USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1037 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 116 TYR OH : rot 180:sc= -0.0704 USER MOD Set 1.2: A 117 GLN : amide:sc= 0.373 X(o=0.3,f=-0.17) USER MOD Set 2.1: A 109 HIS : no HE2:sc= -6.5! C(o=-9.1!,f=-8.9!) USER MOD Set 2.2: A 110 GLN : amide:sc= -0.895 X(o=-9.1,f=-8.8) USER MOD Set 2.3: A 113 GLN : amide:sc= -1.72 K(o=-9.1,f=-11!) USER MOD Set 3.1: A 87 SER OG : rot -160:sc= 0.385 USER MOD Set 3.2: A 95 LYS NZ :NH3+ 146:sc= -0.336 (180deg=-2.96!) USER MOD Set 4.1: A 36 SER OG : rot 68:sc= 0.628 USER MOD Set 4.2: A 39 MET CE :methyl 180:sc= -0.0501 (180deg=0) USER MOD Set 5.1: A 8 CYS SG : rot 146:sc= 0.753 USER MOD Set 5.2: A 34 CYS SG : rot 125:sc= 0.211 USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0106 (180deg=-0.389) USER MOD Single : A 1 MET N :NH3+ -163:sc= -0.0713 (180deg=-0.601) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0.0963 X(o=0.096,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0909 USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 20 CYS SG : rot 80:sc= -2.76! USER MOD Single : A 21 GLN : amide:sc= -5.53! C(o=-5.5!,f=-8.8!) USER MOD Single : A 25 SER OG : rot 4:sc= 0.912 USER MOD Single : A 29 TYR OH : rot 180:sc=-0.00672 USER MOD Single : A 30 GLN : amide:sc= -0.0335 K(o=-0.034,f=-1.9!) USER MOD Single : A 32 GLN : amide:sc= -0.294 X(o=-0.29,f=-0.42) USER MOD Single : A 43 TYR OH : rot 180:sc= -2.74! USER MOD Single : A 45 GLN : amide:sc= -3.81! C(o=-3.8!,f=-6.8!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HE2:sc= -4.4! C(o=-4.4!,f=-10!) USER MOD Single : A 50 GLN : amide:sc= -0.124 X(o=-0.12,f=-0.13) USER MOD Single : A 53 CYS SG : rot -1:sc= -0.107 USER MOD Single : A 60 ASN :FLIP amide:sc= 0.0275 F(o=-0.5,f=0.027) USER MOD Single : A 62 SER OG : rot 180:sc= 0.0114 USER MOD Single : A 68 GLN :FLIP amide:sc= -0.117 F(o=-1.5,f=-0.12) USER MOD Single : A 69 GLN : amide:sc= -0.43 K(o=-0.43,f=-3.4!) USER MOD Single : A 71 CYS SG : rot 30:sc= -3.4! USER MOD Single : A 97 GLN :FLIP amide:sc= 0 F(o=-0.77,f=0) USER MOD Single : A 99 TYR OH : rot -6:sc= -0.305 USER MOD Single : A 100 HIS : no HD1:sc= -20! C(o=-20!,f=-26!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 105 HIS : no HD1:sc= -4.76! C(o=-4.8!,f=-8.3!) USER MOD Single : A 133 THR OG1 : rot 160:sc= 0.0601 USER MOD Single : A 134 MET CE :methyl -156:sc= -0.336 (180deg=-1.82!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.229 8.501 19.174 1.00 0.00 N ATOM 2 CA MET A 1 -2.588 7.155 19.180 1.00 0.00 C ATOM 3 C MET A 1 -1.757 6.936 17.910 1.00 0.00 C ATOM 4 O MET A 1 -1.864 5.919 17.255 1.00 0.00 O ATOM 5 CB MET A 1 -3.757 6.177 19.240 1.00 0.00 C ATOM 6 CG MET A 1 -4.426 6.289 20.609 1.00 0.00 C ATOM 7 SD MET A 1 -5.599 4.930 20.829 1.00 0.00 S ATOM 8 CE MET A 1 -6.866 5.521 19.678 1.00 0.00 C ATOM 0 H1 MET A 1 -3.538 8.743 20.137 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.545 9.210 18.842 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.052 8.491 18.539 1.00 0.00 H new ATOM 0 HA MET A 1 -1.899 7.030 20.015 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.475 6.399 18.450 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.405 5.159 19.074 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.672 6.262 21.396 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.942 7.245 20.695 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.800 4.991 19.862 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.021 6.590 19.825 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.541 5.339 18.654 1.00 0.00 H new ATOM 20 N LEU A 2 -0.925 7.879 17.563 1.00 0.00 N ATOM 21 CA LEU A 2 -0.079 7.711 16.345 1.00 0.00 C ATOM 22 C LEU A 2 0.863 6.523 16.524 1.00 0.00 C ATOM 23 O LEU A 2 1.125 5.774 15.603 1.00 0.00 O ATOM 24 CB LEU A 2 0.727 9.002 16.242 1.00 0.00 C ATOM 25 CG LEU A 2 1.674 8.909 15.048 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.879 9.101 13.757 1.00 0.00 C ATOM 27 CD2 LEU A 2 2.742 10.000 15.155 1.00 0.00 C ATOM 0 H LEU A 2 -0.794 8.756 18.067 1.00 0.00 H new ATOM 0 HA LEU A 2 -0.676 7.525 15.452 1.00 0.00 H new ATOM 0 HB2 LEU A 2 0.058 9.854 16.125 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.293 9.165 17.159 1.00 0.00 H new ATOM 0 HG LEU A 2 2.155 7.931 15.040 1.00 0.00 H new ATOM 0 HD11 LEU A 2 1.552 9.035 12.902 1.00 0.00 H new ATOM 0 HD12 LEU A 2 0.117 8.325 13.680 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.400 10.080 13.767 1.00 0.00 H new ATOM 0 HD21 LEU A 2 3.418 9.933 14.302 1.00 0.00 H new ATOM 0 HD22 LEU A 2 2.263 10.979 15.162 1.00 0.00 H new ATOM 0 HD23 LEU A 2 3.307 9.866 16.077 1.00 0.00 H new ATOM 39 N SER A 3 1.383 6.357 17.709 1.00 0.00 N ATOM 40 CA SER A 3 2.324 5.233 17.972 1.00 0.00 C ATOM 41 C SER A 3 3.303 5.083 16.802 1.00 0.00 C ATOM 42 O SER A 3 4.283 5.797 16.706 1.00 0.00 O ATOM 43 CB SER A 3 1.436 3.996 18.108 1.00 0.00 C ATOM 44 OG SER A 3 0.878 3.959 19.415 1.00 0.00 O ATOM 0 H SER A 3 1.194 6.957 18.512 1.00 0.00 H new ATOM 0 HA SER A 3 2.927 5.393 18.866 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.642 4.021 17.362 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.019 3.094 17.923 1.00 0.00 H new ATOM 0 HG SER A 3 0.307 3.168 19.505 1.00 0.00 H new ATOM 50 N GLN A 4 3.040 4.177 15.906 1.00 0.00 N ATOM 51 CA GLN A 4 3.949 3.996 14.738 1.00 0.00 C ATOM 52 C GLN A 4 3.126 3.826 13.468 1.00 0.00 C ATOM 53 O GLN A 4 1.929 3.634 13.512 1.00 0.00 O ATOM 54 CB GLN A 4 4.739 2.716 15.006 1.00 0.00 C ATOM 55 CG GLN A 4 5.631 2.893 16.230 1.00 0.00 C ATOM 56 CD GLN A 4 6.555 1.681 16.351 1.00 0.00 C ATOM 57 OE1 GLN A 4 6.097 0.564 16.514 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.847 1.850 16.267 1.00 0.00 N ATOM 0 H GLN A 4 2.234 3.552 15.930 1.00 0.00 H new ATOM 0 HA GLN A 4 4.606 4.856 14.608 1.00 0.00 H new ATOM 0 HB2 GLN A 4 4.053 1.883 15.164 1.00 0.00 H new ATOM 0 HB3 GLN A 4 5.348 2.467 14.137 1.00 0.00 H new ATOM 0 HG2 GLN A 4 6.218 3.807 16.139 1.00 0.00 H new ATOM 0 HG3 GLN A 4 5.022 2.994 17.128 1.00 0.00 H new ATOM 0 HE21 GLN A 4 8.231 2.785 16.130 1.00 0.00 H new ATOM 0 HE22 GLN A 4 8.472 1.047 16.338 1.00 0.00 H new ATOM 67 N ILE A 5 3.762 3.879 12.335 1.00 0.00 N ATOM 68 CA ILE A 5 3.019 3.707 11.062 1.00 0.00 C ATOM 69 C ILE A 5 3.153 2.273 10.579 1.00 0.00 C ATOM 70 O ILE A 5 4.222 1.693 10.600 1.00 0.00 O ATOM 71 CB ILE A 5 3.683 4.661 10.081 1.00 0.00 C ATOM 72 CG1 ILE A 5 3.674 6.065 10.681 1.00 0.00 C ATOM 73 CG2 ILE A 5 2.911 4.653 8.762 1.00 0.00 C ATOM 74 CD1 ILE A 5 4.724 6.923 9.980 1.00 0.00 C ATOM 0 H ILE A 5 4.765 4.034 12.236 1.00 0.00 H new ATOM 0 HA ILE A 5 1.955 3.915 11.171 1.00 0.00 H new ATOM 0 HB ILE A 5 4.710 4.350 9.891 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.687 6.514 10.568 1.00 0.00 H new ATOM 0 HG13 ILE A 5 3.882 6.017 11.750 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.386 5.336 8.058 1.00 0.00 H new ATOM 0 HG22 ILE A 5 2.912 3.645 8.346 1.00 0.00 H new ATOM 0 HG23 ILE A 5 1.884 4.971 8.940 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.719 7.926 10.407 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.709 6.476 10.116 1.00 0.00 H new ATOM 0 HD13 ILE A 5 4.495 6.981 8.916 1.00 0.00 H new ATOM 86 N ALA A 6 2.073 1.697 10.145 1.00 0.00 N ATOM 87 CA ALA A 6 2.126 0.298 9.662 1.00 0.00 C ATOM 88 C ALA A 6 2.284 0.271 8.150 1.00 0.00 C ATOM 89 O ALA A 6 1.393 0.638 7.412 1.00 0.00 O ATOM 90 CB ALA A 6 0.787 -0.293 10.062 1.00 0.00 C ATOM 0 H ALA A 6 1.154 2.137 10.104 1.00 0.00 H new ATOM 0 HA ALA A 6 2.966 -0.257 10.080 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.738 -1.334 9.742 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.675 -0.241 11.145 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.016 0.271 9.587 1.00 0.00 H new ATOM 96 N ILE A 7 3.412 -0.167 7.683 1.00 0.00 N ATOM 97 CA ILE A 7 3.626 -0.225 6.215 1.00 0.00 C ATOM 98 C ILE A 7 3.858 -1.668 5.771 1.00 0.00 C ATOM 99 O ILE A 7 4.819 -2.302 6.157 1.00 0.00 O ATOM 100 CB ILE A 7 4.873 0.605 5.957 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.588 2.069 6.293 1.00 0.00 C ATOM 102 CG2 ILE A 7 5.256 0.470 4.485 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.796 2.922 5.911 1.00 0.00 C ATOM 0 H ILE A 7 4.196 -0.488 8.252 1.00 0.00 H new ATOM 0 HA ILE A 7 2.763 0.150 5.664 1.00 0.00 H new ATOM 0 HB ILE A 7 5.695 0.254 6.581 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.703 2.411 5.756 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.376 2.175 7.357 1.00 0.00 H new ATOM 0 HG21 ILE A 7 6.150 1.061 4.286 1.00 0.00 H new ATOM 0 HG22 ILE A 7 5.455 -0.577 4.255 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.437 0.829 3.862 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.594 3.966 6.150 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.670 2.585 6.468 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.987 2.825 4.842 1.00 0.00 H new ATOM 115 N CYS A 8 2.987 -2.189 4.958 1.00 0.00 N ATOM 116 CA CYS A 8 3.157 -3.589 4.490 1.00 0.00 C ATOM 117 C CYS A 8 3.699 -3.596 3.062 1.00 0.00 C ATOM 118 O CYS A 8 3.118 -3.020 2.162 1.00 0.00 O ATOM 119 CB CYS A 8 1.754 -4.190 4.546 1.00 0.00 C ATOM 120 SG CYS A 8 1.844 -5.982 4.320 1.00 0.00 S ATOM 0 H CYS A 8 2.164 -1.706 4.597 1.00 0.00 H new ATOM 0 HA CYS A 8 3.863 -4.155 5.097 1.00 0.00 H new ATOM 0 HB2 CYS A 8 1.287 -3.958 5.503 1.00 0.00 H new ATOM 0 HB3 CYS A 8 1.128 -3.748 3.771 1.00 0.00 H new ATOM 0 HG CYS A 8 0.925 -6.557 5.038 1.00 0.00 H new ATOM 126 N ILE A 9 4.814 -4.236 2.844 1.00 0.00 N ATOM 127 CA ILE A 9 5.384 -4.264 1.474 1.00 0.00 C ATOM 128 C ILE A 9 5.354 -5.677 0.918 1.00 0.00 C ATOM 129 O ILE A 9 5.504 -6.645 1.634 1.00 0.00 O ATOM 130 CB ILE A 9 6.831 -3.816 1.628 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.548 -3.972 0.287 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.519 -4.702 2.664 1.00 0.00 C ATOM 133 CD1 ILE A 9 8.991 -3.491 0.426 1.00 0.00 C ATOM 0 H ILE A 9 5.350 -4.737 3.552 1.00 0.00 H new ATOM 0 HA ILE A 9 4.819 -3.626 0.794 1.00 0.00 H new ATOM 0 HB ILE A 9 6.864 -2.775 1.948 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.529 -5.015 -0.029 1.00 0.00 H new ATOM 0 HG13 ILE A 9 7.033 -3.396 -0.482 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.556 -4.388 2.780 1.00 0.00 H new ATOM 0 HG22 ILE A 9 7.003 -4.612 3.620 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.489 -5.740 2.332 1.00 0.00 H new ATOM 0 HD11 ILE A 9 9.505 -3.601 -0.529 1.00 0.00 H new ATOM 0 HD12 ILE A 9 8.998 -2.442 0.723 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.501 -4.086 1.183 1.00 0.00 H new ATOM 145 N TRP A 10 5.199 -5.803 -0.364 1.00 0.00 N ATOM 146 CA TRP A 10 5.203 -7.161 -0.965 1.00 0.00 C ATOM 147 C TRP A 10 6.321 -7.248 -1.991 1.00 0.00 C ATOM 148 O TRP A 10 6.262 -6.660 -3.053 1.00 0.00 O ATOM 149 CB TRP A 10 3.846 -7.362 -1.631 1.00 0.00 C ATOM 150 CG TRP A 10 3.929 -8.597 -2.473 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.822 -9.597 -2.285 1.00 0.00 C ATOM 152 CD2 TRP A 10 3.124 -8.978 -3.620 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.616 -10.566 -3.243 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.585 -10.230 -4.094 1.00 0.00 C ATOM 155 CE3 TRP A 10 2.059 -8.363 -4.299 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.999 -10.857 -5.188 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.467 -8.993 -5.404 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.940 -10.234 -5.853 1.00 0.00 C ATOM 0 H TRP A 10 5.070 -5.032 -1.019 1.00 0.00 H new ATOM 0 HA TRP A 10 5.370 -7.932 -0.213 1.00 0.00 H new ATOM 0 HB2 TRP A 10 3.063 -7.464 -0.880 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.589 -6.498 -2.244 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.574 -9.630 -1.510 1.00 0.00 H new ATOM 0 HE1 TRP A 10 5.160 -11.426 -3.314 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.694 -7.401 -3.969 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 3.360 -11.819 -5.521 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.641 -8.518 -5.912 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.487 -10.707 -6.711 1.00 0.00 H new ATOM 169 N VAL A 11 7.348 -7.966 -1.670 1.00 0.00 N ATOM 170 CA VAL A 11 8.487 -8.080 -2.607 1.00 0.00 C ATOM 171 C VAL A 11 9.186 -9.429 -2.424 1.00 0.00 C ATOM 172 O VAL A 11 9.460 -9.852 -1.316 1.00 0.00 O ATOM 173 CB VAL A 11 9.381 -6.918 -2.199 1.00 0.00 C ATOM 174 CG1 VAL A 11 9.653 -6.989 -0.699 1.00 0.00 C ATOM 175 CG2 VAL A 11 10.698 -6.985 -2.960 1.00 0.00 C ATOM 0 H VAL A 11 7.450 -8.482 -0.796 1.00 0.00 H new ATOM 0 HA VAL A 11 8.204 -8.038 -3.659 1.00 0.00 H new ATOM 0 HB VAL A 11 8.880 -5.979 -2.435 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.293 -6.157 -0.406 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.710 -6.931 -0.155 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.150 -7.930 -0.463 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.333 -6.150 -2.663 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.203 -7.924 -2.732 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.503 -6.929 -4.031 1.00 0.00 H new ATOM 185 N GLU A 12 9.471 -10.110 -3.498 1.00 0.00 N ATOM 186 CA GLU A 12 10.146 -11.436 -3.386 1.00 0.00 C ATOM 187 C GLU A 12 11.669 -11.277 -3.421 1.00 0.00 C ATOM 188 O GLU A 12 12.403 -12.147 -2.989 1.00 0.00 O ATOM 189 CB GLU A 12 9.619 -12.229 -4.577 1.00 0.00 C ATOM 190 CG GLU A 12 8.209 -12.717 -4.231 1.00 0.00 C ATOM 191 CD GLU A 12 7.572 -13.405 -5.437 1.00 0.00 C ATOM 192 OE1 GLU A 12 8.295 -13.724 -6.366 1.00 0.00 O ATOM 193 OE2 GLU A 12 6.369 -13.602 -5.408 1.00 0.00 O ATOM 0 H GLU A 12 9.266 -9.807 -4.450 1.00 0.00 H new ATOM 0 HA GLU A 12 9.936 -11.942 -2.444 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.598 -11.606 -5.471 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.273 -13.074 -4.792 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.253 -13.410 -3.391 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.593 -11.875 -3.917 1.00 0.00 H new ATOM 200 N SER A 13 12.149 -10.165 -3.906 1.00 0.00 N ATOM 201 CA SER A 13 13.625 -9.940 -3.940 1.00 0.00 C ATOM 202 C SER A 13 14.046 -9.206 -2.657 1.00 0.00 C ATOM 203 O SER A 13 13.505 -8.170 -2.323 1.00 0.00 O ATOM 204 CB SER A 13 13.868 -9.057 -5.165 1.00 0.00 C ATOM 205 OG SER A 13 15.146 -9.357 -5.718 1.00 0.00 O ATOM 0 H SER A 13 11.585 -9.402 -4.280 1.00 0.00 H new ATOM 0 HA SER A 13 14.195 -10.867 -3.998 1.00 0.00 H new ATOM 0 HB2 SER A 13 13.089 -9.225 -5.909 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.819 -8.005 -4.884 1.00 0.00 H new ATOM 0 HG SER A 13 15.303 -8.793 -6.504 1.00 0.00 H new ATOM 211 N THR A 14 14.992 -9.736 -1.926 1.00 0.00 N ATOM 212 CA THR A 14 15.420 -9.063 -0.660 1.00 0.00 C ATOM 213 C THR A 14 15.973 -7.667 -0.954 1.00 0.00 C ATOM 214 O THR A 14 15.725 -6.723 -0.228 1.00 0.00 O ATOM 215 CB THR A 14 16.519 -9.958 -0.093 1.00 0.00 C ATOM 216 OG1 THR A 14 16.238 -11.310 -0.427 1.00 0.00 O ATOM 217 CG2 THR A 14 16.586 -9.811 1.429 1.00 0.00 C ATOM 0 H THR A 14 15.485 -10.601 -2.148 1.00 0.00 H new ATOM 0 HA THR A 14 14.591 -8.934 0.035 1.00 0.00 H new ATOM 0 HB THR A 14 17.478 -9.663 -0.519 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.942 -11.889 -0.067 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.373 -10.454 1.822 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.803 -8.774 1.685 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.630 -10.100 1.865 1.00 0.00 H new ATOM 225 N ALA A 15 16.726 -7.530 -2.009 1.00 0.00 N ATOM 226 CA ALA A 15 17.296 -6.196 -2.349 1.00 0.00 C ATOM 227 C ALA A 15 16.170 -5.166 -2.472 1.00 0.00 C ATOM 228 O ALA A 15 16.241 -4.090 -1.910 1.00 0.00 O ATOM 229 CB ALA A 15 18.001 -6.399 -3.685 1.00 0.00 C ATOM 0 H ALA A 15 16.972 -8.284 -2.651 1.00 0.00 H new ATOM 0 HA ALA A 15 17.981 -5.824 -1.587 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.449 -5.459 -4.006 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.780 -7.153 -3.574 1.00 0.00 H new ATOM 0 HB3 ALA A 15 17.279 -6.730 -4.431 1.00 0.00 H new ATOM 235 N ILE A 16 15.117 -5.492 -3.171 1.00 0.00 N ATOM 236 CA ILE A 16 13.986 -4.529 -3.276 1.00 0.00 C ATOM 237 C ILE A 16 13.394 -4.371 -1.887 1.00 0.00 C ATOM 238 O ILE A 16 13.119 -3.285 -1.421 1.00 0.00 O ATOM 239 CB ILE A 16 12.976 -5.174 -4.232 1.00 0.00 C ATOM 240 CG1 ILE A 16 13.529 -5.128 -5.658 1.00 0.00 C ATOM 241 CG2 ILE A 16 11.646 -4.415 -4.170 1.00 0.00 C ATOM 242 CD1 ILE A 16 12.802 -6.153 -6.533 1.00 0.00 C ATOM 0 H ILE A 16 14.992 -6.374 -3.669 1.00 0.00 H new ATOM 0 HA ILE A 16 14.281 -3.547 -3.645 1.00 0.00 H new ATOM 0 HB ILE A 16 12.809 -6.210 -3.939 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.404 -4.128 -6.074 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.599 -5.338 -5.649 1.00 0.00 H new ATOM 0 HG21 ILE A 16 10.931 -4.877 -4.851 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.254 -4.451 -3.154 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.806 -3.377 -4.461 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.201 -6.114 -7.547 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.950 -7.152 -6.123 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.737 -5.923 -6.554 1.00 0.00 H new ATOM 254 N LEU A 17 13.237 -5.467 -1.216 1.00 0.00 N ATOM 255 CA LEU A 17 12.699 -5.435 0.158 1.00 0.00 C ATOM 256 C LEU A 17 13.588 -4.547 1.034 1.00 0.00 C ATOM 257 O LEU A 17 13.111 -3.763 1.828 1.00 0.00 O ATOM 258 CB LEU A 17 12.752 -6.904 0.592 1.00 0.00 C ATOM 259 CG LEU A 17 12.605 -7.035 2.107 1.00 0.00 C ATOM 260 CD1 LEU A 17 13.935 -6.680 2.773 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.500 -6.101 2.617 1.00 0.00 C ATOM 0 H LEU A 17 13.463 -6.397 -1.568 1.00 0.00 H new ATOM 0 HA LEU A 17 11.693 -5.024 0.236 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.957 -7.462 0.097 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.697 -7.346 0.275 1.00 0.00 H new ATOM 0 HG LEU A 17 12.333 -8.061 2.355 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.836 -6.772 3.855 1.00 0.00 H new ATOM 0 HD12 LEU A 17 14.711 -7.359 2.421 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.207 -5.655 2.519 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.406 -6.205 3.698 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.754 -5.070 2.372 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.554 -6.364 2.144 1.00 0.00 H new ATOM 273 N GLN A 18 14.883 -4.652 0.882 1.00 0.00 N ATOM 274 CA GLN A 18 15.803 -3.804 1.699 1.00 0.00 C ATOM 275 C GLN A 18 15.707 -2.346 1.256 1.00 0.00 C ATOM 276 O GLN A 18 15.479 -1.459 2.056 1.00 0.00 O ATOM 277 CB GLN A 18 17.205 -4.350 1.435 1.00 0.00 C ATOM 278 CG GLN A 18 17.383 -5.675 2.168 1.00 0.00 C ATOM 279 CD GLN A 18 18.800 -6.200 1.936 1.00 0.00 C ATOM 280 OE1 GLN A 18 19.391 -5.951 0.904 1.00 0.00 O ATOM 281 NE2 GLN A 18 19.377 -6.917 2.863 1.00 0.00 N ATOM 0 H GLN A 18 15.343 -5.287 0.229 1.00 0.00 H new ATOM 0 HA GLN A 18 15.552 -3.835 2.759 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.356 -4.492 0.365 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.955 -3.633 1.770 1.00 0.00 H new ATOM 0 HG2 GLN A 18 17.204 -5.540 3.235 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.652 -6.401 1.812 1.00 0.00 H new ATOM 0 HE21 GLN A 18 18.881 -7.126 3.729 1.00 0.00 H new ATOM 0 HE22 GLN A 18 20.324 -7.268 2.721 1.00 0.00 H new ATOM 290 N ASP A 19 15.885 -2.080 -0.007 1.00 0.00 N ATOM 291 CA ASP A 19 15.796 -0.674 -0.465 1.00 0.00 C ATOM 292 C ASP A 19 14.422 -0.110 -0.109 1.00 0.00 C ATOM 293 O ASP A 19 14.303 0.998 0.377 1.00 0.00 O ATOM 294 CB ASP A 19 15.969 -0.732 -1.980 1.00 0.00 C ATOM 295 CG ASP A 19 17.394 -1.171 -2.315 1.00 0.00 C ATOM 296 OD1 ASP A 19 18.131 -1.475 -1.392 1.00 0.00 O ATOM 297 OD2 ASP A 19 17.724 -1.197 -3.488 1.00 0.00 O ATOM 0 H ASP A 19 16.086 -2.769 -0.732 1.00 0.00 H new ATOM 0 HA ASP A 19 16.547 -0.035 0.001 1.00 0.00 H new ATOM 0 HB2 ASP A 19 15.251 -1.430 -2.412 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.766 0.246 -2.417 1.00 0.00 H new ATOM 302 N CYS A 20 13.380 -0.862 -0.345 1.00 0.00 N ATOM 303 CA CYS A 20 12.023 -0.349 -0.018 1.00 0.00 C ATOM 304 C CYS A 20 11.892 -0.089 1.485 1.00 0.00 C ATOM 305 O CYS A 20 11.361 0.923 1.901 1.00 0.00 O ATOM 306 CB CYS A 20 11.042 -1.433 -0.465 1.00 0.00 C ATOM 307 SG CYS A 20 11.125 -1.618 -2.264 1.00 0.00 S ATOM 0 H CYS A 20 13.411 -1.799 -0.746 1.00 0.00 H new ATOM 0 HA CYS A 20 11.825 0.598 -0.521 1.00 0.00 H new ATOM 0 HB2 CYS A 20 11.283 -2.379 0.020 1.00 0.00 H new ATOM 0 HB3 CYS A 20 10.029 -1.169 -0.162 1.00 0.00 H new ATOM 0 HG CYS A 20 12.164 -2.333 -2.579 1.00 0.00 H new ATOM 313 N GLN A 21 12.368 -0.985 2.305 1.00 0.00 N ATOM 314 CA GLN A 21 12.261 -0.766 3.773 1.00 0.00 C ATOM 315 C GLN A 21 13.396 0.134 4.258 1.00 0.00 C ATOM 316 O GLN A 21 13.283 0.801 5.270 1.00 0.00 O ATOM 317 CB GLN A 21 12.351 -2.157 4.396 1.00 0.00 C ATOM 318 CG GLN A 21 11.065 -2.924 4.074 1.00 0.00 C ATOM 319 CD GLN A 21 10.881 -4.076 5.060 1.00 0.00 C ATOM 320 OE1 GLN A 21 9.786 -4.573 5.229 1.00 0.00 O ATOM 321 NE2 GLN A 21 11.906 -4.526 5.723 1.00 0.00 N ATOM 0 H GLN A 21 12.823 -1.853 2.024 1.00 0.00 H new ATOM 0 HA GLN A 21 11.332 -0.267 4.050 1.00 0.00 H new ATOM 0 HB2 GLN A 21 13.217 -2.691 4.005 1.00 0.00 H new ATOM 0 HB3 GLN A 21 12.485 -2.080 5.475 1.00 0.00 H new ATOM 0 HG2 GLN A 21 10.209 -2.251 4.124 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.108 -3.310 3.055 1.00 0.00 H new ATOM 0 HE21 GLN A 21 12.827 -4.110 5.583 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.789 -5.295 6.383 1.00 0.00 H new ATOM 330 N ARG A 22 14.485 0.183 3.543 1.00 0.00 N ATOM 331 CA ARG A 22 15.598 1.069 3.981 1.00 0.00 C ATOM 332 C ARG A 22 15.095 2.500 4.036 1.00 0.00 C ATOM 333 O ARG A 22 15.261 3.195 5.018 1.00 0.00 O ATOM 334 CB ARG A 22 16.678 0.928 2.919 1.00 0.00 C ATOM 335 CG ARG A 22 17.590 -0.239 3.282 1.00 0.00 C ATOM 336 CD ARG A 22 18.363 -0.673 2.040 1.00 0.00 C ATOM 337 NE ARG A 22 19.763 -0.875 2.500 1.00 0.00 N ATOM 338 CZ ARG A 22 20.092 -1.953 3.160 1.00 0.00 C ATOM 339 NH1 ARG A 22 19.176 -2.812 3.519 1.00 0.00 N ATOM 340 NH2 ARG A 22 21.340 -2.158 3.484 1.00 0.00 N ATOM 0 H ARG A 22 14.652 -0.344 2.686 1.00 0.00 H new ATOM 0 HA ARG A 22 15.979 0.806 4.968 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.224 0.760 1.942 1.00 0.00 H new ATOM 0 HB3 ARG A 22 17.257 1.849 2.848 1.00 0.00 H new ATOM 0 HG2 ARG A 22 18.281 0.055 4.072 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.001 -1.071 3.668 1.00 0.00 H new ATOM 0 HD2 ARG A 22 17.950 -1.591 1.621 1.00 0.00 H new ATOM 0 HD3 ARG A 22 18.311 0.086 1.259 1.00 0.00 H new ATOM 0 HE ARG A 22 20.470 -0.168 2.299 1.00 0.00 H new ATOM 0 HH11 ARG A 22 18.198 -2.643 3.284 1.00 0.00 H new ATOM 0 HH12 ARG A 22 19.439 -3.652 4.034 1.00 0.00 H new ATOM 0 HH21 ARG A 22 22.053 -1.478 3.222 1.00 0.00 H new ATOM 0 HH22 ARG A 22 21.602 -2.998 3.999 1.00 0.00 H new ATOM 354 N ALA A 23 14.458 2.941 2.992 1.00 0.00 N ATOM 355 CA ALA A 23 13.914 4.317 2.996 1.00 0.00 C ATOM 356 C ALA A 23 12.924 4.443 4.153 1.00 0.00 C ATOM 357 O ALA A 23 12.943 5.390 4.913 1.00 0.00 O ATOM 358 CB ALA A 23 13.218 4.457 1.650 1.00 0.00 C ATOM 0 H ALA A 23 14.292 2.407 2.139 1.00 0.00 H new ATOM 0 HA ALA A 23 14.670 5.091 3.129 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.783 5.453 1.567 1.00 0.00 H new ATOM 0 HB2 ALA A 23 13.942 4.309 0.849 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.429 3.709 