOM 0 H GLU A 95 2.208 6.510 7.790 1.00 14.12 H new ATOM 0 HA GLU A 95 4.884 6.851 8.624 1.00 1.01 H new ATOM 0 HB2 GLU A 95 2.163 7.662 9.662 1.00 42.24 H new ATOM 0 HB3 GLU A 95 3.594 7.975 10.624 1.00 42.24 H new ATOM 0 HG2 GLU A 95 4.428 8.973 8.237 1.00 71.11 H new ATOM 0 HG3 GLU A 95 2.703 9.230 8.074 1.00 71.11 H new ATOM 1398 N GLY A 96 3.305 4.465 10.044 1.00 53.54 N ATOM 1399 CA GLY A 96 3.400 3.407 11.033 1.00 2.45 C ATOM 1400 C GLY A 96 2.521 3.663 12.241 1.00 23.13 C ATOM 1401 O GLY A 96 2.283 2.761 13.045 1.00 11.13 O ATOM 0 H GLY A 96 2.602 4.314 9.321 1.00 53.54 H new ATOM 0 HA2 GLY A 96 3.116 2.459 10.575 1.00 2.45 H new ATOM 0 HA3 GLY A 96 4.436 3.308 11.356 1.00 2.45 H new ATOM 1405 N ARG A 97 2.038 4.894 12.371 1.00 3.11 N ATOM 1406 CA ARG A 97 1.183 5.265 13.491 1.00 54.23 C ATOM 1407 C ARG A 97 -0.184 4.594 13.377 1.00 3.31 C ATOM 1408 O ARG A 97 -0.857 4.361 14.381 1.00 72.51 O ATOM 1409 CB ARG A 97 1.013 6.784 13.549 1.00 34.05 C ATOM 1410 CG ARG A 97 2.306 7.531 13.833 1.00 52.14 C ATOM 1411 CD ARG A 97 2.245 8.266 15.163 1.00 12.01 C ATOM 1412 NE ARG A 97 2.014 9.697 14.987 1.00 45.53 N ATOM 1413 CZ ARG A 97 2.216 10.598 15.942 1.00 24.54 C ATOM 1414 NH1 ARG A 97 2.652 10.216 17.136 1.00 43.44 N ATOM 1415 NH2 ARG A 97 1.985 11.882 15.706 1.00 15.12 N ATOM 0 H ARG A 97 2.225 5.652 11.714 1.00 3.11 H new ATOM 0 HA ARG A 97 1.661 4.924 14.409 1.00 54.23 H new ATOM 0 HB2 ARG A 97 0.603 7.132 12.601 1.00 34.05 H new ATOM 0 HB3 ARG A 97 0.284 7.030 14.321 1.00 34.05 H new ATOM 0 HG2 ARG A 97 3.139 6.828 13.843 1.00 52.14 H new ATOM 0 HG3 ARG A 97 2.499 8.243 13.031 1.00 52.14 H new ATOM 0 HD2 ARG A 97 1.448 7.843 15.775 1.00 12.01 H new ATOM 0 HD3 ARG A 97 3.178 8.113 15.705 1.00 12.01 H new ATOM 0 HE ARG A 97 1.679 10.023 14.080 1.00 45.53 H new ATOM 0 HH11 ARG A 97 2.832 9.229 17.321 1.00 43.44 H new ATOM 0 HH12 ARG A 97 2.807 10.909 17.868 1.00 43.44 H new ATOM 0 HH21 ARG A 97 1.651 12.180 14.789 1.00 15.12 H new ATOM 0 HH22 ARG A 97 2.141 12.572 16.441 1.00 15.12 H new ATOM 1429 N LEU A 98 -0.585 4.288 12.149 1.00 35.42 N ATOM 1430 CA LEU A 98 -1.871 3.644 11.904 1.00 60.32 C ATOM 1431 C LEU A 98 -1.680 2.272 11.264 1.00 33.13 C ATOM 1432 O LEU A 98 -0.554 1.845 11.015 1.00 41.12 O ATOM 1433 CB LEU A 98 -2.740 4.522 11.002 1.00 51.10 C ATOM 1434 CG LEU A 98 -3.634 5.538 11.715 1.00 42.10 C ATOM 1435 CD1 LEU A 98 -4.930 4.883 12.168 1.00 22.41 C ATOM 1436 CD2 LEU A 98 -2.903 6.153 12.900 1.00 42.55 C ATOM 0 H LEU A 98 -0.039 4.475 11.308 1.00 35.42 H new ATOM 0 HA LEU A 98 -2.371 3.511 12.863 1.00 60.32 H new ATOM 0 HB2 LEU A 98 -2.087 5.061 10.315 1.00 51.10 H new ATOM 0 HB3 LEU A 98 -3.373 3.873 10.397 1.00 51.10 H new ATOM 0 HG LEU A 98 -3.879 6.334 11.012 1.00 42.10 H new ATOM 0 HD11 LEU A 98 -5.553 5.621 12.673 1.00 22.41 H new ATOM 0 HD12 LEU A 98 -5.462 4.491 11.301 1.00 22.41 H new ATOM 0 HD13 LEU A 98 -4.705 4.067 12.855 1.00 22.41 H new ATOM 0 HD21 LEU A 98 -3.554 6.873 13.395 1.00 42.55 H new ATOM 0 HD22 LEU A 98 -2.628 5.368 13.605 1.00 42.55 H new ATOM 0 HD23 LEU A 98 -2.003 6.658 12.550 1.00 42.55 H new ATOM 1448 N GLU A 99 -2.790 1.589 10.999 1.00 64.30 N ATOM 1449 CA GLU A 99 -2.742 0.266 10.387 1.00 54.05 C ATOM 1450 C GLU A 99 -3.683 0.187 9.188 1.00 54.44 C ATOM 1451 O GLU A 99 -4.732 0.832 9.147 1.00 44.40 O ATOM 1452 CB GLU A 99 -3.114 -0.808 11.411 1.00 52.33 C ATOM 1453 CG GLU A 99 -1.911 -1.450 12.082 1.00 71.12 C ATOM 1454 CD GLU A 99 -1.773 -1.051 13.538 1.00 52.41 C ATOM 1455 OE1 GLU A 99 -2.805 -1.001 14.240 1.00 73.21 O ATOM 1456 OE2 GLU A 99 -0.634 -0.787 13.976 1.00 44.32 O ATOM 0 H GLU A 99 -3.731 1.929 11.198 1.00 64.30 H new ATOM 0 HA GLU A 99 -1.723 0.091 10.041 1.00 54.05 H new ATOM 0 HB2 GLU A 99 -3.752 -0.364 12.175 1.00 52.33 H new ATOM 0 HB3 GLU A 99 -3.700 -1.582 10.916 1.00 52.33 H new ATOM 0 HG2 GLU A 99 -1.997 -2.534 12.013 1.00 71.12 H new ATOM 0 HG3 GLU A 99 -1.006 -1.167 11.544 1.00 71.12 H new ATOM 1463 N PRO A 100 -3.302 -0.620 8.188 1.00 33.43 N ATOM 1464 CA PRO A 100 -4.096 -0.802 6.970 1.00 73.34 C ATOM 1465 C PRO A 100 -5.387 -1.572 7.230 1.00 70.14 C ATOM 1466 O PRO A 100 -6.470 -1.143 6.828 1.00 13.54 O ATOM 1467 CB PRO A 100 -3.168 -1.608 6.058 1.00 60.04 C ATOM 1468 CG PRO A 100 -2.255 -2.329 6.989 1.00 71.45 C ATOM 1469 CD PRO A 100 -2.065 -1.419 8.169 1.00 21.02 C ATOM 0 HA PRO A 100 -4.413 0.150 6.544 1.00 73.34 H new ATOM 0 HB2 PRO A 100 -3.731 -2.305 5.437 1.00 60.04 H new ATOM 0 HB3 PRO A 100 -2.612 -0.957 5.384 1.00 60.04 H new ATOM 0 HG2 PRO A 100 -2.685 -3.282 7.297 1.00 71.45 H new ATOM 0 HG3 PRO A 100 -1.302 -2.549 6.508 1.00 71.45 H new ATOM 0 HD2 PRO A 100 -1.936 -1.982 9.094 1.00 21.02 H new ATOM 0 HD3 PRO A 100 -1.182 -0.790 8.053 1.00 21.02 H new ATOM 1477 N LEU A 101 -5.266 -2.710 7.903 1.00 74.45 N ATOM 1478 CA LEU A 101 -6.425 -3.541 8.217 1.00 43.42 C ATOM 1479 C LEU A 101 -7.246 -2.924 9.345 1.00 74.12 C ATOM 1480 O LEU A 101 -8.472 -3.031 9.363 1.00 61.22 O ATOM 1481 CB LEU A 101 -5.976 -4.949 8.608 1.00 23.23 C ATOM 1482 CG LEU A 101 -5.978 -5.990 7.488 1.00 15.15 C ATOM 1483 CD1 LEU A 101 -4.555 -6.358 7.097 1.00 