USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1106 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 ASN :FLIP amide:sc= -3.24 F(o=-4.8,f=-4.1) USER MOD Set 1.2: A 131 THR OG1 : rot 180:sc= -0.833 USER MOD Set 2.1: A 108 SER OG : rot 180:sc= 0.989 USER MOD Set 2.2: A 124 THR OG1 : rot -92:sc= 1.23 USER MOD Set 3.1: A 95 CYS SG : rot -162:sc= -2.34 USER MOD Set 3.2: A 97 GLN : amide:sc= -1.92 K(o=-4.3,f=-4.9) USER MOD Set 4.1: A 75 THR OG1 : rot 69:sc= 1.31 USER MOD Set 4.2: A 81 CYS SG : rot 140:sc= -6.66! USER MOD Set 5.1: A 56 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 57 THR OG1 : rot 180:sc= -0.329 USER MOD Set 6.1: A 25 ASN :FLIP amide:sc= -2.75! C(o=-4.2!,f=-2.7!) USER MOD Set 6.2: A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 7.1: A 2 ASN : amide:sc= -0.572 X(o=-3.7,f=-3.2) USER MOD Set 7.2: A 91 ASN : amide:sc= -3.1 K(o=-3.7,f=-11!) USER MOD Single : A 4 SER OG : rot -2:sc= 1.06 USER MOD Single : A 6 ASN : amide:sc= -2.62 K(o=-2.6,f=-3.9!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -78:sc= -3.91! USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -3.36 K(o=-3.4,f=-9.4!) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 0:sc= -2.13 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0623 USER MOD Single : A 55 SER OG : rot 160:sc= -0.0104 USER MOD Single : A 60 THR OG1 : rot -30:sc= -1.05 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.0138 USER MOD Single : A 64 ASN :FLIP amide:sc= -1.08 F(o=-4.2!,f=-1.1) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 LYS NZ :NH3+ -142:sc= -0.0949 (180deg=-1.52!) USER MOD Single : A 83 SER OG : rot 138:sc= 0.788 USER MOD Single : A 86 LYS NZ :NH3+ -168:sc= -0.212 (180deg=-0.308) USER MOD Single : A 89 SER OG : rot 180:sc= -0.12 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 MET CE :methyl -123:sc= -4.7! (180deg=-5.47!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -173:sc= -0.273 (180deg=-0.287) USER MOD Single : A 107 THR OG1 : rot 180:sc=-0.00752 USER MOD Single : A 110 THR OG1 : rot 50:sc= 0.69 USER MOD Single : A 114 THR OG1 : rot -150:sc= -1.07 USER MOD Single : A 115 ASN :FLIP amide:sc= -0.387 F(o=-1.2,f=-0.39) USER MOD Single : A 122 THR OG1 : rot -153:sc= -3.62! USER MOD Single : A 123 MET CE :methyl -165:sc= -0.108 (180deg=-0.64) USER MOD Single : A 130 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= -1.98 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -15.827 0.742 9.947 1.00 0.00 N ATOM 2 CA PRO A 1 -14.397 0.691 9.491 1.00 0.00 C ATOM 3 C PRO A 1 -14.012 1.982 8.748 1.00 0.00 C ATOM 4 O PRO A 1 -12.867 2.385 8.768 1.00 0.00 O ATOM 5 CB PRO A 1 -14.243 -0.500 8.538 1.00 0.00 C ATOM 6 CG PRO A 1 -15.619 -1.146 8.402 1.00 0.00 C ATOM 7 CD PRO A 1 -16.608 -0.274 9.178 1.00 0.00 C ATOM 0 H2 PRO A 1 -16.214 1.674 9.797 1.00 0.00 H new ATOM 0 H3 PRO A 1 -15.887 0.552 10.947 1.00 0.00 H new ATOM 0 HA PRO A 1 -13.745 0.587 10.359 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -13.874 -0.171 7.567 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -13.519 -1.215 8.929 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -15.909 -1.216 7.354 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -15.608 -2.161 8.799 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -17.301 0.216 8.494 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -17.206 -0.886 9.854 1.00 0.00 H new ATOM 17 N ASN A 2 -14.950 2.612 8.065 1.00 0.00 N ATOM 18 CA ASN A 2 -14.632 3.857 7.292 1.00 0.00 C ATOM 19 C ASN A 2 -13.854 3.449 6.036 1.00 0.00 C ATOM 20 O ASN A 2 -14.168 2.440 5.446 1.00 0.00 O ATOM 21 CB ASN A 2 -13.869 4.867 8.172 1.00 0.00 C ATOM 22 CG ASN A 2 -14.580 5.019 9.518 1.00 0.00 C ATOM 23 OD1 ASN A 2 -15.793 5.057 9.577 1.00 0.00 O ATOM 24 ND2 ASN A 2 -13.871 5.108 10.610 1.00 0.00 N ATOM 0 H ASN A 2 -15.924 2.313 8.013 1.00 0.00 H new ATOM 0 HA ASN A 2 -15.545 4.367 6.984 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -12.845 4.528 8.327 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -13.812 5.832 7.669 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -14.335 5.209 11.513 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -12.853 5.076 10.561 1.00 0.00 H new ATOM 31 N PHE A 3 -12.870 4.211 5.625 1.00 0.00 N ATOM 32 CA PHE A 3 -12.057 3.903 4.388 1.00 0.00 C ATOM 33 C PHE A 3 -12.797 4.364 3.115 1.00 0.00 C ATOM 34 O PHE A 3 -12.204 4.959 2.235 1.00 0.00 O ATOM 35 CB PHE A 3 -11.737 2.404 4.227 1.00 0.00 C ATOM 36 CG PHE A 3 -10.908 1.872 5.376 1.00 0.00 C ATOM 37 CD1 PHE A 3 -11.521 1.448 6.565 1.00 0.00 C ATOM 38 CD2 PHE A 3 -9.519 1.743 5.229 1.00 0.00 C ATOM 39 CE1 PHE A 3 -10.767 0.897 7.584 1.00 0.00 C ATOM 40 CE2 PHE A 3 -8.757 1.201 6.267 1.00 0.00 C ATOM 41 CZ PHE A 3 -9.389 0.768 7.450 1.00 0.00 C ATOM 0 H PHE A 3 -12.582 5.063 6.106 1.00 0.00 H new ATOM 0 HA PHE A 3 -11.121 4.446 4.517 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -12.668 1.840 4.161 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -11.201 2.247 3.291 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -12.589 1.553 6.685 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -9.040 2.062 4.315 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -11.251 0.564 8.490 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -7.686 1.114 6.163 1.00 0.00 H new ATOM 0 HZ PHE A 3 -8.805 0.337 8.250 1.00 0.00 H new ATOM 51 N SER A 4 -14.076 4.076 2.992 1.00 0.00 N ATOM 52 CA SER A 4 -14.843 4.472 1.767 1.00 0.00 C ATOM 53 C SER A 4 -14.663 5.968 1.476 1.00 0.00 C ATOM 54 O SER A 4 -15.129 6.810 2.222 1.00 0.00 O ATOM 55 CB SER A 4 -16.332 4.181 1.984 1.00 0.00 C ATOM 56 OG SER A 4 -16.901 5.187 2.815 1.00 0.00 O ATOM 0 H SER A 4 -14.623 3.579 3.695 1.00 0.00 H new ATOM 0 HA SER A 4 -14.466 3.899 0.920 1.00 0.00 H new ATOM 0 HB2 SER A 4 -16.850 4.151 1.025 1.00 0.00 H new ATOM 0 HB3 SER A 4 -16.458 3.201 2.445 1.00 0.00 H new ATOM 0 HG SER A 4 -16.203 5.819 3.088 1.00 0.00 H new ATOM 62 N GLY A 5 -13.999 6.305 0.398 1.00 0.00 N ATOM 63 CA GLY A 5 -13.804 7.747 0.066 1.00 0.00 C ATOM 64 C GLY A 5 -12.540 7.920 -0.757 1.00 0.00 C ATOM 65 O GLY A 5 -11.610 7.146 -0.661 1.00 0.00 O ATOM 0 H GLY A 5 -13.586 5.646 -0.262 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -14.664 8.121 -0.489 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -13.736 8.334 0.982 1.00 0.00 H new ATOM 69 N ASN A 6 -12.495 8.957 -1.536 1.00 0.00 N ATOM 70 CA ASN A 6 -11.293 9.241 -2.349 1.00 0.00 C ATOM 71 C ASN A 6 -10.284 9.861 -1.402 1.00 0.00 C ATOM 72 O ASN A 6 -10.673 10.462 -0.415 1.00 0.00 O ATOM 73 CB ASN A 6 -11.665 10.215 -3.469 1.00 0.00 C ATOM 74 CG ASN A 6 -11.034 9.762 -4.787 1.00 0.00 C ATOM 75 OD1 ASN A 6 -11.684 9.135 -5.600 1.00 0.00 O ATOM 76 ND2 ASN A 6 -9.788 10.053 -5.038 1.00 0.00 N ATOM 0 H ASN A 6 -13.254 9.630 -1.644 1.00 0.00 H new ATOM 0 HA ASN A 6 -10.883 8.345 -2.814 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -12.749 10.265 -3.573 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -11.322 11.219 -3.218 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -9.361 9.754 -5.915 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -9.240 10.579 -4.357 1.00 0.00 H new ATOM 83 N TRP A 7 -9.006 9.687 -1.631 1.00 0.00 N ATOM 84 CA TRP A 7 -8.028 10.246 -0.651 1.00 0.00 C ATOM 85 C TRP A 7 -6.954 11.097 -1.304 1.00 0.00 C ATOM 86 O TRP A 7 -6.358 10.730 -2.299 1.00 0.00 O ATOM 87 CB TRP A 7 -7.365 9.096 0.074 1.00 0.00 C ATOM 88 CG TRP A 7 -8.404 8.255 0.726 1.00 0.00 C ATOM 89 CD1 TRP A 7 -8.936 7.126 0.213 1.00 0.00 C ATOM 90 CD2 TRP A 7 -9.065 8.483 1.989 1.00 0.00 C ATOM 91 NE1 TRP A 7 -9.835 6.607 1.125 1.00 0.00 N ATOM 92 CE2 TRP A 7 -9.959 7.422 2.235 1.00 0.00 C ATOM 93 CE3 TRP A 7 -8.955 9.497 2.942 1.00 0.00 C ATOM 94 CZ2 TRP A 7 -10.722 7.370 3.403 1.00 0.00 C ATOM 95 CZ3 TRP A 7 -9.723 9.466 4.103 1.00 0.00 C ATOM 96 CH2 TRP A 7 -10.608 8.402 4.341 1.00 0.00 C ATOM 0 H TRP A 7 -8.607 9.196 -2.431 1.00 0.00 H new ATOM 0 HA TRP A 7 -8.580 10.892 0.032 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -6.784 8.497 -0.627 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -6.668 9.476 0.821 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -8.699 6.699 -0.750 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -10.343 5.732 0.996 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -8.268 10.313 2.777 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -11.393 6.542 3.581 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -9.638 10.265 4.825 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -11.199 8.380 5.245 1.00 0.00 H new ATOM 107 N LYS A 8 -6.687 12.227 -0.707 1.00 0.00 N ATOM 108 CA LYS A 8 -5.630 13.126 -1.226 1.00 0.00 C ATOM 109 C LYS A 8 -4.341 12.795 -0.473 1.00 0.00 C ATOM 110 O LYS A 8 -4.384 12.247 0.615 1.00 0.00 O ATOM 111 CB LYS A 8 -5.992 14.606 -0.975 1.00 0.00 C ATOM 112 CG LYS A 8 -7.518 14.814 -0.930 1.00 0.00 C ATOM 113 CD LYS A 8 -7.970 14.962 0.527 1.00 0.00 C ATOM 114 CE LYS A 8 -7.713 16.395 1.009 1.00 0.00 C ATOM 115 NZ LYS A 8 -8.977 16.968 1.552 1.00 0.00 N ATOM 0 H LYS A 8 -7.165 12.565 0.128 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.518 12.982 -2.301 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.551 14.935 -0.034 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.562 15.225 -1.762 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.792 15.702 -1.499 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.025 13.969 -1.395 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -9.030 14.724 0.614 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -7.432 14.255 1.158 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -6.939 16.399 1.777 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -7.347 17.008 0.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.805 17.940 1.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.702 16.977 0.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.307 16.387 2.349 1.00 0.00 H new ATOM 129 N ILE A 9 -3.200 13.114 -1.031 1.00 0.00 N ATOM 130 CA ILE A 9 -1.919 12.805 -0.330 1.00 0.00 C ATOM 131 C ILE A 9 -1.686 13.841 0.776 1.00 0.00 C ATOM 132 O ILE A 9 -1.952 15.016 0.615 1.00 0.00 O ATOM 133 CB ILE A 9 -0.763 12.774 -1.360 1.00 0.00 C ATOM 134 CG1 ILE A 9 0.348 11.831 -0.863 1.00 0.00 C ATOM 135 CG2 ILE A 9 -0.187 14.177 -1.617 1.00 0.00 C ATOM 136 CD1 ILE A 9 1.024 12.388 0.398 1.00 0.00 C ATOM 0 H ILE A 9 -3.101 13.573 -1.937 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.965 11.823 0.141 1.00 0.00 H new ATOM 0 HB ILE A 9 -1.165 12.406 -2.304 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.073 10.849 -0.650 1.00 0.00 H new ATOM 0 HG13 ILE A 9 1.092 11.695 -1.648 1.00 0.00 H new ATOM 0 HG21 ILE A 9 0.621 14.111 -2.345 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -0.972 14.827 -2.004 1.00 0.00 H new ATOM 0 HG23 ILE A 9 0.198 14.589 -0.684 1.00 0.00 H new ATOM 0 HD11 ILE A 9 1.804 11.701 0.726 1.00 0.00 H new ATOM 0 HD12 ILE A 9 1.466 13.359 0.175 1.00 0.00 H new ATOM 0 HD13 ILE A 9 0.283 12.500 1.189 1.00 0.00 H new ATOM 148 N ILE A 10 -1.187 13.394 1.889 1.00 0.00 N ATOM 149 CA ILE A 10 -0.920 14.294 3.033 1.00 0.00 C ATOM 150 C ILE A 10 0.225 13.674 3.843 1.00 0.00 C ATOM 151 O ILE A 10 0.126 12.568 4.333 1.00 0.00 O ATOM 152 CB ILE A 10 -2.209 14.423 3.872 1.00 0.00 C ATOM 153 CG1 ILE A 10 -3.206 15.330 3.133 1.00 0.00 C ATOM 154 CG2 ILE A 10 -1.918 15.030 5.253 1.00 0.00 C ATOM 155 CD1 ILE A 10 -4.175 14.483 2.298 1.00 0.00 C ATOM 0 H ILE A 10 -0.948 12.417 2.055 1.00 0.00 H new ATOM 0 HA ILE A 10 -0.630 15.294 2.711 1.00 0.00 H new ATOM 0 HB ILE A 10 -2.625 13.425 4.011 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -3.763 15.931 3.851 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -2.668 16.023 2.487 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -2.846 15.108 5.819 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.217 14.391 5.791 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.484 16.022 5.130 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.876 15.137 1.780 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -3.613 13.901 1.567 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.725 13.808 2.953 1.00 0.00 H new ATOM 167 N ARG A 11 1.314 14.379 3.954 1.00 0.00 N ATOM 168 CA ARG A 11 2.501 13.864 4.705 1.00 0.00 C ATOM 169 C ARG A 11 3.057 12.628 3.998 1.00 0.00 C ATOM 170 O ARG A 11 2.504 11.548 4.083 1.00 0.00 O ATOM 171 CB ARG A 11 2.105 13.510 6.146 1.00 0.00 C ATOM 172 CG ARG A 11 2.441 14.682 7.072 1.00 0.00 C ATOM 173 CD ARG A 11 1.586 15.894 6.694 1.00 0.00 C ATOM 174 NE ARG A 11 1.508 16.828 7.852 1.00 0.00 N ATOM 175 CZ ARG A 11 0.401 17.473 8.098 1.00 0.00 C ATOM 176 NH1 ARG A 11 0.083 18.519 7.385 1.00 0.00 N ATOM 177 NH2 ARG A 11 -0.389 17.071 9.056 1.00 0.00 N ATOM 0 H ARG A 11 1.438 15.307 3.550 1.00 0.00 H new ATOM 0 HA ARG A 11 3.267 14.639 4.734 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.039 13.287 6.197 1.00 0.00 H new ATOM 0 HB3 ARG A 11 2.634 12.614 6.470 1.00 0.00 H new ATOM 0 HG2 ARG A 11 2.257 14.404 8.110 1.00 0.00 H new ATOM 0 HG3 ARG A 11 3.499 14.931 6.991 1.00 0.00 H new ATOM 0 HD2 ARG A 11 2.018 16.402 5.832 1.00 0.00 H new ATOM 0 HD3 ARG A 11 0.586 15.571 6.406 1.00 0.00 H new ATOM 0 HE ARG A 11 2.321 16.963 8.453 1.00 0.00 H new ATOM 0 HH11 ARG A 11 0.700 18.832 6.636 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -0.783 19.023 7.577 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -0.141 16.253 9.612 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -1.255 17.575 9.249 1.00 0.00 H new ATOM 191 N SER A 12 4.151 12.787 3.296 1.00 0.00 N ATOM 192 CA SER A 12 4.762 11.636 2.570 1.00 0.00 C ATOM 193 C SER A 12 6.285 11.687 2.731 1.00 0.00 C ATOM 194 O SER A 12 6.890 12.741 2.682 1.00 0.00 O ATOM 195 CB SER A 12 4.397 11.724 1.082 1.00 0.00 C ATOM 196 OG SER A 12 3.499 10.673 0.756 1.00 0.00 O ATOM 0 H SER A 12 4.649 13.671 3.195 1.00 0.00 H new ATOM 0 HA SER A 12 4.386 10.699 2.981 1.00 0.00 H new ATOM 0 HB2 SER A 12 3.940 12.689 0.864 1.00 0.00 H new ATOM 0 HB3 SER A 12 5.296 11.652 0.470 1.00 0.00 H new ATOM 0 HG SER A 12 3.998 9.835 0.658 1.00 0.00 H new ATOM 202 N GLU A 13 6.902 10.550 2.919 1.00 0.00 N ATOM 203 CA GLU A 13 8.386 10.504 3.083 1.00 0.00 C ATOM 204 C GLU A 13 8.804 9.052 3.311 1.00 0.00 C ATOM 205 O GLU A 13 8.768 8.561 4.424 1.00 0.00 O ATOM 206 CB GLU A 13 8.800 11.355 4.291 1.00 0.00 C ATOM 207 CG GLU A 13 10.096 12.104 3.973 1.00 0.00 C ATOM 208 CD GLU A 13 10.374 13.133 5.071 1.00 0.00 C ATOM 209 OE1 GLU A 13 9.421 13.708 5.571 1.00 0.00 O ATOM 210 OE2 GLU A 13 11.534 13.329 5.392 1.00 0.00 O ATOM 0 H GLU A 13 6.437 9.643 2.966 1.00 0.00 H new ATOM 0 HA GLU A 13 8.872 10.898 2.190 1.00 0.00 H new ATOM 0 HB2 GLU A 13 8.010 12.064 4.537 1.00 0.00 H new ATOM 0 HB3 GLU A 13 8.941 10.719 5.165 1.00 0.00 H new ATOM 0 HG2 GLU A 13 10.926 11.401 3.900 1.00 0.00 H new ATOM 0 HG3 GLU A 13 10.013 12.601 3.007 1.00 0.00 H new ATOM 217 N ASN A 14 9.188 8.359 2.267 1.00 0.00 N ATOM 218 CA ASN A 14 9.592 6.929 2.431 1.00 0.00 C ATOM 219 C ASN A 14 10.212 6.364 1.142 1.00 0.00 C ATOM 220 O ASN A 14 11.018 5.465 1.211 1.00 0.00 O ATOM 221 CB ASN A 14 8.358 6.096 2.801 1.00 0.00 C ATOM 222 CG ASN A 14 8.318 5.869 4.314 1.00 0.00 C ATOM 223 OD1 ASN A 14 7.377 6.431 5.022 1.00 0.00 O flip ATOM 224 ND2 ASN A 14 9.152 5.172 4.858 1.00 0.00 N flip ATOM 0 H ASN A 14 9.239 8.719 1.314 1.00 0.00 H new ATOM 0 HA ASN A 14 10.342 6.877 3.220 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.452 6.608 2.477 1.00 0.00 H new ATOM 0 HB3 ASN A 14 8.386 5.138 2.281 1.00 0.00 H new ATOM 0 HD21 ASN A 14 9.888 4.732 4.306 1.00 0.00 H new ATOM 0 HD22 ASN A 14 9.116 5.027 5.867 1.00 0.00 H new ATOM 231 N PHE A 15 9.824 6.857 -0.025 1.00 0.00 N ATOM 232 CA PHE A 15 10.368 6.323 -1.330 1.00 0.00 C ATOM 233 C PHE A 15 11.890 6.047 -1.249 1.00 0.00 C ATOM 234 O PHE A 15 12.341 4.960 -1.564 1.00 0.00 O ATOM 235 CB PHE A 15 10.061 7.331 -2.480 1.00 0.00 C ATOM 236 CG PHE A 15 11.193 7.321 -3.493 1.00 0.00 C ATOM 237 CD1 PHE A 15 11.284 6.289 -4.435 1.00 0.00 C ATOM 238 CD2 PHE A 15 12.198 8.290 -3.417 1.00 0.00 C ATOM 239 CE1 PHE A 15 12.371 6.239 -5.305 1.00 0.00 C ATOM 240 CE2 PHE A 15 13.293 8.229 -4.277 1.00 0.00 C ATOM 241 CZ PHE A 15 13.380 7.205 -5.220 1.00 0.00 C ATOM 0 H PHE A 15 9.147 7.613 -0.128 1.00 0.00 H new ATOM 0 HA PHE A 15 9.875 5.373 -1.536 1.00 0.00 H new ATOM 0 HB2 PHE A 15 9.123 7.065 -2.967 1.00 0.00 H new ATOM 0 HB3 PHE A 15 9.935 8.334 -2.072 