1.569 1.00 0.00 H new ATOM 364 N LEU A 24 12.060 3.470 4.299 1.00 0.00 N ATOM 365 CA LEU A 24 11.076 3.490 5.409 1.00 0.00 C ATOM 366 C LEU A 24 11.691 2.805 6.634 1.00 0.00 C ATOM 367 O LEU A 24 11.252 1.760 7.075 1.00 0.00 O ATOM 368 CB LEU A 24 9.892 2.705 4.858 1.00 0.00 C ATOM 369 CG LEU A 24 9.449 3.376 3.558 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.366 2.548 2.865 1.00 0.00 C ATOM 371 CD2 LEU A 24 8.901 4.765 3.874 1.00 0.00 C ATOM 0 H LEU A 24 11.999 2.657 3.687 1.00 0.00 H new ATOM 0 HA LEU A 24 10.781 4.490 5.727 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.173 1.668 4.676 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.074 2.692 5.579 1.00 0.00 H new ATOM 0 HG LEU A 24 10.307 3.454 2.891 1.00 0.00 H new ATOM 0 HD11 LEU A 24 8.065 3.043 1.942 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.757 1.557 2.634 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.503 2.453 3.524 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.583 5.249 2.951 1.00 0.00 H new ATOM 0 HD22 LEU A 24 8.050 4.675 4.549 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.679 5.364 4.349 1.00 0.00 H new ATOM 383 N SER A 25 12.713 3.405 7.176 1.00 0.00 N ATOM 384 CA SER A 25 13.389 2.825 8.368 1.00 0.00 C ATOM 385 C SER A 25 13.123 3.707 9.588 1.00 0.00 C ATOM 386 O SER A 25 13.589 3.424 10.674 1.00 0.00 O ATOM 387 CB SER A 25 14.881 2.815 8.028 1.00 0.00 C ATOM 388 OG SER A 25 15.640 2.717 9.231 1.00 0.00 O ATOM 0 H SER A 25 13.112 4.281 6.840 1.00 0.00 H new ATOM 0 HA SER A 25 13.028 1.824 8.603 1.00 0.00 H new ATOM 0 HB2 SER A 25 15.110 1.976 7.371 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.149 3.724 7.489 1.00 0.00 H new ATOM 0 HG SER A 25 15.033 2.614 9.993 1.00 0.00 H new ATOM 394 N ALA A 26 12.373 4.770 9.416 1.00 0.00 N ATOM 395 CA ALA A 26 12.068 5.661 10.574 1.00 0.00 C ATOM 396 C ALA A 26 11.799 4.796 11.806 1.00 0.00 C ATOM 397 O ALA A 26 11.310 3.689 11.700 1.00 0.00 O ATOM 398 CB ALA A 26 10.811 6.444 10.171 1.00 0.00 C ATOM 0 H ALA A 26 11.962 5.056 8.527 1.00 0.00 H new ATOM 0 HA ALA A 26 12.888 6.338 10.815 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.529 7.120 10.978 1.00 0.00 H new ATOM 0 HB2 ALA A 26 11.015 7.021 9.269 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.994 5.748 9.979 1.00 0.00 H new ATOM 404 N ASP A 27 12.136 5.270 12.967 1.00 0.00 N ATOM 405 CA ASP A 27 11.920 4.449 14.186 1.00 0.00 C ATOM 406 C ASP A 27 10.422 4.298 14.479 1.00 0.00 C ATOM 407 O ASP A 27 10.023 3.563 15.364 1.00 0.00 O ATOM 408 CB ASP A 27 12.645 5.205 15.299 1.00 0.00 C ATOM 409 CG ASP A 27 14.151 4.976 15.147 1.00 0.00 C ATOM 410 OD1 ASP A 27 14.519 3.938 14.620 1.00 0.00 O ATOM 411 OD2 ASP A 27 14.909 5.841 15.557 1.00 0.00 O ATOM 0 H ASP A 27 12.551 6.188 13.126 1.00 0.00 H new ATOM 0 HA ASP A 27 12.302 3.434 14.080 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.417 6.269 15.243 1.00 0.00 H new ATOM 0 HB3 ASP A 27 12.306 4.857 16.275 1.00 0.00 H new ATOM 416 N ARG A 28 9.588 4.972 13.738 1.00 0.00 N ATOM 417 CA ARG A 28 8.119 4.849 13.966 1.00 0.00 C ATOM 418 C ARG A 28 7.476 4.055 12.829 1.00 0.00 C ATOM 419 O ARG A 28 6.278 4.086 12.636 1.00 0.00 O ATOM 420 CB ARG A 28 7.599 6.278 13.964 1.00 0.00 C ATOM 421 CG ARG A 28 7.783 6.874 12.569 1.00 0.00 C ATOM 422 CD ARG A 28 7.279 8.311 12.562 1.00 0.00 C ATOM 423 NE ARG A 28 8.391 9.096 13.160 1.00 0.00 N ATOM 424 CZ ARG A 28 8.169 10.289 13.634 1.00 0.00 C ATOM 425 NH1 ARG A 28 6.961 10.786 13.622 1.00 0.00 N ATOM 426 NH2 ARG A 28 9.156 10.980 14.127 1.00 0.00 N ATOM 0 H ARG A 28 9.859 5.603 12.984 1.00 0.00 H new ATOM 0 HA ARG A 28 7.889 4.329 14.896 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.546 6.296 14.245 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.135 6.875 14.702 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.835 6.845 12.285 1.00 0.00 H new ATOM 0 HG3 ARG A 28 7.238 6.282 11.834 1.00 0.00 H new ATOM 0 HD2 ARG A 28 7.054 8.648 11.550 1.00 0.00 H new ATOM 0 HD3 ARG A 28 6.363 8.414 13.143 1.00 0.00 H new ATOM 0 HE ARG A 28 9.330 8.700 13.199 1.00 0.00 H new ATOM 0 HH11 ARG A 28 6.189 10.240 13.241 1.00 0.00 H new ATOM 0 HH12 ARG A 28 6.790 11.720 13.994 1.00 0.00 H new ATOM 0 HH21 ARG A 28 10.097 10.587 14.141 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.988 11.915 14.500 1.00 0.00 H new ATOM 440 N TYR A 29 8.263 3.353 12.064 1.00 0.00 N ATOM 441 CA TYR A 29 7.688 2.576 10.938 1.00 0.00 C ATOM 442 C TYR A 29 7.562 1.105 11.314 1.00 0.00 C ATOM 443 O TYR A 29 8.416 0.538 11.967 1.00 0.00 O ATOM 444 CB TYR A 29 8.686 2.743 9.793 1.00 0.00 C ATOM 445 CG TYR A 29 8.289 3.926 8.950 1.00 0.00 C ATOM 446 CD1 TYR A 29 6.946 4.149 8.632 1.00 0.00 C ATOM 447 CD2 TYR A 29 9.268 4.810 8.500 1.00 0.00 C ATOM 448 CE1 TYR A 29 6.587 5.264 7.868 1.00 0.00 C ATOM 449 CE2 TYR A 29 8.913 5.921 7.734 1.00 0.00 C ATOM 450 CZ TYR A 29 7.571 6.152 7.418 1.00 0.00 C ATOM 451 OH TYR A 29 7.219 7.253 6.664 1.00 0.00 O ATOM 0 H TYR A 29 9.275 3.285 12.171 1.00 0.00 H new ATOM 0 HA TYR A 29 6.690 2.923 10.671 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.691 2.887 10.190 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.710 1.840 9.183 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.187 3.462 8.976 1.00 0.00 H new ATOM 0 HD2 TYR A 29 10.305 4.635 8.745 1.00 0.00 H new ATOM 0 HE1 TYR A 29 5.550 5.440 7.625 1.00 0.00 H new ATOM 0 HE2 TYR A 29 9.675 6.602 7.385 1.00 0.00 H new ATOM 0 HH TYR A 29 8.023 7.764 6.436 1.00 0.00 H new ATOM 461 N GLN A 30 6.511 0.480 10.880 1.00 0.00 N ATOM 462 CA GLN A 30 6.330 -0.967 11.171 1.00 0.00 C ATOM 463 C GLN A 30 6.334 -1.712 9.841 1.00 0.00 C ATOM 464 O GLN A 30 5.301 -1.988 9.264 1.00 0.00 O ATOM 465 CB GLN A 30 4.974 -1.075 11.864 1.00 0.00 C ATOM 466 CG GLN A 30 4.590 -2.551 12.001 1.00 0.00 C ATOM 467 CD GLN A 30 3.363 -2.672 12.908 1.00 0.00 C ATOM 468 OE1 GLN A 30 3.041 -1.756 13.636 1.00 0.00 O ATOM 469 NE2 GLN A 30 2.662 -3.770 12.892 1.00 0.00 N ATOM 0 H GLN A 30 5.764 0.909 10.333 1.00 0.00 H new ATOM 0 HA GLN A 30 7.113 -1.391 11.800 1.00 0.00 H new ATOM 0 HB2 GLN A 30 5.017 -0.606 12.847 1.00 0.00 H new ATOM 0 HB3 GLN A 30 4.216 -0.542 11.290 1.00 0.00 H new ATOM 0 HG2 GLN A 30 4.375 -2.975 11.020 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.422 -3.118 12.418 1.00 0.00 H new ATOM 0 HE21 GLN A 30 2.933 -4.539 12.280 1.00 0.00 H new ATOM 0 HE22 GLN A 30 1.842 -3.860 13.492 1.00 0.00 H new ATOM 478 N LEU A 31 7.496 -1.996 9.329 1.00 0.00 N ATOM 479 CA LEU A 31 7.590 -2.674 8.013 1.00 0.00 C ATOM 480 C LEU A 31 7.157 -4.137 8.097 1.00 0.00 C ATOM 481 O LEU A 31 7.633 -4.893 8.919 1.00 0.00 O ATOM 482 CB LEU A 31 9.073 -2.609 7.644 1.00 0.00 C ATOM 483 CG LEU A 31 9.439 -1.221 7.114 1.00 0.00 C ATOM 484 CD1 LEU A 31 8.782 -0.980 5.750 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.972 -0.155 8.098 1.00 0.00 C ATOM 0 H LEU A 31 8.391 -1.785 9.771 1.00 0.00 H new ATOM 0 HA LEU A 31 6.939 -2.196 7.281 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.681 -2.842 8.518 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.298 -3.363 6.890 1.00 0.00 H new ATOM 0 HG LEU A 31 10.522 -1.165 7.000 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.052 0.011 5.386 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.128 -1.733 5.042 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.699 -1.047 5.851 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.235 0.832 7.717 1.00 0.00 H new ATOM 0 HD22 LEU A 31 7.891 -0.221 8.220 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.456 -0.312 9.062 1.00 0.00 H new ATOM 497 N GLN A 32 6.299 -4.552 7.212 1.00 0.00 N ATOM 498 CA GLN A 32 5.880 -5.976 7.189 1.00 0.00 C ATOM 499 C GLN A 32 6.258 -6.563 5.831 1.00 0.00 C ATOM 500 O GLN A 32 5.907 -6.023 4.802 1.00 0.00 O ATOM 501 CB GLN A 32 4.363 -5.990 7.365 1.00 0.00 C ATOM 502 CG GLN A 32 3.882 -7.441 7.334 1.00 0.00 C ATOM 503 CD GLN A 32 4.532 -8.210 8.487 1.00 0.00 C ATOM 504 OE1 GLN A 32 4.488 -7.773 9.621 1.00 0.00 O ATOM 505 NE2 GLN A 32 5.141 -9.341 8.246 1.00 0.00 N ATOM 0 H GLN A 32 5.868 -3.962 6.500 1.00 0.00 H new ATOM 0 HA GLN A 32 6.359 -6.561 7.974 1.00 0.00 H new ATOM 0 HB2 GLN A 32 4.087 -5.520 8.309 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.885 -5.416 6.572 1.00 0.00 H new ATOM 0 HG2 GLN A 32 2.796 -7.479 7.422 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.141 -7.903 6.381 1.00 0.00 H new ATOM 0 HE21 GLN A 32 5.178 -9.708 7.295 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.579 -9.857 9.009 1.00 0.00 H new ATOM 514 N VAL A 33 6.984 -7.641 5.803 1.00 0.00 N ATOM 515 CA VAL A 33 7.382 -8.205 4.487 1.00 0.00 C ATOM 516 C VAL A 33 6.511 -9.391 4.093 1.00 0.00 C ATOM 517 O VAL A 33 6.391 -10.364 4.811 1.00 0.00 O ATOM 518 CB VAL A 33 8.824 -8.643 4.660 1.00 0.00 C ATOM 519 CG1 VAL A 33 9.376 -9.055 3.295 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.632 -7.477 5.229 1.00 0.00 C ATOM 0 H VAL A 33 7.316 -8.151 6.622 1.00 0.00 H new ATOM 0 HA VAL A 33 7.263 -7.468 3.693 1.00 0.00 H new ATOM 0 HB VAL A 33 8.890 -9.488 5.345 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.413 -9.373 3.403 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.784 -9.879 2.896 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.325 -8.208 2.611 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.671 -7.782 5.357 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.584 -6.632 4.542 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.218 -7.184 6.194 1.00 0.00 H new ATOM 530 N CYS A 34 5.916 -9.314 2.938 1.00 0.00 N ATOM 531 CA CYS A 34 5.053 -10.427 2.454 1.00 0.00 C ATOM 532 C CYS A 34 5.756 -11.177 1.322 1.00 0.00 C ATOM 533 O CYS A 34 5.923 -10.662 0.238 1.00 0.00 O ATOM 534 CB CYS A 34 3.793 -9.744 1.931 1.00 0.00 C ATOM 535 SG CYS A 34 2.901 -8.983 3.308 1.00 0.00 S ATOM 0 H CYS A 34 5.991 -8.520 2.302 1.00 0.00 H new ATOM 0 HA CYS A 34 4.833 -11.154 3.236 1.00 0.00 H new ATOM 0 HB2 CYS A 34 4.057 -8.987 1.193 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.155 -10.471 1.428 1.00 0.00 H new ATOM 0 HG CYS A 34 2.712 -7.721 3.058 1.00 0.00 H new ATOM 541 N GLU A 35 6.178 -12.385 1.562 1.00 0.00 N ATOM 542 CA GLU A 35 6.881 -13.152 0.493 1.00 0.00 C ATOM 543 C GLU A 35 5.972 -13.390 -0.719 1.00 0.00 C ATOM 544 O GLU A 35 6.428 -13.418 -1.842 1.00 0.00 O ATOM 545 CB GLU A 35 7.257 -14.483 1.139 1.00 0.00 C ATOM 546 CG GLU A 35 8.165 -14.231 2.343 1.00 0.00 C ATOM 547 CD GLU A 35 9.576 -13.906 1.853 1.00 0.00 C ATOM 548 OE1 GLU A 35 9.740 -12.876 1.222 1.00 0.00 O ATOM 549 OE2 GLU A 35 10.467 -14.692 2.117 1.00 0.00 O ATOM 0 H GLU A 35 6.068 -12.876 2.449 1.00 0.00 H new ATOM 0 HA GLU A 35 7.749 -12.607 0.122 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.358 -15.013 1.454 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.765 -15.120 0.415 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.776 -13.406 2.940 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.185 -15.109 2.988 1.00 0.00 H new ATOM 556 N SER A 36 4.694 -13.578 -0.516 1.00 0.00 N ATOM 557 CA SER A 36 3.803 -13.830 -1.686 1.00 0.00 C ATOM 558 C SER A 36 2.800 -12.696 -1.857 1.00 0.00 C ATOM 559 O SER A 36 2.884 -11.669 -1.214 1.00 0.00 O ATOM 560 CB SER A 36 3.071 -15.131 -1.366 1.00 0.00 C ATOM 561 OG SER A 36 3.994 -16.077 -0.841 1.00 0.00 O ATOM 0 H SER A 36 4.235 -13.568 0.395 1.00 0.00 H new ATOM 0 HA SER A 36 4.372 -13.894 -2.614 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.275 -14.945 -0.645 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.600 -15.527 -2.266 1.00 0.00 H new ATOM 0 HG SER A 36 4.303 -15.778 0.040 1.00 0.00 H new ATOM 567 N GLY A 37 1.829 -12.891 -2.702 1.00 0.00 N ATOM 568 CA GLY A 37 