54.30 C ATOM 1484 CD2 LEU A 101 -6.754 -7.229 7.913 1.00 44.32 C ATOM 0 H LEU A 101 -4.378 -3.080 8.242 1.00 74.45 H new ATOM 0 HA LEU A 101 -7.051 -3.601 7.327 1.00 43.42 H new ATOM 0 HB2 LEU A 101 -4.967 -4.887 9.017 1.00 23.23 H new ATOM 0 HB3 LEU A 101 -6.623 -5.306 9.409 1.00 23.23 H new ATOM 0 HG LEU A 101 -6.471 -5.557 6.617 1.00 15.15 H new ATOM 0 HD11 LEU A 101 -4.577 -7.100 6.299 1.00 54.30 H new ATOM 0 HD12 LEU A 101 -4.031 -5.467 6.750 1.00 54.30 H new ATOM 0 HD13 LEU A 101 -4.035 -6.771 7.962 1.00 54.30 H new ATOM 0 HD21 LEU A 101 -6.745 -7.959 7.104 1.00 44.32 H new ATOM 0 HD22 LEU A 101 -6.290 -7.663 8.799 1.00 44.32 H new ATOM 0 HD23 LEU A 101 -7.783 -6.953 8.141 1.00 44.32 H new ATOM 1496 N SER A 102 -6.562 -2.278 10.284 1.00 42.12 N ATOM 1497 CA SER A 102 -7.228 -1.646 11.416 1.00 43.11 C ATOM 1498 C SER A 102 -7.984 -0.396 10.974 1.00 61.43 C ATOM 1499 O SER A 102 -9.066 -0.100 11.480 1.00 65.23 O ATOM 1500 CB SER A 102 -6.208 -1.283 12.497 1.00 41.42 C ATOM 1501 OG SER A 102 -6.767 -1.419 13.792 1.00 14.14 O ATOM 0 H SER A 102 -5.547 -2.179 10.283 1.00 42.12 H new ATOM 0 HA SER A 102 -7.945 -2.357 11.827 1.00 43.11 H new ATOM 0 HB2 SER A 102 -5.333 -1.926 12.406 1.00 41.42 H new ATOM 0 HB3 SER A 102 -5.867 -0.258 12.350 1.00 41.42 H new ATOM 0 HG SER A 102 -6.095 -1.183 14.465 1.00 14.14 H new ATOM 1507 N ALA A 103 -7.405 0.333 10.026 1.00 44.04 N ATOM 1508 CA ALA A 103 -8.023 1.549 9.512 1.00 71.21 C ATOM 1509 C ALA A 103 -9.310 1.234 8.758 1.00 44.30 C ATOM 1510 O ALA A 103 -10.343 1.867 8.982 1.00 75.12 O ATOM 1511 CB ALA A 103 -7.050 2.296 8.612 1.00 50.34 C ATOM 0 H ALA A 103 -6.508 0.103 9.598 1.00 44.04 H new ATOM 0 HA ALA A 103 -8.277 2.185 10.360 1.00 71.21 H new ATOM 0 HB1 ALA A 103 -7.525 3.202 8.235 1.00 50.34 H new ATOM 0 HB2 ALA A 103 -6.160 2.563 9.181 1.00 50.34 H new ATOM 0 HB3 ALA A 103 -6.767 1.659 7.774 1.00 50.34 H new ATOM 1517 N LEU A 104 -9.242 0.255 7.863 1.00 3.32 N ATOM 1518 CA LEU A 104 -10.403 -0.144 7.075 1.00 43.43 C ATOM 1519 C LEU A 104 -11.465 -0.790 7.957 1.00 3.21 C ATOM 1520 O LEU A 104 -12.649 -0.789 7.622 1.00 23.45 O ATOM 1521 CB LEU A 104 -9.983 -1.112 5.967 1.00 30.55 C ATOM 1522 CG LEU A 104 -10.289 -2.590 6.219 1.00 70.13 C ATOM 1523 CD1 LEU A 104 -11.638 -2.965 5.626 1.00 51.31 C ATOM 1524 CD2 LEU A 104 -9.188 -3.468 5.640 1.00 53.40 C ATOM 0 H LEU A 104 -8.395 -0.277 7.665 1.00 3.32 H new ATOM 0 HA LEU A 104 -10.830 0.751 6.624 1.00 43.43 H new ATOM 0 HB2 LEU A 104 -10.476 -0.811 5.042 1.00 30.55 H new ATOM 0 HB3 LEU A 104 -8.910 -1.005 5.805 1.00 30.55 H new ATOM 0 HG LEU A 104 -10.330 -2.754 7.296 1.00 70.13 H new ATOM 0 HD11 LEU A 104 -11.838 -4.020 5.815 1.00 51.31 H new ATOM 0 HD12 LEU A 104 -12.419 -2.359 6.086 1.00 51.31 H new ATOM 0 HD13 LEU A 104 -11.626 -2.785 4.551 1.00 51.31 H new ATOM 0 HD21 LEU A 104 -9.422 -4.516 5.828 1.00 53.40 H new ATOM 0 HD22 LEU A 104 -9.116 -3.300 4.566 1.00 53.40 H new ATOM 0 HD23 LEU A 104 -8.238 -3.218 6.111 1.00 53.40 H new ATOM 1536 N MET A 105 -11.033 -1.339 9.088 1.00 71.42 N ATOM 1537 CA MET A 105 -11.948 -1.987 10.021 1.00 10.33 C ATOM 1538 C MET A 105 -12.554 -0.969 10.983 1.00 62.32 C ATOM 1539 O MET A 105 -13.706 -1.100 11.394 1.00 2.14 O ATOM 1540 CB MET A 105 -11.220 -3.079 10.807 1.00 52.22 C ATOM 1541 CG MET A 105 -11.303 -4.452 10.159 1.00 65.00 C ATOM 1542 SD MET A 105 -12.038 -5.690 11.243 1.00 53.21 S ATOM 1543 CE MET A 105 -13.691 -5.798 10.560 1.00 3.15 C ATOM 0 H MET A 105 -10.056 -1.348 9.380 1.00 71.42 H new ATOM 0 HA MET A 105 -12.754 -2.441 9.445 1.00 10.33 H new ATOM 0 HB2 MET A 105 -10.172 -2.800 10.915 1.00 52.22 H new ATOM 0 HB3 MET A 105 -11.640 -3.134 11.811 1.00 52.22 H new ATOM 0 HG2 MET A 105 -11.890 -4.382 9.243 1.00 65.00 H new ATOM 0 HG3 MET A 105 -10.302 -4.775 9.872 1.00 65.00 H new ATOM 0 HE1 MET A 105 -14.352 -6.278 11.281 1.00 3.15 H new ATOM 0 HE2 MET A 105 -14.060 -4.796 10.341 1.00 3.15 H new ATOM 0 HE3 MET A 105 -13.668 -6.385 9.642 1.00 3.15 H new ATOM 1553 N ARG A 106 -11.769 0.043 11.337 1.00 63.24 N ATOM 1554 CA ARG A 106 -12.228 1.082 12.251 1.00 64.11 C ATOM 1555 C ARG A 106 -13.198 2.030 11.554 1.00 71.11 C ATOM 1556 O ARG A 106 -13.940 2.765 12.205 1.00 62.21 O ATOM 1557 CB ARG A 106 -11.037 1.868 12.803 1.00 24.00 C ATOM 1558 CG ARG A 106 -10.329 1.173 13.955 1.00 11.41 C ATOM 1559 CD ARG A 106 -9.309 2.088 14.614 1.00 30.21 C ATOM 1560 NE ARG A 106 -9.666 2.402 15.995 1.00 33.51 N ATOM 1561 CZ ARG A 106 -8.953 3.208 16.774 1.00 13.14 C ATOM 1562 NH1 ARG A 106 -7.851 3.779 16.309 1.00 11.12 N ATOM 1563 NH2 ARG A 106 -9.343 3.445 18.020 1.00 71.51 N ATOM 0 H ARG A 106 -10.812 0.166 11.005 1.00 63.24 H new ATOM 0 HA ARG A 106 -12.750 0.599 13.077 1.00 64.11 H new ATOM 0 HB2 ARG A 106 -10.322 2.040 11.999 1.00 24.00 H new ATOM 0 HB3 ARG A 106 -11.382 2.847 13.137 1.00 24.00 H new ATOM 0 HG2 ARG A 106 -11.063 0.852 14.694 1.00 11.41 H new ATOM 0 HG3 ARG A 106 -9.831 0.275 13.589 1.00 11.41 H new ATOM 0 HD2 ARG A 106 -8.328 1.613 14.592 1.00 30.21 H new ATOM 0 HD3 ARG A 106 -9.228 3.012 14.042 1.00 30.21 H new ATOM 0 HE ARG A 106 -10.509 1.979 16.383 1.00 33.51 