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.514 5.534 -4.487 1.00 0.00 H new ATOM 0 HD2 PHE A 15 12.126 9.086 -2.691 1.00 0.00 H new ATOM 0 HE1 PHE A 15 12.435 5.455 -6.045 1.00 0.00 H new ATOM 0 HE2 PHE A 15 14.073 8.973 -4.213 1.00 0.00 H new ATOM 0 HZ PHE A 15 14.228 7.157 -5.886 1.00 0.00 H new ATOM 251 N GLU A 16 12.674 7.022 -0.881 1.00 0.00 N ATOM 252 CA GLU A 16 14.145 6.795 -0.833 1.00 0.00 C ATOM 253 C GLU A 16 14.456 5.829 0.302 1.00 0.00 C ATOM 254 O GLU A 16 15.342 5.003 0.197 1.00 0.00 O ATOM 255 CB GLU A 16 14.885 8.120 -0.626 1.00 0.00 C ATOM 256 CG GLU A 16 14.292 8.868 0.571 1.00 0.00 C ATOM 257 CD GLU A 16 15.243 9.990 0.992 1.00 0.00 C ATOM 258 OE1 GLU A 16 16.419 9.711 1.161 1.00 0.00 O ATOM 259 OE2 GLU A 16 14.780 11.109 1.138 1.00 0.00 O ATOM 0 H GLU A 16 12.364 7.956 -0.614 1.00 0.00 H new ATOM 0 HA GLU A 16 14.480 6.368 -1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 16 15.946 7.932 -0.459 1.00 0.00 H new ATOM 0 HB3 GLU A 16 14.808 8.734 -1.524 1.00 0.00 H new ATOM 0 HG2 GLU A 16 13.318 9.281 0.309 1.00 0.00 H new ATOM 0 HG3 GLU A 16 14.134 8.180 1.401 1.00 0.00 H new ATOM 266 N GLU A 17 13.703 5.895 1.371 1.00 0.00 N ATOM 267 CA GLU A 17 13.918 4.944 2.501 1.00 0.00 C ATOM 268 C GLU A 17 13.683 3.512 1.989 1.00 0.00 C ATOM 269 O GLU A 17 14.147 2.550 2.567 1.00 0.00 O ATOM 270 CB GLU A 17 12.923 5.255 3.616 1.00 0.00 C ATOM 271 CG GLU A 17 13.335 4.524 4.893 1.00 0.00 C ATOM 272 CD GLU A 17 12.686 5.201 6.102 1.00 0.00 C ATOM 273 OE1 GLU A 17 13.090 6.306 6.424 1.00 0.00 O ATOM 274 OE2 GLU A 17 11.796 4.604 6.684 1.00 0.00 O ATOM 0 H GLU A 17 12.948 6.567 1.509 1.00 0.00 H new ATOM 0 HA GLU A 17 14.933 5.040 2.886 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.888 6.329 3.796 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.920 4.949 3.318 1.00 0.00 H new ATOM 0 HG2 GLU A 17 13.030 3.479 4.841 1.00 0.00 H new ATOM 0 HG3 GLU A 17 14.420 4.534 4.996 1.00 0.00 H new ATOM 281 N LEU A 18 12.968 3.380 0.894 1.00 0.00 N ATOM 282 CA LEU A 18 12.692 2.047 0.311 1.00 0.00 C ATOM 283 C LEU A 18 13.939 1.531 -0.365 1.00 0.00 C ATOM 284 O LEU A 18 14.344 0.407 -0.165 1.00 0.00 O ATOM 285 CB LEU A 18 11.599 2.163 -0.757 1.00 0.00 C ATOM 286 CG LEU A 18 10.425 3.052 -0.328 1.00 0.00 C ATOM 287 CD1 LEU A 18 9.252 2.769 -1.253 1.00 0.00 C ATOM 288 CD2 LEU A 18 9.981 2.792 1.108 1.00 0.00 C ATOM 0 H LEU A 18 12.562 4.161 0.379 1.00 0.00 H new ATOM 0 HA LEU A 18 12.374 1.374 1.108 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.035 2.565 -1.671 1.00 0.00 H new ATOM 0 HB3 LEU A 18 11.224 1.167 -0.994 1.00 0.00 H new ATOM 0 HG LEU A 18 10.754 4.089 -0.387 1.00 0.00 H new ATOM 0 HD11 LEU A 18 8.404 3.391 -0.966 1.00 0.00 H new ATOM 0 HD12 LEU A 18 9.536 2.995 -2.281 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.973 1.718 -1.176 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.148 3.450 1.356 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.666 1.753 1.209 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.811 2.987 1.787 1.00 0.00 H new ATOM 300 N LEU A 19 14.542 2.346 -1.174 1.00 0.00 N ATOM 301 CA LEU A 19 15.770 1.905 -1.877 1.00 0.00 C ATOM 302 C LEU A 19 16.973 1.993 -0.925 1.00 0.00 C ATOM 303 O LEU A 19 18.065 1.570 -1.252 1.00 0.00 O ATOM 304 CB LEU A 19 16.021 2.779 -3.115 1.00 0.00 C ATOM 305 CG LEU A 19 14.752 2.952 -3.992 1.00 0.00 C ATOM 306 CD1 LEU A 19 13.783 1.758 -3.891 1.00 0.00 C ATOM 307 CD2 LEU A 19 14.024 4.234 -3.582 1.00 0.00 C ATOM 0 H LEU A 19 14.239 3.298 -1.379 1.00 0.00 H new ATOM 0 HA LEU A 19 15.638 0.872 -2.199 1.00 0.00 H new ATOM 0 HB2 LEU A 19 16.375 3.760 -2.797 1.00 0.00 H new ATOM 0 HB3 LEU A 19 16.814 2.333 -3.715 1.00 0.00 H new ATOM 0 HG LEU A 19 15.083 3.008 -5.029 1.00 0.00 H new ATOM 0 HD11 LEU A 19 12.916 1.938 -4.526 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.289 0.850 -4.218 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.457 1.640 -2.858 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.132 4.358 -4.196 1.00 0.00 H new ATOM 0 HD22 LEU A 19 13.736 4.169 -2.533 1.00 0.00 H new ATOM 0 HD23 LEU A 19 14.685 5.089 -3.725 1.00 0.00 H new ATOM 319 N LYS A 20 16.774 2.536 0.253 1.00 0.00 N ATOM 320 CA LYS A 20 17.875 2.657 1.237 1.00 0.00 C ATOM 321 C LYS A 20 17.827 1.475 2.210 1.00 0.00 C ATOM 322 O LYS A 20 18.816 1.123 2.825 1.00 0.00 O ATOM 323 CB LYS A 20 17.678 3.952 2.018 1.00 0.00 C ATOM 324 CG LYS A 20 18.437 5.081 1.326 1.00 0.00 C ATOM 325 CD LYS A 20 18.680 6.221 2.317 1.00 0.00 C ATOM 326 CE LYS A 20 19.934 6.995 1.908 1.00 0.00 C ATOM 327 NZ LYS A 20 20.422 7.798 3.065 1.00 0.00 N ATOM 0 H LYS A 20 15.877 2.904 0.571 1.00 0.00 H new ATOM 0 HA LYS A 20 18.836 2.661 0.723 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.617 4.196 2.078 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.036 3.831 3.040 1.00 0.00 H new ATOM 0 HG2 LYS A 20 19.388 4.711 0.942 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.867 5.445 0.471 1.00 0.00 H new ATOM 0 HD2 LYS A 20 17.819 6.889 2.338 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.799 5.822 3.324 1.00 0.00 H new ATOM 0 HE2 LYS A 20 20.710 6.304 1.579 1.00 0.00 H new ATOM 0 HE3 LYS A 20 19.712 7.650 1.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 21.275 8.324 2.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 19.683 8.467 3.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.650 7.163 3.857 1.00 0.00 H new ATOM 341 N VAL A 21 16.674 0.874 2.362 1.00 0.00 N ATOM 342 CA VAL A 21 16.531 -0.269 3.299 1.00 0.00 C ATOM 343 C VAL A 21 16.608 -1.585 2.532 1.00 0.00 C ATOM 344 O VAL A 21 17.136 -2.563 3.029 1.00 0.00 O ATOM 345 CB VAL A 21 15.193 -0.152 4.027 1.00 0.00 C ATOM 346 CG1 VAL A 21 15.169 1.149 4.827 1.00 0.00 C ATOM 347 CG2 VAL A 21 14.037 -0.152 3.022 1.00 0.00 C ATOM 0 H VAL A 21 15.819 1.133 1.869 1.00 0.00 H new ATOM 0 HA VAL A 21 17.340 -0.251 4.029 1.00 0.00 H new ATOM 0 HB VAL A 21 15.077 -1.004 4.696 1.00 0.00 H new ATOM 0 HG11 VAL A 21 14.216 1.238 5.349 1.00 0.00 H new ATOM 0 HG12 VAL A 21 15.981 1.144 5.554 1.00 0.00 H new ATOM 0 HG13 VAL A 21 15.292 1.995 4.150 1.00 0.00 H new ATOM 0 HG21 VAL A 21 13.091 -0.068 3.556 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.146 0.693 2.342 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.051 -1.081 2.452 1.00 0.00 H new ATOM 357 N LEU A 22 16.130 -1.614 1.311 1.00 0.00 N ATOM 358 CA LEU A 22 16.230 -2.865 0.505 1.00 0.00 C ATOM 359 C LEU A 22 17.716 -3.188 0.311 1.00 0.00 C ATOM 360 O LEU A 22 18.091 -4.313 0.041 1.00 0.00 O ATOM 361 CB LEU A 22 15.525 -2.691 -0.862 1.00 0.00 C ATOM 362 CG LEU A 22 16.071 -1.515 -1.676 1.00 0.00 C ATOM 363 CD1 LEU A 22 17.470 -1.819 -2.231 1.00 0.00 C ATOM 364 CD2 LEU A 22 15.112 -1.294 -2.848 1.00 0.00 C ATOM 0 H LEU A 22 15.678 -0.829 0.842 1.00 0.00 H new ATOM 0 HA LEU A 22 15.735 -3.685 1.025 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.637 -3.608 -1.441 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.457 -2.546 -0.697 1.00 0.00 H new ATOM 0 HG LEU A 22 16.148 -0.635 -1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 22 17.828 -0.963 -2.804 1.00 0.00 H new ATOM 0 HD12 LEU A 22 18.154 -2.015 -1.405 1.00 0.00 H new ATOM 0 HD13 LEU A 22 17.422 -2.695 -2.878 1.00 0.00 H new ATOM 0 HD21 LEU A 22 15.466 -0.461 -3.456 1.00 0.00 H new ATOM 0 HD22 LEU A 22 15.069 -2.196 -3.458 1.00 0.00 H new ATOM 0 HD23 LEU A 22 14.117 -1.067 -2.466 1.00 0.00 H new ATOM 376 N GLY A 23 18.563 -2.190 0.451 1.00 0.00 N ATOM 377 CA GLY A 23 20.015 -2.401 0.285 1.00 0.00 C ATOM 378 C GLY A 23 20.561 -1.390 -0.707 1.00 0.00 C ATOM 379 O GLY A 23 20.790 -1.705 -1.859 1.00 0.00 O ATOM 0 H GLY A 23 18.293 -1.233 0.676 1.00 0.00 H new ATOM 0 HA2 GLY A 23 20.521 -2.295 1.245 1.00 0.00 H new ATOM 0 HA3 GLY A 23 20.209 -3.414 -0.068 1.00 0.00 H new ATOM 383 N VAL A 24 20.766 -0.174 -0.268 1.00 0.00 N ATOM 384 CA VAL A 24 21.302 0.887 -1.181 1.00 0.00 C ATOM 385 C VAL A 24 22.542 0.358 -1.937 1.00 0.00 C ATOM 386 O VAL A 24 23.253 -0.508 -1.465 1.00 0.00 O ATOM 387 CB VAL A 24 21.612 2.161 -0.342 1.00 0.00 C ATOM 388 CG1 VAL A 24 23.121 2.459 -0.234 1.00 0.00 C ATOM 389 CG2 VAL A 24 20.924 3.368 -0.987 1.00 0.00 C ATOM 0 H VAL A 24 20.585 0.133 0.688 1.00 0.00 H new ATOM 0 HA VAL A 24 20.563 1.153 -1.937 1.00 0.00 H new ATOM 0 HB VAL A 24 21.238 1.977 0.665 1.00 0.00 H new ATOM 0 HG11 VAL A 24 23.272 3.359 0.363 1.00 0.00 H new ATOM 0 HG12 VAL A 24 23.625 1.618 0.243 1.00 0.00 H new ATOM 0 HG13 VAL A 24 23.534 2.611 -1.231 1.00 0.00 H new ATOM 0 HG21 VAL A 24 21.138 4.263 -0.403 1.00 0.00 H new ATOM 0 HG22 VAL A 24 21.297 3.499 -2.003 1.00 0.00 H new ATOM 0 HG23 VAL A 24 19.847 3.201 -1.014 1.00 0.00 H new ATOM 399 N ASN A 25 22.778 0.876 -3.106 1.00 0.00 N ATOM 400 CA ASN A 25 23.942 0.433 -3.937 1.00 0.00 C ATOM 401 C ASN A 25 23.759 1.062 -5.305 1.00 0.00 C ATOM 402 O ASN A 25 23.364 0.411 -6.249 1.00 0.00 O ATOM 403 CB ASN A 25 24.007 -1.107 -4.069 1.00 0.00 C ATOM 404 CG ASN A 25 22.605 -1.743 -4.044 1.00 0.00 C ATOM 405 OD1 ASN A 25 21.578 -1.087 -4.515 1.00 0.00 O flip ATOM 406 ND2 ASN A 25 22.447 -2.857 -3.587 1.00 0.00 N flip ATOM 0 H ASN A 25 22.205 1.603 -3.534 1.00 0.00 H new ATOM 0 HA ASN A 25 24.875 0.743 -3.466 1.00 0.00 H new ATOM 0 HB2 ASN A 25 24.509 -1.371 -5.000 1.00 0.00 H new ATOM 0 HB3 ASN A 25 24.606 -1.516 -3.256 1.00 0.00 H new ATOM 0 HD21 ASN A 25 23.245 -3.375 -3.218 1.00 0.00 H new ATOM 0 HD22 ASN A 25 21.517 -3.275 -3.573 1.00 0.00 H new ATOM 413 N VAL A 26 23.987 2.352 -5.373 1.00 0.00 N ATOM 414 CA VAL A 26 23.789 3.151 -6.626 1.00 0.00 C ATOM 415 C VAL A 26 22.336 3.630 -6.691 1.00 0.00 C ATOM 416 O VAL A 26 22.009 4.503 -7.475 1.00 0.00 O ATOM 417 CB VAL A 26 24.133 2.371 -7.905 1.00 0.00 C ATOM 418 CG1 VAL A 26 24.070 3.321 -9.099 1.00 0.00 C ATOM 419 CG2 VAL A 26 25.543 1.786 -7.788 1.00 0.00 C ATOM 0 H VAL A 26 24.315 2.904 -4.581 1.00 0.00 H new ATOM 0 HA VAL A 26 24.477 3.995 -6.581 1.00 0.00 H new ATOM 0 HB VAL A 26 23.420 1.558 -8.043 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.313 2.776 -10.011 1.00 0.00 H new ATOM 0 HG12 VAL A 26 23.066 3.736 -9.181 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.787 4.130 -8.958 1.00 0.00 H new ATOM 0 HG21 VAL A 26 25.784 1.234 -8.696 1.00 0.00 H new ATOM 0 HG22 VAL A 26 26.262 2.594 -7.653 1.00 0.00 H new ATOM 0 HG23 VAL A 26 25.588 1.113 -6.931 1.00 0.00 H new ATOM 429 N MET A 27 21.461 3.110 -5.849 1.00 0.00 N ATOM 430 CA MET A 27 20.056 3.585 -5.843 1.00 0.00 C ATOM 431 C MET A 27 20.106 5.045 -5.412 1.00 0.00 C ATOM 432 O MET A 27 19.783 5.940 -6.169 1.00 0.00 O ATOM 433 CB MET A 27 19.235 2.778 -4.827 1.00 0.00 C ATOM 434 CG MET A 27 19.461 1.266 -5.018 1.00 0.00 C ATOM 435 SD MET A 27 18.038 0.529 -5.865 1.00 0.00 S ATOM 436 CE MET A 27 18.970 -0.595 -6.934 1.00 0.00 C ATOM 0 H MET A 27 21.673 2.378 -5.171 1.00 0.00 H new ATOM 0 HA MET A 27 19.592 3.468 -6.822 1.00 0.00 H new ATOM 0 HB2 MET A 27 19.516 3.067 -3.814 1.00 0.00 H new ATOM 0 HB3 MET A 27 18.176 3.009 -4.943 1.00 0.00 H new ATOM 0 HG2 MET A 27 20.368 1.096 -5.598 1.00 0.00 H new ATOM 0 HG3 MET A 27 19.607 0.787 -4.050 1.00 0.00 H new ATOM 0 HE1 MET A 27 18.278 -1.162 -7.557 1.00 0.00 H new ATOM 0 HE2 MET A 27 19.642 -0.019 -7.570 1.00 0.00 H new ATOM 0 HE3 MET A 27 19.552 -1.282 -6.320 1.00 0.00 H new ATOM 446 N LEU A 28 20.570 5.288 -4.204 1.00 0.00 N ATOM 447 CA LEU A 28 20.710 6.691 -3.709 1.00 0.00 C ATOM 448 C LEU A 28 19.401 7.452 -3.937 1.00 0.00 C ATOM 449 O LEU A 28 19.344 8.404 -4.692 1.00 0.00 O ATOM 450 CB LEU A 28 21.865 7.337 -4.483 1.00 0.00 C ATOM 451 CG LEU A 28 23.082 7.546 -3.568 1.00 0.00 C ATOM 452 CD1 LEU A 28 22.706 8.448 -2.391 1.00 0.00 C ATOM 453 CD2 LEU A 28 23.567 6.192 -3.037 1.00 0.00 C ATOM 0 H LEU A 28 20.858 4.568 -3.541 1.00 0.00 H new ATOM 0 HA LEU A 28 20.922 6.713 -2.640 1.00 0.00 H new ATOM 0 HB2 LEU A 28 22.142 6.705 -5.327 1.00 0.00 H new ATOM 0 HB3 LEU A 28 21.544 8.294 -4.894 1.00 0.00 H new ATOM 0 HG LEU A 28 23.878 8.020 -4.142 1.00 0.00 H new ATOM 0 HD11 LEU A 28 23.575 8.590 -1.749 1.00 0.00 H new ATOM 0 HD12 LEU A 28 22.371 9.415 -2.766 1.00 0.00 H new ATOM 0 HD13 LEU A 28 21.904 7.983 -1.818 1.00 0.00 H new ATOM 0 HD21 LEU A 28 24.430 6.343 -2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 28 22.767 5.715 -2.471 1.00 0.00 H new ATOM 0 HD23 LEU A 28 23.850 5.553 -3.874 1.00 0.00 H new ATOM 465 N ARG A 29 18.334 7.001 -3.319 1.00 0.00 N ATOM 466 CA ARG A 29 17.006 7.654 -3.533 1.00 0.00 C ATOM 467 C ARG A 29 16.668 7.570 -5.030 1.00 0.00 C ATOM 468 O ARG A 29 15.968 8.407 -5.563 1.00 0.00 O ATOM 469 CB ARG A 29 17.069 9.125 -3.100 1.00 0.00 C ATOM 470 CG ARG A 29 17.687 9.233 -1.697 1.00 0.00 C ATOM 471 CD ARG A 29 19.107 9.801 -1.795 1.00 0.00 C ATOM 472 NE ARG A 29 19.091 11.242 -1.415 1.00 0.00 N ATOM 473 CZ ARG A 29 20.202 11.927 -1.405 1.00 0.00 C ATOM 474 NH1 ARG A 29 20.618 12.512 -2.494 1.00 0.00 N ATOM 475 NH2 ARG A 29 20.897 12.026 -0.304 1.00 0.00 N ATOM 0 H ARG A 29 18.327 6.209 -2.676 1.00 0.00 H new ATOM 0 HA ARG A 29 16.241 7.150 -2.941 1.00 0.00 H new ATOM 0 HB2 ARG A 29 17.662 9.698 -3.813 1.00 0.00 H new ATOM 0 HB3 ARG A 29 16.068 9.556 -3.100 1.00 0.00 H new ATOM 0 HG2 ARG A 29 17.072 9.876 -1.067 1.00 0.00 H new ATOM 0 HG3 ARG A 29 17.710 8.251 -1.224 1.00 0.00 H new ATOM 0 HD2 ARG A 29 19.778 9.248 -1.138 1.00 0.00 H new ATOM 0 HD3 ARG A 29 19.488 9.685 -2.810 1.00 0.00 H new ATOM 0 HE ARG A 29 18.212 11.693 -1.163 1.00 0.00 H new ATOM 0 HH11 ARG A 29 20.075 12.434 -3.354 1.00 0.00 H new ATOM 0 HH12 ARG A 29 21.486 13.047 -2.486 1.00 0.00 H new ATOM 0 HH21 ARG A 29 20.572 11.568 0.547 1.00 0.00 H new ATOM 0 HH22 ARG A 29 21.765 12.561 -0.295 1.00 0.00 H new ATOM 489 N LYS A 30 17.206 6.561 -5.703 1.00 0.00 N ATOM 490 CA LYS A 30 16.995 6.354 -7.179 1.00 0.00 C ATOM 491 C LYS A 30 16.985 7.689 -7.943 1.00 0.00 C ATOM 492 O LYS A 30 16.350 7.817 -8.965 1.00 0.00 O ATOM 493 CB LYS A 30 15.693 5.582 -7.413 1.00 0.00 C ATOM 494 CG LYS A 30 16.015 4.152 -7.863 1.00 0.00 C ATOM 495 CD LYS A 30 14.789 3.543 -8.548 1.00 0.00 C ATOM 496 CE LYS A 30 14.710 2.049 -8.229 1.00 0.00 C ATOM 497 NZ LYS A 30 13.569 1.443 -8.972 1.00 0.00 N ATOM 0 H LYS A 30 17.800 5.854 -5.270 1.00 0.00 H new ATOM 0 HA LYS A 30 17.830 5.769 -7.565 1.00 0.00 H new ATOM 0 HB2 LYS A 30 15.102 5.561 -6.498 1.00 0.00 H new ATOM 0 HB3 LYS A 30 15.091 6.085 -8.170 1.00 0.00 H new ATOM 0 HG2 LYS A 30 16.862 4.157 -8.549 1.00 0.00 H new ATOM 0 HG3 LYS A 30 16.304 3.546 -7.004 1.00 0.00 H new ATOM 0 HD2 LYS A 30 13.883 4.046 -8.208 1.00 0.00 H new ATOM 0 HD3 LYS A 30 14.851 3.692 -9.626 1.00 0.00 H new ATOM 0 HE2 LYS A 30 15.642 1.557 -8.507 1.00 0.00 H new ATOM 0 HE3 LYS A 30 14.579 1.901 -7.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 13.514 0.427 -8.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 12.683 1.906 -8.