0.797 -11.848 -2.899 1.00 0.00 C ATOM 569 C GLY A 37 -0.423 -12.274 -2.099 1.00 0.00 C ATOM 570 O GLY A 37 -1.206 -11.468 -1.645 1.00 0.00 O ATOM 0 H GLY A 37 1.708 -13.733 -3.265 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.160 -10.877 -2.561 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.549 -11.745 -3.955 1.00 0.00 H new ATOM 574 N GLU A 38 -0.551 -13.557 -1.898 1.00 0.00 N ATOM 575 CA GLU A 38 -1.673 -14.097 -1.101 1.00 0.00 C ATOM 576 C GLU A 38 -1.423 -13.769 0.361 1.00 0.00 C ATOM 577 O GLU A 38 -2.313 -13.400 1.107 1.00 0.00 O ATOM 578 CB GLU A 38 -1.586 -15.604 -1.319 1.00 0.00 C ATOM 579 CG GLU A 38 -2.437 -16.009 -2.522 1.00 0.00 C ATOM 580 CD GLU A 38 -2.680 -17.519 -2.481 1.00 0.00 C ATOM 581 OE1 GLU A 38 -1.998 -18.185 -1.716 1.00 0.00 O ATOM 582 OE2 GLU A 38 -3.542 -17.981 -3.209 1.00 0.00 O ATOM 0 H GLU A 38 0.090 -14.262 -2.262 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.646 -13.693 -1.379 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.549 -15.897 -1.482 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.929 -16.129 -0.427 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -3.387 -15.475 -2.507 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.932 -15.735 -3.448 1.00 0.00 H new ATOM 589 N MET A 39 -0.191 -13.889 0.762 1.00 0.00 N ATOM 590 CA MET A 39 0.176 -13.593 2.164 1.00 0.00 C ATOM 591 C MET A 39 -0.170 -12.131 2.468 1.00 0.00 C ATOM 592 O MET A 39 -0.633 -11.795 3.539 1.00 0.00 O ATOM 593 CB MET A 39 1.692 -13.822 2.209 1.00 0.00 C ATOM 594 CG MET A 39 2.000 -15.318 2.048 1.00 0.00 C ATOM 595 SD MET A 39 3.796 -15.551 1.951 1.00 0.00 S ATOM 596 CE MET A 39 3.804 -17.361 1.915 1.00 0.00 C ATOM 0 H MET A 39 0.584 -14.183 0.168 1.00 0.00 H new ATOM 0 HA MET A 39 -0.347 -14.208 2.896 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.178 -13.254 1.415 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.096 -13.458 3.154 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.594 -15.878 2.890 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.522 -15.705 1.148 1.00 0.00 H new ATOM 0 HE1 MET A 39 4.832 -17.719 1.855 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.338 -17.745 2.823 1.00 0.00 H new ATOM 0 HE3 MET A 39 3.247 -17.710 1.046 1.00 0.00 H new ATOM 606 N LEU A 40 0.045 -11.265 1.516 1.00 0.00 N ATOM 607 CA LEU A 40 -0.276 -9.823 1.713 1.00 0.00 C ATOM 608 C LEU A 40 -1.779 -9.654 1.932 1.00 0.00 C ATOM 609 O LEU A 40 -2.216 -8.826 2.704 1.00 0.00 O ATOM 610 CB LEU A 40 0.192 -9.156 0.414 1.00 0.00 C ATOM 611 CG LEU A 40 -0.400 -7.751 0.289 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.005 -6.914 1.507 1.00 0.00 C ATOM 613 CD2 LEU A 40 0.142 -7.093 -0.985 1.00 0.00 C ATOM 0 H LEU A 40 0.433 -11.497 0.602 1.00 0.00 H new ATOM 0 HA LEU A 40 0.207 -9.383 2.585 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.280 -9.101 0.398 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.109 -9.761 -0.441 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.487 -7.814 0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.429 -5.914 1.414 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.386 -7.387 2.412 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.081 -6.844 1.564 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.275 -6.091 -1.082 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.229 -7.030 -0.928 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.142 -7.690 -1.852 1.00 0.00 H new ATOM 625 N LEU A 41 -2.576 -10.447 1.270 1.00 0.00 N ATOM 626 CA LEU A 41 -4.048 -10.350 1.454 1.00 0.00 C ATOM 627 C LEU A 41 -4.407 -10.640 2.914 1.00 0.00 C ATOM 628 O LEU A 41 -5.156 -9.915 3.539 1.00 0.00 O ATOM 629 CB LEU A 41 -4.620 -11.438 0.543 1.00 0.00 C ATOM 630 CG LEU A 41 -4.191 -11.182 -0.903 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.719 -12.301 -1.801 1.00 0.00 C ATOM 632 CD2 LEU A 41 -4.751 -9.844 -1.383 1.00 0.00 C ATOM 0 H LEU A 41 -2.268 -11.159 0.608 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.439 -9.361 1.214 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -4.270 -12.418 0.868 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.708 -11.449 0.613 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.102 -11.156 -0.951 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.412 -12.117 -2.831 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.315 -13.257 -1.467 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.807 -12.329 -1.746 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.441 -9.669 -2.413 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.839 -9.865 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.372 -9.042 -0.749 1.00 0.00 H new ATOM 644 N GLU A 42 -3.873 -11.700 3.460 1.00 0.00 N ATOM 645 CA GLU A 42 -4.183 -12.049 4.877 1.00 0.00 C ATOM 646 C GLU A 42 -3.814 -10.896 5.816 1.00 0.00 C ATOM 647 O GLU A 42 -4.579 -10.529 6.685 1.00 0.00 O ATOM 648 CB GLU A 42 -3.317 -13.271 5.179 1.00 0.00 C ATOM 649 CG GLU A 42 -3.736 -13.867 6.525 1.00 0.00 C ATOM 650 CD GLU A 42 -3.226 -15.308 6.628 1.00 0.00 C ATOM 651 OE1 GLU A 42 -3.067 -15.935 5.593 1.00 0.00 O ATOM 652 OE2 GLU A 42 -3.003 -15.760 7.741 1.00 0.00 O ATOM 0 H GLU A 42 -3.235 -12.339 2.986 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.245 -12.244 5.023 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.428 -14.014 4.389 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.265 -12.988 5.205 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.332 -13.268 7.341 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -4.822 -13.847 6.621 1.00 0.00 H new ATOM 659 N TYR A 43 -2.648 -10.328 5.657 1.00 0.00 N ATOM 660 CA TYR A 43 -2.246 -9.208 6.556 1.00 0.00 C ATOM 661 C TYR A 43 -3.142 -7.987 6.331 1.00 0.00 C ATOM 662 O TYR A 43 -3.465 -7.271 7.255 1.00 0.00 O ATOM 663 CB TYR A 43 -0.793 -8.896 6.192 1.00 0.00 C ATOM 664 CG TYR A 43 -0.392 -7.567 6.792 1.00 0.00 C ATOM 665 CD1 TYR A 43 -0.708 -6.373 6.132 1.00 0.00 C ATOM 666 CD2 TYR A 43 0.307 -7.530 8.004 1.00 0.00 C ATOM 667 CE1 TYR A 43 -0.327 -5.144 6.686 1.00 0.00 C ATOM 668 CE2 TYR A 43 0.689 -6.301 8.557 1.00 0.00 C ATOM 669 CZ TYR A 43 0.371 -5.107 7.900 1.00 0.00 C ATOM 670 OH TYR A 43 0.752 -3.898 8.446 1.00 0.00 O ATOM 0 H TYR A 43 -1.962 -10.589 4.949 1.00 0.00 H new ATOM 0 HA TYR A 43 -2.347 -9.475 7.608 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -0.138 -9.685 6.561 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.678 -8.867 5.109 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -1.246 -6.400 5.196 1.00 0.00 H new ATOM 0 HD2 TYR A 43 0.552 -8.450 8.514 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -0.572 -4.224 6.176 1.00 0.00 H new ATOM 0 HE2 TYR A 43 1.230 -6.275 9.492 1.00 0.00 H new ATOM 0 HH TYR A 43 1.225 -4.055 9.290 1.00 0.00 H new ATOM 680 N ALA A 44 -3.548 -7.739 5.115 1.00 0.00 N ATOM 681 CA ALA A 44 -4.416 -6.562 4.859 1.00 0.00 C ATOM 682 C ALA A 44 -5.895 -6.936 5.052 1.00 0.00 C ATOM 683 O ALA A 44 -6.747 -6.082 5.190 1.00 0.00 O ATOM 684 CB ALA A 44 -4.128 -6.190 3.405 1.00 0.00 C ATOM 0 H ALA A 44 -3.316 -8.299 4.294 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.219 -5.735 5.541 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.729 -5.325 3.125 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.071 -5.949 3.294 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.379 -7.030 2.758 1.00 0.00 H new ATOM 690 N GLN A 45 -6.202 -8.208 5.062 1.00 0.00 N ATOM 691 CA GLN A 45 -7.624 -8.637 5.241 1.00 0.00 C ATOM 692 C GLN A 45 -8.056 -8.538 6.701 1.00 0.00 C ATOM 693 O GLN A 45 -9.201 -8.770 7.030 1.00 0.00 O ATOM 694 CB GLN A 45 -7.653 -10.098 4.806 1.00 0.00 C ATOM 695 CG GLN A 45 -7.776 -10.160 3.294 1.00 0.00 C ATOM 696 CD GLN A 45 -7.442 -11.569 2.807 1.00 0.00 C ATOM 697 OE1 GLN A 45 -6.982 -12.395 3.570 1.00 0.00 O ATOM 698 NE2 GLN A 45 -7.654 -11.878 1.559 1.00 0.00 N ATOM 0 H GLN A 45 -5.531 -8.968 4.954 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.300 -8.005 4.666 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.745 -10.606 5.131 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.492 -10.614 5.274 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.788 -9.890 2.991 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.102 -9.437 2.835 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -8.040 -11.183 0.920 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.434 -12.815 1.221 1.00 0.00 H new ATOM 707 N THR A 46 -7.160 -8.226 7.586 1.00 0.00 N ATOM 708 CA THR A 46 -7.552 -8.152 9.019 1.00 0.00 C ATOM 709 C THR A 46 -6.950 -6.913 9.675 1.00 0.00 C ATOM 710 O THR A 46 -6.718 -6.883 10.861 1.00 0.00 O ATOM 711 CB THR A 46 -6.984 -9.433 9.626 1.00 0.00 C ATOM 712 OG1 THR A 46 -5.575 -9.310 9.759 1.00 0.00 O ATOM 713 CG2 THR A 46 -7.314 -10.615 8.703 1.00 0.00 C ATOM 0 H THR A 46 -6.181 -8.020 7.386 1.00 0.00 H new ATOM 0 HA THR A 46 -8.630 -8.072 9.161 1.00 0.00 H new ATOM 0 HB THR A 46 -7.424 -9.602 10.609 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.210 -10.131 10.150 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.911 -11.534 9.130 1.00 0.00 H new ATOM 0 HG22 THR A 46 -8.395 -10.706 8.601 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.870 -10.446 7.722 1.00 0.00 H new ATOM 721 N HIS A 47 -6.702 -5.898 8.897 1.00 0.00 N ATOM 722 CA HIS A 47 -6.114 -4.638 9.444 1.00 0.00 C ATOM 723 C HIS A 47 -6.169 -3.552 8.360 1.00 0.00 C ATOM 724 O HIS A 47 -5.355 -2.653 8.326 1.00 0.00 O ATOM 725 CB HIS A 47 -4.656 -4.991 9.750 1.00 0.00 C ATOM 726 CG HIS A 47 -4.400 -4.975 11.235 1.00 0.00 C ATOM 727 ND1 HIS A 47 -5.285 -5.514 12.157 1.00 0.00 N ATOM 728 CD2 HIS A 47 -3.333 -4.517 11.971 1.00 0.00 C ATOM 729 CE1 HIS A 47 -4.737 -5.372 13.380 1.00 0.00 C ATOM 730 NE2 HIS A 47 -3.550 -4.770 13.324 1.00 0.00 N ATOM 0 H HIS A 47 -6.883 -5.885 7.893 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.641 -4.268 10.323 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.424 -5.977 9.347 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.994 -4.281 9.255 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -6.187 -5.941 11.947 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.458 -4.034 11.562 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -5.204 -5.706 14.295 1.00 0.00 H new ATOM 738 N ARG A 48 -7.107 -3.660 7.455 1.00 0.00 N ATOM 739 CA ARG A 48 -7.193 -2.657 6.339 1.00 0.00 C ATOM 740 C ARG A 48 -6.971 -1.259 6.887 1.00 0.00 C ATOM 741 O ARG A 48 -6.117 -0.520 6.434 1.00 0.00 O ATOM 742 CB ARG A 48 -8.617 -2.723 5.756 1.00 0.00 C ATOM 743 CG ARG A 48 -9.219 -4.116 5.904 1.00 0.00 C ATOM 744 CD ARG A 48 -10.511 -4.222 5.085 1.00 0.00 C ATOM 745 NE ARG A 48 -11.128 -5.494 5.552 1.00 0.00 N ATOM 746 CZ ARG A 48 -12.400 -5.730 5.370 1.00 0.00 C ATOM 747 NH1 ARG A 48 -13.146 -4.886 4.707 1.00 0.00 N ATOM 748 NH2 ARG A 48 -12.921 -6.828 5.844 1.00 0.00 N ATOM 0 H ARG A 48 -7.816 -4.393 7.436 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.440 -2.877 5.582 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.252 -1.996 6.262 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.593 -2.446 4.702 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.504 -4.867 5.568 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.427 -4.321 6.954 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -11.168 -3.371 5.263 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -10.305 -4.247 4.015 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.549 -6.191 6.021 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.736 -4.033 4.326 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -14.138 -5.080 4.571 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.336 -7.492 6.351 