H new ATOM 0 HH11 ARG A 106 -7.549 3.600 15.351 1.00 11.12 H new ATOM 0 HH12 ARG A 106 -7.305 4.398 16.909 1.00 11.12 H new ATOM 0 HH21 ARG A 106 -10.191 3.008 18.381 1.00 71.51 H new ATOM 0 HH22 ARG A 106 -8.795 4.064 18.617 1.00 71.51 H new ATOM 1577 N GLY A 107 -13.186 2.009 10.224 1.00 23.42 N ATOM 1578 CA GLY A 107 -14.069 2.872 9.460 1.00 3.13 C ATOM 1579 C GLY A 107 -13.343 4.062 8.865 1.00 71.51 C ATOM 1580 O GLY A 107 -13.872 5.173 8.843 1.00 54.32 O ATOM 0 H GLY A 107 -12.581 1.410 9.662 1.00 23.42 H new ATOM 0 HA2 GLY A 107 -14.532 2.295 8.659 1.00 3.13 H new ATOM 0 HA3 GLY A 107 -14.873 3.226 10.105 1.00 3.13 H new ATOM 1584 N LEU A 108 -12.127 3.831 8.383 1.00 41.35 N ATOM 1585 CA LEU A 108 -11.326 4.894 7.785 1.00 32.11 C ATOM 1586 C LEU A 108 -11.103 4.638 6.298 1.00 11.11 C ATOM 1587 O LEU A 108 -11.195 5.553 5.479 1.00 74.20 O ATOM 1588 CB LEU A 108 -9.980 5.009 8.502 1.00 71.10 C ATOM 1589 CG LEU A 108 -10.032 5.029 10.030 1.00 32.44 C ATOM 1590 CD1 LEU A 108 -8.635 4.888 10.614 1.00 2.24 C ATOM 1591 CD2 LEU A 108 -10.694 6.307 10.525 1.00 22.34 C ATOM 0 H LEU A 108 -11.674 2.917 8.394 1.00 41.35 H new ATOM 0 HA LEU A 108 -11.871 5.832 7.895 1.00 32.11 H new ATOM 0 HB2 LEU A 108 -9.353 4.173 8.191 1.00 71.10 H new ATOM 0 HB3 LEU A 108 -9.488 5.921 8.163 1.00 71.10 H new ATOM 0 HG LEU A 108 -10.630 4.181 10.365 1.00 32.44 H new ATOM 0 HD11 LEU A 108 -8.692 4.904 11.702 1.00 2.24 H new ATOM 0 HD12 LEU A 108 -8.198 3.944 10.288 1.00 2.24 H new ATOM 0 HD13 LEU A 108 -8.012 5.714 10.271 1.00 2.24 H new ATOM 0 HD21 LEU A 108 -10.722 6.304 11.615 1.00 22.34 H new ATOM 0 HD22 LEU A 108 -10.124 7.169 10.179 1.00 22.34 H new ATOM 0 HD23 LEU A 108 -11.711 6.364 10.136 1.00 22.34 H new ATOM 1603 N LEU A 109 -10.812 3.387 5.956 1.00 41.41 N ATOM 1604 CA LEU A 109 -10.578 3.010 4.567 1.00 75.44 C ATOM 1605 C LEU A 109 -11.819 2.360 3.962 1.00 14.13 C ATOM 1606 O LEU A 109 -12.852 2.241 4.622 1.00 45.21 O ATOM 1607 CB LEU A 109 -9.390 2.052 4.471 1.00 32.03 C ATOM 1608 CG LEU A 109 -8.104 2.506 5.162 1.00 51.54 C ATOM 1609 CD1 LEU A 109 -7.123 1.350 5.277 1.00 4.11 C ATOM 1610 CD2 LEU A 109 -7.475 3.669 4.407 1.00 60.23 C ATOM 0 H LEU A 109 -10.733 2.618 6.621 1.00 41.41 H new ATOM 0 HA LEU A 109 -10.353 3.916 4.004 1.00 75.44 H new ATOM 0 HB2 LEU A 109 -9.687 1.093 4.895 1.00 32.03 H new ATOM 0 HB3 LEU A 109 -9.171 1.881 3.417 1.00 32.03 H new ATOM 0 HG LEU A 109 -8.354 2.844 6.168 1.00 51.54 H new ATOM 0 HD11 LEU A 109 -6.214 1.692 5.771 1.00 4.11 H new ATOM 0 HD12 LEU A 109 -7.573 0.547 5.861 1.00 4.11 H new ATOM 0 HD13 LEU A 109 -6.878 0.981 4.281 1.00 4.11 H new ATOM 0 HD21 LEU A 109 -6.561 3.979 4.913 1.00 60.23 H new ATOM 0 HD22 LEU A 109 -7.239 3.357 3.390 1.00 60.23 H new ATOM 0 HD23 LEU A 109 -8.175 4.504 4.377 1.00 60.23 H new ATOM 1622 N GLU A 110 -11.710 1.940 2.706 1.00 12.50 N ATOM 1623 CA GLU A 110 -12.823 1.302 2.014 1.00 34.44 C ATOM 1624 C GLU A 110 -12.323 0.435 0.862 1.00 30.34 C ATOM 1625 O GLU A 110 -11.749 0.938 -0.104 1.00 31.22 O ATOM 1626 CB GLU A 110 -13.798 2.357 1.488 1.00 54.01 C ATOM 1627 CG GLU A 110 -15.223 1.850 1.342 1.00 1.22 C ATOM 1628 CD GLU A 110 -15.925 2.424 0.127 1.00 33.12 C ATOM 1629 OE1 GLU A 110 -16.106 3.658 0.073 1.00 42.11 O ATOM 1630 OE2 GLU A 110 -16.294 1.637 -0.771 1.00 1.33 O ATOM 0 H GLU A 110 -10.862 2.030 2.147 1.00 12.50 H new ATOM 0 HA GLU A 110 -13.342 0.662 2.728 1.00 34.44 H new ATOM 0 HB2 GLU A 110 -13.793 3.213 2.163 1.00 54.01 H new ATOM 0 HB3 GLU A 110 -13.447 2.713 0.519 1.00 54.01 H new ATOM 0 HG2 GLU A 110 -15.212 0.762 1.271 1.00 1.22 H new ATOM 0 HG3 GLU A 110 -15.789 2.105 2.238 1.00 1.22 H new ATOM 1637 N LEU A 111 -12.545 -0.870 0.972 1.00 14.04 N ATOM 1638 CA LEU A 111 -12.118 -1.809 -0.059 1.00 25.33 C ATOM 1639 C LEU A 111 -13.190 -1.964 -1.133 1.00 12.03 C ATOM 1640 O LEU A 111 -14.246 -2.549 -0.891 1.00 44.41 O ATOM 1641 CB LEU A 111 -11.801 -3.171 0.563 1.00 43.24 C ATOM 1642 CG LEU A 111 -11.176 -4.206 -0.373 1.00 14.31 C ATOM 1643 CD1 LEU A 111 -9.677 -3.981 -0.494 1.00 32.33 C ATOM 1644 CD2 LEU A 111 -11.468 -5.616 0.120 1.00 32.13 C ATOM 0 H LEU A 111 -13.019 -1.302 1.765 1.00 14.04 H new ATOM 0 HA LEU A 111 -11.217 -1.412 -0.527 1.00 25.33 H new ATOM 0 HB2 LEU A 111 -11.125 -3.016 1.404 1.00 43.24 H new ATOM 0 HB3 LEU A 111 -12.724 -3.587 0.968 1.00 43.24 H new ATOM 0 HG LEU A 111 -11.620 -4.089 -1.361 1.00 14.31 H new ATOM 0 HD11 LEU A 111 -9.250 -4.727 -1.164 1.00 32.33 H new ATOM 0 HD12 LEU A 111 -9.490 -2.985 -0.894 1.00 32.33 H new ATOM 0 HD13 LEU A 111 -9.215 -4.070 0.489 1.00 32.33 H new ATOM 0 HD21 LEU A 111 -11.016 -6.340 -0.558 1.00 32.13 H new ATOM 0 HD22 LEU A 111 -11.052 -5.746 1.119 1.00 32.13 H new ATOM 0 HD23 LEU A 111 -12.546 -5.774 0.153 1.00 32.13 H new ATOM 1656 N LYS A 112 -12.911 -1.438 -2.320 1.00 63.13 N ATOM 1657 CA LYS A 112 -13.849 -1.520 -3.434 1.00 30.53 C ATOM 1658 C LYS A 112 -13.761 -2.881 -4.120 1.00 43.41 C ATOM 1659 O LYS A 112 -14.775 -3.542 -4.341 1.00 74.23 O ATOM 1660 CB LYS A 112 -13.569 -0.407 -4.446 1.00 35.43 C ATOM 1661 CG LYS A 112 -14.293 0.892 -4.136 1.00 64.32 C ATOM 1662 CD