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 13.712 1.572 -9.994 1.00 0.00 H new ATOM 511 N ILE A 31 17.729 8.653 -7.447 1.00 0.00 N ATOM 512 CA ILE A 31 17.866 10.004 -8.087 1.00 0.00 C ATOM 513 C ILE A 31 16.558 10.527 -8.730 1.00 0.00 C ATOM 514 O ILE A 31 15.867 11.332 -8.139 1.00 0.00 O ATOM 515 CB ILE A 31 18.995 9.939 -9.115 1.00 0.00 C ATOM 516 CG1 ILE A 31 20.252 9.324 -8.458 1.00 0.00 C ATOM 517 CG2 ILE A 31 19.313 11.352 -9.601 1.00 0.00 C ATOM 518 CD1 ILE A 31 20.468 7.903 -8.986 1.00 0.00 C ATOM 0 H ILE A 31 18.269 8.552 -6.588 1.00 0.00 H new ATOM 0 HA ILE A 31 18.100 10.722 -7.301 1.00 0.00 H new ATOM 0 HB ILE A 31 18.689 9.322 -9.960 1.00 0.00 H new ATOM 0 HG12 ILE A 31 21.125 9.939 -8.675 1.00 0.00 H new ATOM 0 HG13 ILE A 31 20.136 9.306 -7.374 1.00 0.00 H new ATOM 0 HG21 ILE A 31 20.118 11.312 -10.335 1.00 0.00 H new ATOM 0 HG22 ILE A 31 18.425 11.787 -10.060 1.00 0.00 H new ATOM 0 HG23 ILE A 31 19.623 11.966 -8.756 1.00 0.00 H new ATOM 0 HD11 ILE A 31 21.355 7.473 -8.521 1.00 0.00 H new ATOM 0 HD12 ILE A 31 19.599 7.290 -8.747 1.00 0.00 H new ATOM 0 HD13 ILE A 31 20.604 7.933 -10.067 1.00 0.00 H new ATOM 530 N ALA A 32 16.233 10.107 -9.937 1.00 0.00 N ATOM 531 CA ALA A 32 14.991 10.597 -10.640 1.00 0.00 C ATOM 532 C ALA A 32 13.778 10.675 -9.695 1.00 0.00 C ATOM 533 O ALA A 32 12.919 11.523 -9.853 1.00 0.00 O ATOM 534 CB ALA A 32 14.664 9.643 -11.791 1.00 0.00 C ATOM 0 H ALA A 32 16.783 9.436 -10.473 1.00 0.00 H new ATOM 0 HA ALA A 32 15.191 11.604 -11.007 1.00 0.00 H new ATOM 0 HB1 ALA A 32 13.767 9.988 -12.306 1.00 0.00 H new ATOM 0 HB2 ALA A 32 15.499 9.619 -12.492 1.00 0.00 H new ATOM 0 HB3 ALA A 32 14.493 8.642 -11.396 1.00 0.00 H new ATOM 540 N VAL A 33 13.708 9.811 -8.716 1.00 0.00 N ATOM 541 CA VAL A 33 12.555 9.847 -7.755 1.00 0.00 C ATOM 542 C VAL A 33 13.067 10.334 -6.399 1.00 0.00 C ATOM 543 O VAL A 33 14.228 10.174 -6.073 1.00 0.00 O ATOM 544 CB VAL A 33 11.892 8.452 -7.592 1.00 0.00 C ATOM 545 CG1 VAL A 33 10.570 8.409 -8.356 1.00 0.00 C ATOM 546 CG2 VAL A 33 12.802 7.328 -8.115 1.00 0.00 C ATOM 0 H VAL A 33 14.397 9.081 -8.537 1.00 0.00 H new ATOM 0 HA VAL A 33 11.797 10.524 -8.149 1.00 0.00 H new ATOM 0 HB VAL A 33 11.719 8.295 -6.527 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.112 7.427 -8.236 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.898 9.173 -7.964 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.755 8.596 -9.414 1.00 0.00 H new ATOM 0 HG21 VAL A 33 12.305 6.367 -7.984 1.00 0.00 H new ATOM 0 HG22 VAL A 33 13.008 7.489 -9.173 1.00 0.00 H new ATOM 0 HG23 VAL A 33 13.739 7.330 -7.559 1.00 0.00 H new ATOM 556 N ALA A 34 12.210 10.937 -5.613 1.00 0.00 N ATOM 557 CA ALA A 34 12.637 11.450 -4.276 1.00 0.00 C ATOM 558 C ALA A 34 11.439 12.087 -3.571 1.00 0.00 C ATOM 559 O ALA A 34 10.909 11.545 -2.618 1.00 0.00 O ATOM 560 CB ALA A 34 13.737 12.500 -4.455 1.00 0.00 C ATOM 0 H ALA A 34 11.229 11.096 -5.842 1.00 0.00 H new ATOM 0 HA ALA A 34 13.019 10.624 -3.677 1.00 0.00 H new ATOM 0 HB1 ALA A 34 14.047 12.873 -3.479 1.00 0.00 H new ATOM 0 HB2 ALA A 34 14.592 12.049 -4.959 1.00 0.00 H new ATOM 0 HB3 ALA A 34 13.357 13.327 -5.055 1.00 0.00 H new ATOM 566 N ALA A 35 11.010 13.233 -4.034 1.00 0.00 N ATOM 567 CA ALA A 35 9.846 13.916 -3.398 1.00 0.00 C ATOM 568 C ALA A 35 9.397 15.085 -4.281 1.00 0.00 C ATOM 569 O ALA A 35 9.609 16.240 -3.959 1.00 0.00 O ATOM 570 CB ALA A 35 10.254 14.437 -2.017 1.00 0.00 C ATOM 0 H ALA A 35 11.418 13.726 -4.828 1.00 0.00 H new ATOM 0 HA ALA A 35 9.022 13.211 -3.288 1.00 0.00 H new ATOM 0 HB1 ALA A 35 9.405 14.936 -1.551 1.00 0.00 H new ATOM 0 HB2 ALA A 35 10.572 13.602 -1.392 1.00 0.00 H new ATOM 0 HB3 ALA A 35 11.077 15.144 -2.123 1.00 0.00 H new ATOM 576 N ALA A 36 8.776 14.789 -5.396 1.00 0.00 N ATOM 577 CA ALA A 36 8.308 15.873 -6.310 1.00 0.00 C ATOM 578 C ALA A 36 7.146 15.355 -7.161 1.00 0.00 C ATOM 579 O ALA A 36 6.952 15.782 -8.284 1.00 0.00 O ATOM 580 CB ALA A 36 9.458 16.303 -7.222 1.00 0.00 C ATOM 0 H ALA A 36 8.573 13.841 -5.712 1.00 0.00 H new ATOM 0 HA ALA A 36 7.974 16.727 -5.721 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.117 17.094 -7.889 1.00 0.00 H new ATOM 0 HB2 ALA A 36 10.285 16.672 -6.615 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.793 15.450 -7.812 1.00 0.00 H new ATOM 586 N SER A 37 6.375 14.439 -6.633 1.00 0.00 N ATOM 587 CA SER A 37 5.222 13.887 -7.402 1.00 0.00 C ATOM 588 C SER A 37 3.944 14.026 -6.572 1.00 0.00 C ATOM 589 O SER A 37 3.947 14.623 -5.511 1.00 0.00 O ATOM 590 CB SER A 37 5.474 12.410 -7.708 1.00 0.00 C ATOM 591 OG SER A 37 6.203 11.828 -6.635 1.00 0.00 O ATOM 0 H SER A 37 6.496 14.049 -5.698 1.00 0.00 H new ATOM 0 HA SER A 37 5.110 14.437 -8.336 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.527 11.888 -7.845 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.032 12.309 -8.639 1.00 0.00 H new ATOM 0 HG SER A 37 6.365 10.881 -6.826 1.00 0.00 H new ATOM 597 N LYS A 38 2.853 13.481 -7.047 1.00 0.00 N ATOM 598 CA LYS A 38 1.569 13.578 -6.290 1.00 0.00 C ATOM 599 C LYS A 38 0.698 12.343 -6.590 1.00 0.00 C ATOM 600 O LYS A 38 -0.169 12.404 -7.439 1.00 0.00 O ATOM 601 CB LYS A 38 0.820 14.850 -6.706 1.00 0.00 C ATOM 602 CG LYS A 38 0.725 14.925 -8.236 1.00 0.00 C ATOM 603 CD LYS A 38 1.778 15.899 -8.771 1.00 0.00 C ATOM 604 CE LYS A 38 1.603 16.060 -10.282 1.00 0.00 C ATOM 605 NZ LYS A 38 2.592 17.050 -10.795 1.00 0.00 N ATOM 0 H LYS A 38 2.796 12.972 -7.929 1.00 0.00 H new ATOM 0 HA LYS A 38 1.782 13.619 -5.222 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.179 14.853 -6.271 1.00 0.00 H new ATOM 0 HB3 LYS A 38 1.337 15.729 -6.322 1.00 0.00 H new ATOM 0 HG2 LYS A 38 0.877 13.936 -8.668 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -0.271 15.253 -8.533 1.00 0.00 H new ATOM 0 HD2 LYS A 38 1.679 16.866 -8.278 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.778 15.529 -8.547 1.00 0.00 H new ATOM 0 HE2 LYS A 38 1.742 15.100 -10.779 1.00 0.00 H new ATOM 0 HE3 LYS A 38 0.590 16.392 -10.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.473 17.159 -11.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.439 17.967 -10.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.556 16.715 -10.592 1.00 0.00 H new ATOM 619 N PRO A 39 0.945 11.249 -5.888 1.00 0.00 N ATOM 620 CA PRO A 39 0.175 10.008 -6.087 1.00 0.00 C ATOM 621 C PRO A 39 -1.189 10.110 -5.397 1.00 0.00 C ATOM 622 O PRO A 39 -1.276 10.395 -4.217 1.00 0.00 O ATOM 623 CB PRO A 39 1.041 8.932 -5.426 1.00 0.00 C ATOM 624 CG PRO A 39 1.948 9.663 -4.410 1.00 0.00 C ATOM 625 CD PRO A 39 1.996 11.139 -4.844 1.00 0.00 C ATOM 0 HA PRO A 39 -0.029 9.796 -7.136 1.00 0.00 H new ATOM 0 HB2 PRO A 39 0.421 8.187 -4.927 1.00 0.00 H new ATOM 0 HB3 PRO A 39 1.638 8.404 -6.169 1.00 0.00 H new ATOM 0 HG2 PRO A 39 1.551 9.569 -3.399 1.00 0.00 H new ATOM 0 HG3 PRO A 39 2.948 9.229 -4.401 1.00 0.00 H new ATOM 0 HD2 PRO A 39 1.796 11.807 -4.006 1.00 0.00 H new ATOM 0 HD3 PRO A 39 2.977 11.406 -5.237 1.00 0.00 H new ATOM 633 N ALA A 40 -2.250 9.878 -6.127 1.00 0.00 N ATOM 634 CA ALA A 40 -3.613 9.959 -5.524 1.00 0.00 C ATOM 635 C ALA A 40 -4.244 8.566 -5.502 1.00 0.00 C ATOM 636 O ALA A 40 -3.782 7.656 -6.165 1.00 0.00 O ATOM 637 CB ALA A 40 -4.484 10.901 -6.358 1.00 0.00 C ATOM 0 H ALA A 40 -2.230 9.635 -7.118 1.00 0.00 H new ATOM 0 HA ALA A 40 -3.538 10.340 -4.505 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.480 10.961 -5.918 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -4.034 11.894 -6.374 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.559 10.520 -7.377 1.00 0.00 H new ATOM 643 N VAL A 41 -5.297 8.395 -4.744 1.00 0.00 N ATOM 644 CA VAL A 41 -5.967 7.064 -4.671 1.00 0.00 C ATOM 645 C VAL A 41 -7.480 7.265 -4.561 1.00 0.00 C ATOM 646 O VAL A 41 -7.953 8.370 -4.382 1.00 0.00 O ATOM 647 CB VAL A 41 -5.421 6.284 -3.449 1.00 0.00 C ATOM 648 CG1 VAL A 41 -6.109 6.721 -2.148 1.00 0.00 C ATOM 649 CG2 VAL A 41 -5.631 4.777 -3.656 1.00 0.00 C ATOM 0 H VAL A 41 -5.722 9.124 -4.171 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.759 6.487 -5.572 1.00 0.00 H new ATOM 0 HB VAL A 41 -4.357 6.503 -3.362 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.701 6.153 -1.312 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -5.935 7.784 -1.984 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.181 6.536 -2.223 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.245 4.234 -2.793 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -6.695 4.570 -3.769 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -5.102 4.456 -4.553 1.00 0.00 H new ATOM 659 N GLU A 42 -8.228 6.201 -4.631 1.00 0.00 N ATOM 660 CA GLU A 42 -9.701 6.316 -4.493 1.00 0.00 C ATOM 661 C GLU A 42 -10.251 5.004 -3.949 1.00 0.00 C ATOM 662 O GLU A 42 -10.234 3.986 -4.615 1.00 0.00 O ATOM 663 CB GLU A 42 -10.338 6.638 -5.843 1.00 0.00 C ATOM 664 CG GLU A 42 -9.924 5.587 -6.870 1.00 0.00 C ATOM 665 CD GLU A 42 -10.075 6.167 -8.278 1.00 0.00 C ATOM 666 OE1 GLU A 42 -9.274 7.014 -8.637 1.00 0.00 O ATOM 667 OE2 GLU A 42 -10.988 5.753 -8.973 1.00 0.00 O ATOM 0 H GLU A 42 -7.879 5.254 -4.778 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.939 7.126 -3.804 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.424 6.660 -5.748 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -10.027 7.628 -6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.892 5.282 -6.699 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.542 4.695 -6.764 1.00 0.00 H new ATOM 674 N ILE A 43 -10.726 5.025 -2.734 1.00 0.00 N ATOM 675 CA ILE A 43 -11.269 3.787 -2.119 1.00 0.00 C ATOM 676 C ILE A 43 -12.769 3.706 -2.373 1.00 0.00 C ATOM 677 O ILE A 43 -13.457 4.704 -2.474 1.00 0.00 O ATOM 678 CB ILE A 43 -10.992 3.794 -0.613 1.00 0.00 C ATOM 679 CG1 ILE A 43 -9.477 3.884 -0.368 1.00 0.00 C ATOM 680 CG2 ILE A 43 -11.545 2.515 0.033 1.00 0.00 C ATOM 681 CD1 ILE A 43 -8.768 2.665 -0.966 1.00 0.00 C ATOM 0 H ILE A 43 -10.760 5.853 -2.139 1.00 0.00 H new ATOM 0 HA ILE A 43 -10.784 2.918 -2.565 1.00 0.00 H new ATOM 0 HB ILE A 43 -11.485 4.657 -0.166 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -9.083 4.797 -0.814 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -9.278 3.940 0.702 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -11.342 2.531 1.104 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -12.621 2.460 -0.132 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -11.065 1.645 -0.414 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -7.696 2.742 -0.785 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.150 1.757 -0.500 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -8.953 2.627 -2.040 1.00 0.00 H new ATOM 693 N LYS A 44 -13.263 2.512 -2.474 1.00 0.00 N ATOM 694 CA LYS A 44 -14.710 2.294 -2.726 1.00 0.00 C ATOM 695 C LYS A 44 -15.094 1.009 -1.997 1.00 0.00 C ATOM 696 O LYS A 44 -14.592 -0.048 -2.314 1.00 0.00 O ATOM 697 CB LYS A 44 -14.917 2.144 -4.238 1.00 0.00 C ATOM 698 CG LYS A 44 -14.284 3.339 -4.962 1.00 0.00 C ATOM 699 CD LYS A 44 -14.890 3.489 -6.357 1.00 0.00 C ATOM 700 CE LYS A 44 -14.606 2.242 -7.200 1.00 0.00 C ATOM 701 NZ LYS A 44 -15.829 1.878 -7.971 1.00 0.00 N ATOM 0 H LYS A 44 -12.714 1.657 -2.391 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.324 3.122 -2.372 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.468 1.214 -4.587 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -15.981 2.089 -4.466 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.446 4.250 -4.387 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.206 3.198 -5.039 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -15.966 3.645 -6.278 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.475 4.370 -6.848 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.776 2.431 -7.881 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.308 1.414 -6.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.639 1.031 -8.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.609 1.682 -7.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.093 2.667 -8.595 1.00 0.00 H new ATOM 715 N GLN A 45 -15.925 1.081 -0.987 1.00 0.00 N ATOM 716 CA GLN A 45 -16.238 -0.167 -0.233 1.00 0.00 C ATOM 717 C GLN A 45 -17.684 -0.214 0.267 1.00 0.00 C ATOM 718 O GLN A 45 -18.299 0.791 0.561 1.00 0.00 O ATOM 719 CB GLN A 45 -15.289 -0.239 0.964 1.00 0.00 C ATOM 720 CG GLN A 45 -15.476 0.996 1.848 1.00 0.00 C ATOM 721 CD GLN A 45 -16.438 0.665 2.997 1.00 0.00 C ATOM 722 OE1 GLN A 45 -17.149 -0.320 2.949 1.00 0.00 O ATOM 723 NE2 GLN A 45 -16.491 1.449 4.039 1.00 0.00 N ATOM 0 H GLN A 45 -16.389 1.928 -0.659 1.00 0.00 H new ATOM 0 HA GLN A 45 -16.111 -1.014 -0.907 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.484 -1.143 1.541 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.257 -0.298 0.619 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -14.514 1.319 2.247 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -15.870 1.823 1.257 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -15.897 2.277 4.085 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -17.126 1.234 4.807 1.00 0.00 H new ATOM 732 N GLU A 46 -18.199 -1.408 0.390 1.00 0.00 N ATOM 733 CA GLU A 46 -19.578 -1.610 0.900 1.00 0.00 C ATOM 734 C GLU A 46 -19.518 -2.660 2.015 1.00 0.00 C ATOM 735 O GLU A 46 -19.679 -3.843 1.775 1.00 0.00 O ATOM 736 CB GLU A 46 -20.471 -2.116 -0.233 1.00 0.00 C ATOM 737 CG GLU A 46 -21.933 -1.843 0.114 1.00 0.00 C ATOM 738 CD GLU A 46 -22.829 -2.315 -1.033 1.00 0.00 C ATOM 739 OE1 GLU A 46 -22.939 -1.590 -2.008 1.00 0.00 O ATOM 740 OE2 GLU A 46 -23.389 -3.392 -0.916 1.00 0.00 O ATOM 0 H GLU A 46 -17.707 -2.269 0.152 1.00 0.00 H new ATOM 0 HA GLU A 46 -19.987 -0.674 1.280 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -20.209 -1.620 -1.167 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -20.315 -3.184 -0.385 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -22.201 -2.360 1.035 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -22.083 -0.778 0.291 1.00 0.00 H new ATOM 747 N GLY A 47 -19.261 -2.238 3.229 1.00 0.00 N ATOM 748 CA GLY A 47 -19.164 -3.208 4.362 1.00 0.00 C ATOM 749 C GLY A 47 -17.788 -3.882 4.333 1.00 0.00 C ATOM 750 O GLY A 47 -16.771 -3.221 4.242 1.00 0.00 O ATOM 0 H GLY A 47 -19.114 -1.261 3.484 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -19.309 -2.692 5.311 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -19.951 -3.958 4.283 1.00 0.00 H new ATOM 754 N ASP A 48 -17.749 -5.191 4.409 1.00 0.00 N ATOM 755 CA ASP A 48 -16.442 -5.906 4.385 1.00 0.00 C ATOM 756 C ASP A 48 -15.894 -5.989 2.955 1.00 0.00 C ATOM 757 O ASP A 48 -14.802 -6.481 2.741 1.00 0.00 O ATOM 758 CB ASP A 48 -16.627 -7.312 4.940 1.00 0.00 C ATOM 759 CG ASP A 48 -17.718 -8.040 4.153 1.00 0.00 C ATOM 760 OD1 ASP A 48 -17.390 -8.651 3.150 1.00 0.00 O ATOM 761 OD2 ASP A 48 -18.864 -7.973 4.567 1.00 0.00 O ATOM 0 H ASP A 48 -18.569 -5.792 4.487 1.00 0.00 H new ATOM 0 HA ASP A 48 -15.730 -5.354 4.998 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -15.690 -7.864 4.876 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -16.897 -7.264 5.995 1.00 0.00 H new ATOM 766 N THR A 49 -16.618 -5.496 1.978 1.00 0.00 N ATOM 767 CA THR A 49 -16.108 -5.531 0.581 1.00 0.00 C ATOM 768 C THR A 49 -15.359 -4.223 0.326 1.00 0.00 C ATOM 769 O THR A 49 -15.809 -3.171 0.729 1.00 0.00 O ATOM 770 CB THR A 49 -17.287 -5.646 -0.387 1.00 0.00 C ATOM 771 OG1 THR A 49 -18.058 -6.793 -0.058 1.00 0.00 O ATOM 772 CG2 THR A 49 -16.766 -5.772 -1.816 1.00 0.00 C ATOM 0 H THR A 49 -17.539 -5.072 2.093 1.00 0.00 H new ATOM 0 HA THR A 49 -15.446 -6.384 0.433 1.00 0.00 H new ATOM 0 HB THR A 49 -17.910 -4.755 -0.308 1.00 0.00 H new ATOM 0 HG1 THR A 49 -18.815 -6.867 -0.676 1.00 0.00 H new ATOM 0 HG21 THR A 49 -17.607 -5.854 -2.504 1.00 0.00 H new ATOM 0 HG22 THR A 49 -16.176 -4.891 -2.067 1.00 0.00 H new ATOM 0 HG23 THR A 49 -16.142 -6.662 -1.899 1.00 0.00 H new ATOM 780 N PHE A 50 -14.218 -4.268 -0.313 1.00 0.00 N ATOM 781 CA PHE A 50 -13.464 -3.003 -0.559 1.00 0.00 C ATOM 782 C PHE A 50 -12.866 -2.976 -1.968 1.00 0.00 C ATOM 783 O PHE A 50 -12.687 -3.988 -2.617 1.00 0.00 O ATOM 784 CB PHE A 50 -12.329 -2.867 0.462 1.00 0.00 C ATOM 785 CG PHE A 50 -12.906 -2.875 1.853 1.00 0.00 C ATOM 786 CD1 PHE A 50 -13.180 -4.089 2.477 1.00 0.00 C ATOM 787 CD2 PHE A 50 -13.183 -1.670 2.509 1.00 0.00 C ATOM 788 CE1 PHE A 50 -13.736 -4.108 3.755 1.00 0.00 C ATOM 789 CE2 PHE A 50 -13.736 -1.687 3.797 1.00 0.00 C ATOM 790 CZ PHE A 50 -14.015 -2.912 4.417 1.00 0.00 C ATOM 0 H PHE A 50 -13.780 -5.116 -0.672 1.00 0.00 H new ATOM 0 HA PHE A 50 -14.165 -2.174 -0.459 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.620 -3.686 0.346 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -11.779 -1.942 0.290 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -12.961 -5.017 1.970 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -12.971 -0.729 2.024 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -13.952 -5.052 4.234 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -13.946 -0.760 4.309 1.00 0.00 H new ATOM 0 HZ PHE A 50 -14.446 -2.930 5.407 1.00 0.00 H new ATOM 800 N TYR A 51 -12.529 -1.799 -2.408 1.00 0.00 N ATOM 801 CA TYR A 51 -11.900 -1.599 -3.740 1.00 0.00 C ATOM 802 C TYR A 51 -10.796 -0.567 -3.492 1.00 0.00 C ATOM 803 O TYR A 51 -10.955 0.316 -2.667 1.00 0.00 O ATOM 804 CB TYR A 51 -12.984 -1.117 -4.743 1.00 0.00 C ATOM 805 CG TYR A 51 -12.437 -0.212 -5.835 1.00 0.00 C ATOM 806 CD1 TYR A 51 -12.083 1.105 -5.540 1.00 0.00 C ATOM 807 CD2 TYR A 51 -12.328 -0.682 -7.143 1.00 0.00 C ATOM 808 CE1 TYR A 51 -11.622 1.952 -6.539 1.00 0.00 C ATOM 809 CE2 TYR A 51 -11.854 0.168 -8.154 1.00 0.00 C ATOM 810 CZ TYR A 51 -11.502 1.487 -7.851 1.00 0.00 C ATOM 811 OH TYR A 51 -11.051 2.330 -8.846 1.00 0.00 O ATOM 0 H TYR A 51 -12.669 -0.938 -1.880 1.00 0.00 H new ATOM 0 HA TYR A 51 -11.475 -2.502 -4.178 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -13.454 -1.986 -5.203 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -13.763 -0.585 -4.197 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -12.168 1.468 -4.527 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -12.608 -1.698 -7.378 