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -13.913 -7.022 5.708 1.00 0.00 H new ATOM 762 N ASP A 49 -7.751 -0.889 7.853 1.00 0.00 N ATOM 763 CA ASP A 49 -7.618 0.473 8.446 1.00 0.00 C ATOM 764 C ASP A 49 -6.301 0.586 9.208 1.00 0.00 C ATOM 765 O ASP A 49 -5.723 1.649 9.331 1.00 0.00 O ATOM 766 CB ASP A 49 -8.800 0.598 9.407 1.00 0.00 C ATOM 767 CG ASP A 49 -8.591 -0.339 10.598 1.00 0.00 C ATOM 768 OD1 ASP A 49 -8.594 -1.542 10.391 1.00 0.00 O ATOM 769 OD2 ASP A 49 -8.431 0.162 11.699 1.00 0.00 O ATOM 0 H ASP A 49 -8.481 -1.470 8.264 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.619 1.258 7.689 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -8.894 1.627 9.753 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -9.728 0.348 8.893 1.00 0.00 H new ATOM 774 N GLN A 50 -5.840 -0.510 9.737 1.00 0.00 N ATOM 775 CA GLN A 50 -4.573 -0.510 10.521 1.00 0.00 C ATOM 776 C GLN A 50 -3.347 -0.322 9.620 1.00 0.00 C ATOM 777 O GLN A 50 -2.349 0.231 10.038 1.00 0.00 O ATOM 778 CB GLN A 50 -4.552 -1.881 11.189 1.00 0.00 C ATOM 779 CG GLN A 50 -5.494 -1.863 12.395 1.00 0.00 C ATOM 780 CD GLN A 50 -4.889 -0.985 13.490 1.00 0.00 C ATOM 781 OE1 GLN A 50 -3.852 -1.308 14.033 1.00 0.00 O ATOM 782 NE2 GLN A 50 -5.487 0.123 13.836 1.00 0.00 N ATOM 0 H GLN A 50 -6.293 -1.420 9.659 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.534 0.311 11.236 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.862 -2.649 10.481 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.539 -2.130 11.506 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.471 -1.479 12.103 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.647 -2.876 12.767 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.358 0.396 13.381 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.083 0.716 14.561 1.00 0.00 H new ATOM 791 N ILE A 51 -3.398 -0.763 8.389 1.00 0.00 N ATOM 792 CA ILE A 51 -2.210 -0.574 7.507 1.00 0.00 C ATOM 793 C ILE A 51 -2.149 0.891 7.087 1.00 0.00 C ATOM 794 O ILE A 51 -3.096 1.431 6.552 1.00 0.00 O ATOM 795 CB ILE A 51 -2.422 -1.484 6.289 1.00 0.00 C ATOM 796 CG1 ILE A 51 -2.717 -2.927 6.728 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.155 -1.488 5.430 1.00 0.00 C ATOM 798 CD1 ILE A 51 -1.969 -3.252 8.022 1.00 0.00 C ATOM 0 H ILE A 51 -4.195 -1.237 7.964 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.274 -0.826 8.006 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.270 -1.102 5.721 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.789 -3.057 6.877 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.418 -3.621 5.943 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.304 -2.134 4.565 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -0.941 -0.474 5.093 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.317 -1.859 6.020 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.187 -4.277 8.321 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.897 -3.142 7.860 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.289 -2.569 8.809 1.00 0.00 H new ATOM 810 N ASP A 52 -1.058 1.548 7.351 1.00 0.00 N ATOM 811 CA ASP A 52 -0.964 2.985 6.991 1.00 0.00 C ATOM 812 C ASP A 52 -0.492 3.156 5.546 1.00 0.00 C ATOM 813 O ASP A 52 -0.931 4.045 4.853 1.00 0.00 O ATOM 814 CB ASP A 52 0.048 3.562 7.976 1.00 0.00 C ATOM 815 CG ASP A 52 -0.627 3.752 9.333 1.00 0.00 C ATOM 816 OD1 ASP A 52 -1.845 3.802 9.366 1.00 0.00 O ATOM 817 OD2 ASP A 52 0.084 3.850 10.317 1.00 0.00 O ATOM 0 H ASP A 52 -0.231 1.154 7.799 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.927 3.492 7.051 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.903 2.893 8.072 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.429 4.515 7.609 1.00 0.00 H new ATOM 822 N CYS A 53 0.399 2.318 5.088 1.00 0.00 N ATOM 823 CA CYS A 53 0.893 2.451 3.685 1.00 0.00 C ATOM 824 C CYS A 53 1.291 1.082 3.137 1.00 0.00 C ATOM 825 O CYS A 53 1.937 0.307 3.810 1.00 0.00 O ATOM 826 CB CYS A 53 2.129 3.342 3.791 1.00 0.00 C ATOM 827 SG CYS A 53 2.237 4.409 2.335 1.00 0.00 S ATOM 0 H CYS A 53 0.805 1.550 5.622 1.00 0.00 H new ATOM 0 HA CYS A 53 0.135 2.863 3.019 1.00 0.00 H new ATOM 0 HB2 CYS A 53 2.076 3.948 4.695 1.00 0.00 H new ATOM 0 HB3 CYS A 53 3.026 2.728 3.871 1.00 0.00 H new ATOM 0 HG CYS A 53 1.245 4.153 1.535 1.00 0.00 H new ATOM 833 N LEU A 54 0.928 0.772 1.929 1.00 0.00 N ATOM 834 CA LEU A 54 1.326 -0.563 1.391 1.00 0.00 C ATOM 835 C LEU A 54 2.305 -0.403 0.221 1.00 0.00 C ATOM 836 O LEU A 54 2.120 0.415 -0.657 1.00 0.00 O ATOM 837 CB LEU A 54 0.023 -1.223 0.939 1.00 0.00 C ATOM 838 CG LEU A 54 0.232 -2.734 0.806 1.00 0.00 C ATOM 839 CD1 LEU A 54 -1.127 -3.431 0.748 1.00 0.00 C ATOM 840 CD2 LEU A 54 1.008 -3.028 -0.480 1.00 0.00 C ATOM 0 H LEU A 54 0.386 1.365 1.300 1.00 0.00 H new ATOM 0 HA LEU A 54 1.840 -1.169 2.137 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.769 -1.017 1.659 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.297 -0.804 -0.015 1.00 0.00 H new ATOM 0 HG LEU A 54 0.795 -3.101 1.664 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.980 -4.507 0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.684 -3.220 1.661 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -1.688 -3.064 -0.112 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.158 -4.103 -0.577 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.443 -2.662 -1.337 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.976 -2.529 -0.443 1.00 0.00 H new ATOM 852 N ILE A 55 3.354 -1.189 0.205 1.00 0.00 N ATOM 853 CA ILE A 55 4.351 -1.096 -0.907 1.00 0.00 C ATOM 854 C ILE A 55 4.118 -2.246 -1.884 1.00 0.00 C ATOM 855 O ILE A 55 3.779 -3.346 -1.493 1.00 0.00 O ATOM 856 CB ILE A 55 5.725 -1.226 -0.240 1.00 0.00 C ATOM 857 CG1 ILE A 55 5.886 -0.139 0.820 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.835 -1.075 -1.286 1.00 0.00 C ATOM 859 CD1 ILE A 55 7.109 -0.460 1.675 1.00 0.00 C ATOM 0 H ILE A 55 3.563 -1.891 0.915 1.00 0.00 H new ATOM 0 HA ILE A 55 4.271 -0.163 -1.465 1.00 0.00 H new ATOM 0 HB ILE A 55 5.798 -2.209 0.225 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.003 0.836 0.346 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.994 -0.085 1.444 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.807 -1.169 -0.801 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.730 -1.853 -2.043 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.759 -0.096 -1.759 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.233 0.311 2.436 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.972 -1.428 2.158 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.996 -0.492 1.043 1.00 0.00 H new ATOM 871 N LEU A 56 4.284 -2.002 -3.150 1.00 0.00 N ATOM 872 CA LEU A 56 4.062 -3.084 -4.147 1.00 0.00 C ATOM 873 C LEU A 56 5.079 -2.984 -5.284 1.00 0.00 C ATOM 874 O LEU A 56 5.654 -1.943 -5.527 1.00 0.00 O ATOM 875 CB LEU A 56 2.645 -2.837 -4.670 1.00 0.00 C ATOM 876 CG LEU A 56 1.623 -3.215 -3.597 1.00 0.00 C ATOM 877 CD1 LEU A 56 0.215 -2.913 -4.107 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.734 -4.708 -3.279 1.00 0.00 C ATOM 0 H LEU A 56 4.564 -1.102 -3.539 1.00 0.00 H new ATOM 0 HA LEU A 56 4.178 -4.078 -3.714 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.527 -1.789 -4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.473 -3.424 -5.572 1.00 0.00 H new ATOM 0 HG LEU A 56 1.820 -2.636 -2.695 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.514 -3.182 -3.343 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.130 -1.850 -4.332 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.024 -3.491 -5.011 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.004 -4.972 -2.514 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.540 -5.288 -4.181 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.737 -4.929 -2.915 1.00 0.00 H new ATOM 890 N VAL A 57 5.291 -4.055 -5.995 1.00 0.00 N ATOM 891 CA VAL A 57 6.251 -4.016 -7.134 1.00 0.00 C ATOM 892 C VAL A 57 5.509 -4.401 -8.421 1.00 0.00 C ATOM 893 O VAL A 57 5.196 -5.556 -8.647 1.00 0.00 O ATOM 894 CB VAL A 57 7.328 -5.051 -6.798 1.00 0.00 C ATOM 895 CG1 VAL A 57 8.204 -5.286 -8.030 1.00 0.00 C ATOM 896 CG2 VAL A 57 8.198 -4.533 -5.647 1.00 0.00 C ATOM 0 H VAL A 57 4.841 -4.957 -5.837 1.00 0.00 H new ATOM 0 HA VAL A 57 6.690 -3.030 -7.284 1.00 0.00 H new ATOM 0 HB VAL A 57 6.853 -5.986 -6.500 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.972 -6.023 -7.795 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.587 -5.654 -8.850 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.677 -4.349 -8.324 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.964 -5.271 -5.409 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.674 -3.598 -5.943 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.575 -4.361 -4.769 1.00 0.00 H new ATOM 906 N ALA A 58 5.209 -3.439 -9.244 1.00 0.00 N ATOM 907 CA ALA A 58 4.459 -3.726 -10.506 1.00 0.00 C ATOM 908 C ALA A 58 5.204 -4.726 -11.397 1.00 0.00 C ATOM 909 O ALA A 58 4.624 -5.326 -12.284 1.00 0.00 O ATOM 910 CB ALA A 58 4.355 -2.372 -11.195 1.00 0.00 C ATOM 0 H ALA A 58 5.450 -2.458 -9.100 1.00 0.00 H new ATOM 0 HA ALA A 58 3.488 -4.179 -10.305 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.817 -2.483 -12.136 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.819 -1.676 -10.550 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.355 -1.987 -11.393 1.00 0.00 H new ATOM 916 N ALA A 59 6.476 -4.916 -11.183 1.00 0.00 N ATOM 917 CA ALA A 59 7.238 -5.881 -12.029 1.00 0.00 C ATOM 918 C ALA A 59 6.638 -7.287 -11.925 1.00 0.00 C ATOM 919 O ALA A 59 6.919 -8.149 -12.732 1.00 0.00 O ATOM 920 CB ALA A 59 8.652 -5.874 -11.459 1.00 0.00 C ATOM 0 H ALA A 59 7.022 -4.446 -10.460 1.00 0.00 H new ATOM 0 HA ALA A 59 7.212 -5.603 -13.083 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.277 -6.561 -12.029 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.066 -4.868 -11.525 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.625 -6.188 -10.416 1.00 0.00 H new ATOM 926 N ASN A 60 5.819 -7.530 -10.933 1.00 0.00 N ATOM 927 CA ASN A 60 5.214 -8.890 -10.783 1.00 0.00 C ATOM 928 C ASN A 60 4.053 -9.070 -11.768 1.00 0.00 C ATOM 929 O ASN A 60 3.374 -8.121 -12.112 1.00 0.00 O ATOM 930 CB ASN A 60 4.723 -8.948 -9.337 1.00 0.00 C ATOM 931 CG ASN A 60 5.828 -9.506 -8.438 1.00 0.00 C ATOM 932 OD1 ASN A 60 7.073 -9.212 -8.690 1.00 0.00 O flip ATOM 933 ND2 ASN A 60 5.555 -10.219 -7.495 1.00 0.00 N flip ATOM 0 H ASN A 60 5.544 -6.850 -10.224 1.00 0.00 H new ATOM 0 HA ASN A 60 5.926 -9.686 -10.998 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.436 -7.952 -9.000 1.00 0.00 H new ATOM 0 HB3 ASN A 60 3.835 -9.576 -9.270 1.00 0.00 H new ATOM 0 HD21 ASN A 60 4.582 -10.451 -7.296 1.00 0.00 H new ATOM 0 HD22 ASN A 60 6.299 -10.587 -6.902 1.00 0.00 H new ATOM 940 N PRO A 61 3.887 -10.289 -12.201 1.00 0.00 N ATOM 941 CA PRO A 61 2.819 -10.617 -13.181 1.00 0.00 C ATOM 942 C PRO A 61 1.429 -10.621 -12.537 1.00 0.00 C ATOM 943 O PRO A 61 0.572 -9.843 -12.899 1.00 0.00 O ATOM 944 CB PRO A 61 3.204 -12.012 -13.663 1.00 0.00 C ATOM 945 CG PRO A 61 4.012 -12.604 -12.553 1.00 0.00 C ATOM 946 CD PRO A 61 4.670 -11.466 -11.819 1.00 0.00 C ATOM 0 HA PRO A 61 2.752 -9.884 -13.985 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.320 -12.614 -13.870 1.00 0.00 H new ATOM 0 HB3 PRO A 61 3.781 -11.964 -14.587 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.376 -13.179 -11.879 1.00 0.00 H new ATOM 0 HG3 PRO A 61 4.761 -13.291 -12.947 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.651 -11.624 -10.741 1.00 0.00 H new ATOM 0 HD3 PRO A 61 5.716 -11.359 -12.107 1.00 0.00 H new ATOM 954 N SER A 62 1.189 -11.492 -11.601 1.00 0.00 N ATOM 955 CA SER A 62 -0.159 -11.528 -10.965 1.00 0.00 C ATOM 956 C