LYS A 112 -15.303 1.238 -5.217 1.00 12.44 C ATOM 1663 CE LYS A 112 -14.617 1.655 -6.509 1.00 14.53 C ATOM 1664 NZ LYS A 112 -15.592 2.149 -7.520 1.00 11.33 N ATOM 0 H LYS A 112 -12.042 -0.950 -2.536 1.00 63.13 H new ATOM 0 HA LYS A 112 -14.857 -1.397 -3.038 1.00 30.53 H new ATOM 0 HB2 LYS A 112 -12.496 -0.217 -4.477 1.00 35.43 H new ATOM 0 HB3 LYS A 112 -13.861 -0.748 -5.439 1.00 35.43 H new ATOM 0 HG2 LYS A 112 -14.801 0.806 -3.176 1.00 64.32 H new ATOM 0 HG3 LYS A 112 -13.568 1.700 -4.042 1.00 64.32 H new ATOM 0 HD2 LYS A 112 -15.944 0.377 -5.406 1.00 12.44 H new ATOM 0 HD3 LYS A 112 -15.947 2.045 -4.869 1.00 12.44 H new ATOM 0 HE2 LYS A 112 -13.887 2.436 -6.297 1.00 14.53 H new ATOM 0 HE3 LYS A 112 -14.067 0.807 -6.918 1.00 14.53 H new ATOM 0 HZ1 LYS A 112 -15.085 2.423 -8.386 1.00 11.33 H new ATOM 0 HZ2 LYS A 112 -16.274 1.396 -7.742 1.00 11.33 H new ATOM 0 HZ3 LYS A 112 -16.099 2.974 -7.140 1.00 11.33 H new ATOM 1678 N LYS A 113 -12.542 -3.291 -4.453 1.00 74.51 N ATOM 1679 CA LYS A 113 -12.320 -4.573 -5.112 1.00 32.33 C ATOM 1680 C LYS A 113 -12.228 -5.702 -4.089 1.00 54.32 C ATOM 1681 O LYS A 113 -12.506 -5.505 -2.907 1.00 35.33 O ATOM 1682 CB LYS A 113 -11.041 -4.526 -5.950 1.00 13.24 C ATOM 1683 CG LYS A 113 -11.273 -4.775 -7.429 1.00 75.14 C ATOM 1684 CD LYS A 113 -10.994 -3.531 -8.255 1.00 50.11 C ATOM 1685 CE LYS A 113 -12.209 -2.616 -8.314 1.00 64.41 C ATOM 1686 NZ LYS A 113 -11.874 -1.286 -8.894 1.00 4.01 N ATOM 0 H LYS A 113 -11.693 -2.754 -4.277 1.00 74.51 H new ATOM 0 HA LYS A 113 -13.169 -4.767 -5.767 1.00 32.33 H new ATOM 0 HB2 LYS A 113 -10.570 -3.551 -5.824 1.00 13.24 H new ATOM 0 HB3 LYS A 113 -10.341 -5.270 -5.571 1.00 13.24 H new ATOM 0 HG2 LYS A 113 -10.631 -5.589 -7.767 1.00 75.14 H new ATOM 0 HG3 LYS A 113 -12.303 -5.095 -7.588 1.00 75.14 H new ATOM 0 HD2 LYS A 113 -10.150 -2.990 -7.826 1.00 50.11 H new ATOM 0 HD3 LYS A 113 -10.706 -3.821 -9.266 1.00 50.11 H new ATOM 0 HE2 LYS A 113 -12.989 -3.087 -8.912 1.00 64.41 H new ATOM 0 HE3 LYS A 113 -12.613 -2.483 -7.310 1.00 64.41 H new ATOM 0 HZ1 LYS A 113 -12.728 -0.692 -8.917 1.00 4.01 H new ATOM 0 HZ2 LYS A 113 -11.147 -0.825 -8.309 1.00 4.01 H new ATOM 0 HZ3 LYS A 113 -11.513 -1.410 -9.861 1.00 4.01 H new ATOM 1700 N GLY A 114 -11.836 -6.885 -4.553 1.00 11.21 N ATOM 1701 CA GLY A 114 -11.714 -8.026 -3.665 1.00 4.45 C ATOM 1702 C GLY A 114 -12.757 -8.020 -2.566 1.00 31.23 C ATOM 1703 O GLY A 114 -13.858 -7.500 -2.747 1.00 34.53 O ATOM 0 H GLY A 114 -11.601 -7.073 -5.528 1.00 11.21 H new ATOM 0 HA2 GLY A 114 -11.807 -8.945 -4.244 1.00 4.45 H new ATOM 0 HA3 GLY A 114 -10.720 -8.030 -3.218 1.00 4.45 H new ATOM 1707 N THR A 115 -12.413 -8.603 -1.421 1.00 43.41 N ATOM 1708 CA THR A 115 -13.329 -8.665 -0.289 1.00 5.21 C ATOM 1709 C THR A 115 -12.570 -8.805 1.025 1.00 52.32 C ATOM 1710 O THR A 115 -11.499 -9.410 1.073 1.00 72.42 O ATOM 1711 CB THR A 115 -14.313 -9.842 -0.428 1.00 5.11 C ATOM 1712 OG1 THR A 115 -15.371 -9.711 0.527 1.00 0.13 O ATOM 1713 CG2 THR A 115 -13.601 -11.171 -0.224 1.00 43.41 C ATOM 0 H THR A 115 -11.506 -9.039 -1.254 1.00 43.41 H new ATOM 0 HA THR A 115 -13.890 -7.730 -0.284 1.00 5.21 H new ATOM 0 HB THR A 115 -14.728 -9.822 -1.436 1.00 5.11 H new ATOM 0 HG1 THR A 115 -15.993 -10.462 0.431 1.00 0.13 H new ATOM 0 HG21 THR A 115 -14.317 -11.987 -0.327 1.00 43.41 H new ATOM 0 HG22 THR A 115 -12.815 -11.281 -0.971 1.00 43.41 H new ATOM 0 HG23 THR A 115 -13.160 -11.199 0.773 1.00 43.41 H new ATOM 1721 N ILE A 116 -13.131 -8.241 2.090 1.00 74.14 N ATOM 1722 CA ILE A 116 -12.508 -8.305 3.405 1.00 25.14 C ATOM 1723 C ILE A 116 -12.369 -9.748 3.879 1.00 34.33 C ATOM 1724 O ILE A 116 -11.425 -10.092 4.588 1.00 44.30 O ATOM 1725 CB ILE A 116 -13.313 -7.509 4.449 1.00 1.51 C ATOM 1726 CG1 ILE A 116 -12.530 -7.406 5.760 1.00 3.00 C ATOM 1727 CG2 ILE A 116 -14.667 -8.163 4.685 1.00 41.43 C ATOM 1728 CD1 ILE A 116 -13.091 -6.383 6.721 1.00 55.30 C ATOM 0 H ILE A 116 -14.016 -7.735 2.067 1.00 74.14 H new ATOM 0 HA ILE A 116 -11.518 -7.861 3.306 1.00 25.14 H new ATOM 0 HB ILE A 116 -13.479 -6.502 4.067 1.00 1.51 H new ATOM 0 HG12 ILE A 116 -12.521 -8.382 6.246 1.00 3.00 H new ATOM 0 HG13 ILE A 116 -11.494 -7.152 5.536 1.00 3.00 H new ATOM 0 HG21 ILE A 116 -15.224 -7.589 5.425 1.00 41.43 H new ATOM 0 HG22 ILE A 116 -15.226 -8.189 3.750 1.00 41.43 H new ATOM 0 HG23 ILE A 116 -14.521 -9.180 5.049 1.00 41.43 H new ATOM 0 HD11 ILE A 116 -12.486 -6.365 7.627 1.00 55.30 H new ATOM 0 HD12 ILE A 116 -13.075 -5.398 6.254 1.00 55.30 H new ATOM 0 HD13 ILE A 116 -14.117 -6.647 6.975 1.00 55.30 H new ATOM 1740 N ALA A 117 -13.318 -10.590 3.480 1.00 3.42 N ATOM 1741 CA ALA A 117 -13.300 -11.996 3.861 1.00 43.13 C ATOM 1742 C ALA A 117 -12.036 -12.684 3.359 1.00 25.24 C ATOM 1743 O ALA A 117 -11.743 -13.820 3.736 1.00 54.21 O ATOM 1744 CB ALA A 117 -14.536 -12.704 3.324 1.00 1.23 C ATOM 0 H ALA A 117 -14.108 -10.322 2.893 1.00 3.42 H new ATOM 0 HA ALA A 117 -13.306 -12.052 4.950 1.00 43.13 H new ATOM 0 HB1 ALA A 117 -14.510 -13.754 3.616 1.00 1.23 H new ATOM 0 HB2 ALA A 117 -15.431 -12.236 3.734 1.00 1.23 H new ATOM 0 HB3 ALA A 117 -14.554 -12.630 2.237 