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -11.356 2.971 -6.302 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -11.761 -0.197 -9.166 1.00 0.00 H new ATOM 0 HH TYR A 51 -10.862 3.213 -8.466 1.00 0.00 H new ATOM 821 N ILE A 52 -9.675 -0.683 -4.148 1.00 0.00 N ATOM 822 CA ILE A 52 -8.567 0.287 -3.879 1.00 0.00 C ATOM 823 C ILE A 52 -7.807 0.588 -5.166 1.00 0.00 C ATOM 824 O ILE A 52 -7.058 -0.236 -5.655 1.00 0.00 O ATOM 825 CB ILE A 52 -7.595 -0.310 -2.841 1.00 0.00 C ATOM 826 CG1 ILE A 52 -8.390 -1.055 -1.747 1.00 0.00 C ATOM 827 CG2 ILE A 52 -6.765 0.818 -2.210 1.00 0.00 C ATOM 828 CD1 ILE A 52 -7.444 -1.635 -0.688 1.00 0.00 C ATOM 0 H ILE A 52 -9.476 -1.396 -4.850 1.00 0.00 H new ATOM 0 HA ILE A 52 -8.996 1.211 -3.492 1.00 0.00 H new ATOM 0 HB ILE A 52 -6.927 -1.016 -3.334 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.097 -0.372 -1.275 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.974 -1.857 -2.198 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.078 0.397 -1.476 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.197 1.330 -2.987 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.430 1.528 -1.719 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -8.025 -2.156 0.073 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.755 -2.335 -1.160 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.879 -0.827 -0.223 1.00 0.00 H new ATOM 840 N LYS A 53 -7.991 1.765 -5.717 1.00 0.00 N ATOM 841 CA LYS A 53 -7.275 2.113 -6.979 1.00 0.00 C ATOM 842 C LYS A 53 -6.280 3.252 -6.742 1.00 0.00 C ATOM 843 O LYS A 53 -6.636 4.415 -6.766 1.00 0.00 O ATOM 844 CB LYS A 53 -8.285 2.529 -8.047 1.00 0.00 C ATOM 845 CG LYS A 53 -7.568 2.699 -9.389 1.00 0.00 C ATOM 846 CD LYS A 53 -8.266 3.784 -10.212 1.00 0.00 C ATOM 847 CE LYS A 53 -9.271 3.140 -11.171 1.00 0.00 C ATOM 848 NZ LYS A 53 -9.228 3.846 -12.482 1.00 0.00 N ATOM 0 H LYS A 53 -8.603 2.493 -5.348 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.725 1.235 -7.317 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -9.069 1.777 -8.134 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -8.770 3.462 -7.761 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -6.525 2.969 -9.224 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -7.570 1.756 -9.936 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -8.777 4.483 -9.550 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -7.529 4.358 -10.774 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -9.036 2.084 -11.306 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -10.275 3.191 -10.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -9.910 3.409 -13.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -9.472 4.848 -12.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -8.271 3.775 -12.883 1.00 0.00 H new ATOM 862 N THR A 54 -5.030 2.918 -6.535 1.00 0.00 N ATOM 863 CA THR A 54 -3.989 3.965 -6.314 1.00 0.00 C ATOM 864 C THR A 54 -3.438 4.425 -7.660 1.00 0.00 C ATOM 865 O THR A 54 -2.444 3.911 -8.138 1.00 0.00 O ATOM 866 CB THR A 54 -2.850 3.388 -5.478 1.00 0.00 C ATOM 867 OG1 THR A 54 -3.384 2.678 -4.369 1.00 0.00 O ATOM 868 CG2 THR A 54 -1.956 4.525 -4.983 1.00 0.00 C ATOM 0 H THR A 54 -4.686 1.958 -6.510 1.00 0.00 H new ATOM 0 HA THR A 54 -4.435 4.810 -5.790 1.00 0.00 H new ATOM 0 HB THR A 54 -2.260 2.705 -6.089 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.651 2.307 -3.835 1.00 0.00 H new ATOM 0 HG21 THR A 54 -1.142 4.114 -4.386 1.00 0.00 H new ATOM 0 HG22 THR A 54 -1.544 5.062 -5.837 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.544 5.211 -4.373 1.00 0.00 H new ATOM 876 N SER A 55 -4.075 5.389 -8.273 1.00 0.00 N ATOM 877 CA SER A 55 -3.587 5.883 -9.590 1.00 0.00 C ATOM 878 C SER A 55 -3.500 7.411 -9.573 1.00 0.00 C ATOM 879 O SER A 55 -4.006 8.060 -8.677 1.00 0.00 O ATOM 880 CB SER A 55 -4.551 5.440 -10.691 1.00 0.00 C ATOM 881 OG SER A 55 -5.766 6.169 -10.572 1.00 0.00 O ATOM 0 H SER A 55 -4.911 5.853 -7.917 1.00 0.00 H new ATOM 0 HA SER A 55 -2.597 5.469 -9.783 1.00 0.00 H new ATOM 0 HB2 SER A 55 -4.105 5.611 -11.671 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.746 4.370 -10.611 1.00 0.00 H new ATOM 0 HG SER A 55 -6.250 6.140 -11.424 1.00 0.00 H new ATOM 887 N THR A 56 -2.860 7.985 -10.560 1.00 0.00 N ATOM 888 CA THR A 56 -2.731 9.472 -10.615 1.00 0.00 C ATOM 889 C THR A 56 -3.500 10.011 -11.824 1.00 0.00 C ATOM 890 O THR A 56 -4.025 11.109 -11.793 1.00 0.00 O ATOM 891 CB THR A 56 -1.255 9.853 -10.738 1.00 0.00 C ATOM 892 OG1 THR A 56 -1.145 11.256 -10.935 1.00 0.00 O ATOM 893 CG2 THR A 56 -0.636 9.119 -11.926 1.00 0.00 C ATOM 0 H THR A 56 -2.420 7.485 -11.333 1.00 0.00 H new ATOM 0 HA THR A 56 -3.143 9.904 -9.703 1.00 0.00 H new ATOM 0 HB THR A 56 -0.729 9.572 -9.826 1.00 0.00 H new ATOM 0 HG1 THR A 56 -0.200 11.502 -11.013 1.00 0.00 H new ATOM 0 HG21 THR A 56 0.416 9.391 -12.014 1.00 0.00 H new ATOM 0 HG22 THR A 56 -0.721 8.043 -11.774 1.00 0.00 H new ATOM 0 HG23 THR A 56 -1.160 9.399 -12.840 1.00 0.00 H new ATOM 901 N THR A 57 -3.567 9.250 -12.887 1.00 0.00 N ATOM 902 CA THR A 57 -4.298 9.714 -14.102 1.00 0.00 C ATOM 903 C THR A 57 -4.876 8.509 -14.845 1.00 0.00 C ATOM 904 O THR A 57 -6.079 8.339 -14.927 1.00 0.00 O ATOM 905 CB THR A 57 -3.334 10.466 -15.020 1.00 0.00 C ATOM 906 OG1 THR A 57 -2.302 11.058 -14.241 1.00 0.00 O ATOM 907 CG2 THR A 57 -4.092 11.555 -15.779 1.00 0.00 C ATOM 0 H THR A 57 -3.145 8.325 -12.965 1.00 0.00 H new ATOM 0 HA THR A 57 -5.110 10.378 -13.805 1.00 0.00 H new ATOM 0 HB THR A 57 -2.895 9.769 -15.734 1.00 0.00 H new ATOM 0 HG1 THR A 57 -1.683 11.539 -14.829 1.00 0.00 H new ATOM 0 HG21 THR A 57 -3.403 12.090 -16.433 1.00 0.00 H new ATOM 0 HG22 THR A 57 -4.881 11.099 -16.378 1.00 0.00 H new ATOM 0 HG23 THR A 57 -4.534 12.254 -15.068 1.00 0.00 H new ATOM 915 N VAL A 58 -4.029 7.671 -15.388 1.00 0.00 N ATOM 916 CA VAL A 58 -4.522 6.472 -16.128 1.00 0.00 C ATOM 917 C VAL A 58 -3.471 5.362 -16.063 1.00 0.00 C ATOM 918 O VAL A 58 -2.360 5.574 -15.615 1.00 0.00 O ATOM 919 CB VAL A 58 -4.782 6.843 -17.589 1.00 0.00 C ATOM 920 CG1 VAL A 58 -5.943 7.835 -17.666 1.00 0.00 C ATOM 921 CG2 VAL A 58 -3.526 7.483 -18.180 1.00 0.00 C ATOM 0 H VAL A 58 -3.014 7.767 -15.350 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.448 6.122 -15.672 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.035 5.945 -18.153 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.128 8.099 -18.707 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -6.839 7.380 -17.243 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.691 8.734 -17.103 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -3.708 7.748 -19.221 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.275 8.381 -17.615 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -2.698 6.777 -18.125 1.00 0.00 H new ATOM 931 N ARG A 59 -3.817 4.178 -16.507 1.00 0.00 N ATOM 932 CA ARG A 59 -2.847 3.040 -16.477 1.00 0.00 C ATOM 933 C ARG A 59 -2.413 2.771 -15.034 1.00 0.00 C ATOM 934 O ARG A 59 -1.381 3.239 -14.590 1.00 0.00 O ATOM 935 CB ARG A 59 -1.619 3.388 -17.323 1.00 0.00 C ATOM 936 CG ARG A 59 -1.002 2.103 -17.880 1.00 0.00 C ATOM 937 CD ARG A 59 0.490 2.321 -18.135 1.00 0.00 C ATOM 938 NE ARG A 59 0.671 3.429 -19.114 1.00 0.00 N ATOM 939 CZ ARG A 59 1.613 4.314 -18.931 1.00 0.00 C ATOM 940 NH1 ARG A 59 1.444 5.279 -18.069 1.00 0.00 N ATOM 941 NH2 ARG A 59 2.724 4.234 -19.611 1.00 0.00 N ATOM 0 H ARG A 59 -4.734 3.951 -16.891 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.326 2.149 -16.883 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -1.903 4.051 -18.140 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -0.887 3.923 -16.718 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -1.145 1.283 -17.176 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -1.502 1.819 -18.806 1.00 0.00 H new ATOM 0 HD2 ARG A 59 0.998 2.561 -17.201 1.00 0.00 H new ATOM 0 HD3 ARG A 59 0.942 1.406 -18.518 1.00 0.00 H new ATOM 0 HE ARG A 59 0.059 3.496 -19.927 1.00 0.00 H new ATOM 0 HH11 ARG A 59 0.576 5.342 -17.538 1.00 0.00 H new ATOM 0 HH12 ARG A 59 2.180 5.970 -17.926 1.00 0.00 H new ATOM 0 HH21 ARG A 59 2.856 3.480 -20.285 1.00 0.00 H new ATOM 0 HH22 ARG A 59 3.460 4.925 -19.468 1.00 0.00 H new ATOM 955 N THR A 60 -3.195 2.018 -14.301 1.00 0.00 N ATOM 956 CA THR A 60 -2.838 1.712 -12.885 1.00 0.00 C ATOM 957 C THR A 60 -3.585 0.458 -12.429 1.00 0.00 C ATOM 958 O THR A 60 -4.661 0.158 -12.912 1.00 0.00 O ATOM 959 CB THR A 60 -3.231 2.893 -11.993 1.00 0.00 C ATOM 960 OG1 THR A 60 -2.767 4.100 -12.580 1.00 0.00 O ATOM 961 CG2 THR A 60 -2.606 2.727 -10.604 1.00 0.00 C ATOM 0 H THR A 60 -4.068 1.602 -14.625 1.00 0.00 H new ATOM 0 HA THR A 60 -1.764 1.541 -12.810 1.00 0.00 H new ATOM 0 HB THR A 60 -4.316 2.925 -11.895 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.950 3.922 -13.092 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.889 3.570 -9.974 1.00 0.00 H new ATOM 0 HG22 THR A 60 -2.963 1.801 -10.153 1.00 0.00 H new ATOM 0 HG23 THR A 60 -1.520 2.691 -10.695 1.00 0.00 H new ATOM 969 N THR A 61 -3.021 -0.275 -11.503 1.00 0.00 N ATOM 970 CA THR A 61 -3.692 -1.513 -11.009 1.00 0.00 C ATOM 971 C THR A 61 -4.467 -1.200 -9.727 1.00 0.00 C ATOM 972 O THR A 61 -4.147 -0.270 -9.010 1.00 0.00 O ATOM 973 CB THR A 61 -2.638 -2.583 -10.720 1.00 0.00 C ATOM 974 OG1 THR A 61 -3.264 -3.716 -10.133 1.00 0.00 O ATOM 975 CG2 THR A 61 -1.592 -2.021 -9.759 1.00 0.00 C ATOM 0 H THR A 61 -2.122 -0.068 -11.067 1.00 0.00 H new ATOM 0 HA THR A 61 -4.383 -1.878 -11.769 1.00 0.00 H new ATOM 0 HB THR A 61 -2.153 -2.878 -11.650 1.00 0.00 H new ATOM 0 HG1 THR A 61 -2.590 -4.403 -9.949 1.00 0.00 H new ATOM 0 HG21 THR A 61 -0.841 -2.783 -9.553 1.00 0.00 H new ATOM 0 HG22 THR A 61 -1.113 -1.152 -10.210 1.00 0.00 H new ATOM 0 HG23 THR A 61 -2.075 -1.726 -8.827 1.00 0.00 H new ATOM 983 N GLU A 62 -5.481 -1.973 -9.436 1.00 0.00 N ATOM 984 CA GLU A 62 -6.283 -1.734 -8.202 1.00 0.00 C ATOM 985 C GLU A 62 -6.813 -3.076 -7.682 1.00 0.00 C ATOM 986 O GLU A 62 -7.055 -3.987 -8.452 1.00 0.00 O ATOM 987 CB GLU A 62 -7.444 -0.776 -8.522 1.00 0.00 C ATOM 988 CG GLU A 62 -8.396 -1.386 -9.551 1.00 0.00 C ATOM 989 CD GLU A 62 -7.779 -1.299 -10.949 1.00 0.00 C ATOM 990 OE1 GLU A 62 -7.078 -0.334 -11.207 1.00 0.00 O ATOM 991 OE2 GLU A 62 -8.017 -2.199 -11.738 1.00 0.00 O ATOM 0 H GLU A 62 -5.788 -2.763 -10.004 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.661 -1.278 -7.432 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.991 -0.546 -7.608 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.048 0.166 -8.902 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.600 -2.427 -9.298 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.351 -0.860 -9.532 1.00 0.00 H new ATOM 998 N ILE A 63 -6.987 -3.211 -6.387 1.00 0.00 N ATOM 999 CA ILE A 63 -7.494 -4.510 -5.841 1.00 0.00 C ATOM 1000 C ILE A 63 -8.987 -4.426 -5.556 1.00 0.00 C ATOM 1001 O ILE A 63 -9.417 -3.829 -4.586 1.00 0.00 O ATOM 1002 CB ILE A 63 -6.748 -4.929 -4.558 1.00 0.00 C ATOM 1003 CG1 ILE A 63 -6.452 -3.717 -3.660 1.00 0.00 C ATOM 1004 CG2 ILE A 63 -5.441 -5.615 -4.949 1.00 0.00 C ATOM 1005 CD1 ILE A 63 -5.720 -4.174 -2.393 1.00 0.00 C ATOM 0 H ILE A 63 -6.802 -2.487 -5.693 1.00 0.00 H new ATOM 0 HA ILE A 63 -7.310 -5.267 -6.603 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.381 -5.614 -3.993 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.843 -2.992 -4.201 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -7.382 -3.216 -3.392 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -4.905 -5.916 -4.049 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -5.659 -6.496 -5.553 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -4.825 -4.924 -5.524 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.513 -3.310 -1.761 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -6.344 -4.882 -1.848 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -4.782 -4.655 -2.669 1.00 0.00 H new ATOM 1017 N ASN A 64 -9.776 -5.061 -6.383 1.00 0.00 N ATOM 1018 CA ASN A 64 -11.243 -5.080 -6.159 1.00 0.00 C ATOM 1019 C ASN A 64 -11.532 -6.374 -5.427 1.00 0.00 C ATOM 1020 O ASN A 64 -11.855 -7.387 -6.019 1.00 0.00 O ATOM 1021 CB ASN A 64 -12.004 -5.054 -7.492 1.00 0.00 C ATOM 1022 CG ASN A 64 -11.389 -4.021 -8.444 1.00 0.00 C ATOM 1023 OD1 ASN A 64 -10.807 -2.958 -7.959 1.00 0.00 O flip ATOM 1024 ND2 ASN A 64 -11.440 -4.186 -9.646 1.00 0.00 N flip ATOM 0 H ASN A 64 -9.460 -5.570 -7.209 1.00 0.00 H new ATOM 0 HA ASN A 64 -11.563 -4.206 -5.591 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -11.977 -6.042 -7.952 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -13.052 -4.814 -7.314 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -11.894 -5.016 -10.028 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -11.029 -3.495 -10.274 1.00 0.00 H new ATOM 1031 N PHE A 65 -11.348 -6.351 -4.146 1.00 0.00 N ATOM 1032 CA PHE A 65 -11.527 -7.578 -3.334 1.00 0.00 C ATOM 1033 C PHE A 65 -12.561 -7.341 -2.226 1.00 0.00 C ATOM 1034 O PHE A 65 -13.331 -6.407 -2.260 1.00 0.00 O ATOM 1035 CB PHE A 65 -10.151 -7.910 -2.707 1.00 0.00 C ATOM 1036 CG PHE A 65 -9.804 -6.868 -1.647 1.00 0.00 C ATOM 1037 CD1 PHE A 65 -9.286 -5.624 -2.031 1.00 0.00 C ATOM 1038 CD2 PHE A 65 -10.051 -7.128 -0.288 1.00 0.00 C ATOM 1039 CE1 PHE A 65 -9.012 -4.652 -1.072 1.00 0.00 C ATOM 1040 CE2 PHE A 65 -9.782 -6.148 0.671 1.00 0.00 C ATOM 1041 CZ PHE A 65 -9.263 -4.909 0.280 1.00 0.00 C ATOM 0 H PHE A 65 -11.077 -5.522 -3.617 1.00 0.00 H new ATOM 0 HA PHE A 65 -11.886 -8.400 -3.954 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -10.175 -8.904 -2.260 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -9.383 -7.926 -3.480 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.099 -5.418 -3.074 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -10.449 -8.085 0.015 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.605 -3.698 -1.373 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.975 -6.347 1.715 1.00 0.00 H new ATOM 0 HZ PHE A 65 -9.056 -4.151 1.021 1.00 0.00 H new ATOM 1051 N LYS A 66 -12.521 -8.177 -1.231 1.00 0.00 N ATOM 1052 CA LYS A 66 -13.404 -8.051 -0.055 1.00 0.00 C ATOM 1053 C LYS A 66 -12.608 -8.641 1.098 1.00 0.00 C ATOM 1054 O LYS A 66 -12.161 -9.769 1.022 1.00 0.00 O ATOM 1055 CB LYS A 66 -14.704 -8.826 -0.266 1.00 0.00 C ATOM 1056 CG LYS A 66 -14.393 -10.248 -0.733 1.00 0.00 C ATOM 1057 CD LYS A 66 -15.653 -10.879 -1.330 1.00 0.00 C ATOM 1058 CE LYS A 66 -15.266 -11.785 -2.501 1.00 0.00 C ATOM 1059 NZ LYS A 66 -16.385 -12.724 -2.794 1.00 0.00 N ATOM 0 H LYS A 66 -11.884 -8.973 -1.189 1.00 0.00 H new ATOM 0 HA LYS A 66 -13.690 -7.016 0.131 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -15.275 -8.856 0.662 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -15.324 -8.319 -1.005 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -13.595 -10.231 -1.476 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -14.036 -10.847 0.105 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -16.179 -11.455 -0.569 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -16.336 -10.101 -1.669 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -15.042 -11.183 -3.382 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -14.362 -12.344 -2.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -16.122 -13.340 -3.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -16.578 -13.307 -1.