SER A 62 -0.266 -10.441 -9.898 1.00 0.00 C ATOM 957 O SER A 62 -1.229 -10.371 -9.164 1.00 0.00 O ATOM 958 CB SER A 62 -0.279 -12.911 -10.333 1.00 0.00 C ATOM 959 OG SER A 62 0.797 -13.108 -9.426 1.00 0.00 O ATOM 0 H SER A 62 1.859 -12.176 -11.249 1.00 0.00 H new ATOM 0 HA SER A 62 -0.955 -11.348 -11.688 1.00 0.00 H new ATOM 0 HB2 SER A 62 -1.231 -13.003 -9.811 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.263 -13.679 -11.106 1.00 0.00 H new ATOM 0 HG SER A 62 0.722 -13.995 -9.017 1.00 0.00 H new ATOM 965 N PHE A 63 0.717 -9.587 -9.804 1.00 0.00 N ATOM 966 CA PHE A 63 0.662 -8.506 -8.781 1.00 0.00 C ATOM 967 C PHE A 63 -0.700 -7.808 -8.841 1.00 0.00 C ATOM 968 O PHE A 63 -1.341 -7.580 -7.835 1.00 0.00 O ATOM 969 CB PHE A 63 1.804 -7.554 -9.160 1.00 0.00 C ATOM 970 CG PHE A 63 1.474 -6.145 -8.732 1.00 0.00 C ATOM 971 CD1 PHE A 63 1.233 -5.858 -7.384 1.00 0.00 C ATOM 972 CD2 PHE A 63 1.402 -5.128 -9.691 1.00 0.00 C ATOM 973 CE1 PHE A 63 0.920 -4.554 -6.998 1.00 0.00 C ATOM 974 CE2 PHE A 63 1.092 -3.824 -9.306 1.00 0.00 C ATOM 975 CZ PHE A 63 0.849 -3.533 -7.959 1.00 0.00 C ATOM 0 H PHE A 63 1.552 -9.591 -10.389 1.00 0.00 H new ATOM 0 HA PHE A 63 0.775 -8.873 -7.761 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.730 -7.878 -8.685 1.00 0.00 H new ATOM 0 HB3 PHE A 63 1.970 -7.585 -10.237 1.00 0.00 H new ATOM 0 HD1 PHE A 63 1.289 -6.643 -6.645 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.587 -5.354 -10.731 1.00 0.00 H new ATOM 0 HE1 PHE A 63 0.732 -4.330 -5.958 1.00 0.00 H new ATOM 0 HE2 PHE A 63 1.040 -3.040 -10.047 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.607 -2.524 -7.659 1.00 0.00 H new ATOM 985 N ARG A 64 -1.145 -7.472 -10.016 1.00 0.00 N ATOM 986 CA ARG A 64 -2.466 -6.796 -10.150 1.00 0.00 C ATOM 987 C ARG A 64 -3.553 -7.639 -9.483 1.00 0.00 C ATOM 988 O ARG A 64 -4.377 -7.139 -8.738 1.00 0.00 O ATOM 989 CB ARG A 64 -2.702 -6.715 -11.656 1.00 0.00 C ATOM 990 CG ARG A 64 -2.134 -5.402 -12.184 1.00 0.00 C ATOM 991 CD ARG A 64 -0.651 -5.581 -12.512 1.00 0.00 C ATOM 992 NE ARG A 64 -0.590 -5.594 -14.004 1.00 0.00 N ATOM 993 CZ ARG A 64 0.504 -5.960 -14.617 1.00 0.00 C ATOM 994 NH1 ARG A 64 1.553 -6.333 -13.934 1.00 0.00 N ATOM 995 NH2 ARG A 64 0.547 -5.959 -15.921 1.00 0.00 N ATOM 0 H ARG A 64 -0.651 -7.636 -10.893 1.00 0.00 H new ATOM 0 HA ARG A 64 -2.488 -5.815 -9.676 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.226 -7.558 -12.156 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.768 -6.777 -11.873 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.679 -5.090 -13.075 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.260 -4.614 -11.441 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -0.053 -4.769 -12.099 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -0.262 -6.509 -12.092 1.00 0.00 H new ATOM 0 HE ARG A 64 -1.407 -5.316 -14.547 1.00 0.00 H new ATOM 0 HH11 ARG A 64 1.522 -6.340 -12.915 1.00 0.00 H new ATOM 0 HH12 ARG A 64 2.403 -6.617 -14.420 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -0.272 -5.673 -16.458 1.00 0.00 H new ATOM 0 HH22 ARG A 64 1.399 -6.244 -16.403 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.548 -8.916 -9.733 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.565 -9.803 -9.111 1.00 0.00 C ATOM 1011 C ALA A 65 -4.499 -9.667 -7.583 1.00 0.00 C ATOM 1012 O ALA A 65 -5.503 -9.624 -6.910 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.162 -11.207 -9.561 1.00 0.00 C ATOM 0 H ALA A 65 -2.880 -9.385 -10.344 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.588 -9.563 -9.402 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -4.860 -11.936 -9.148 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.183 -11.260 -10.649 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.155 -11.428 -9.207 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.319 -9.583 -7.040 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.181 -9.429 -5.562 1.00 0.00 C ATOM 1021 C VAL A 66 -3.716 -8.060 -5.128 1.00 0.00 C ATOM 1022 O VAL A 66 -4.402 -7.937 -4.127 1.00 0.00 O ATOM 1023 CB VAL A 66 -1.679 -9.535 -5.319 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.350 -9.199 -3.863 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.225 -10.960 -5.642 1.00 0.00 C ATOM 0 H VAL A 66 -2.439 -9.614 -7.555 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.742 -10.173 -4.996 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.157 -8.826 -5.961 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.274 -9.279 -3.705 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.674 -8.182 -3.642 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.866 -9.896 -3.203 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.152 -11.047 -5.472 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.753 -11.665 -4.999 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.446 -11.185 -6.685 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.432 -7.029 -5.882 1.00 0.00 N ATOM 1036 CA VAL A 67 -3.958 -5.691 -5.500 1.00 0.00 C ATOM 1037 C VAL A 67 -5.481 -5.712 -5.615 1.00 0.00 C ATOM 1038 O VAL A 67 -6.182 -5.167 -4.787 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.389 -4.683 -6.498 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.692 -3.271 -5.989 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -1.875 -4.875 -6.647 1.00 0.00 C ATOM 0 H VAL A 67 -2.868 -7.057 -6.731 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.677 -5.428 -4.480 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.848 -4.834 -7.475 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.293 -2.538 -6.690 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.770 -3.139 -5.902 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.229 -3.129 -5.013 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.485 -4.150 -7.361 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.393 -4.728 -5.681 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.670 -5.884 -7.005 1.00 0.00 H new ATOM 1051 N GLN A 68 -5.999 -6.349 -6.636 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.472 -6.399 -6.784 1.00 0.00 C ATOM 1053 C GLN A 68 -8.067 -6.949 -5.493 1.00 0.00 C ATOM 1054 O GLN A 68 -9.026 -6.423 -4.971 1.00 0.00 O ATOM 1055 CB GLN A 68 -7.742 -7.323 -7.994 1.00 0.00 C ATOM 1056 CG GLN A 68 -8.226 -8.706 -7.534 1.00 0.00 C ATOM 1057 CD GLN A 68 -8.562 -9.577 -8.748 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -7.979 -9.342 -9.891 1.00 0.00 O flip ATOM 1059 NE2 GLN A 68 -9.365 -10.481 -8.654 1.00 0.00 N flip ATOM 0 H GLN A 68 -5.467 -6.829 -7.362 1.00 0.00 H new ATOM 0 HA GLN A 68 -7.925 -5.423 -6.957 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.491 -6.869 -8.643 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -6.832 -7.430 -8.584 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -7.455 -9.188 -6.933 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -9.105 -8.599 -6.899 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.822 -10.666 -7.761 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.583 -11.056 -9.468 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.494 -7.994 -4.956 1.00 0.00 N ATOM 1069 CA GLN A 69 -8.040 -8.541 -3.689 1.00 0.00 C ATOM 1070 C GLN A 69 -8.089 -7.433 -2.647 1.00 0.00 C ATOM 1071 O GLN A 69 -9.091 -7.239 -1.991 1.00 0.00 O ATOM 1072 CB GLN A 69 -7.082 -9.633 -3.243 1.00 0.00 C ATOM 1073 CG GLN A 69 -7.224 -10.842 -4.154 1.00 0.00 C ATOM 1074 CD GLN A 69 -8.514 -11.584 -3.801 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -9.043 -11.423 -2.720 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -9.051 -12.394 -4.673 1.00 0.00 N ATOM 0 H GLN A 69 -6.684 -8.483 -5.336 1.00 0.00 H new ATOM 0 HA GLN A 69 -9.048 -8.935 -3.819 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -6.057 -9.264 -3.270 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -7.292 -9.916 -2.212 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -7.245 -10.527 -5.197 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -6.366 -11.504 -4.038 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -8.609 -12.531 -5.582 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -9.913 -12.890 -4.445 1.00 0.00 H new ATOM 1085 N LEU A 70 -7.028 -6.685 -2.494 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.084 -5.591 -1.492 1.00 0.00 C ATOM 1087 C LEU A 70 -8.342 -4.766 -1.773 1.00 0.00 C ATOM 1088 O LEU A 70 -9.176 -4.578 -0.913 1.00 0.00 O ATOM 1089 CB LEU A 70 -5.803 -4.774 -1.686 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.684 -5.382 -0.829 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.414 -5.540 -1.662 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.392 -4.466 0.365 1.00 0.00 C ATOM 0 H LEU A 70 -6.151 -6.782 -3.005 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.138 -5.942 -0.461 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.513 -4.773 -2.737 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.973 -3.736 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.006 -6.360 -0.472 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.626 -5.972 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.614 -6.197 -2.509 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.095 -4.564 -2.027 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.597 -4.901 0.971 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.079 -3.486 0.004 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.292 -4.359 0.970 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.507 -4.309 -2.988 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.737 -3.536 -3.331 1.00 0.00 C ATOM 1106 C CYS A 71 -10.973 -4.430 -3.178 1.00 0.00 C ATOM 1107 O CYS A 71 -12.003 -4.012 -2.692 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.573 -3.140 -4.799 1.00 0.00 C ATOM 1109 SG CYS A 71 -8.174 -2.007 -4.969 1.00 0.00 S ATOM 0 H CYS A 71 -7.846 -4.437 -3.754 1.00 0.00 H new ATOM 0 HA CYS A 71 -9.866 -2.669 -2.682 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.411 -4.028 -5.410 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.485 -2.665 -5.162 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.293 -2.264 -4.048 1.00 0.00 H new ATOM 1115 N PHE A 72 -10.869 -5.662 -3.593 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.027 -6.595 -3.483 1.00 0.00 C ATOM 1117 C PHE A 72 -12.572 -6.571 -2.055 1.00 0.00 C ATOM 1118 O PHE A 72 -13.738 -6.317 -1.832 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.441 -7.963 -3.824 1.00 0.00 C ATOM 1120 CG PHE A 72 -12.358 -9.058 -3.338 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -13.718 -9.021 -3.653 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -11.843 -10.114 -2.574 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -14.569 -10.040 -3.206 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -12.693 -11.134 -2.129 1.00 0.00 C ATOM 1125 CZ PHE A 72 -14.055 -11.096 -2.443 1.00 0.00 C ATOM 0 H PHE A 72 -10.028 -6.065 -4.006 1.00 0.00 H new ATOM 0 HA PHE A 72 -12.856 -6.332 -4.140 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.300 -8.048 -4.901 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.458 -8.071 -3.365 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -14.114 -8.206 -4.241 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -10.792 -10.141 -2.329 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -15.621 -10.011 -3.450 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -12.297 -11.950 -1.543 1.00 0.00 H new ATOM 0 HZ PHE A 72 -14.711 -11.881 -2.097 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.734 -6.810 -1.085 1.00 0.00 N ATOM 1136 CA GLU A 73 -12.208 -6.773 0.327 1.00 0.00 C ATOM 1137 C GLU A 73 -12.557 -5.339 0.701 1.00 0.00 C ATOM 1138 O GLU A 73 -13.329 -5.084 