1.00 1.23 H new ATOM 1750 N ALA A 118 -11.287 -11.991 2.508 1.00 73.14 N ATOM 1751 CA ALA A 118 -10.053 -12.535 1.956 1.00 74.42 C ATOM 1752 C ALA A 118 -8.834 -11.973 2.679 1.00 44.43 C ATOM 1753 O ALA A 118 -7.694 -12.241 2.296 1.00 2.14 O ATOM 1754 CB ALA A 118 -9.967 -12.242 0.465 1.00 24.22 C ATOM 0 H ALA A 118 -11.514 -11.050 2.186 1.00 73.14 H new ATOM 0 HA ALA A 118 -10.064 -13.615 2.102 1.00 74.42 H new ATOM 0 HB1 ALA A 118 -9.040 -12.654 0.066 1.00 24.22 H new ATOM 0 HB2 ALA A 118 -10.816 -12.698 -0.045 1.00 24.22 H new ATOM 0 HB3 ALA A 118 -9.983 -11.164 0.304 1.00 24.22 H new ATOM 1760 N LEU A 119 -9.081 -11.190 3.724 1.00 24.42 N ATOM 1761 CA LEU A 119 -8.001 -10.589 4.501 1.00 73.11 C ATOM 1762 C LEU A 119 -7.954 -11.173 5.909 1.00 52.12 C ATOM 1763 O LEU A 119 -7.129 -10.773 6.729 1.00 11.43 O ATOM 1764 CB LEU A 119 -8.183 -9.072 4.571 1.00 23.31 C ATOM 1765 CG LEU A 119 -8.624 -8.388 3.276 1.00 22.34 C ATOM 1766 CD1 LEU A 119 -9.181 -7.004 3.568 1.00 51.42 C ATOM 1767 CD2 LEU A 119 -7.464 -8.303 2.296 1.00 43.30 C ATOM 0 H LEU A 119 -10.018 -10.957 4.053 1.00 24.42 H new ATOM 0 HA LEU A 119 -7.058 -10.814 4.003 1.00 73.11 H new ATOM 0 HB2 LEU A 119 -8.918 -8.850 5.344 1.00 23.31 H new ATOM 0 HB3 LEU A 119 -7.240 -8.627 4.890 1.00 23.31 H new ATOM 0 HG LEU A 119 -9.413 -8.987 2.821 1.00 22.34 H new ATOM 0 HD11 LEU A 119 -9.490 -6.532 2.635 1.00 51.42 H new ATOM 0 HD12 LEU A 119 -10.040 -7.090 4.233 1.00 51.42 H new ATOM 0 HD13 LEU A 119 -8.413 -6.396 4.045 1.00 51.42 H new ATOM 0 HD21 LEU A 119 -7.796 -7.814 1.381 1.00 43.30 H new ATOM 0 HD22 LEU A 119 -6.653 -7.727 2.741 1.00 43.30 H new ATOM 0 HD23 LEU A 119 -7.110 -9.307 2.063 1.00 43.30 H new ATOM 1779 N ALA A 120 -8.842 -12.123 6.181 1.00 74.14 N ATOM 1780 CA ALA A 120 -8.899 -12.765 7.489 1.00 50.14 C ATOM 1781 C ALA A 120 -7.569 -13.428 7.832 1.00 2.44 C ATOM 1782 O ALA A 120 -6.933 -13.112 8.838 1.00 72.33 O ATOM 1783 CB ALA A 120 -10.026 -13.787 7.527 1.00 64.14 C ATOM 0 H ALA A 120 -9.532 -12.466 5.513 1.00 74.14 H new ATOM 0 HA ALA A 120 -9.096 -11.996 8.236 1.00 50.14 H new ATOM 0 HB1 ALA A 120 -10.057 -14.258 8.509 1.00 64.14 H new ATOM 0 HB2 ALA A 120 -10.976 -13.288 7.334 1.00 64.14 H new ATOM 0 HB3 ALA A 120 -9.854 -14.547 6.765 1.00 64.14 H new ATOM 1789 N PRO A 121 -7.138 -14.368 6.979 1.00 63.12 N ATOM 1790 CA PRO A 121 -5.879 -15.095 7.172 1.00 33.34 C ATOM 1791 C PRO A 121 -4.659 -14.206 6.963 1.00 44.11 C ATOM 1792 O PRO A 121 -3.628 -14.388 7.611 1.00 43.13 O ATOM 1793 CB PRO A 121 -5.934 -16.189 6.103 1.00 64.11 C ATOM 1794 CG PRO A 121 -6.828 -15.641 5.045 1.00 4.43 C ATOM 1795 CD PRO A 121 -7.845 -14.794 5.760 1.00 70.30 C ATOM 0 HA PRO A 121 -5.780 -15.478 8.188 1.00 33.34 H new ATOM 0 HB2 PRO A 121 -4.942 -16.407 5.709 1.00 64.11 H new ATOM 0 HB3 PRO A 121 -6.327 -17.121 6.510 1.00 64.11 H new ATOM 0 HG2 PRO A 121 -6.263 -15.048 4.325 1.00 4.43 H new ATOM 0 HG3 PRO A 121 -7.311 -16.444 4.488 1.00 4.43 H new ATOM 0 HD2 PRO A 121 -8.154 -13.941 5.156 1.00 70.30 H new ATOM 0 HD3 PRO A 121 -8.746 -15.361 5.995 1.00 70.30 H new ATOM 1803 N TYR A 122 -4.781 -13.244 6.055 1.00 14.40 N ATOM 1804 CA TYR A 122 -3.687 -12.327 5.760 1.00 42.22 C ATOM 1805 C TYR A 122 -3.899 -10.984 6.450 1.00 30.33 C ATOM 1806 O TYR A 122 -3.865 -9.933 5.812 1.00 11.23 O ATOM 1807 CB TYR A 122 -3.561 -12.122 4.249 1.00 63.14 C ATOM 1808 CG TYR A 122 -3.699 -13.398 3.450 1.00 20.41 C ATOM 1809 CD1 TYR A 122 -2.679 -14.340 3.426 1.00 44.02 C ATOM 1810 CD2 TYR A 122 -4.852 -13.663 2.721 1.00 11.43 C ATOM 1811 CE1 TYR A 122 -2.801 -15.507 2.697 1.00 64.21 C ATOM 1812 CE2 TYR A 122 -4.983 -14.827 1.990 1.00 33.13 C ATOM 1813 CZ TYR A 122 -3.955 -15.746 1.981 1.00 34.44 C ATOM 1814 OH TYR A 122 -4.082 -16.909 1.255 1.00 5.30 O ATOM 0 H TYR A 122 -5.627 -13.079 5.510 1.00 14.40 H new ATOM 0 HA TYR A 122 -2.765 -12.767 6.140 1.00 42.22 H new ATOM 0 HB2 TYR A 122 -4.323 -11.415 3.922 1.00 63.14 H new ATOM 0 HB3 TYR A 122 -2.593 -11.670 4.032 1.00 63.14 H new ATOM 0 HD1 TYR A 122 -1.775 -14.157 3.987 1.00 44.02 H new ATOM 0 HD2 TYR A 122 -5.660 -12.946 2.726 1.00 11.43 H new ATOM 0 HE1 TYR A 122 -1.997 -16.228 2.688 1.00 64.21 H new ATOM 0 HE2 TYR A 122 -5.886 -15.017 1.428 1.00 33.13 H new ATOM 0 HH TYR A 122 -3.488 -16.875 0.476 1.00 5.30 H new ATOM 1824 N ALA A 123 -4.118 -11.028 7.760 1.00 12.25 N ATOM 1825 CA ALA A 123 -4.333 -9.816 8.540 1.00 15.32 C ATOM 1826 C ALA A 123 -3.031 -9.327 9.166 1.00 73.25 C ATOM 1827 O ALA A 123 -2.688 -8.150 9.065 1.00 1.44 O ATOM 1828 CB ALA A 123 -5.379 -10.060 9.618 1.00 31.13 C ATOM 0 H ALA A 123 -4.151 -11.891 8.303 1.00 12.25 H new ATOM 0 HA ALA A 123 -4.696 -9.040 7.866 1.00 15.32 H new ATOM 0 HB1 ALA A 123 -5.529 -9.146 10.193 1.00 31.13 H new ATOM 0 HB2 ALA A 123 -6.319 -10.355 9.152 1.00 31.13 H new ATOM 0 HB3 ALA A 123 -5.039 -10.854 10.282 1.00 31.13 H new ATOM 1834 N GLN A 124 -2.312 -10.239 9.811 1.00 2.32 N ATOM 1835 CA GLN A 124 -1.048 -9.899 10.454 1.00 3.43 C ATOM 1836 C GLN A 124 0.020 -9.570 9.416 1.00 65.12 C ATOM 1837 O GLN A 124 0.865 -8.702 9.633 1.00 22.11 O ATOM 1838 CB GLN A 124 -0.575 -11.051 11.342 