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -17.237 -12.182 -3.043 1.00 0.00 H new ATOM 1073 N VAL A 67 -12.367 -7.871 2.131 1.00 0.00 N ATOM 1074 CA VAL A 67 -11.529 -8.354 3.277 1.00 0.00 C ATOM 1075 C VAL A 67 -11.895 -9.796 3.665 1.00 0.00 C ATOM 1076 O VAL A 67 -13.034 -10.213 3.568 1.00 0.00 O ATOM 1077 CB VAL A 67 -11.696 -7.411 4.467 1.00 0.00 C ATOM 1078 CG1 VAL A 67 -10.840 -7.908 5.635 1.00 0.00 C ATOM 1079 CG2 VAL A 67 -11.219 -6.012 4.074 1.00 0.00 C ATOM 0 H VAL A 67 -12.718 -6.919 2.231 1.00 0.00 H new ATOM 0 HA VAL A 67 -10.484 -8.356 2.969 1.00 0.00 H new ATOM 0 HB VAL A 67 -12.746 -7.382 4.759 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.958 -7.236 6.485 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.159 -8.911 5.919 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.793 -7.932 5.334 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -11.337 -5.336 4.921 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -10.169 -6.053 3.786 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -11.811 -5.648 3.234 1.00 0.00 H new ATOM 1089 N GLY A 68 -10.910 -10.558 4.046 1.00 0.00 N ATOM 1090 CA GLY A 68 -11.141 -11.989 4.383 1.00 0.00 C ATOM 1091 C GLY A 68 -10.810 -12.842 3.145 1.00 0.00 C ATOM 1092 O GLY A 68 -11.183 -13.996 3.061 1.00 0.00 O ATOM 0 H GLY A 68 -9.943 -10.247 4.139 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -10.516 -12.285 5.225 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -12.177 -12.145 4.684 1.00 0.00 H new ATOM 1096 N GLU A 69 -10.111 -12.274 2.179 1.00 0.00 N ATOM 1097 CA GLU A 69 -9.755 -13.031 0.950 1.00 0.00 C ATOM 1098 C GLU A 69 -8.349 -12.626 0.495 1.00 0.00 C ATOM 1099 O GLU A 69 -7.777 -11.668 0.989 1.00 0.00 O ATOM 1100 CB GLU A 69 -10.761 -12.705 -0.158 1.00 0.00 C ATOM 1101 CG GLU A 69 -11.988 -13.611 -0.022 1.00 0.00 C ATOM 1102 CD GLU A 69 -11.858 -14.799 -0.977 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -11.130 -15.722 -0.648 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -12.487 -14.766 -2.022 1.00 0.00 O ATOM 0 H GLU A 69 -9.775 -11.311 2.201 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.778 -14.100 1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.060 -11.659 -0.095 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -10.299 -12.846 -1.135 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.079 -13.965 1.005 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.894 -13.049 -0.246 1.00 0.00 H new ATOM 1111 N GLU A 70 -7.785 -13.358 -0.431 1.00 0.00 N ATOM 1112 CA GLU A 70 -6.407 -13.039 -0.916 1.00 0.00 C ATOM 1113 C GLU A 70 -6.413 -12.649 -2.389 1.00 0.00 C ATOM 1114 O GLU A 70 -7.353 -12.901 -3.117 1.00 0.00 O ATOM 1115 CB GLU A 70 -5.508 -14.272 -0.786 1.00 0.00 C ATOM 1116 CG GLU A 70 -6.229 -15.509 -1.329 1.00 0.00 C ATOM 1117 CD GLU A 70 -6.871 -16.279 -0.173 1.00 0.00 C ATOM 1118 OE1 GLU A 70 -6.137 -16.888 0.588 1.00 0.00 O ATOM 1119 OE2 GLU A 70 -8.086 -16.247 -0.068 1.00 0.00 O ATOM 0 H GLU A 70 -8.221 -14.167 -0.874 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.039 -12.211 -0.310 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.579 -14.114 -1.334 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.240 -14.427 0.259 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -6.992 -15.211 -2.048 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -5.524 -16.150 -1.859 1.00 0.00 H new ATOM 1126 N PHE A 71 -5.317 -12.095 -2.835 1.00 0.00 N ATOM 1127 CA PHE A 71 -5.168 -11.742 -4.271 1.00 0.00 C ATOM 1128 C PHE A 71 -3.927 -12.468 -4.764 1.00 0.00 C ATOM 1129 O PHE A 71 -3.329 -13.239 -4.042 1.00 0.00 O ATOM 1130 CB PHE A 71 -4.959 -10.228 -4.511 1.00 0.00 C ATOM 1131 CG PHE A 71 -5.584 -9.359 -3.440 1.00 0.00 C ATOM 1132 CD1 PHE A 71 -6.839 -9.662 -2.899 1.00 0.00 C ATOM 1133 CD2 PHE A 71 -4.899 -8.214 -3.013 1.00 0.00 C ATOM 1134 CE1 PHE A 71 -7.399 -8.818 -1.927 1.00 0.00 C ATOM 1135 CE2 PHE A 71 -5.463 -7.373 -2.054 1.00 0.00 C ATOM 1136 CZ PHE A 71 -6.707 -7.673 -1.511 1.00 0.00 C ATOM 0 H PHE A 71 -4.509 -11.870 -2.254 1.00 0.00 H new ATOM 0 HA PHE A 71 -6.082 -12.025 -4.793 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -3.890 -10.019 -4.560 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -5.381 -9.959 -5.479 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -7.374 -10.541 -3.228 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -3.930 -7.981 -3.428 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -8.363 -9.051 -1.500 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.933 -6.488 -1.733 1.00 0.00 H new ATOM 0 HZ PHE A 71 -7.141 -7.022 -0.767 1.00 0.00 H new ATOM 1146 N GLU A 72 -3.522 -12.212 -5.970 1.00 0.00 N ATOM 1147 CA GLU A 72 -2.294 -12.868 -6.497 1.00 0.00 C ATOM 1148 C GLU A 72 -1.346 -11.800 -7.018 1.00 0.00 C ATOM 1149 O GLU A 72 -1.755 -10.704 -7.355 1.00 0.00 O ATOM 1150 CB GLU A 72 -2.636 -13.823 -7.631 1.00 0.00 C ATOM 1151 CG GLU A 72 -3.727 -14.784 -7.172 1.00 0.00 C ATOM 1152 CD GLU A 72 -4.396 -15.423 -8.390 1.00 0.00 C ATOM 1153 OE1 GLU A 72 -5.182 -14.746 -9.033 1.00 0.00 O ATOM 1154 OE2 GLU A 72 -4.113 -16.579 -8.659 1.00 0.00 O ATOM 0 H GLU A 72 -3.987 -11.576 -6.618 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.826 -13.434 -5.691 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -2.973 -13.263 -8.504 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -1.749 -14.380 -7.932 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -3.299 -15.556 -6.533 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.468 -14.251 -6.576 1.00 0.00 H new ATOM 1161 N GLU A 73 -0.086 -12.115 -7.085 1.00 0.00 N ATOM 1162 CA GLU A 73 0.903 -11.114 -7.588 1.00 0.00 C ATOM 1163 C GLU A 73 2.252 -11.781 -7.863 1.00 0.00 C ATOM 1164 O GLU A 73 2.415 -12.973 -7.706 1.00 0.00 O ATOM 1165 CB GLU A 73 1.078 -10.007 -6.538 1.00 0.00 C ATOM 1166 CG GLU A 73 1.046 -8.635 -7.218 1.00 0.00 C ATOM 1167 CD GLU A 73 0.939 -7.540 -6.154 1.00 0.00 C ATOM 1168 OE1 GLU A 73 1.846 -7.438 -5.345 1.00 0.00 O ATOM 1169 OE2 GLU A 73 -0.047 -6.822 -6.167 1.00 0.00 O ATOM 0 H GLU A 73 0.305 -13.017 -6.815 1.00 0.00 H new ATOM 0 HA GLU A 73 0.533 -10.687 -8.520 1.00 0.00 H new ATOM 0 HB2 GLU A 73 0.285 -10.072 -5.793 1.00 0.00 H new ATOM 0 HB3 GLU A 73 2.023 -10.140 -6.011 1.00 0.00 H new ATOM 0 HG2 GLU A 73 1.948 -8.491 -7.813 1.00 0.00 H new ATOM 0 HG3 GLU A 73 0.199 -8.576 -7.902 1.00 0.00 H new ATOM 1176 N GLN A 74 3.216 -11.001 -8.277 1.00 0.00 N ATOM 1177 CA GLN A 74 4.576 -11.548 -8.571 1.00 0.00 C ATOM 1178 C GLN A 74 5.629 -10.617 -7.958 1.00 0.00 C ATOM 1179 O GLN A 74 5.569 -9.413 -8.125 1.00 0.00 O ATOM 1180 CB GLN A 74 4.781 -11.624 -10.086 1.00 0.00 C ATOM 1181 CG GLN A 74 4.097 -12.878 -10.633 1.00 0.00 C ATOM 1182 CD GLN A 74 3.769 -12.676 -12.114 1.00 0.00 C ATOM 1183 OE1 GLN A 74 4.656 -12.636 -12.944 1.00 0.00 O ATOM 1184 NE2 GLN A 74 2.524 -12.547 -12.483 1.00 0.00 N ATOM 0 H GLN A 74 3.119 -9.997 -8.426 1.00 0.00 H new ATOM 0 HA GLN A 74 4.672 -12.547 -8.145 1.00 0.00 H new ATOM 0 HB2 GLN A 74 4.370 -10.735 -10.564 1.00 0.00 H new ATOM 0 HB3 GLN A 74 5.846 -11.647 -10.319 1.00 0.00 H new ATOM 0 HG2 GLN A 74 4.748 -13.744 -10.509 1.00 0.00 H new ATOM 0 HG3 GLN A 74 3.185 -13.082 -10.072 1.00 0.00 H new ATOM 0 HE21 GLN A 74 1.780 -12.581 -11.787 1.00 0.00 H new ATOM 0 HE22 GLN A 74 2.295 -12.413 -13.468 1.00 0.00 H new ATOM 1193 N THR A 75 6.586 -11.161 -7.242 1.00 0.00 N ATOM 1194 CA THR A 75 7.633 -10.298 -6.610 1.00 0.00 C ATOM 1195 C THR A 75 8.809 -10.123 -7.572 1.00 0.00 C ATOM 1196 O THR A 75 8.755 -10.529 -8.718 1.00 0.00 O ATOM 1197 CB THR A 75 8.135 -10.929 -5.300 1.00 0.00 C ATOM 1198 OG1 THR A 75 7.852 -12.321 -5.294 1.00 0.00 O ATOM 1199 CG2 THR A 75 7.449 -10.264 -4.101 1.00 0.00 C ATOM 0 H THR A 75 6.686 -12.161 -7.069 1.00 0.00 H new ATOM 0 HA THR A 75 7.192 -9.326 -6.388 1.00 0.00 H new ATOM 0 HB THR A 75 9.212 -10.778 -5.228 1.00 0.00 H new ATOM 0 HG1 THR A 75 8.416 -12.772 -5.957 1.00 0.00 H new ATOM 0 HG21 THR A 75 7.810 -10.717 -3.178 1.00 0.00 H new ATOM 0 HG22 THR A 75 7.678 -9.198 -4.096 1.00 0.00 H new ATOM 0 HG23 THR A 75 6.371 -10.403 -4.176 1.00 0.00 H new ATOM 1207 N VAL A 76 9.868 -9.511 -7.109 1.00 0.00 N ATOM 1208 CA VAL A 76 11.059 -9.287 -7.979 1.00 0.00 C ATOM 1209 C VAL A 76 12.228 -10.164 -7.510 1.00 0.00 C ATOM 1210 O VAL A 76 13.169 -10.392 -8.247 1.00 0.00 O ATOM 1211 CB VAL A 76 11.473 -7.818 -7.903 1.00 0.00 C ATOM 1212 CG1 VAL A 76 12.490 -7.520 -9.003 1.00 0.00 C ATOM 1213 CG2 VAL A 76 10.245 -6.920 -8.088 1.00 0.00 C ATOM 0 H VAL A 76 9.958 -9.154 -6.158 1.00 0.00 H new ATOM 0 HA VAL A 76 10.803 -9.549 -9.005 1.00 0.00 H new ATOM 0 HB VAL A 76 11.918 -7.621 -6.928 1.00 0.00 H new ATOM 0 HG11 VAL A 76 12.786 -6.472 -8.950 1.00 0.00 H new ATOM 0 HG12 VAL A 76 13.367 -8.153 -8.868 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.043 -7.722 -9.976 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.547 -5.874 -8.033 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.794 -7.116 -9.061 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.519 -7.130 -7.302 1.00 0.00 H new ATOM 1223 N ASP A 77 12.183 -10.651 -6.291 1.00 0.00 N ATOM 1224 CA ASP A 77 13.297 -11.506 -5.773 1.00 0.00 C ATOM 1225 C ASP A 77 13.515 -12.709 -6.697 1.00 0.00 C ATOM 1226 O ASP A 77 14.608 -13.236 -6.789 1.00 0.00 O ATOM 1227 CB ASP A 77 12.944 -12.002 -4.369 1.00 0.00 C ATOM 1228 CG ASP A 77 12.923 -10.819 -3.399 1.00 0.00 C ATOM 1229 OD1 ASP A 77 13.991 -10.404 -2.978 1.00 0.00 O ATOM 1230 OD2 ASP A 77 11.840 -10.346 -3.095 1.00 0.00 O ATOM 0 H ASP A 77 11.421 -10.492 -5.632 1.00 0.00 H new ATOM 0 HA ASP A 77 14.212 -10.915 -5.738 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.972 -12.494 -4.380 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.673 -12.743 -4.040 1.00 0.00 H new ATOM 1235 N GLY A 78 12.487 -13.143 -7.381 1.00 0.00 N ATOM 1236 CA GLY A 78 12.636 -14.310 -8.301 1.00 0.00 C ATOM 1237 C GLY A 78 11.439 -15.257 -8.159 1.00 0.00 C ATOM 1238 O GLY A 78 11.168 -16.051 -9.041 1.00 0.00 O ATOM 0 H GLY A 78 11.551 -12.739 -7.342 1.00 0.00 H new ATOM 0 HA2 GLY A 78 12.713 -13.962 -9.331 1.00 0.00 H new ATOM 0 HA3 GLY A 78 13.559 -14.844 -8.075 1.00 0.00 H new ATOM 1242 N ARG A 79 10.723 -15.187 -7.061 1.00 0.00 N ATOM 1243 CA ARG A 79 9.550 -16.089 -6.872 1.00 0.00 C ATOM 1244 C ARG A 79 8.256 -15.265 -6.978 1.00 0.00 C ATOM 1245 O ARG A 79 8.314 -14.053 -6.988 1.00 0.00 O ATOM 1246 CB ARG A 79 9.634 -16.742 -5.488 1.00 0.00 C ATOM 1247 CG ARG A 79 10.169 -18.170 -5.622 1.00 0.00 C ATOM 1248 CD ARG A 79 11.699 -18.143 -5.635 1.00 0.00 C ATOM 1249 NE ARG A 79 12.220 -19.539 -5.659 1.00 0.00 N ATOM 1250 CZ ARG A 79 12.307 -20.222 -4.551 1.00 0.00 C ATOM 1251 NH1 ARG A 79 12.859 -19.687 -3.496 1.00 0.00 N ATOM 1252 NH2 ARG A 79 11.843 -21.440 -4.497 1.00 0.00 N ATOM 0 H ARG A 79 10.903 -14.544 -6.290 1.00 0.00 H new ATOM 0 HA ARG A 79 9.550 -16.864 -7.639 1.00 0.00 H new ATOM 0 HB2 ARG A 79 10.287 -16.158 -4.839 1.00 0.00 H new ATOM 0 HB3 ARG A 79 8.649 -16.755 -5.021 1.00 0.00 H new ATOM 0 HG2 ARG A 79 9.813 -18.782 -4.794 1.00 0.00 H new ATOM 0 HG3 ARG A 79 9.795 -18.625 -6.539 1.00 0.00 H new ATOM 0 HD2 ARG A 79 12.056 -17.595 -6.507 1.00 0.00 H new ATOM 0 HD3 ARG A 79 12.072 -17.619 -4.755 1.00 0.00 H new ATOM 0 HE ARG A 79 12.509 -19.960 -6.542 1.00 0.00 H new ATOM 0 HH11 ARG A 79 13.222 -18.735 -3.538 1.00 0.00 H new ATOM 0 HH12 ARG A 79 12.927 -20.221 -2.630 1.00 0.00 H new ATOM 0 HH21 ARG A 79 11.412 -21.859 -5.321 1.00 0.00 H new ATOM 0 HH22 ARG A 79 11.911 -21.974 -3.630 1.00 0.00 H new ATOM 1266 N PRO A 80 7.118 -15.933 -7.048 1.00 0.00 N ATOM 1267 CA PRO A 80 5.821 -15.242 -7.141 1.00 0.00 C ATOM 1268 C PRO A 80 5.406 -14.728 -5.760 1.00 0.00 C ATOM 1269 O PRO A 80 6.190 -14.740 -4.829 1.00 0.00 O ATOM 1270 CB PRO A 80 4.863 -16.328 -7.634 1.00 0.00 C ATOM 1271 CG PRO A 80 5.507 -17.684 -7.258 1.00 0.00 C ATOM 1272 CD PRO A 80 7.008 -17.415 -7.046 1.00 0.00 C ATOM 0 HA PRO A 80 5.838 -14.375 -7.802 1.00 0.00 H new ATOM 0 HB2 PRO A 80 3.883 -16.221 -7.169 1.00 0.00 H new ATOM 0 HB3 PRO A 80 4.714 -16.254 -8.711 1.00 0.00 H new ATOM 0 HG2 PRO A 80 5.055 -18.090 -6.353 1.00 0.00 H new ATOM 0 HG3 PRO A 80 5.353 -18.418 -8.049 1.00 0.00 H new ATOM 0 HD2 PRO A 80 7.359 -17.839 -6.105 1.00 0.00 H new ATOM 0 HD3 PRO A 80 7.608 -17.860 -7.840 1.00 0.00 H new ATOM 1280 N CYS A 81 4.182 -14.283 -5.618 1.00 0.00 N ATOM 1281 CA CYS A 81 3.718 -13.775 -4.293 1.00 0.00 C ATOM 1282 C CYS A 81 2.252 -13.363 -4.362 1.00 0.00 C ATOM 1283 O CYS A 81 1.812 -12.715 -5.291 1.00 0.00 O ATOM 1284 CB CYS A 81 4.566 -12.566 -3.864 1.00 0.00 C ATOM 1285 SG CYS A 81 4.450 -11.249 -5.101 1.00 0.00 S ATOM 0 H CYS A 81 3.486 -14.250 -6.363 1.00 0.00 H new ATOM 0 HA CYS A 81 3.829 -14.576 -3.562 1.00 0.00 H new ATOM 0 HB2 CYS A 81 4.224 -12.198 -2.897 1.00 0.00 H new ATOM 0 HB3 CYS A 81 5.606 -12.868 -3.740 1.00 0.00 H new ATOM 0 HG CYS A 81 4.373 -10.097 -4.503 1.00 0.00 H new ATOM 1291 N LYS A 82 1.513 -13.723 -3.358 1.00 0.00 N ATOM 1292 CA LYS A 82 0.078 -13.362 -3.293 1.00 0.00 C ATOM 1293 C LYS A 82 -0.120 -12.399 -2.129 1.00 0.00 C ATOM 1294 O LYS A 82 0.831 -11.954 -1.513 1.00 0.00 O ATOM 1295 CB LYS A 82 -0.750 -14.623 -3.067 1.00 0.00 C ATOM 1296 CG LYS A 82 -0.288 -15.348 -1.790 1.00 0.00 C ATOM 1297 CD LYS A 82 -1.058 -16.673 -1.602 1.00 0.00 C ATOM 1298 CE LYS A 82 -2.544 -16.499 -1.948 1.00 0.00 C ATOM 1299 NZ LYS A 82 -3.364 -17.450 -1.144 1.00 0.00 N ATOM 0 H LYS A 82 1.851 -14.264 -2.562 1.00 0.00 H new ATOM 0 HA LYS A 82 -0.239 -12.892 -4.224 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.805 -14.362 -2.983 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.653 -15.288 -3.925 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.782 -15.549 -1.847 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -0.445 -14.705 -0.924 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -0.621 -17.445 -2.236 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -0.958 -17.013 -0.571 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.856 -15.474 -1.746 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.703 -16.677 -3.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.144 -17.815 -1.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -2.768 -18.241 -0.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -3.754 -16.958 -0.315 1.00 0.00 H new ATOM 1313 N SER A 83 -1.341 -12.071 -1.831 1.00 0.00 N ATOM 1314 CA SER A 83 -1.608 -11.127 -0.708 1.00 0.00 C ATOM 1315 C SER A 83 -2.867 -11.530 0.040 1.00 0.00 C ATOM 1316 O SER A 83 -3.541 -12.468 -0.323 1.00 0.00 O ATOM 1317 CB SER A 83 -1.799 -9.725 -1.276 1.00 0.00 C ATOM 1318 OG SER A 83 -2.787 -9.773 -2.300 1.00 0.00 O ATOM 0 H SER A 83 -2.170 -12.415 -2.315 1.00 0.00 H new ATOM 0 HA SER A 83 -0.764 -11.150 -0.019 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.106 -9.038 -0.488 1.00 0.00 H new ATOM 0 HB3 SER A 83 -0.858 -9.350 -1.678 1.00 0.00 H new ATOM 0 HG SER A 83 -3.378 -8.996 -2.221 1.00 0.00 H new ATOM 1324 N LEU A 84 -3.190 -10.812 1.082 1.00 0.00 N ATOM 1325 CA LEU A 84 -4.425 -11.137 1.856 1.00 0.00 C ATOM 1326 C LEU A 84 -4.750 -10.004 2.824 1.00 0.00 C ATOM 1327 O LEU A 84 -3.983 -9.698 3.713 1.00 0.00 O ATOM 1328 CB LEU A 84 -4.228 -12.442 2.620 1.00 0.00 C ATOM 1329 CG LEU A 84 -5.498 -13.283 2.505 1.00 0.00 C ATOM 1330 CD1 LEU A 84 -5.149 -14.757 2.681 1.00 0.00 C ATOM 1331 CD2 LEU A 84 -6.496 -12.855 3.579 1.00 0.00 C ATOM 0 H LEU A 84 -2.655 -10.017 1.431 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.259 -11.254 1.164 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.376 -12.989 2.216 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.007 -12.235 3.667 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.945 -13.134 1.522 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.055 -15.358 2.599 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.442 -15.058 1.908 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.700 -14.910 3.662 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.401 -13.456 3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -6.054 -13.000 4.565 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.746 -11.803 3.445 1.00 0.00 H new ATOM 1343 N VAL A 85 -5.885 -9.379 2.641 1.00 0.00 N ATOM 1344 CA VAL A 85 -6.280 -8.242 3.524 1.00 0.00 C ATOM 1345 C VAL A 85 -7.057 -8.745 4.751 1.00 0.00 C ATOM 1346 O VAL A 85 -7.810 -9.695 4.687 1.00 0.00 O ATOM 1347 CB VAL A 85 -7.138 -7.261 2.703 1.00 0.00 C ATOM 1348 CG1 VAL A 85 -7.776 -6.194 3.609 1.00 0.00 C ATOM 1349 CG2 VAL A 85 -6.247 -6.571 1.669 1.00 0.00 C ATOM 0 H VAL A 85 -6.560 -9.610 1.912 1.00 0.00 H new ATOM 0 HA VAL A 85 -5.386 -7.736 3.889 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.935 -7.820 2.213 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -8.376 -5.515 3.004 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -8.412 -6.679 4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.992 -5.632 4.116 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -6.844 -5.874 1.082 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -5.452 -6.027 2.179 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -5.809 -7.320 1.009 1.00 0.00 H new ATOM 1359 N LYS A 86 -6.879 -8.072 5.861 1.00 0.00 N ATOM 1360 CA LYS A 86 -7.587 -8.438 7.114 1.00 0.00 C ATOM 1361 C LYS A 86 -7.795 -7.168 7.949 1.00 0.00 C ATOM 1362 O LYS A 86 -7.726 -6.064 7.444 1.00 0.00 O ATOM 1363 CB LYS A 86 -6.742 -9.447 7.896 1.00 0.00 C ATOM 1364 CG LYS A 86 -7.636 -10.542 8.488 1.00 0.00 C ATOM 1365 CD LYS A 86 -8.348 -11.312 7.366 1.00 0.00 C ATOM 1366 CE LYS A 86 -9.834 -10.928 7.322 1.00 0.00 C ATOM 1367 NZ LYS A 86 -10.659 -12.083 7.775 1.00 0.00 N ATOM 0 H LYS A 86 -6.258 -7.268 5.947 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.553 -8.887 6.885 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -5.995 -9.893 7.239 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.201 -8.938 8.694 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -7.035 -11.228 9.085 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -8.372 -10.098 9.158 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -7.879 -11.090 6.408 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -8.246 -12.385 7.530 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -10.016 -10.064 7.961 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -10.117 -10.641 6.