1.604 1.00 0.00 O ATOM 1139 CB GLU A 73 -11.024 -7.244 1.175 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.628 -8.667 0.782 1.00 0.00 C ATOM 1141 CD GLU A 73 -11.707 -9.639 1.256 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -12.782 -9.177 1.601 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -11.438 -10.829 1.273 1.00 0.00 O ATOM 0 H GLU A 73 -10.745 -7.029 -1.208 1.00 0.00 H new ATOM 0 HA GLU A 73 -13.090 -7.396 0.478 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -10.177 -6.571 1.036 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.288 -7.211 2.232 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -10.507 -8.738 -0.299 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.668 -8.926 1.228 1.00 0.00 H new ATOM 1150 N GLY A 74 -11.966 -4.400 0.019 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.223 -2.970 0.332 1.00 0.00 C ATOM 1152 C GLY A 74 -11.003 -2.414 1.062 1.00 0.00 C ATOM 1153 O GLY A 74 -11.056 -1.370 1.684 1.00 0.00 O ATOM 0 H GLY A 74 -11.312 -4.564 -0.746 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.407 -2.408 -0.584 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.114 -2.871 0.951 1.00 0.00 H new ATOM 1157 N VAL A 75 -9.898 -3.106 0.993 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.678 -2.616 1.684 1.00 0.00 C ATOM 1159 C VAL A 75 -8.010 -1.536 0.846 1.00 0.00 C ATOM 1160 O VAL A 75 -7.332 -1.818 -0.123 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.770 -3.837 1.790 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.551 -3.487 2.638 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.536 -4.983 2.449 1.00 0.00 C ATOM 0 H VAL A 75 -9.790 -3.986 0.489 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.897 -2.182 2.660 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.447 -4.141 0.794 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.900 -4.358 2.716 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.006 -2.667 2.171 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.875 -3.186 3.634 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.889 -5.857 2.526 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.857 -4.680 3.446 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.410 -5.231 1.846 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.188 -0.300 1.200 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.553 0.777 0.404 1.00 0.00 C ATOM 1175 C VAL A 76 -6.590 1.566 1.284 1.00 0.00 C ATOM 1176 O VAL A 76 -6.923 2.006 2.366 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.702 1.657 -0.095 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.227 2.489 -1.292 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -9.865 0.767 -0.533 1.00 0.00 C ATOM 0 H VAL A 76 -8.741 0.010 1.999 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.972 0.389 -0.433 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.026 2.321 0.706 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.045 3.116 -1.647 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.392 3.120 -0.988 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.906 1.823 -2.093 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.686 1.390 -0.889 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.536 0.107 -1.335 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.204 0.169 0.313 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.390 1.741 0.821 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.376 2.495 1.608 1.00 0.00 C ATOM 1191 C VAL A 77 -3.456 3.253 0.658 1.00 0.00 C ATOM 1192 O VAL A 77 -3.435 2.976 -0.527 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.559 1.427 2.352 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.292 0.987 3.620 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -3.338 0.211 1.443 1.00 0.00 C ATOM 0 H VAL A 77 -5.062 1.391 -0.079 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.838 3.211 2.287 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.595 1.855 2.627 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.702 0.230 4.137 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.434 1.847 4.275 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.263 0.570 3.353 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.758 -0.542 1.977 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.302 -0.209 1.157 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.796 0.519 0.549 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.681 4.148 1.205 1.00 0.00 N ATOM 1206 CA PRO A 78 -1.708 4.885 0.378 1.00 0.00 C ATOM 1207 C PRO A 78 -0.669 3.876 -0.066 1.00 0.00 C ATOM 1208 O PRO A 78 0.271 3.585 0.641 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.107 5.901 1.334 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.319 5.304 2.683 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.624 4.552 2.611 1.00 0.00 C ATOM 0 HA PRO A 78 -2.122 5.374 -0.504 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.048 6.061 1.131 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.598 6.870 1.246 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.499 4.636 2.946 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.358 6.078 3.449 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.634 3.692 3.281 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.470 5.181 2.887 1.00 0.00 H new ATOM 1219 N ALA A 79 -0.860 3.291 -1.197 1.00 0.00 N ATOM 1220 CA ALA A 79 0.086 2.249 -1.641 1.00 0.00 C ATOM 1221 C ALA A 79 1.087 2.806 -2.647 1.00 0.00 C ATOM 1222 O ALA A 79 0.730 3.413 -3.636 1.00 0.00 O ATOM 1223 CB ALA A 79 -0.814 1.190 -2.271 1.00 0.00 C ATOM 0 H ALA A 79 -1.630 3.487 -1.837 1.00 0.00 H new ATOM 0 HA ALA A 79 0.692 1.851 -0.827 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.203 0.364 -2.636 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.517 0.819 -1.525 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.365 1.629 -3.102 1.00 0.00 H new ATOM 1229 N ILE A 80 2.348 2.594 -2.394 1.00 0.00 N ATOM 1230 CA ILE A 80 3.391 3.098 -3.322 1.00 0.00 C ATOM 1231 C ILE A 80 3.785 1.989 -4.291 1.00 0.00 C ATOM 1232 O ILE A 80 4.217 0.925 -3.894 1.00 0.00 O ATOM 1233 CB ILE A 80 4.548 3.476 -2.408 1.00 0.00 C ATOM 1234 CG1 ILE A 80 4.023 4.422 -1.326 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.636 4.174 -3.224 1.00 0.00 C ATOM 1236 CD1 ILE A 80 5.093 4.636 -0.253 1.00 0.00 C ATOM 0 H ILE A 80 2.700 2.091 -1.580 1.00 0.00 H new ATOM 0 HA ILE A 80 3.065 3.942 -3.930 1.00 0.00 H new ATOM 0 HB ILE A 80 4.971 2.583 -1.947 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.746 5.378 -1.770 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.122 4.007 -0.875 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.464 4.445 -2.569 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.994 3.501 -4.003 1.00 0.00 H new ATOM 0 HG23 ILE A 80 5.226 5.074 -3.682 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.710 5.311 0.513 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.349 3.679 0.201 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.983 5.071 -0.708 1.00 0.00 H new ATOM 1248 N VAL A 81 3.617 2.222 -5.559 1.00 0.00 N ATOM 1249 CA VAL A 81 3.960 1.171 -6.554 1.00 0.00 C ATOM 1250 C VAL A 81 5.318 1.467 -7.196 1.00 0.00 C ATOM 1251 O VAL A 81 5.700 2.605 -7.384 1.00 0.00 O ATOM 1252 CB VAL A 81 2.818 1.217 -7.572 1.00 0.00 C ATOM 1253 CG1 VAL A 81 3.080 0.205 -8.686 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.505 0.862 -6.864 1.00 0.00 C ATOM 0 H VAL A 81 3.258 3.093 -5.950 1.00 0.00 H new ATOM 0 HA VAL A 81 4.056 0.180 -6.111 1.00 0.00 H new ATOM 0 HB VAL A 81 2.752 2.216 -8.002 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.265 0.240 -9.409 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.018 0.448 -9.185 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.144 -0.796 -8.260 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.685 0.892 -7.582 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.579 -0.139 -6.440 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.316 1.581 -6.067 1.00 0.00 H new ATOM 1264 N VAL A 82 6.059 0.436 -7.504 1.00 0.00 N ATOM 1265 CA VAL A 82 7.413 0.628 -8.104 1.00 0.00 C ATOM 1266 C VAL A 82 7.479 0.006 -9.503 1.00 0.00 C ATOM 1267 O VAL A 82 6.609 -0.738 -9.910 1.00 0.00 O ATOM 1268 CB VAL A 82 8.358 -0.120 -7.159 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.802 0.332 -7.400 1.00 0.00 C ATOM 1270 CG2 VAL A 82 7.975 0.168 -5.704 1.00 0.00 C ATOM 0 H VAL A 82 5.784 -0.536 -7.365 1.00 0.00 H new ATOM 0 HA VAL A 82 7.667 1.682 -8.213 1.00 0.00 H new ATOM 0 HB VAL A 82 8.275 -1.190 -7.352 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.469 -0.204 -6.724 1.00 0.00 H new ATOM 0 HG12 VAL A 82 10.083 0.119 -8.431 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.883 1.403 -7.216 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.651 -0.367 -5.037 1.00 0.00 H new ATOM 0 HG22 VAL A 82 8.049 1.239 -5.513 1.00 0.00 H new ATOM 0 HG23 VAL A 82 6.952 -0.162 -5.525 1.00 0.00 H new ATOM 1280 N GLY A 83 8.524 0.294 -10.232 1.00 0.00 N ATOM 1281 CA GLY A 83 8.682 -0.291 -11.598 1.00 0.00 C ATOM 1282 C GLY A 83 7.713 0.357 -12.596 1.00 0.00 C ATOM 1283 O GLY A 83 7.346 -0.250 -13.584 1.00 0.00 O ATOM 0 H GLY A 83 9.280 0.913 -9.939 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.707 -0.151 -11.940 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.503 -1.365 -11.559 1.00 0.00 H new ATOM 1287 N ASP A 84 7.296 1.575 -12.371 1.00 0.00 N ATOM 1288 CA ASP A 84 6.358 2.215 -13.345 1.00 0.00 C ATOM 1289 C ASP A 84 6.710 3.685 -13.583 1.00 0.00 C ATOM 1290 O ASP A 84 6.827 4.469 -12.661 1.00 0.00 O ATOM 1291 CB ASP A 84 4.971 2.094 -12.713 1.00 0.00 C ATOM 1292 CG ASP A 84 3.918 2.580 -13.713 1.00 0.00 C ATOM 1293 OD1 ASP A 84 3.779 1.952 -14.750 1.00 0.00 O ATOM 1294 OD2 ASP A 84 3.272 3.577 -13.428 1.00 0.00 O ATOM 0 H ASP A 84 7.558 2.148 -11.569 1.00 0.00 H new ATOM 0 HA ASP A 84 6.412 1.729 -14.319 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.774 1.059 -12.434 1.00 0.00 H new ATOM 0 HB3 ASP A 84 4.922 2.685 -11.799 1.00 0.00 H new ATOM 1299 N ARG A 85 6.863 4.063 -14.825 1.00 0.00 N ATOM 1300 CA ARG A 85 7.192 5.483 -15.157 1.00 0.00 C ATOM 1301 C ARG A 85 6.095 6.078 -16.052 1.00 0.00 C ATOM 1302 O ARG A 85 5.008 5.546 -16.157 1.00 0.00 O ATOM 1303 CB ARG A 85 8.515 5.422 -15.922 1.00 0.00 C ATOM 1304 CG ARG A 85 9.675 5.186 -14.955 1.00 0.00 C ATOM 1305 CD ARG A 85 10.994 5.423 -15.695 1.00 0.00 C ATOM 1306 NE ARG A 85 11.180 6.901 -15.674 1.00 0.00 N ATOM 1307 CZ ARG A 85 11.467 7.503 -14.553 1.00 0.00 C ATOM 1308 NH1 ARG A 85 11.538 6.818 -13.443 1.00 0.00 N ATOM 1309 NH2 ARG A 85 11.672 8.794 -14.532 1.00 0.00 N ATOM 0 H ARG A 85 6.774 3.444 -15.631 1.00 0.00 H new ATOM 0 HA ARG A 85 7.264 6.107 -14.266 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.479 4.621 -16.661 1.00 0.00 H new ATOM 0 HB3 ARG A 85 8.671 6.353 -16.468 1.00 0.00 H new ATOM 0 HG2 ARG A 85 9.596 5.858 -14.101 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.639 4.169 -14.565 1.00 0.00 H new ATOM 0 HD2 ARG A 85 11.822 4.913 -15.202 1.00 0.00 H new ATOM 0 HD3 ARG A 85 10.949 5.044 -16.716 1.00 0.00 H new ATOM 0 HE ARG A 85 11.083 7.441 -16.534 1.00 0.00 H new ATOM 0 HH11 ARG A 85 11.369 5.812 -13.453 1.00 0.00 H new ATOM 0 HH12 ARG A 85 11.762 7.289 -12.567 1.00 0.00 H new ATOM 0 HH21 ARG A 85 11.608 9.335 -15.395 1.00 0.00 H new ATOM 0 HH22 ARG A 85 11.896 9.261 -13.653 1.00 0.00 H new ATOM 1323 N ASP A 86 6.376 7.178 -16.703 1.00 0.00 N ATOM 1324 CA ASP A 86 5.353 7.806 -17.593 1.00 0.00 C ATOM 1325 C ASP A 86 5.184 6.986 -18.873 1.00 0.00 C ATOM 1326 O ASP A 86 5.898 7.171 -19.840 1.00 0.00 O ATOM 1327 CB ASP A 86 5.915 9.189 -17.925 1.00 