1.00 72.12 C ATOM 1839 CG GLN A 124 -1.444 -11.268 12.571 1.00 20.22 C ATOM 1840 CD GLN A 124 -0.647 -11.238 13.860 1.00 35.34 C ATOM 1841 OE1 GLN A 124 0.522 -11.622 13.890 1.00 45.11 O ATOM 1842 NE2 GLN A 124 -1.278 -10.781 14.936 1.00 74.22 N ATOM 0 H GLN A 124 -2.582 -11.218 9.902 1.00 2.32 H new ATOM 0 HA GLN A 124 -1.211 -9.017 11.073 1.00 3.43 H new ATOM 0 HB2 GLN A 124 -0.557 -11.968 10.754 1.00 72.12 H new ATOM 0 HB3 GLN A 124 0.449 -10.856 11.661 1.00 72.12 H new ATOM 0 HG2 GLN A 124 -2.215 -10.499 12.607 1.00 20.22 H new ATOM 0 HG3 GLN A 124 -1.955 -12.227 12.486 1.00 20.22 H new ATOM 0 HE21 GLN A 124 -2.248 -10.473 14.866 1.00 74.22 H new ATOM 0 HE22 GLN A 124 -0.793 -10.738 15.832 1.00 74.22 H new ATOM 1851 N ALA A 125 -0.024 -10.272 8.287 1.00 51.41 N ATOM 1852 CA ALA A 125 0.939 -10.053 7.215 1.00 74.24 C ATOM 1853 C ALA A 125 1.066 -8.570 6.885 1.00 41.55 C ATOM 1854 O ALA A 125 2.127 -8.106 6.468 1.00 1.34 O ATOM 1855 CB ALA A 125 0.535 -10.839 5.976 1.00 4.31 C ATOM 0 H ALA A 125 -0.716 -10.996 8.092 1.00 51.41 H new ATOM 0 HA ALA A 125 1.912 -10.406 7.556 1.00 74.24 H new ATOM 0 HB1 ALA A 125 1.262 -10.667 5.183 1.00 4.31 H new ATOM 0 HB2 ALA A 125 0.503 -11.902 6.214 1.00 4.31 H new ATOM 0 HB3 ALA A 125 -0.450 -10.512 5.643 1.00 4.31 H new ATOM 1861 N ALA A 126 -0.023 -7.831 7.073 1.00 43.53 N ATOM 1862 CA ALA A 126 -0.032 -6.400 6.796 1.00 44.53 C ATOM 1863 C ALA A 126 1.137 -5.701 7.482 1.00 22.14 C ATOM 1864 O ALA A 126 1.853 -4.914 6.862 1.00 72.40 O ATOM 1865 CB ALA A 126 -1.351 -5.785 7.238 1.00 12.25 C ATOM 0 H ALA A 126 -0.910 -8.200 7.416 1.00 43.53 H new ATOM 0 HA ALA A 126 0.077 -6.262 5.720 1.00 44.53 H new ATOM 0 HB1 ALA A 126 -1.344 -4.716 7.025 1.00 12.25 H new ATOM 0 HB2 ALA A 126 -2.172 -6.257 6.698 1.00 12.25 H new ATOM 0 HB3 ALA A 126 -1.484 -5.941 8.309 1.00 12.25 H new ATOM 1871 N GLN A 127 1.323 -5.991 8.765 1.00 20.32 N ATOM 1872 CA GLN A 127 2.404 -5.389 9.536 1.00 44.43 C ATOM 1873 C GLN A 127 3.720 -5.446 8.766 1.00 50.14 C ATOM 1874 O GLN A 127 4.533 -4.526 8.838 1.00 52.40 O ATOM 1875 CB GLN A 127 2.557 -6.099 10.882 1.00 41.43 C ATOM 1876 CG GLN A 127 1.639 -5.554 11.964 1.00 34.34 C ATOM 1877 CD GLN A 127 2.344 -5.376 13.294 1.00 43.02 C ATOM 1878 OE1 GLN A 127 3.483 -5.811 13.468 1.00 2.23 O ATOM 1879 NE2 GLN A 127 1.671 -4.732 14.241 1.00 63.43 N ATOM 0 H GLN A 127 0.739 -6.639 9.293 1.00 20.32 H new ATOM 0 HA GLN A 127 2.151 -4.343 9.711 1.00 44.43 H new ATOM 0 HB2 GLN A 127 2.356 -7.162 10.748 1.00 41.43 H new ATOM 0 HB3 GLN A 127 3.591 -6.010 11.215 1.00 41.43 H new ATOM 0 HG2 GLN A 127 1.233 -4.595 11.641 1.00 34.34 H new ATOM 0 HG3 GLN A 127 0.794 -6.231 12.093 1.00 34.34 H new ATOM 0 HE21 GLN A 127 0.729 -4.388 14.053 1.00 63.43 H new ATOM 0 HE22 GLN A 127 2.096 -4.581 15.156 1.00 63.43 H new ATOM 1888 N GLU A 128 3.921 -6.535 8.028 1.00 2.44 N ATOM 1889 CA GLU A 128 5.138 -6.712 7.246 1.00 44.52 C ATOM 1890 C GLU A 128 5.232 -5.664 6.141 1.00 51.30 C ATOM 1891 O GLU A 128 6.126 -4.815 6.147 1.00 32.41 O ATOM 1892 CB GLU A 128 5.181 -8.115 6.638 1.00 74.13 C ATOM 1893 CG GLU A 128 5.179 -9.228 7.673 1.00 41.51 C ATOM 1894 CD GLU A 128 6.180 -8.989 8.786 1.00 25.44 C ATOM 1895 OE1 GLU A 128 7.209 -8.330 8.529 1.00 73.02 O ATOM 1896 OE2 GLU A 128 5.934 -9.463 9.915 1.00 3.55 O ATOM 0 H GLU A 128 3.257 -7.306 7.956 1.00 2.44 H new ATOM 0 HA GLU A 128 5.990 -6.588 7.915 1.00 44.52 H new ATOM 0 HB2 GLU A 128 4.323 -8.242 5.978 1.00 74.13 H new ATOM 0 HB3 GLU A 128 6.074 -8.207 6.020 1.00 74.13 H new ATOM 0 HG2 GLU A 128 4.181 -9.320 8.101 1.00 41.51 H new ATOM 0 HG3 GLU A 128 5.405 -10.175 7.183 1.00 41.51 H new ATOM 1903 N LEU A 129 4.304 -5.728 5.193 1.00 43.23 N ATOM 1904 CA LEU A 129 4.282 -4.785 4.080 1.00 55.23 C ATOM 1905 C LEU A 129 4.535 -3.361 4.566 1.00 24.21 C ATOM 1906 O LEU A 129 5.290 -2.609 3.950 1.00 72.24 O ATOM 1907 CB LEU A 129 2.937 -4.855 3.354 1.00 74.14 C ATOM 1908 CG LEU A 129 2.787 -5.977 2.325 1.00 52.23 C ATOM 1909 CD1 LEU A 129 1.692 -6.945 2.747 1.00 43.54 C ATOM 1910 CD2 LEU A 129 2.491 -5.401 0.948 1.00 52.32 C ATOM 0 H LEU A 129 3.557 -6.422 5.172 1.00 43.23 H new ATOM 0 HA LEU A 129 5.078 -5.060 3.388 1.00 55.23 H new ATOM 0 HB2 LEU A 129 2.150 -4.965 4.100 1.00 74.14 H new ATOM 0 HB3 LEU A 129 2.768 -3.903 2.851 1.00 74.14 H new ATOM 0 HG LEU A 129 3.728 -6.525 2.273 1.00 52.23 H new ATOM 0 HD11 LEU A 129 1.599 -7.736 2.003 1.00 43.54 H new ATOM 0 HD12 LEU A 129 1.945 -7.382 3.713 1.00 43.54 H new ATOM 0 HD13 LEU A 129 0.745 -6.411 2.828 1.00 43.54 H new ATOM 0 HD21 LEU A 129 2.387 -6.213 0.228 1.00 52.32 H new ATOM 0 HD22 LEU A 129 1.564 -4.828 0.985 1.00 52.32 H new ATOM 0 HD23 LEU A 129 3.309 -4.748 0.643 1.00 52.32 H new ATOM 1922 N VAL A 130 3.903 -3.000 5.677 1.00 53.51 N ATOM 1923 CA VAL A 130 4.063 -1.668 6.248 1.00 13.22 C ATOM 1924 C VAL A 130 5.521 -1.392 6.600 1.00 72.14 C ATOM 1925 O VAL A 130 6.096 -0.390 6.173 1.00 74.21 O ATOM 1926 CB VAL A 130 3.200 -1.491 7.512 1.00 74.22 C ATOM 1927 CG1 VAL A 130 3.506 -0.163 8.186 1.00 32.24 C ATOM 1928 CG2 VAL A 130 1.722 -1.596 7.166 1.00 51.33 C ATOM 0 H VAL A 130 3.275 -3.611 6.200 1.00 53.51 H new ATOM 0 HA VAL A 130 3.734 -0.958 5.490 1.00 13.22 H new ATOM 0 HB VAL A 130 3.443 -2.290 8.212 1.00 74.22 H new ATOM 0 HG11 VAL A 130 2.887 -0.056 9.077 1.00 32.24 H new ATOM 0 HG12 VAL A 130 4.558 -0.133 8.470 1.00 32.24 H new ATOM 0 HG13 VAL A 130 3.293 0.653 7.496 1.00 32.24 H new ATOM 0 HG21 VAL A 130 1.127 -1.469 8.070 1.00 51.33 H new ATOM 0 HG22 VAL A 130 1.461 -0.820 6.447 1.00 51.33 H new ATOM 0 HG23 VAL A 130 1.518 -2.575 6.733 1.00 51.33 H new ATOM 1938 N LYS A 131 6.115 -2.288 7.380 1.00 0.04 N ATOM 1939 CA LYS A 131 7.507 -2.145 7.788 1.00 1.11 C ATOM 1940 C LYS A 131 8.397 -1.831 6.590 1.00 53.21 C ATOM 1941 O LYS A 131 9.099 -0.820 6.573 1.00 64.42 O ATOM 1942 CB LYS A 131 7.993 -3.422 8.477 1.00 42.14 C ATOM 1943 CG LYS A 131 9.486 -3.435 8.750 1.00 24.25 C ATOM 1944 CD LYS A 131 9.814 -2.789 10.086 1.00 2.41 C ATOM 1945 CE LYS A 131 11.283 -2.404 10.174 1.00 24.33 C ATOM 1946 NZ LYS A 131 12.033 -3.287 11.110 1.00 14.12 N ATOM 0 H LYS A 131 5.653 -3.122 7.743 1.00 0.04 H new ATOM 0 HA LYS A 131 7.569 -1.314 8.491 1.00 1.11 H new ATOM 0 HB2 LYS A 131 7.459 -3.542 9.419 1.00 42.14 H new ATOM 0 HB3 LYS A 131 7.738 -4.280 7.855 1.00 42.14 H new ATOM 0 HG2 LYS A 131 9.849 -4.463 8.743 1.00 24.25 H new ATOM 0 HG3 LYS A 131 10.007 -2.907 7.952 1.00 24.25 H new ATOM 0 HD2 LYS A 131 9.196 -1.902 10.224 1.00 2.41 H new ATOM 0 HD3 LYS A 131 9.568 -3.478 10.894 1.00 2.41 H new ATOM 0 HE2 LYS A 131 11.733 -2.460 9.183 1.00 24.33 H new ATOM 0 HE3 LYS A 131 11.368 -1.369 10.505 1.00 24.33 H new ATOM 0 HZ1 LYS A 131 13.030 -2.992 11.142 1.00 14.12 H new ATOM 0 HZ2 LYS A 131 11.620 -3.215 12.062 1.00 14.12 H new ATOM 0 HZ3 LYS A 131 11.974 -4.272 10.781 1.00 14.12 H new ATOM 1960 N VAL A 132 8.360 -2.703 5.587 1.00 52.30 N ATOM 1961 CA VAL A 132 9.160 -2.516 4.383 1.00 75.55 C ATOM 1962 C VAL A 132 8.785 -1.224 3.668 1.00 50.14 C ATOM 1963 O VAL A 132 9.647 -0.522 3.139 1.00 60.33 O ATOM 1964 CB VAL A 132 8.989 -3.697 3.408 1.00 23.41 C ATOM 1965 CG1 VAL A 132 9.846 -3.493 2.167 1.00 62.31 C ATOM 1966 CG2 VAL A 132 9.336 -5.010 4.095 1.00 12.55 C ATOM 0 H VAL A 132 7.785 -3.545 5.585 1.00 52.30 H new ATOM 0 HA VAL A 132 10.201 -2.462 4.700 1.00 75.55 H new ATOM 0 HB VAL A 132 7.945 -3.741 3.097 1.00 23.41 H new ATOM 0 HG11 VAL A 132 9.712 -4.337 1.490 1.00 62.31 H new ATOM 0 HG12 VAL A 132 9.546 -2.573 1.665 1.00 62.31 H new ATOM 0 HG13 VAL A 132 10.894 -3.423 2.456 1.00 62.31 H new ATOM 0 HG21 VAL A 132 9.210 -5.833 3.392 1.00 12.55 H new ATOM 0 HG22 VAL A 132 10.371 -4.980 4.436 1.00 12.55 H new ATOM 0 HG23 VAL A 132 8.676 -5.159 4.950 1.00 12.55 H new ATOM 1976 N ALA A 133 7.492 -0.913 3.656 1.00 63.15 N ATOM 1977 CA ALA A 133 7.003 0.297 3.007 1.00 23.25 C ATOM 1978 C ALA A 133 7.728 1.532 3.533 1.00 32.22 C ATOM 1979 O ALA A 133 7.905 2.514 2.811 1.00 72.41 O ATOM 1980 CB ALA A 133 5.502 0.436 3.214 1.00 65.34 C ATOM 0 H ALA A 133 6.765 -1.483 4.089 1.00 63.15 H new ATOM 0 HA ALA A 133 7.206 0.215 1.939 1.00 23.25 H new ATOM 0 HB1 ALA A 133 5.150 1.344 2.724 1.00 65.34 H new ATOM 0 HB2 ALA A 133 4.994 -0.428 2.785 1.00 65.34 H new ATOM 0 HB3 ALA A 133 5.285 0.492 4.281 1.00 65.34 H new ATOM 1986 N ARG A 134 8.145 1.477 4.793 1.00 33.35 N ATOM 1987 CA ARG A 134 8.848 2.591 5.416 1.00 52.12 C ATOM 1988 C ARG A 134 10.314 2.614 4.991 1.00 12.10 C ATOM 1989 O ARG A 134 10.872 3.675 4.711 1.00 72.24 O ATOM 1990 CB ARG A 134 8.748 2.499 6.940 1.00 64.12 C ATOM 1991 CG ARG A 134 7.333 2.657 7.469 1.00 54.33 C ATOM 1992 CD ARG A 134 7.311 2.740 8.986 1.00 5.32 C ATOM 1993 NE ARG A 134 7.841 4.011 9.473 1.00 41.11 N ATOM 1994 CZ ARG A 134 8.159 4.237 10.742 1.00 30.44 C ATOM 1995 NH1 ARG A 134 8.000 3.282 11.650 1.00 50.15 N ATOM 1996 NH2 ARG A 134 8.636 5.420 11.108 1.00 63.15 N ATOM 0 H ARG A 134 8.008 0.671 5.403 1.00 33.35 H new ATOM 0 HA ARG A 134 8.377 3.516 5.084 1.00 52.12 H new ATOM 0 HB2 ARG A 134 9.142 1.536 7.264 1.00 64.12 H new ATOM 0 HB3 ARG A 134 9.381 3.268 7.384 1.00 64.12 H new ATOM 0 HG2 ARG A 134 6.885 3.557 7.048 1.00 54.33 H new ATOM 0 HG3 ARG A 134 6.725 1.814 7.141 1.00 54.33 H new ATOM 0 HD2 ARG A 134 6.288 2.614 9.341 1.00 5.32 H new ATOM 0 HD3 ARG A 134 7.896 1.920 9.402 1.00 5.32 H new ATOM 0 HE ARG A 134 7.974 4.767 8.801 1.00 41.11 H new ATOM 0 HH11 ARG A 134 7.633 2.371 11.374 1.00 50.15 H new ATOM 0 HH12 ARG A 134 8.245 3.459 12.624 1.00 50.15 H new ATOM 0 HH21 ARG A 134 8.759 6.157 10.414 1.00 63.15 H new ATOM 0 HH22 ARG A 134 8.880 5.592 12.083 1.00 63.15 H new ATOM 2010 N GLU A 135 10.930 1.437 4.947 1.00 52.44 N ATOM 2011 CA GLU A 135 12.330 1.324 4.558 1.00 64.35 C ATOM 2012 C GLU A 135 12.622 2.170 3.321 1.00 24.43 C ATOM 2013 O GLU A 135 13.569 2.957 3.303 1.00 32.54 O ATOM 2014 CB GLU A 135 12.690 -0.138 4.285 1.00 32.41 C ATOM 2015 CG GLU A 135 12.867 -0.967 5.546 1.00 60.42 C ATOM 2016 CD GLU A 135 13.968 -2.001 5.415 1.00 65.42 C ATOM 2017 OE1 GLU A 135 14.199 -2.484 4.287 1.00 13.31 O ATOM 2018 OE2 GLU A 135 14.601 -2.327 6.442 1.00 40.42 O ATOM 0 H GLU A 135 10.482 0.550 5.176 1.00 52.44 H new ATOM 0 HA GLU A 135 12.940 1.694 5.382 1.00 64.35 