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -11.659 -11.902 7.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.348 -12.946 7.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -10.546 -12.209 8.801 1.00 0.00 H new ATOM 1381 N TRP A 87 -8.061 -7.325 9.214 1.00 0.00 N ATOM 1382 CA TRP A 87 -8.290 -6.148 10.103 1.00 0.00 C ATOM 1383 C TRP A 87 -7.356 -6.189 11.307 1.00 0.00 C ATOM 1384 O TRP A 87 -6.522 -7.061 11.451 1.00 0.00 O ATOM 1385 CB TRP A 87 -9.717 -6.189 10.617 1.00 0.00 C ATOM 1386 CG TRP A 87 -10.629 -6.093 9.467 1.00 0.00 C ATOM 1387 CD1 TRP A 87 -11.231 -7.137 8.883 1.00 0.00 C ATOM 1388 CD2 TRP A 87 -11.031 -4.909 8.733 1.00 0.00 C ATOM 1389 NE1 TRP A 87 -12.018 -6.671 7.858 1.00 0.00 N ATOM 1390 CE2 TRP A 87 -11.919 -5.303 7.715 1.00 0.00 C ATOM 1391 CE3 TRP A 87 -10.720 -3.544 8.856 1.00 0.00 C ATOM 1392 CZ2 TRP A 87 -12.483 -4.382 6.844 1.00 0.00 C ATOM 1393 CZ3 TRP A 87 -11.283 -2.609 7.976 1.00 0.00 C ATOM 1394 CH2 TRP A 87 -12.164 -3.029 6.972 1.00 0.00 C ATOM 0 H TRP A 87 -8.131 -8.230 9.678 1.00 0.00 H new ATOM 0 HA TRP A 87 -8.102 -5.241 9.529 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -9.896 -7.113 11.166 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -9.894 -5.367 11.311 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -11.117 -8.172 9.170 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -12.605 -7.265 7.273 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -10.045 -3.214 9.631 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -13.164 -4.710 6.072 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -11.037 -1.562 8.073 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -12.597 -2.306 6.296 1.00 0.00 H new ATOM 1405 N GLU A 88 -7.526 -5.241 12.177 1.00 0.00 N ATOM 1406 CA GLU A 88 -6.707 -5.161 13.414 1.00 0.00 C ATOM 1407 C GLU A 88 -7.661 -4.800 14.558 1.00 0.00 C ATOM 1408 O GLU A 88 -7.798 -5.518 15.530 1.00 0.00 O ATOM 1409 CB GLU A 88 -5.614 -4.083 13.207 1.00 0.00 C ATOM 1410 CG GLU A 88 -5.222 -3.378 14.519 1.00 0.00 C ATOM 1411 CD GLU A 88 -4.652 -4.402 15.503 1.00 0.00 C ATOM 1412 OE1 GLU A 88 -3.874 -5.238 15.073 1.00 0.00 O ATOM 1413 OE2 GLU A 88 -5.003 -4.333 16.669 1.00 0.00 O ATOM 0 H GLU A 88 -8.217 -4.497 12.081 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.206 -6.100 13.649 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.730 -4.547 12.770 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.971 -3.341 12.493 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.484 -2.601 14.319 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.093 -2.887 14.954 1.00 0.00 H new ATOM 1420 N SER A 89 -8.316 -3.684 14.424 1.00 0.00 N ATOM 1421 CA SER A 89 -9.274 -3.228 15.464 1.00 0.00 C ATOM 1422 C SER A 89 -10.674 -3.163 14.854 1.00 0.00 C ATOM 1423 O SER A 89 -11.626 -3.705 15.377 1.00 0.00 O ATOM 1424 CB SER A 89 -8.867 -1.832 15.932 1.00 0.00 C ATOM 1425 OG SER A 89 -8.646 -1.006 14.792 1.00 0.00 O ATOM 0 H SER A 89 -8.226 -3.058 13.624 1.00 0.00 H new ATOM 0 HA SER A 89 -9.269 -3.919 16.307 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.647 -1.404 16.562 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.963 -1.887 16.538 1.00 0.00 H new ATOM 0 HG SER A 89 -8.386 -0.108 15.084 1.00 0.00 H new ATOM 1431 N GLU A 90 -10.781 -2.490 13.744 1.00 0.00 N ATOM 1432 CA GLU A 90 -12.085 -2.329 13.028 1.00 0.00 C ATOM 1433 C GLU A 90 -11.883 -1.269 11.949 1.00 0.00 C ATOM 1434 O GLU A 90 -12.391 -1.369 10.851 1.00 0.00 O ATOM 1435 CB GLU A 90 -13.195 -1.870 13.988 1.00 0.00 C ATOM 1436 CG GLU A 90 -12.727 -0.643 14.777 1.00 0.00 C ATOM 1437 CD GLU A 90 -13.315 -0.688 16.189 1.00 0.00 C ATOM 1438 OE1 GLU A 90 -14.521 -0.548 16.312 1.00 0.00 O ATOM 1439 OE2 GLU A 90 -12.550 -0.862 17.123 1.00 0.00 O ATOM 0 H GLU A 90 -9.995 -2.029 13.286 1.00 0.00 H new ATOM 0 HA GLU A 90 -12.389 -3.285 12.601 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -14.097 -1.629 13.426 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -13.452 -2.678 14.673 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -11.638 -0.623 14.826 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -13.041 0.270 14.270 1.00 0.00 H new ATOM 1446 N ASN A 91 -11.098 -0.275 12.260 1.00 0.00 N ATOM 1447 CA ASN A 91 -10.783 0.797 11.276 1.00 0.00 C ATOM 1448 C ASN A 91 -9.319 0.660 10.848 1.00 0.00 C ATOM 1449 O ASN A 91 -8.831 1.442 10.056 1.00 0.00 O ATOM 1450 CB ASN A 91 -10.992 2.162 11.915 1.00 0.00 C ATOM 1451 CG ASN A 91 -12.442 2.318 12.383 1.00 0.00 C ATOM 1452 OD1 ASN A 91 -13.211 1.377 12.364 1.00 0.00 O ATOM 1453 ND2 ASN A 91 -12.849 3.486 12.797 1.00 0.00 N ATOM 0 H ASN A 91 -10.654 -0.159 13.171 1.00 0.00 H new ATOM 0 HA ASN A 91 -11.439 0.702 10.410 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -10.316 2.281 12.761 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -10.748 2.947 11.199 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.813 3.610 13.105 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -12.203 4.275 12.813 1.00 0.00 H new ATOM 1460 N LYS A 92 -8.613 -0.332 11.357 1.00 0.00 N ATOM 1461 CA LYS A 92 -7.205 -0.530 10.956 1.00 0.00 C ATOM 1462 C LYS A 92 -7.122 -1.896 10.275 1.00 0.00 C ATOM 1463 O LYS A 92 -7.392 -2.910 10.879 1.00 0.00 O ATOM 1464 CB LYS A 92 -6.311 -0.501 12.194 1.00 0.00 C ATOM 1465 CG LYS A 92 -4.868 -0.252 11.767 1.00 0.00 C ATOM 1466 CD LYS A 92 -4.171 -1.587 11.497 1.00 0.00 C ATOM 1467 CE LYS A 92 -2.714 -1.333 11.107 1.00 0.00 C ATOM 1468 NZ LYS A 92 -1.885 -1.208 12.339 1.00 0.00 N ATOM 0 H LYS A 92 -8.967 -1.007 12.035 1.00 0.00 H new ATOM 0 HA LYS A 92 -6.872 0.257 10.280 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.641 0.282 12.877 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -6.385 -1.446 12.733 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.846 0.368 10.871 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -4.337 0.295 12.546 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -4.216 -2.219 12.384 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -4.684 -2.122 10.698 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -2.344 -2.151 10.488 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -2.639 -0.423 10.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.894 -1.035 12.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.234 -0.414 12.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -1.948 -2.088 12.890 1.00 0.00 H new ATOM 1482 N MET A 93 -6.772 -1.927 9.022 1.00 0.00 N ATOM 1483 CA MET A 93 -6.689 -3.222 8.291 1.00 0.00 C ATOM 1484 C MET A 93 -5.292 -3.424 7.740 1.00 0.00 C ATOM 1485 O MET A 93 -4.524 -2.496 7.567 1.00 0.00 O ATOM 1486 CB MET A 93 -7.703 -3.314 7.129 1.00 0.00 C ATOM 1487 CG MET A 93 -8.116 -1.929 6.610 1.00 0.00 C ATOM 1488 SD MET A 93 -8.397 -1.999 4.821 1.00 0.00 S ATOM 1489 CE MET A 93 -9.567 -3.377 4.827 1.00 0.00 C ATOM 0 H MET A 93 -6.538 -1.104 8.467 1.00 0.00 H new ATOM 0 HA MET A 93 -6.931 -4.003 9.012 1.00 0.00 H new ATOM 0 HB2 MET A 93 -7.267 -3.891 6.313 1.00 0.00 H new ATOM 0 HB3 MET A 93 -8.589 -3.854 7.464 1.00 0.00 H new ATOM 0 HG2 MET A 93 -9.022 -1.597 7.116 1.00 0.00 H new ATOM 0 HG3 MET A 93 -7.338 -1.199 6.836 1.00 0.00 H new ATOM 0 HE1 MET A 93 -9.190 -4.177 4.190 1.00 0.00 H new ATOM 0 HE2 MET A 93 -9.686 -3.749 5.845 1.00 0.00 H new ATOM 0 HE3 MET A 93 -10.531 -3.037 4.450 1.00 0.00 H new ATOM 1499 N VAL A 94 -4.970 -4.650 7.477 1.00 0.00 N ATOM 1500 CA VAL A 94 -3.626 -4.993 6.942 1.00 0.00 C ATOM 1501 C VAL A 94 -3.767 -5.699 5.603 1.00 0.00 C ATOM 1502 O VAL A 94 -4.845 -5.854 5.068 1.00 0.00 O ATOM 1503 CB VAL A 94 -2.923 -5.945 7.913 1.00 0.00 C ATOM 1504 CG1 VAL A 94 -2.427 -5.175 9.132 1.00 0.00 C ATOM 1505 CG2 VAL A 94 -3.909 -7.022 8.354 1.00 0.00 C ATOM 0 H VAL A 94 -5.591 -5.448 7.611 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.050 -4.076 6.820 1.00 0.00 H new ATOM 0 HB VAL A 94 -2.069 -6.405 7.416 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -1.928 -5.860 9.817 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -1.725 -4.404 8.814 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.273 -4.709 9.637 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -3.416 -7.705 9.046 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -4.760 -6.555 8.849 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.256 -7.577 7.482 1.00 0.00 H new ATOM 1515 N CYS A 95 -2.667 -6.139 5.082 1.00 0.00 N ATOM 1516 CA CYS A 95 -2.666 -6.873 3.795 1.00 0.00 C ATOM 1517 C CYS A 95 -1.319 -7.555 3.678 1.00 0.00 C ATOM 1518 O CYS A 95 -0.428 -7.073 3.012 1.00 0.00 O ATOM 1519 CB CYS A 95 -2.867 -5.907 2.640 1.00 0.00 C ATOM 1520 SG CYS A 95 -3.106 -6.843 1.109 1.00 0.00 S ATOM 0 H CYS A 95 -1.746 -6.019 5.503 1.00 0.00 H new ATOM 0 HA CYS A 95 -3.476 -7.602 3.762 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -3.732 -5.271 2.829 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -2.003 -5.250 2.546 1.00 0.00 H new ATOM 0 HG CYS A 95 -2.908 -6.063 0.088 1.00 0.00 H new ATOM 1526 N GLU A 96 -1.153 -8.650 4.364 1.00 0.00 N ATOM 1527 CA GLU A 96 0.163 -9.341 4.344 1.00 0.00 C ATOM 1528 C GLU A 96 0.429 -9.981 2.983 1.00 0.00 C ATOM 1529 O GLU A 96 -0.180 -10.968 2.616 1.00 0.00 O ATOM 1530 CB GLU A 96 0.207 -10.419 5.424 1.00 0.00 C ATOM 1531 CG GLU A 96 1.637 -10.951 5.528 1.00 0.00 C ATOM 1532 CD GLU A 96 1.666 -12.179 6.439 1.00 0.00 C ATOM 1533 OE1 GLU A 96 1.150 -12.087 7.541 1.00 0.00 O ATOM 1534 OE2 GLU A 96 2.203 -13.191 6.020 1.00 0.00 O ATOM 0 H GLU A 96 -1.871 -9.095 4.936 1.00 0.00 H new ATOM 0 HA GLU A 96 0.934 -8.595 4.536 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.114 -10.008 6.381 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.480 -11.228 5.178 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.011 -11.212 4.538 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.295 -10.177 5.924 1.00 0.00 H new ATOM 1541 N GLN A 97 1.360 -9.434 2.250 1.00 0.00 N ATOM 1542 CA GLN A 97 1.714 -10.001 0.929 1.00 0.00 C ATOM 1543 C GLN A 97 2.957 -10.882 1.099 1.00 0.00 C ATOM 1544 O GLN A 97 3.966 -10.438 1.614 1.00 0.00 O ATOM 1545 CB GLN A 97 2.023 -8.856 -0.034 1.00 0.00 C ATOM 1546 CG GLN A 97 0.799 -7.948 -0.166 1.00 0.00 C ATOM 1547 CD GLN A 97 0.698 -7.423 -1.601 1.00 0.00 C ATOM 1548 OE1 GLN A 97 1.675 -7.400 -2.324 1.00 0.00 O ATOM 1549 NE2 GLN A 97 -0.453 -6.997 -2.047 1.00 0.00 N ATOM 0 H GLN A 97 1.894 -8.608 2.519 1.00 0.00 H new ATOM 0 HA GLN A 97 0.890 -10.595 0.532 1.00 0.00 H new ATOM 0 HB2 GLN A 97 2.876 -8.282 0.330 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.300 -9.254 -1.010 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -0.105 -8.499 0.094 1.00 0.00 H new ATOM 0 HG3 GLN A 97 0.876 -7.114 0.532 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -1.273 -7.016 -1.441 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -0.532 -6.645 -3.001 1.00 0.00 H new ATOM 1558 N LYS A 98 2.894 -12.128 0.693 1.00 0.00 N ATOM 1559 CA LYS A 98 4.086 -13.024 0.862 1.00 0.00 C ATOM 1560 C LYS A 98 4.463 -13.671 -0.474 1.00 0.00 C ATOM 1561 O LYS A 98 3.668 -13.724 -1.389 1.00 0.00 O ATOM 1562 CB LYS A 98 3.754 -14.119 1.877 1.00 0.00 C ATOM 1563 CG LYS A 98 2.474 -14.840 1.449 1.00 0.00 C ATOM 1564 CD LYS A 98 2.226 -16.035 2.371 1.00 0.00 C ATOM 1565 CE LYS A 98 1.391 -17.084 1.634 1.00 0.00 C ATOM 1566 NZ LYS A 98 1.389 -18.355 2.412 1.00 0.00 N ATOM 0 H LYS A 98 2.080 -12.561 0.257 1.00 0.00 H new ATOM 0 HA LYS A 98 4.928 -12.429 1.215 1.00 0.00 H new ATOM 0 HB2 LYS A 98 4.578 -14.829 1.945 1.00 0.00 H new ATOM 0 HB3 LYS A 98 3.625 -13.684 2.868 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.627 -14.155 1.490 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.562 -15.177 0.416 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.175 -16.467 2.687 1.00 0.00 H new ATOM 0 HD3 LYS A 98 1.707 -15.710 3.273 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.370 -16.725 1.502 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.800 -17.256 0.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.821 -19.068 1.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 2.365 -18.700 2.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 0.980 -18.185 3.353 1.00 0.00 H new ATOM 1580 N LEU A 99 5.670 -14.180 -0.584 1.00 0.00 N ATOM 1581 CA LEU A 99 6.091 -14.846 -1.864 1.00 0.00 C ATOM 1582 C LEU A 99 5.926 -16.360 -1.735 1.00 0.00 C ATOM 1583 O LEU A 99 6.716 -17.129 -2.248 1.00 0.00 O ATOM 1584 CB LEU A 99 7.545 -14.511 -2.269 1.00 0.00 C ATOM 1585 CG LEU A 99 8.424 -14.232 -1.050 1.00 0.00 C ATOM 1586 CD1 LEU A 99 9.853 -14.707 -1.330 1.00 0.00 C ATOM 1587 CD2 LEU A 99 8.437 -12.726 -0.776 1.00 0.00 C ATOM 0 H LEU A 99 6.378 -14.164 0.150 1.00 0.00 H new ATOM 0 HA LEU A 99 5.445 -14.459 -2.652 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.964 -15.341 -2.837 1.00 0.00 H new ATOM 0 HB3 LEU A 99 7.548 -13.641 -2.926 1.00 0.00 H new ATOM 0 HG LEU A 99 8.028 -14.763 -0.184 1.00 0.00 H new ATOM 0 HD11 LEU A 99 10.480 -14.508 -0.461 1.00 0.00 H new ATOM 0 HD12 LEU A 99 9.847 -15.777 -1.535 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.251 -14.174 -2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 99 9.062 -12.520 0.093 1.00 0.00 H new ATOM 0 HD22 LEU A 99 8.837 -12.202 -1.644 1.00 0.00 H new ATOM 0 HD23 LEU A 99 7.421 -12.383 -0.581 1.00 0.00 H new ATOM 1599 N LEU A 100 4.885 -16.790 -1.065 1.00 0.00 N ATOM 1600 CA LEU A 100 4.627 -18.253 -0.905 1.00 0.00 C ATOM 1601 C LEU A 100 5.819 -18.958 -0.247 1.00 0.00 C ATOM 1602 O LEU A 100 5.961 -20.163 -0.342 1.00 0.00 O ATOM 1603 CB LEU A 100 4.390 -18.865 -2.279 1.00 0.00 C ATOM 1604 CG LEU A 100 3.199 -18.174 -2.947 1.00 0.00 C ATOM 1605 CD1 LEU A 100 3.201 -18.479 -4.447 1.00 0.00 C ATOM 1606 CD2 LEU A 100 1.898 -18.683 -2.322 1.00 0.00 C ATOM 0 H LEU A 100 4.197 -16.183 -0.618 1.00 0.00 H new ATOM 0 HA LEU A 100 3.753 -18.382 -0.267 1.00 0.00 H new ATOM 0 HB2 LEU A 100 5.281 -18.755 -2.897 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.198 -19.934 -2.185 1.00 0.00 H new ATOM 0 HG LEU A 100 3.276 -17.097 -2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.352 -17.986 -4.920 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.127 -18.113 -4.891 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.126 -19.556 -4.599 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.049 -18.191 -2.797 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.821 -19.760 -2.468 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.895 -18.460 -1.255 1.00 0.00 H new ATOM 1618 N LYS A 101 6.672 -18.224 0.415 1.00 0.00 N ATOM 1619 CA LYS A 101 7.853 -18.850 1.081 1.00 0.00 C ATOM 1620 C LYS A 101 8.647 -17.773 1.817 1.00 0.00 C ATOM 1621 O LYS A 101 8.899 -17.873 3.004 1.00 0.00 O ATOM 1622 CB LYS A 101 8.743 -19.520 0.024 1.00 0.00 C ATOM 1623 CG LYS A 101 9.186 -20.899 0.519 1.00 0.00 C ATOM 1624 CD LYS A 101 7.997 -21.861 0.483 1.00 0.00 C ATOM 1625 CE LYS A 101 8.432 -23.232 1.005 1.00 0.00 C ATOM 1626 NZ LYS A 101 7.386 -24.242 0.678 1.00 0.00 N ATOM 0 H LYS A 101 6.602 -17.212 0.524 1.00 0.00 H new ATOM 0 HA LYS A 101 7.516 -19.602 1.794 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.198 -19.618 -0.915 1.00 0.00 H new ATOM 0 HB3 LYS A 101 9.615 -18.898 -0.178 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.994 -21.279 -0.106 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.576 -20.825 1.534 1.00 0.00 H new ATOM 0 HD2 LYS A 101 7.181 -21.471 1.092 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.620 -21.951 -0.536 1.00 0.00 H new ATOM 0 HE2 LYS A 101 9.383 -23.519 0.556 1.00 0.00 H new ATOM 0 HE3 LYS A 101 8.588 -23.190 2.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.681 -25.174 1.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.488 -23.969 1.