H new ATOM 0 HB2 GLU A 135 11.909 -0.587 3.672 1.00 32.41 H new ATOM 0 HB3 GLU A 135 13.612 -0.174 3.704 1.00 32.41 H new ATOM 0 HG2 GLU A 135 13.093 -0.305 6.382 1.00 60.42 H new ATOM 0 HG3 GLU A 135 11.928 -1.469 5.781 1.00 60.42 H new ATOM 2025 N VAL A 136 11.803 2.001 2.289 1.00 75.52 N ATOM 2026 CA VAL A 136 11.972 2.747 1.049 1.00 54.43 C ATOM 2027 C VAL A 136 11.652 4.225 1.250 1.00 71.13 C ATOM 2028 O VAL A 136 12.290 5.095 0.656 1.00 70.22 O ATOM 2029 CB VAL A 136 11.074 2.188 -0.071 1.00 72.04 C ATOM 2030 CG1 VAL A 136 11.425 2.826 -1.406 1.00 71.42 C ATOM 2031 CG2 VAL A 136 11.198 0.673 -0.145 1.00 4.12 C ATOM 0 H VAL A 136 11.015 1.353 2.287 1.00 75.52 H new ATOM 0 HA VAL A 136 13.016 2.639 0.755 1.00 54.43 H new ATOM 0 HB VAL A 136 10.038 2.435 0.160 1.00 72.04 H new ATOM 0 HG11 VAL A 136 10.780 2.419 -2.185 1.00 71.42 H new ATOM 0 HG12 VAL A 136 11.281 3.905 -1.343 1.00 71.42 H new ATOM 0 HG13 VAL A 136 12.466 2.613 -1.649 1.00 71.42 H new ATOM 0 HG21 VAL A 136 10.557 0.294 -0.941 1.00 4.12 H new ATOM 0 HG22 VAL A 136 12.233 0.402 -0.352 1.00 4.12 H new ATOM 0 HG23 VAL A 136 10.892 0.236 0.806 1.00 4.12 H new ATOM 2041 N ALA A 137 10.661 4.502 2.090 1.00 24.04 N ATOM 2042 CA ALA A 137 10.258 5.873 2.372 1.00 2.42 C ATOM 2043 C ALA A 137 11.311 6.595 3.206 1.00 44.11 C ATOM 2044 O ALA A 137 11.921 6.005 4.098 1.00 44.42 O ATOM 2045 CB ALA A 137 8.913 5.894 3.084 1.00 41.33 C ATOM 0 H ALA A 137 10.122 3.794 2.588 1.00 24.04 H new ATOM 0 HA ALA A 137 10.161 6.398 1.422 1.00 2.42 H new ATOM 0 HB1 ALA A 137 8.625 6.925 3.288 1.00 41.33 H new ATOM 0 HB2 ALA A 137 8.159 5.425 2.451 1.00 41.33 H new ATOM 0 HB3 ALA A 137 8.990 5.346 4.023 1.00 41.33 H new ATOM 2051 N SER A 138 11.520 7.873 2.911 1.00 41.31 N ATOM 2052 CA SER A 138 12.504 8.674 3.631 1.00 14.22 C ATOM 2053 C SER A 138 11.882 9.973 4.136 1.00 61.13 C ATOM 2054 O SER A 138 12.012 10.322 5.308 1.00 21.45 O ATOM 2055 CB SER A 138 13.699 8.985 2.728 1.00 24.31 C ATOM 2056 OG SER A 138 14.778 9.520 3.477 1.00 75.32 O ATOM 0 H SER A 138 11.021 8.377 2.178 1.00 41.31 H new ATOM 0 HA SER A 138 12.847 8.097 4.490 1.00 14.22 H new ATOM 0 HB2 SER A 138 14.021 8.076 2.219 1.00 24.31 H new ATOM 0 HB3 SER A 138 13.401 9.694 1.956 1.00 24.31 H new ATOM 0 HG SER A 138 15.530 9.709 2.878 1.00 75.32 H new ATOM 2062 N GLY A 139 11.207 10.686 3.240 1.00 14.01 N ATOM 2063 CA GLY A 139 10.574 11.938 3.612 1.00 42.51 C ATOM 2064 C GLY A 139 9.103 11.975 3.251 1.00 63.31 C ATOM 2065 O GLY A 139 8.592 11.104 2.545 1.00 22.43 O ATOM 0 H GLY A 139 11.087 10.419 2.263 1.00 14.01 H new ATOM 0 HA2 GLY A 139 10.685 12.093 4.685 1.00 42.51 H new ATOM 0 HA3 GLY A 139 11.087 12.762 3.116 1.00 42.51 H new ATOM 2069 N PRO A 140 8.395 13.003 3.741 1.00 2.12 N ATOM 2070 CA PRO A 140 6.963 13.174 3.480 1.00 71.22 C ATOM 2071 C PRO A 140 6.678 13.543 2.027 1.00 13.52 C ATOM 2072 O PRO A 140 7.577 13.957 1.295 1.00 55.03 O ATOM 2073 CB PRO A 140 6.567 14.322 4.411 1.00 51.02 C ATOM 2074 CG PRO A 140 7.826 15.090 4.623 1.00 72.34 C ATOM 2075 CD PRO A 140 8.938 14.079 4.588 1.00 23.42 C ATOM 0 HA PRO A 140 6.405 12.254 3.654 1.00 71.22 H new ATOM 0 HB2 PRO A 140 5.793 14.946 3.963 1.00 51.02 H new ATOM 0 HB3 PRO A 140 6.168 13.947 5.354 1.00 51.02 H new ATOM 0 HG2 PRO A 140 7.959 15.843 3.847 1.00 72.34 H new ATOM 0 HG3 PRO A 140 7.806 15.616 5.578 1.00 72.34 H new ATOM 0 HD2 PRO A 140 9.851 14.500 4.167 1.00 23.42 H new ATOM 0 HD3 PRO A 140 9.185 13.718 5.587 1.00 23.42 H new ATOM 2083 N SER A 141 5.423 13.391 1.618 1.00 14.51 N ATOM 2084 CA SER A 141 5.021 13.707 0.252 1.00 74.42 C ATOM 2085 C SER A 141 5.189 15.196 -0.034 1.00 5.22 C ATOM 2086 O SER A 141 5.219 16.016 0.883 1.00 42.04 O ATOM 2087 CB SER A 141 3.567 13.293 0.018 1.00 63.33 C ATOM 2088 OG SER A 141 3.253 13.297 -1.365 1.00 13.32 O ATOM 0 H SER A 141 4.667 13.051 2.212 1.00 14.51 H new ATOM 0 HA SER A 141 5.665 13.149 -0.428 1.00 74.42 H new ATOM 0 HB2 SER A 141 3.398 12.298 0.430 1.00 63.33 H new ATOM 0 HB3 SER A 141 2.901 13.975 0.548 1.00 63.33 H new ATOM 0 HG SER A 141 2.319 13.027 -1.489 1.00 13.32 H new ATOM 2094 N SER A 142 5.301 15.536 -1.314 1.00 53.41 N ATOM 2095 CA SER A 142 5.471 16.927 -1.723 1.00 73.33 C ATOM 2096 C SER A 142 4.122 17.632 -1.821 1.00 44.20 C ATOM 2097 O SER A 142 3.248 17.224 -2.585 1.00 25.04 O ATOM 2098 CB SER A 142 6.196 16.999 -3.068 1.00 25.22 C ATOM 2099 OG SER A 142 7.027 18.145 -3.137 1.00 72.55 O ATOM 0 H SER A 142 5.277 14.869 -2.085 1.00 53.41 H new ATOM 0 HA SER A 142 6.072 17.433 -0.967 1.00 73.33 H new ATOM 0 HB2 SER A 142 6.797 16.101 -3.210 1.00 25.22 H new ATOM 0 HB3 SER A 142 5.466 17.025 -3.877 1.00 25.22 H new ATOM 0 HG SER A 142 7.930 17.913 -2.835 1.00 72.55 H new ATOM 2105 N GLY A 143 3.960 18.697 -1.039 1.00 44.24 N ATOM 2106 CA GLY A 143 2.716 19.444 -1.052 1.00 63.00 C ATOM 2107 C GLY A 143 2.866 20.830 -0.456 1.00 73.25 C ATOM 2108 O GLY A 143 3.138 21.794 -1.172 1.00 1.20 O ATOM 0 H GLY A 143 4.668 19.055 -0.398 1.00 44.24 H new ATOM 0 HA2 GLY A 143 2.358 19.530 -2.078 1.00 63.00 H new ATOM 0 HA3 GLY A 143 1.959 18.892 -0.495 1.00 63.00 H new TER 2112 GLY A 143