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.258 -24.288 -0.353 1.00 0.00 H new ATOM 1640 N GLY A 102 9.039 -16.744 1.117 1.00 0.00 N ATOM 1641 CA GLY A 102 9.817 -15.645 1.758 1.00 0.00 C ATOM 1642 C GLY A 102 11.282 -16.057 1.889 1.00 0.00 C ATOM 1643 O GLY A 102 11.594 -17.181 2.236 1.00 0.00 O ATOM 0 H GLY A 102 8.853 -16.616 0.122 1.00 0.00 H new ATOM 0 HA2 GLY A 102 9.737 -14.735 1.163 1.00 0.00 H new ATOM 0 HA3 GLY A 102 9.404 -15.420 2.741 1.00 0.00 H new ATOM 1647 N GLU A 103 12.177 -15.145 1.627 1.00 0.00 N ATOM 1648 CA GLU A 103 13.630 -15.453 1.745 1.00 0.00 C ATOM 1649 C GLU A 103 14.233 -14.553 2.823 1.00 0.00 C ATOM 1650 O GLU A 103 15.024 -14.987 3.639 1.00 0.00 O ATOM 1651 CB GLU A 103 14.332 -15.209 0.403 1.00 0.00 C ATOM 1652 CG GLU A 103 14.026 -13.797 -0.102 1.00 0.00 C ATOM 1653 CD GLU A 103 14.678 -13.595 -1.472 1.00 0.00 C ATOM 1654 OE1 GLU A 103 14.521 -14.463 -2.314 1.00 0.00 O ATOM 1655 OE2 GLU A 103 15.323 -12.575 -1.654 1.00 0.00 O ATOM 0 H GLU A 103 11.962 -14.192 1.334 1.00 0.00 H new ATOM 0 HA GLU A 103 13.765 -16.500 2.018 1.00 0.00 H new ATOM 0 HB2 GLU A 103 15.408 -15.337 0.518 1.00 0.00 H new ATOM 0 HB3 GLU A 103 14.000 -15.945 -0.329 1.00 0.00 H new ATOM 0 HG2 GLU A 103 12.948 -13.650 -0.175 1.00 0.00 H new ATOM 0 HG3 GLU A 103 14.402 -13.057 0.605 1.00 0.00 H new ATOM 1662 N GLY A 104 13.845 -13.307 2.836 1.00 0.00 N ATOM 1663 CA GLY A 104 14.359 -12.360 3.860 1.00 0.00 C ATOM 1664 C GLY A 104 13.203 -11.446 4.302 1.00 0.00 C ATOM 1665 O GLY A 104 12.498 -11.776 5.235 1.00 0.00 O ATOM 0 H GLY A 104 13.186 -12.902 2.171 1.00 0.00 H new ATOM 0 HA2 GLY A 104 14.758 -12.906 4.715 1.00 0.00 H new ATOM 0 HA3 GLY A 104 15.176 -11.766 3.451 1.00 0.00 H new ATOM 1669 N PRO A 105 13.020 -10.327 3.621 1.00 0.00 N ATOM 1670 CA PRO A 105 11.936 -9.390 3.951 1.00 0.00 C ATOM 1671 C PRO A 105 10.620 -9.852 3.311 1.00 0.00 C ATOM 1672 O PRO A 105 10.474 -11.005 2.948 1.00 0.00 O ATOM 1673 CB PRO A 105 12.408 -8.068 3.350 1.00 0.00 C ATOM 1674 CG PRO A 105 13.425 -8.422 2.238 1.00 0.00 C ATOM 1675 CD PRO A 105 13.864 -9.879 2.485 1.00 0.00 C ATOM 0 HA PRO A 105 11.741 -9.315 5.021 1.00 0.00 H new ATOM 0 HB2 PRO A 105 11.568 -7.507 2.941 1.00 0.00 H new ATOM 0 HB3 PRO A 105 12.870 -7.440 4.112 1.00 0.00 H new ATOM 0 HG2 PRO A 105 12.972 -8.316 1.252 1.00 0.00 H new ATOM 0 HG3 PRO A 105 14.282 -7.749 2.269 1.00 0.00 H new ATOM 0 HD2 PRO A 105 13.704 -10.498 1.602 1.00 0.00 H new ATOM 0 HD3 PRO A 105 14.925 -9.939 2.729 1.00 0.00 H new ATOM 1683 N LYS A 106 9.658 -8.969 3.184 1.00 0.00 N ATOM 1684 CA LYS A 106 8.351 -9.360 2.586 1.00 0.00 C ATOM 1685 C LYS A 106 7.530 -8.112 2.256 1.00 0.00 C ATOM 1686 O LYS A 106 7.856 -7.015 2.665 1.00 0.00 O ATOM 1687 CB LYS A 106 7.595 -10.202 3.603 1.00 0.00 C ATOM 1688 CG LYS A 106 6.894 -11.366 2.898 1.00 0.00 C ATOM 1689 CD LYS A 106 6.737 -12.535 3.873 1.00 0.00 C ATOM 1690 CE LYS A 106 8.065 -13.286 3.989 1.00 0.00 C ATOM 1691 NZ LYS A 106 7.822 -14.634 4.576 1.00 0.00 N ATOM 0 H LYS A 106 9.726 -7.993 3.471 1.00 0.00 H new ATOM 0 HA LYS A 106 8.519 -9.924 1.668 1.00 0.00 H new ATOM 0 HB2 LYS A 106 8.284 -10.584 4.356 1.00 0.00 H new ATOM 0 HB3 LYS A 106 6.862 -9.587 4.124 1.00 0.00 H new ATOM 0 HG2 LYS A 106 5.917 -11.049 2.534 1.00 0.00 H new ATOM 0 HG3 LYS A 106 7.472 -11.679 2.028 1.00 0.00 H new ATOM 0 HD2 LYS A 106 6.429 -12.167 4.852 1.00 0.00 H new ATOM 0 HD3 LYS A 106 5.955 -13.210 3.525 1.00 0.00 H new ATOM 0 HE2 LYS A 106 8.528 -13.383 3.007 1.00 0.00 H new ATOM 0 HE3 LYS A 106 8.759 -12.725 4.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 8.733 -15.099 4.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 7.292 -14.535 5.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 7.272 -15.210 3.907 1.00 0.00 H new ATOM 1705 N THR A 107 6.458 -8.284 1.528 1.00 0.00 N ATOM 1706 CA THR A 107 5.595 -7.128 1.165 1.00 0.00 C ATOM 1707 C THR A 107 4.324 -7.160 2.011 1.00 0.00 C ATOM 1708 O THR A 107 3.994 -8.162 2.611 1.00 0.00 O ATOM 1709 CB THR A 107 5.223 -7.234 -0.318 1.00 0.00 C ATOM 1710 OG1 THR A 107 5.111 -8.602 -0.688 1.00 0.00 O ATOM 1711 CG2 THR A 107 6.298 -6.576 -1.175 1.00 0.00 C ATOM 0 H THR A 107 6.143 -9.185 1.168 1.00 0.00 H new ATOM 0 HA THR A 107 6.128 -6.195 1.348 1.00 0.00 H new ATOM 0 HB THR A 107 4.271 -6.728 -0.477 1.00 0.00 H new ATOM 0 HG1 THR A 107 4.871 -8.666 -1.636 1.00 0.00 H new ATOM 0 HG21 THR A 107 6.024 -6.657 -2.227 1.00 0.00 H new ATOM 0 HG22 THR A 107 6.387 -5.524 -0.903 1.00 0.00 H new ATOM 0 HG23 THR A 107 7.252 -7.076 -1.009 1.00 0.00 H new ATOM 1719 N SER A 108 3.612 -6.061 2.065 1.00 0.00 N ATOM 1720 CA SER A 108 2.350 -6.000 2.869 1.00 0.00 C ATOM 1721 C SER A 108 1.844 -4.555 2.886 1.00 0.00 C ATOM 1722 O SER A 108 2.533 -3.654 2.450 1.00 0.00 O ATOM 1723 CB SER A 108 2.626 -6.443 4.311 1.00 0.00 C ATOM 1724 OG SER A 108 3.910 -5.979 4.707 1.00 0.00 O ATOM 0 H SER A 108 3.853 -5.195 1.582 1.00 0.00 H new ATOM 0 HA SER A 108 1.606 -6.660 2.423 1.00 0.00 H new ATOM 0 HB2 SER A 108 1.861 -6.046 4.978 1.00 0.00 H new ATOM 0 HB3 SER A 108 2.580 -7.530 4.385 1.00 0.00 H new ATOM 0 HG SER A 108 4.089 -6.259 5.629 1.00 0.00 H new ATOM 1730 N TRP A 109 0.672 -4.318 3.425 1.00 0.00 N ATOM 1731 CA TRP A 109 0.164 -2.914 3.517 1.00 0.00 C ATOM 1732 C TRP A 109 -0.957 -2.835 4.522 1.00 0.00 C ATOM 1733 O TRP A 109 -1.764 -3.738 4.645 1.00 0.00 O ATOM 1734 CB TRP A 109 -0.288 -2.333 2.158 1.00 0.00 C ATOM 1735 CG TRP A 109 -1.516 -2.958 1.566 1.00 0.00 C ATOM 1736 CD1 TRP A 109 -1.516 -3.625 0.394 1.00 0.00 C ATOM 1737 CD2 TRP A 109 -2.917 -2.921 2.018 1.00 0.00 C ATOM 1738 NE1 TRP A 109 -2.808 -4.015 0.092 1.00 0.00 N ATOM 1739 CE2 TRP A 109 -3.706 -3.612 1.059 1.00 0.00 C ATOM 1740 CE3 TRP A 109 -3.582 -2.381 3.148 1.00 0.00 C ATOM 1741 CZ2 TRP A 109 -5.087 -3.756 1.212 1.00 0.00 C ATOM 1742 CZ3 TRP A 109 -4.968 -2.532 3.294 1.00 0.00 C ATOM 1743 CH2 TRP A 109 -5.715 -3.216 2.330 1.00 0.00 C ATOM 0 H TRP A 109 0.049 -5.032 3.803 1.00 0.00 H new ATOM 0 HA TRP A 109 1.002 -2.300 3.847 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -0.468 -1.265 2.281 1.00 0.00 H new ATOM 0 HB3 TRP A 109 0.531 -2.438 1.447 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -0.645 -3.823 -0.213 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -3.066 -4.538 -0.745 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -3.017 -1.850 3.900 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -5.664 -4.283 0.467 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -5.463 -2.116 4.159 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -6.782 -3.325 2.454 1.00 0.00 H new ATOM 1754 N THR A 110 -1.005 -1.753 5.256 1.00 0.00 N ATOM 1755 CA THR A 110 -2.076 -1.599 6.272 1.00 0.00 C ATOM 1756 C THR A 110 -2.739 -0.234 6.142 1.00 0.00 C ATOM 1757 O THR A 110 -2.167 0.789 6.457 1.00 0.00 O ATOM 1758 CB THR A 110 -1.500 -1.751 7.675 1.00 0.00 C ATOM 1759 OG1 THR A 110 -0.737 -0.599 8.003 1.00 0.00 O ATOM 1760 CG2 THR A 110 -0.613 -2.994 7.740 1.00 0.00 C ATOM 0 H THR A 110 -0.349 -0.975 5.192 1.00 0.00 H new ATOM 0 HA THR A 110 -2.821 -2.376 6.103 1.00 0.00 H new ATOM 0 HB THR A 110 -2.316 -1.859 8.389 1.00 0.00 H new ATOM 0 HG1 THR A 110 -1.262 0.206 7.813 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.204 -3.097 8.745 1.00 0.00 H new ATOM 0 HG22 THR A 110 -1.205 -3.876 7.497 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.204 -2.896 7.025 1.00 0.00 H new ATOM 1768 N ARG A 111 -3.963 -0.236 5.711 1.00 0.00 N ATOM 1769 CA ARG A 111 -4.730 1.039 5.572 1.00 0.00 C ATOM 1770 C ARG A 111 -5.370 1.329 6.921 1.00 0.00 C ATOM 1771 O ARG A 111 -6.022 0.478 7.467 1.00 0.00 O ATOM 1772 CB ARG A 111 -5.818 0.856 4.507 1.00 0.00 C ATOM 1773 CG ARG A 111 -5.186 0.907 3.113 1.00 0.00 C ATOM 1774 CD ARG A 111 -6.267 0.706 2.044 1.00 0.00 C ATOM 1775 NE ARG A 111 -6.487 1.987 1.313 1.00 0.00 N ATOM 1776 CZ ARG A 111 -5.545 2.477 0.555 1.00 0.00 C ATOM 1777 NH1 ARG A 111 -4.875 1.692 -0.246 1.00 0.00 N ATOM 1778 NH2 ARG A 111 -5.272 3.752 0.595 1.00 0.00 N ATOM 0 H ARG A 111 -4.477 -1.075 5.444 1.00 0.00 H new ATOM 0 HA ARG A 111 -4.081 1.862 5.272 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -6.326 -0.097 4.652 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.572 1.637 4.604 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -4.688 1.865 2.964 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -4.423 0.134 3.021 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -5.964 -0.075 1.347 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -7.196 0.376 2.509 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.375 2.481 1.406 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -5.088 0.695 -0.279 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -4.139 2.076 -0.838 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -5.795 4.366 1.219 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -4.535 4.135 0.002 1.00 0.00 H new ATOM 1792 N GLU A 112 -5.189 2.500 7.478 1.00 0.00 N ATOM 1793 CA GLU A 112 -5.802 2.768 8.814 1.00 0.00 C ATOM 1794 C GLU A 112 -6.530 4.104 8.817 1.00 0.00 C ATOM 1795 O GLU A 112 -6.205 5.010 8.079 1.00 0.00 O ATOM 1796 CB GLU A 112 -4.713 2.768 9.890 1.00 0.00 C ATOM 1797 CG GLU A 112 -5.362 2.841 11.274 1.00 0.00 C ATOM 1798 CD GLU A 112 -4.274 2.892 12.349 1.00 0.00 C ATOM 1799 OE1 GLU A 112 -3.239 3.484 12.089 1.00 0.00 O ATOM 1800 OE2 GLU A 112 -4.495 2.339 13.413 1.00 0.00 O ATOM 0 H GLU A 112 -4.654 3.269 7.075 1.00 0.00 H new ATOM 0 HA GLU A 112 -6.526 1.981 9.027 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -4.106 1.866 9.808 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -4.044 3.616 9.745 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.997 3.724 11.343 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -6.003 1.974 11.432 1.00 0.00 H new ATOM 1807 N LEU A 113 -7.527 4.213 9.646 1.00 0.00 N ATOM 1808 CA LEU A 113 -8.322 5.462 9.737 1.00 0.00 C ATOM 1809 C LEU A 113 -8.009 6.134 11.076 1.00 0.00 C ATOM 1810 O LEU A 113 -7.391 5.538 11.939 1.00 0.00 O ATOM 1811 CB LEU A 113 -9.809 5.081 9.685 1.00 0.00 C ATOM 1812 CG LEU A 113 -10.302 4.774 8.257 1.00 0.00 C ATOM 1813 CD1 LEU A 113 -10.751 6.064 7.578 1.00 0.00 C ATOM 1814 CD2 LEU A 113 -9.230 4.090 7.410 1.00 0.00 C ATOM 0 H LEU A 113 -7.829 3.471 10.277 1.00 0.00 H new ATOM 0 HA LEU A 113 -8.084 6.144 8.921 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -9.977 4.209 10.317 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -10.402 5.896 10.101 1.00 0.00 H new ATOM 0 HG LEU A 113 -11.142 4.084 8.342 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -11.099 5.842 6.569 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -11.562 6.513 8.151 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -9.913 6.760 7.528 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -9.624 3.894 6.413 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -8.357 4.739 7.334 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.942 3.148 7.878 1.00 0.00 H new ATOM 1826 N THR A 114 -8.430 7.358 11.263 1.00 0.00 N ATOM 1827 CA THR A 114 -8.152 8.051 12.558 1.00 0.00 C ATOM 1828 C THR A 114 -9.475 8.417 13.231 1.00 0.00 C ATOM 1829 O THR A 114 -9.839 7.855 14.248 1.00 0.00 O ATOM 1830 CB THR A 114 -7.332 9.317 12.299 1.00 0.00 C ATOM 1831 OG1 THR A 114 -6.157 8.975 11.578 1.00 0.00 O ATOM 1832 CG2 THR A 114 -6.944 9.960 13.632 1.00 0.00 C ATOM 0 H THR A 114 -8.952 7.906 10.579 1.00 0.00 H new ATOM 0 HA THR A 114 -7.585 7.388 13.212 1.00 0.00 H new ATOM 0 HB THR A 114 -7.926 10.023 11.718 1.00 0.00 H new ATOM 0 HG1 THR A 114 -5.439 9.601 11.807 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.360 10.861 13.445 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.846 10.220 14.186 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.349 9.257 14.216 1.00 0.00 H new ATOM 1840 N ASN A 115 -10.199 9.349 12.668 1.00 0.00 N ATOM 1841 CA ASN A 115 -11.504 9.753 13.264 1.00 0.00 C ATOM 1842 C ASN A 115 -12.586 9.661 12.194 1.00 0.00 C ATOM 1843 O ASN A 115 -13.466 8.822 12.254 1.00 0.00 O ATOM 1844 CB ASN A 115 -11.411 11.191 13.779 1.00 0.00 C ATOM 1845 CG ASN A 115 -10.699 11.202 15.133 1.00 0.00 C ATOM 1846 OD1 ASN A 115 -9.463 11.613 15.203 1.00 0.00 O flip ATOM 1847 ND2 ASN A 115 -11.274 10.833 16.138 1.00 0.00 N flip ATOM 0 H ASN A 115 -9.940 9.849 11.817 1.00 0.00 H new ATOM 0 HA ASN A 115 -11.750 9.092 14.095 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -10.868 11.810 13.065 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -12.409 11.619 13.877 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -12.241 10.512 16.084 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -10.790 10.845 17.036 1.00 0.00 H new ATOM 1854 N ASP A 116 -12.516 10.514 11.213 1.00 0.00 N ATOM 1855 CA ASP A 116 -13.523 10.491 10.118 1.00 0.00 C ATOM 1856 C ASP A 116 -12.999 11.324 8.948 1.00 0.00 C ATOM 1857 O ASP A 116 -13.636 12.256 8.493 1.00 0.00 O ATOM 1858 CB ASP A 116 -14.848 11.069 10.624 1.00 0.00 C ATOM 1859 CG ASP A 116 -16.003 10.494 9.802 1.00 0.00 C ATOM 1860 OD1 ASP A 116 -16.017 9.292 9.598 1.00 0.00 O ATOM 1861 OD2 ASP A 116 -16.854 11.266 9.392 1.00 0.00 O ATOM 0 H ASP A 116 -11.798 11.233 11.122 1.00 0.00 H new ATOM 0 HA ASP A 116 -13.692 9.466 9.789 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -14.983 10.828 11.678 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -14.837 12.156 10.544 1.00 0.00 H new ATOM 1866 N GLY A 117 -11.836 10.984 8.460 1.00 0.00 N ATOM 1867 CA GLY A 117 -11.246 11.739 7.316 1.00 0.00 C ATOM 1868 C GLY A 117 -9.729 11.547 7.270 1.00 0.00 C ATOM 1869 O GLY A 117 -9.120 11.775 6.257 1.00 0.00 O ATOM 0 H GLY A 117 -11.266 10.212 8.806 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -11.690 11.398 6.381 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -11.481 12.799 7.413 1.00 0.00 H new ATOM 1873 N GLU A 118 -9.113 11.134 8.348 1.00 0.00 N ATOM 1874 CA GLU A 118 -7.634 10.929 8.329 1.00 0.00 C ATOM 1875 C GLU A 118 -7.354 9.449 8.055 1.00 0.00 C ATOM 1876 O GLU A 118 -7.744 8.584 8.816 1.00 0.00 O ATOM 1877 CB GLU A 118 -7.036 11.343 9.680 1.00 0.00 C ATOM 1878 CG GLU A 118 -6.268 12.659 9.524 1.00 0.00 C ATOM 1879 CD GLU A 118 -5.272 12.810 10.675 1.00 0.00 C ATOM 1880 OE1 GLU A 118 -5.711 12.842 11.813 1.00 0.00 O ATOM 1881 OE2 GLU A 118 -4.087 12.892 10.399 1.00 0.00 O ATOM 0 H GLU A 118 -9.569 10.931 9.238 1.00 0.00 H new ATOM 0 HA GLU A 118 -7.178 11.540 7.550 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -7.829 11.459 10.419 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -6.369 10.563 10.048 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -5.742 12.674 8.570 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -6.963 13.499 9.518 1.00 0.00 H new ATOM 1888 N LEU A 119 -6.705 9.156 6.959 1.00 0.00 N ATOM 1889 CA LEU A 119 -6.421 7.735 6.602 1.00 0.00 C ATOM 1890 C LEU A 119 -4.918 7.542 6.365 1.00 0.00 C ATOM 1891 O LEU A 119 -4.390 7.946 5.350 1.00 0.00 O ATOM 1892 CB LEU A 119 -7.192 7.402 5.319 1.00 0.00 C ATOM 1893 CG LEU A 119 -7.273 5.883 5.126 1.00 0.00 C ATOM 1894 CD1 LEU A 119 -8.670 5.491 4.638 1.00 0.00 C ATOM 1895 CD2 LEU A 119 -6.238 5.445 4.091 1.00 0.00 C ATOM 0 H LEU A 119 -6.357 9.845 6.292 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.731 7.077 7.414 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.196 7.823 5.370 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.698 7.859 4.461 1.00 0.00 H new ATOM 0 HG LEU A 119 -7.073 5.393 6.079 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.719 4.410 4.504 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.412 5.799 5.374 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.875 5.984 3.688 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.295 4.365 3.954 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.439 5.943 3.142 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.240 5.714 4.438 1.00 0.00 H new ATOM 1907 N ILE A 120 -4.227 6.913 7.286 1.00 0.00 N ATOM 1908 CA ILE A 120 -2.759 6.681 7.095 1.00 0.00 C ATOM 1909 C ILE A 120 -2.566 5.296 6.476 1.00 0.00 C ATOM 1910 O ILE A 120 -2.832 4.289 7.093 1.00 0.00 O ATOM 1911 CB ILE A 120 -2.037 6.790 8.442 1.00 0.00 C ATOM 1912 CG1 ILE A 120 -2.525 5.700 9.405 1.00 0.00 C ATOM 1913 CG2 ILE A 120 -2.340 8.157 9.042 1.00 0.00 C ATOM 1914 CD1 ILE A 120 -1.505 4.560 9.444 1.00 0.00 C ATOM 0 H ILE A 120 -4.614 6.552 8.158 1.00 0.00 H new ATOM 0 HA ILE A 120 -2.336 7.433 6.429 1.00 0.00 H new ATOM 0 HB ILE A 120 -0.965 6.664 8.288 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -2.660 6.116 10.403 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -3.496 5.323 9.083 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -1.834 8.253 10.003 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -1.988 8.937 8.367 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -3.415 8.261 9.187 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -1.851 3.785 10.128 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -1.392 4.138 8.445 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -0.544 4.943 9.787 1.00 0.00 H new ATOM 1926 N LEU A 121 -2.142 5.249 5.246 1.00 0.00 N ATOM 1927 CA LEU A 121 -1.980 3.943 4.556 1.00 0.00 C ATOM 1928 C LEU A 121 -0.487 3.629 4.329 1.00 0.00 C ATOM 1929 O LEU A 121 0.253 4.401 3.751 1.00 0.00 O ATOM 1930 CB LEU A 121 -2.785 4.023 3.235 1.00 0.00 C ATOM 1931 CG LEU A 121 -2.456 2.891 2.246 1.00 0.00 C ATOM 1932 CD1 LEU A 121 -1.201 3.255 1.455 1.00 0.00 C ATOM 1933 CD2 LEU A 121 -2.235 1.565 2.976 1.00 0.00 C ATOM 0 H LEU A 121 -1.899 6.066 4.686 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.363 3.122 5.161 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.850 3.995 3.466 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.588 4.982 2.756 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.302 2.771 1.569 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -0.967 2.453 0.754 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.373 4.180 0.904 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.365 3.392 2.141 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -2.004 0.785 2.251 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.405 1.668 3.674 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.138 1.296 3.524 1.00 0.00 H new ATOM 1945 N THR A 122 -0.060 2.483 4.807 1.00 0.00 N ATOM 1946 CA THR A 122 1.365 2.045 4.670 1.00 0.00 C ATOM 1947 C THR A 122 1.438 0.858 3.710 1.00 0.00 C ATOM 1948 O THR A 122 0.473 0.165 3.506 1.00 0.00 O ATOM 1949 CB THR A 122 1.866 1.575 6.031 1.00 0.00 C ATOM 1950 OG1 THR A 122 1.665 2.599 6.995 1.00 0.00 O ATOM 1951 CG2 THR A 122 3.349 1.224 5.948 1.00 0.00 C ATOM 0 H THR A 122 -0.656 1.817 5.299 1.00 0.00 H new ATOM 0 HA THR A 122 1.967 2.874 4.297 1.00 0.00 H new ATOM 0 HB THR A 122 1.309 0.687 6.329 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.326 2.507 7.712 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.699 0.889 6.925 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.494 0.428 5.218 1.00 0.00 H new ATOM 0 HG23 THR A 122 3.915 2.104 5.642 1.00 0.00 H new ATOM 1959 N MET A 123 2.586 0.598 3.155 1.00 0.00 N ATOM 1960 CA MET A 123 2.724 -0.572 2.233 1.00 0.00 C ATOM 1961 C MET A 123 4.188 -0.992 2.175 1.00 0.00 C ATOM 1962 O MET A 123 4.975 -0.448 1.425 1.00 0.00 O ATOM 1963 CB MET A 123 2.228 -0.201 0.838 1.00 0.00 C ATOM 1964 CG MET A 123 2.215 -1.453 -0.051 1.00 0.00 C ATOM 1965 SD MET A 123 3.614 -1.418 -1.202 1.00 0.00 S ATOM 1966 CE MET A 123 3.653 -3.191 -1.564 1.00 0.00 C ATOM 0 H MET A 123 3.437 1.142 3.297 1.00 0.00 H new ATOM 0 HA MET A 123 2.123 -1.402 2.605 1.00 0.00 H new ATOM 0 HB2 MET A 123 1.227 0.226 0.898 1.00 0.00 H new ATOM 0 HB3 MET A 123 2.874 0.561 0.402 1.00 0.00 H new ATOM 0 HG2 MET A 123 2.267 -2.348 0.569 1.00 0.00 H new ATOM 0 HG3 MET A 123 1.279 -1.504 -0.607 1.00 0.00 H new ATOM 0 HE1 MET A 123 4.598 -3.444 -2.044 1.00 0.00 H new ATOM 0 HE2 MET A 123 3.556 -3.754 -0.636 1.00 0.00 H new ATOM 0 HE3 MET A 123 2.828 -3.445 -2.230 1.00 0.00 H new ATOM 1976 N THR A 124 4.556 -1.949 2.983 1.00 0.00 N ATOM 1977 CA THR A 124 5.979 -2.405 3.014 1.00 0.00 C ATOM 1978 C THR A 124 6.308 -3.204 1.765 1.00 0.00 C ATOM 1979 O THR A 124 5.441 -3.563 0.990 1.00 0.00 O ATOM 1980 CB THR A 124 6.289 -3.261 4.271 1.00 0.00 C ATOM 1981 OG1 THR A 124 6.177 -4.649 3.971 1.00 0.00 O ATOM 1982 CG2 THR A 124 5.344 -2.935 5.433 1.00 0.00 C ATOM 0 H THR A 124 3.932 -2.437 3.625 1.00 0.00 H new ATOM 0 HA THR A 124 6.600 -1.510 3.053 1.00 0.00 H new ATOM 0 HB THR A 124 7.309 -3.021 4.570 1.00 0.00 H new ATOM 0 HG1 THR A 124 5.265 -4.953 4.163 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.596 -3.557 6.292 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.448 -1.884 5.702 1.00 0.00 H new ATOM 0 HG23 THR A 124 4.315 -3.132 5.132 1.00 0.00 H new ATOM 1990 N ALA A 125 7.570 -3.485 1.578 1.00 0.00 N ATOM 1991 CA ALA A 125 7.984 -4.270 0.379 1.00 0.00 C ATOM 1992 C ALA A 125 9.478 -4.591 0.396 1.00 0.00 C ATOM 1993 O ALA A 125 10.307 -3.765 0.077 1.00 0.00 O ATOM 1994 CB ALA A 125 7.665 -3.479 -0.883 1.00 0.00 C ATOM 0 H ALA A 125 8.329 -3.207 2.200 1.00 0.00 H new ATOM 0 HA ALA A 125 7.432 -5.210 0.394 1.00 0.00 H new ATOM 0 HB1 ALA A 125 7.968 -4.053 -1.759 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.593 -3.284 -0.929 1.00 0.00 H new ATOM 0 HB3 ALA A 125 8.205 -2.532 -0.865 1.00 0.00 H new ATOM 2000 N ASP A 126 9.831 -5.806 0.729 1.00 0.00 N ATOM 2001 CA ASP A 126 11.278 -6.189 0.742 1.00 0.00 C ATOM 2002 C ASP A 126 12.004 -5.399 1.833 1.00 0.00 C ATOM 2003 O ASP A 126 13.165 -5.069 1.699 1.00 0.00 O ATOM 2004 CB ASP A 126 11.913 -5.881 -0.617 1.00 0.00 C ATOM 2005 CG ASP A 126 12.856 -7.017 -1.020 1.00 0.00 C ATOM 2006 OD1 ASP A 126 13.939 -7.087 -0.463 1.00 0.00 O ATOM 2007 OD2 ASP A 126 12.478 -7.797 -1.879 1.00 0.00 O ATOM 0 H ASP A 126 9.183 -6.549 0.992 1.00 0.00 H new ATOM 0 HA ASP A 126 11.363 -7.257 0.943 1.00 0.00 H new ATOM 0 HB2 ASP A 126 11.136 -5.756 -1.371 1.00 0.00 H new ATOM 0 HB3 ASP A 126 12.462 -4.941 -0.567 1.00 0.00 H new ATOM 2012 N ASP A 127 11.300 -5.108 2.906 1.00 0.00 N ATOM 2013 CA ASP A 127 11.857 -4.344 4.085 1.00 0.00 C ATOM 2014 C ASP A 127 11.592 -2.847 3.931 1.00 0.00 C ATOM 2015 O ASP A 127 11.824 -2.085 4.852 1.00 0.00 O ATOM 2016 CB ASP A 127 13.364 -4.577 4.275 1.00 0.00 C ATOM 2017 CG ASP A 127 13.766 -4.188 5.698 1.00 0.00 C ATOM 2018 OD1 ASP A 127 13.352 -4.874 6.618 1.00 0.00 O ATOM 2019 OD2 ASP A 127 14.482 -3.211 5.845 1.00 0.00 O ATOM 0 H ASP A 127 10.323 -5.378 3.020 1.00 0.00 H new ATOM 0 HA ASP A 127 11.344 -4.721 4.970 1.00 0.00 H new ATOM 0 HB2 ASP A 127 13.607 -5.623 4.091 1.00 0.00 H new ATOM 0 HB3 ASP A 127 13.928 -3.987 3.553 1.00 0.00 H new ATOM 2024 N VAL A 128 11.094 -2.410 2.797 1.00 0.00 N ATOM 2025 CA VAL A 128 10.807 -0.968 2.630 1.00 0.00 C ATOM 2026 C VAL A 128 9.440 -0.679 3.250 1.00 0.00 C ATOM 2027 O VAL A 128 8.738 -1.579 3.666 1.00 0.00 O ATOM 2028 CB VAL A 128 10.793 -0.611 1.128 1.00 0.00 C ATOM 2029 CG1 VAL A 128 12.050 -1.154 0.444 1.00 0.00 C ATOM 2030 CG2 VAL A 128 9.565 -1.209 0.439 1.00 0.00 C ATOM 0 H VAL A 128 10.878 -2.995 1.989 1.00 0.00 H new ATOM 0 HA VAL A 128 11.574 -0.369 3.121 1.00 0.00 H new ATOM 0 HB VAL A 128 10.762 0.475 1.044 1.00 0.00 H new ATOM 0 HG11 VAL A 128 12.028 -0.896 -0.615 1.00 0.00 H new ATOM 0 HG12 VAL A 128 12.934 -0.715 0.907 1.00 0.00 H new ATOM 0 HG13 VAL A 128 12.084 -2.238 0.552 1.00 0.00 H new ATOM 0 HG21 VAL A 128 9.576 -0.945 -0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 128 9.582 -2.294 0.542 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.660 -0.815 0.902 1.00 0.00 H new ATOM 2040 N VAL A 129 9.056 0.559 3.288 1.00 0.00 N ATOM 2041 CA VAL A 129 7.726 0.909 3.840 1.00 0.00 C ATOM 2042 C VAL A 129 7.276 2.251 3.265 1.00 0.00 C ATOM 2043 O VAL A 129 7.905 3.276 3.450 1.00 0.00 O ATOM 2044 CB VAL A 129 7.786 0.888 5.384 1.00 0.00 C ATOM 2045 CG1 VAL A 129 6.910 1.986 6.023 1.00 0.00 C ATOM 2046 CG2 VAL A 129 7.284 -0.477 5.855 1.00 0.00 C ATOM 0 H VAL A 129 9.610 1.350 2.958 1.00 0.00 H new ATOM 0 HA VAL A 129 6.976 0.174 3.547 1.00 0.00 H new ATOM 0 HB VAL A 129 8.816 1.073 5.689 1.00 0.00 H new ATOM 0 HG11 VAL A 129 6.988 1.928 7.109 1.00 0.00 H new ATOM 0 HG12 VAL A 129 7.251 2.965 5.687 1.00 0.00 H new ATOM 0 HG13 VAL A 129 5.871 1.842 5.725 1.00 0.00 H new ATOM 0 HG21 VAL A 129 7.315 -0.520 6.944 1.00 0.00 H new ATOM 0 HG22 VAL A 129 6.259 -0.625 5.515 1.00 0.00 H new ATOM 0 HG23 VAL A 129 7.919 -1.261 5.442 1.00 0.00 H new ATOM 2056 N CYS A 130 6.173 2.226 2.574 1.00 0.00 N ATOM 2057 CA CYS A 130 5.625 3.472 1.971 1.00 0.00 C ATOM 2058 C CYS A 130 4.505 3.992 2.869 1.00 0.00 C ATOM 2059 O CYS A 130 3.359 3.609 2.728 1.00 0.00 O ATOM 2060 CB CYS A 130 5.067 3.167 0.579 1.00 0.00 C ATOM 2061 SG CYS A 130 4.857 4.712 -0.340 1.00 0.00 S ATOM 0 H CYS A 130 5.621 1.386 2.399 1.00 0.00 H new ATOM 0 HA CYS A 130 6.411 4.221 1.881 1.00 0.00 H new ATOM 0 HB2 CYS A 130 5.743 2.502 0.042 1.00 0.00 H new ATOM 0 HB3 CYS A 130 4.111 2.649 0.664 1.00 0.00 H new ATOM 0 HG CYS A 130 4.385 4.452 -1.523 1.00 0.00 H new ATOM 2067 N THR A 131 4.835 4.845 3.803 1.00 0.00 N ATOM 2068 CA THR A 131 3.801 5.383 4.733 1.00 0.00 C ATOM 2069 C THR A 131 3.466 6.825 4.367 1.00 0.00 C ATOM 2070 O THR A 131 4.342 7.640 4.143 1.00 0.00 O ATOM 2071 CB THR A 131 4.340 5.351 6.165 1.00 0.00 C ATOM 2072 OG1 THR A 131 5.287 4.299 6.293 1.00 0.00 O ATOM 2073 CG2 THR A 131 3.188 5.126 7.148 1.00 0.00 C ATOM 0 H THR A 131 5.781 5.193 3.962 1.00 0.00 H new ATOM 0 HA THR A 131 2.903 4.770 4.655 1.00 0.00 H new ATOM 0 HB THR A 131 4.822 6.303 6.389 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.633 4.280 7.210 1.00 0.00 H new ATOM 0 HG21 THR A 131 3.577 5.104 8.166 1.00 0.00 H new ATOM 0 HG22 THR A 131 2.465 5.936 7.053 1.00 0.00 H new ATOM 0 HG23 THR A 131 2.700 4.177 6.926 1.00 0.00 H new ATOM 2081 N ARG A 132 2.202 7.147 4.326 1.00 0.00 N ATOM 2082 CA ARG A 132 1.790 8.544 3.998 1.00 0.00 C ATOM 2083 C ARG A 132 0.362 8.764 4.481 1.00 0.00 C ATOM 2084 O ARG A 132 -0.511 7.945 4.260 1.00 0.00 O ATOM 2085 CB ARG A 132 1.877 8.810 2.484 1.00 0.00 C ATOM 2086 CG ARG A 132 1.553 7.549 1.678 1.00 0.00 C ATOM 2087 CD ARG A 132 1.413 7.919 0.202 1.00 0.00 C ATOM 2088 NE ARG A 132 1.452 6.683 -0.629 1.00 0.00 N ATOM 2089 CZ ARG A 132 1.784 6.754 -1.889 1.00 0.00 C ATOM 2090 NH1 ARG A 132 2.881 7.368 -2.240 1.00 0.00 N ATOM 2091 NH2 ARG A 132 1.021 6.211 -2.797 1.00 0.00 N ATOM 0 H ARG A 132 1.433 6.501 4.506 1.00 0.00 H new ATOM 0 HA ARG A 132 2.467 9.236 4.498 1.00 0.00 H new ATOM 0 HB2 ARG A 132 1.184 9.606 2.212 1.00 0.00 H new ATOM 0 HB3 ARG A 132 2.878 9.159 2.231 1.00 0.00 H new ATOM 0 HG2 ARG A 132 2.342 6.808 1.806 1.00 0.00 H new ATOM 0 HG3 ARG A 132 0.630 7.098 2.041 1.00 0.00 H new ATOM 0 HD2 ARG A 132 0.476 8.451 0.037 1.00 0.00 H new ATOM 0 HD3 ARG A 132 2.218 8.593 -0.092 1.00 0.00 H new ATOM 0 HE ARG A 132 1.219 5.781 -0.213 1.00 0.00 H new ATOM 0 HH11 ARG A 132 3.478 7.792 -1.530 1.00 0.00 H new ATOM 0 HH12 ARG A 132 3.141 7.424 -3.225 1.00 0.00 H new ATOM 0 HH21 ARG A 132 0.164 5.731 -2.522 1.00 0.00 H new ATOM 0 HH22 ARG A 132 1.281 6.267 -3.782 1.00 0.00 H new ATOM 2105 N VAL A 133 0.120 9.864 5.145 1.00 0.00 N ATOM 2106 CA VAL A 133 -1.248 10.144 5.654 1.00 0.00 C ATOM 2107 C VAL A 133 -2.126 10.596 4.491 1.00 0.00 C ATOM 2108 O VAL A 133 -1.645 11.046 3.475 1.00 0.00 O ATOM 2109 CB VAL A 133 -1.178 11.243 6.730 1.00 0.00 C ATOM 2110 CG1 VAL A 133 -2.588 11.707 7.116 1.00 0.00 C ATOM 2111 CG2 VAL A 133 -0.473 10.687 7.970 1.00 0.00 C ATOM 0 H VAL A 133 0.815 10.580 5.355 1.00 0.00 H new ATOM 0 HA VAL A 133 -1.675 9.245 6.098 1.00 0.00 H new ATOM 0 HB VAL A 133 -0.624 12.093 6.332 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -2.520 12.484 7.878 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -3.094 12.105 6.236 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -3.154 10.863 7.509 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -0.420 11.461 8.736 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -1.032 9.834 8.354 1.00 0.00 H new ATOM 0 HG23 VAL A 133 0.535 10.370 7.704 1.00 0.00 H new ATOM 2121 N TYR A 134 -3.411 10.478 4.651 1.00 0.00 N ATOM 2122 CA TYR A 134 -4.347 10.901 3.581 1.00 0.00 C ATOM 2123 C TYR A 134 -5.502 11.675 4.195 1.00 0.00 C ATOM 2124 O TYR A 134 -5.660 11.729 5.400 1.00 0.00 O ATOM 2125 CB TYR A 134 -4.963 9.685 2.914 1.00 0.00 C ATOM 2126 CG TYR A 134 -3.959 8.988 2.050 1.00 0.00 C ATOM 2127 CD1 TYR A 134 -2.958 8.219 2.637 1.00 0.00 C ATOM 2128 CD2 TYR A 134 -4.044 9.096 0.661 1.00 0.00 C ATOM 2129 CE1 TYR A 134 -2.035 7.552 1.838 1.00 0.00 C ATOM 2130 CE2 TYR A 134 -3.120 8.432 -0.145 1.00 0.00 C ATOM 2131 CZ TYR A 134 -2.111 7.656 0.442 1.00 0.00 C ATOM 2132 OH TYR A 134 -1.198 6.994 -0.352 1.00 0.00 O ATOM 0 H TYR A 134 -3.857 10.102 5.488 1.00 0.00 H new ATOM 0 HA TYR A 134 -3.789 11.504 2.865 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -5.336 8.998 3.673 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -5.819 9.989 2.312 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -2.898 8.140 3.712 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -4.824 9.693 0.211 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -1.260 6.954 2.293 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -3.182 8.515 -1.220 1.00 0.00 H new ATOM 0 HH TYR A 134 -1.395 7.173 -1.295 1.00 0.00 H new ATOM 2142 N VAL A 135 -6.346 12.214 3.364 1.00 0.00 N ATOM 2143 CA VAL A 135 -7.545 12.915 3.861 1.00 0.00 C ATOM 2144 C VAL A 135 -8.664 12.652 2.870 1.00 0.00 C ATOM 2145 O VAL A 135 -8.406 12.271 1.754 1.00 0.00 O ATOM 2146 CB VAL A 135 -7.310 14.399 3.994 1.00 0.00 C ATOM 2147 CG1 VAL A 135 -8.548 15.006 4.635 1.00 0.00 C ATOM 2148 CG2 VAL A 135 -6.109 14.637 4.897 1.00 0.00 C ATOM 0 H VAL A 135 -6.249 12.195 2.349 1.00 0.00 H new ATOM 0 HA VAL A 135 -7.800 12.546 4.854 1.00 0.00 H new ATOM 0 HB VAL A 135 -7.120 14.849 3.020 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -8.410 16.082 4.746 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -9.416 14.814 4.004 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -8.707 14.558 5.616 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -5.935 15.708 4.996 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -6.302 14.208 5.880 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -5.228 14.165 4.462 1.00 0.00 H new ATOM 2158 N ARG A 136 -9.896 12.822 3.249 1.00 0.00 N ATOM 2159 CA ARG A 136 -10.982 12.535 2.266 1.00 0.00 C ATOM 2160 C ARG A 136 -11.190 13.748 1.367 1.00 0.00 C ATOM 2161 O ARG A 136 -11.546 14.822 1.811 1.00 0.00 O ATOM 2162 CB ARG A 136 -12.296 12.159 2.956 1.00 0.00 C ATOM 2163 CG ARG A 136 -12.540 10.653 2.809 1.00 0.00 C ATOM 2164 CD ARG A 136 -13.194 10.108 4.080 1.00 0.00 C ATOM 2165 NE ARG A 136 -14.650 10.424 4.065 1.00 0.00 N ATOM 2166 CZ ARG A 136 -15.139 11.283 4.918 1.00 0.00 C ATOM 2167 NH1 ARG A 136 -15.436 10.902 6.131 1.00 0.00 N ATOM 2168 NH2 ARG A 136 -15.333 12.522 4.558 1.00 0.00 N ATOM 0 H ARG A 136 -10.198 13.139 4.171 1.00 0.00 H new ATOM 0 HA ARG A 136 -10.674 11.678 1.667 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -12.255 12.430 4.011 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -13.123 12.716 2.515 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -13.181 10.461 1.948 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -11.597 10.139 2.625 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -13.046 9.030 4.144 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -12.725 10.547 4.960 1.00 0.00 H new ATOM 0 HE ARG A 136 -15.264 9.970 3.389 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -15.286 9.933 6.412 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -15.818 11.573 6.797 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -15.103 12.820 3.610 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -15.715 13.193 5.225 1.00 0.00 H new ATOM 2182 N GLU A 137 -10.959 13.567 0.099 1.00 0.00 N ATOM 2183 CA GLU A 137 -11.120 14.678 -0.884 1.00 0.00 C ATOM 2184 C GLU A 137 -12.522 15.289 -0.774 1.00 0.00 C ATOM 2185 O GLU A 137 -12.617 16.506 -0.755 1.00 0.00 O ATOM 2186 CB GLU A 137 -10.916 14.132 -2.298 1.00 0.00 C ATOM 2187 CG GLU A 137 -10.443 15.260 -3.220 1.00 0.00 C ATOM 2188 CD GLU A 137 -11.630 15.814 -4.010 1.00 0.00 C ATOM 2189 OE1 GLU A 137 -12.301 15.030 -4.661 1.00 0.00 O ATOM 2190 OE2 GLU A 137 -11.848 17.013 -3.951 1.00 0.00 O ATOM 2191 OXT GLU A 137 -13.475 14.530 -0.711 1.00 0.00 O ATOM 0 H GLU A 137 -10.660 12.681 -0.308 1.00 0.00 H new ATOM 0 HA GLU A 137 -10.381 15.450 -0.671 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -10.182 13.327 -2.285 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -11.848 13.708 -2.673 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -9.983 16.054 -2.632 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -9.681 14.888 -3.904 1.00 0.00 H new TER 2198 GLU A 137