0.00 C ATOM 1328 CG ASP A 86 6.087 9.994 -16.638 1.00 0.00 C ATOM 1329 OD1 ASP A 86 7.127 9.862 -16.014 1.00 0.00 O ATOM 1330 OD2 ASP A 86 5.177 10.733 -16.301 1.00 0.00 O ATOM 0 H ASP A 86 7.269 7.668 -16.657 1.00 0.00 H new ATOM 0 HA ASP A 86 4.374 7.860 -17.116 1.00 0.00 H new ATOM 0 HB2 ASP A 86 6.873 9.091 -18.435 1.00 0.00 H new ATOM 0 HB3 ASP A 86 5.243 9.712 -18.606 1.00 0.00 H new ATOM 1335 N SER A 87 4.242 6.084 -18.893 1.00 0.00 N ATOM 1336 CA SER A 87 4.033 5.265 -20.118 1.00 0.00 C ATOM 1337 C SER A 87 3.294 6.090 -21.176 1.00 0.00 C ATOM 1338 O SER A 87 2.223 6.611 -20.935 1.00 0.00 O ATOM 1339 CB SER A 87 3.188 4.071 -19.664 1.00 0.00 C ATOM 1340 OG SER A 87 2.151 4.522 -18.800 1.00 0.00 O ATOM 0 H SER A 87 3.611 5.880 -18.118 1.00 0.00 H new ATOM 0 HA SER A 87 4.971 4.940 -20.568 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.760 3.565 -20.530 1.00 0.00 H new ATOM 0 HB3 SER A 87 3.815 3.344 -19.148 1.00 0.00 H new ATOM 0 HG SER A 87 1.818 3.769 -18.268 1.00 0.00 H new ATOM 1346 N GLU A 88 3.857 6.216 -22.350 1.00 0.00 N ATOM 1347 CA GLU A 88 3.179 7.008 -23.414 1.00 0.00 C ATOM 1348 C GLU A 88 1.890 6.305 -23.844 1.00 0.00 C ATOM 1349 O GLU A 88 0.985 6.918 -24.374 1.00 0.00 O ATOM 1350 CB GLU A 88 4.175 7.065 -24.578 1.00 0.00 C ATOM 1351 CG GLU A 88 4.312 5.678 -25.211 1.00 0.00 C ATOM 1352 CD GLU A 88 5.425 5.699 -26.261 1.00 0.00 C ATOM 1353 OE1 GLU A 88 5.163 6.143 -27.367 1.00 0.00 O ATOM 1354 OE2 GLU A 88 6.519 5.264 -25.942 1.00 0.00 O ATOM 0 H GLU A 88 4.753 5.806 -22.615 1.00 0.00 H new ATOM 0 HA GLU A 88 2.905 8.006 -23.073 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.836 7.784 -25.324 1.00 0.00 H new ATOM 0 HB3 GLU A 88 5.146 7.410 -24.222 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.537 4.938 -24.443 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.369 5.383 -25.672 1.00 0.00 H new ATOM 1361 N ASP A 89 1.801 5.021 -23.622 1.00 0.00 N ATOM 1362 CA ASP A 89 0.569 4.280 -24.020 1.00 0.00 C ATOM 1363 C ASP A 89 -0.319 4.025 -22.801 1.00 0.00 C ATOM 1364 O ASP A 89 0.009 3.220 -21.952 1.00 0.00 O ATOM 1365 CB ASP A 89 1.073 2.952 -24.594 1.00 0.00 C ATOM 1366 CG ASP A 89 2.011 3.228 -25.770 1.00 0.00 C ATOM 1367 OD1 ASP A 89 1.802 4.221 -26.448 1.00 0.00 O ATOM 1368 OD2 ASP A 89 2.918 2.440 -25.977 1.00 0.00 O ATOM 0 H ASP A 89 2.527 4.454 -23.183 1.00 0.00 H new ATOM 0 HA ASP A 89 -0.030 4.840 -24.739 1.00 0.00 H new ATOM 0 HB2 ASP A 89 1.596 2.385 -23.823 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.231 2.342 -24.922 1.00 0.00 H new ATOM 1373 N PRO A 90 -1.424 4.719 -22.755 1.00 0.00 N ATOM 1374 CA PRO A 90 -2.370 4.558 -21.626 1.00 0.00 C ATOM 1375 C PRO A 90 -3.126 3.230 -21.744 1.00 0.00 C ATOM 1376 O PRO A 90 -3.490 2.627 -20.757 1.00 0.00 O ATOM 1377 CB PRO A 90 -3.310 5.751 -21.772 1.00 0.00 C ATOM 1378 CG PRO A 90 -3.246 6.127 -23.219 1.00 0.00 C ATOM 1379 CD PRO A 90 -1.889 5.710 -23.734 1.00 0.00 C ATOM 0 HA PRO A 90 -1.880 4.533 -20.653 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.326 5.490 -21.478 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -2.997 6.579 -21.136 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -4.038 5.631 -23.780 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -3.391 7.200 -23.344 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -1.956 5.281 -24.734 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -1.208 6.559 -23.796 1.00 0.00 H new ATOM 1387 N ASP A 91 -3.359 2.762 -22.942 1.00 0.00 N ATOM 1388 CA ASP A 91 -4.089 1.467 -23.103 1.00 0.00 C ATOM 1389 C ASP A 91 -3.390 0.362 -22.314 1.00 0.00 C ATOM 1390 O ASP A 91 -4.024 -0.461 -21.684 1.00 0.00 O ATOM 1391 CB ASP A 91 -4.025 1.153 -24.596 1.00 0.00 C ATOM 1392 CG ASP A 91 -4.932 2.115 -25.357 1.00 0.00 C ATOM 1393 OD1 ASP A 91 -6.137 1.925 -25.308 1.00 0.00 O ATOM 1394 OD2 ASP A 91 -4.409 3.026 -25.976 1.00 0.00 O ATOM 0 H ASP A 91 -3.078 3.216 -23.811 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.113 1.532 -22.736 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -2.999 1.243 -24.954 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.336 0.124 -24.776 1.00 0.00 H new ATOM 1399 N GLU A 92 -2.087 0.337 -22.345 1.00 0.00 N ATOM 1400 CA GLU A 92 -1.345 -0.718 -21.598 1.00 0.00 C ATOM 1401 C GLU A 92 -1.634 -0.605 -20.101 1.00 0.00 C ATOM 1402 O GLU A 92 -2.173 0.383 -19.643 1.00 0.00 O ATOM 1403 CB GLU A 92 0.137 -0.446 -21.874 1.00 0.00 C ATOM 1404 CG GLU A 92 0.454 -0.727 -23.345 1.00 0.00 C ATOM 1405 CD GLU A 92 1.736 -1.559 -23.444 1.00 0.00 C ATOM 1406 OE1 GLU A 92 1.716 -2.698 -23.011 1.00 0.00 O ATOM 1407 OE2 GLU A 92 2.718 -1.040 -23.952 1.00 0.00 O ATOM 0 H GLU A 92 -1.504 1.001 -22.855 1.00 0.00 H new ATOM 0 HA GLU A 92 -1.638 -1.721 -21.909 1.00 0.00 H new ATOM 0 HB2 GLU A 92 0.376 0.590 -21.633 1.00 0.00 H new ATOM 0 HB3 GLU A 92 0.756 -1.074 -21.233 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -0.375 -1.260 -23.811 1.00 0.00 H new ATOM 0 HG3 GLU A 92 0.574 0.211 -23.887 1.00 0.00 H new ATOM 1414 N PRO A 93 -1.259 -1.629 -19.387 1.00 0.00 N ATOM 1415 CA PRO A 93 -1.468 -1.655 -17.927 1.00 0.00 C ATOM 1416 C PRO A 93 -0.333 -0.890 -17.229 1.00 0.00 C ATOM 1417 O PRO A 93 0.338 -0.078 -17.833 1.00 0.00 O ATOM 1418 CB PRO A 93 -1.423 -3.146 -17.593 1.00 0.00 C ATOM 1419 CG PRO A 93 -0.611 -3.780 -18.684 1.00 0.00 C ATOM 1420 CD PRO A 93 -0.610 -2.847 -19.872 1.00 0.00 C ATOM 0 HA PRO A 93 -2.397 -1.185 -17.603 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -0.968 -3.315 -16.617 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -2.427 -3.570 -17.555 1.00 0.00 H new ATOM 0 HG2 PRO A 93 0.408 -3.963 -18.343 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -1.033 -4.747 -18.960 1.00 0.00 H new ATOM 0 HD2 PRO A 93 0.404 -2.645 -20.216 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -1.153 -3.277 -20.714 1.00 0.00 H new ATOM 1428 N ALA A 94 -0.111 -1.153 -15.966 1.00 0.00 N ATOM 1429 CA ALA A 94 0.989 -0.454 -15.218 1.00 0.00 C ATOM 1430 C ALA A 94 0.635 1.009 -14.954 1.00 0.00 C ATOM 1431 O ALA A 94 1.329 1.913 -15.378 1.00 0.00 O ATOM 1432 CB ALA A 94 2.222 -0.537 -16.116 1.00 0.00 C ATOM 0 H ALA A 94 -0.645 -1.825 -15.414 1.00 0.00 H new ATOM 0 HA ALA A 94 1.156 -0.920 -14.247 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.062 -0.044 -15.627 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.470 -1.583 -16.297 1.00 0.00 H new ATOM 0 HB3 ALA A 94 2.015 -0.043 -17.065 1.00 0.00 H new ATOM 1438 N LYS A 95 -0.433 1.252 -14.256 1.00 0.00 N ATOM 1439 CA LYS A 95 -0.823 2.655 -13.967 1.00 0.00 C ATOM 1440 C LYS A 95 -1.555 2.732 -12.629 1.00 0.00 C ATOM 1441 O LYS A 95 -1.620 1.771 -11.886 1.00 0.00 O ATOM 1442 CB LYS A 95 -1.756 3.036 -15.115 1.00 0.00 C ATOM 1443 CG LYS A 95 -1.214 4.282 -15.816 1.00 0.00 C ATOM 1444 CD LYS A 95 -2.217 4.768 -16.861 1.00 0.00 C ATOM 1445 CE LYS A 95 -1.607 5.938 -17.635 1.00 0.00 C ATOM 1446 NZ LYS A 95 -0.688 5.308 -18.625 1.00 0.00 N ATOM 0 H LYS A 95 -1.054 0.539 -13.872 1.00 0.00 H new ATOM 0 HA LYS A 95 0.035 3.324 -13.894 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -1.835 2.212 -15.824 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -2.760 3.226 -14.735 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -1.027 5.069 -15.085 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -0.260 4.056 -16.292 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -2.471 3.957 -17.544 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -3.143 5.079 -16.377 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -2.378 6.528 -18.131 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -1.068 6.613 -16.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -0.682 5.870 -19.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 0.274 5.271 -18.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -1.013 4.343 -18.836 1.00 0.00 H new ATOM 1460 N GLU A 96 -2.114 3.866 -12.318 1.00 0.00 N ATOM 1461 CA GLU A 96 -2.855 4.008 -11.036 1.00 0.00 C ATOM 1462 C GLU A 96 -3.851 2.855 -10.879 1.00 0.00 C ATOM 1463 O GLU A 96 -4.269 2.523 -9.787 1.00 0.00 O ATOM 1464 CB GLU A 96 -3.588 5.341 -11.170 1.00 0.00 C ATOM 1465 CG GLU A 96 -4.623 5.478 -10.054 1.00 0.00 C ATOM 1466 CD GLU A 96 -4.443 6.826 -9.359 1.00 0.00 C ATOM 1467 OE1 GLU A 96 -4.785 7.831 -9.960 1.00 0.00 O ATOM 1468 OE2 GLU A 96 -3.965 6.833 -8.236 1.00 0.00 O ATOM 0 H GLU A 96 -2.090 4.704 -12.899 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.203 3.983 -10.163 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -2.876 6.165 -11.121 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -4.078 5.401 -12.142 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -5.630 5.400 -10.465 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -4.508 4.667 -9.335 1.00 0.00 H new ATOM 1475 N GLN A 97 -4.247 2.252 -11.970 1.00 0.00 N ATOM 1476 CA GLN A 97 -5.232 1.130 -11.903 1.00 0.00 C ATOM 1477 C GLN A 97 -4.664 -0.073 -11.150 1.00 0.00 C ATOM 1478 O GLN A 97 -5.394 -0.899 -10.646 1.00 0.00 O ATOM 1479 CB GLN A 97 -5.505 0.744 -13.351 1.00 0.00 C ATOM 1480 CG GLN A 97 -6.515 -0.403 -13.376 1.00 0.00 C ATOM 1481 CD GLN A 97 -6.831 -0.777 -14.825 1.00 0.00 C ATOM 1482 OE1 GLN A 97 -5.892 -0.690 -15.728 1.00 0.00 O flip ATOM 1483 NE2 GLN A 97 -7.946 -1.149 -15.141 1.00 0.00 N flip ATOM 0 H GLN A 97 -3.929 2.489 -12.910 1.00 0.00 H new ATOM 0 HA GLN A 97 -6.133 1.436 -11.371 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -5.893 1.600 -13.902 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -4.580 0.442 -13.841 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -6.113 -1.267 -12.846 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -7.428 -0.108 -12.858 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -8.680 -1.217 -14.436 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -8.147 -1.393 -16.111 1.00 0.00 H new ATOM 1492 N LEU A 98 -3.373 -0.184 -11.065 1.00 0.00 N ATOM 1493 CA LEU A 98 -2.790 -1.339 -10.345 1.00 0.00 C ATOM 1494 C LEU A 98 -3.420 -1.395 -8.970 1.00 0.00 C ATOM 1495 O LEU A 98 -3.580 -2.445 -8.384 1.00 0.00 O ATOM 1496 CB LEU A 98 -1.289 -1.058 -10.280 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.746 -0.947 -11.708 1.00 0.00 C ATOM 1498 CD1 LEU A 98 0.671 -0.380 -11.685 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.720 -2.332 -12.345 1.00 0.00 C ATOM 0 H LEU A 98 -2.700 0.472 -11.461 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.968 -2.300 -10.827 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.101 -0.135 -9.732 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.778 -1.857 -9.743 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.390 -0.283 -12.285 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.049 -0.305 -12.704 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.660 0.610 -11.228 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.317 -1.040 -11.106 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.334 -2.258 -13.362 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.077 -2.990 -11.760 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.730 -2.740 -12.369 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.821 -0.261 -8.471 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.485 -0.233 -7.141 1.00 0.00 C ATOM 1513 C TYR A 99 -5.667 0.750 -7.154 1.00 0.00 C ATOM 1514 O TYR A 99 -6.535 0.670 -8.001 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.402 0.203 -6.151 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.748 -0.274 -4.756 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -5.080 -0.529 -4.395 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.724 -0.451 -3.816 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.382 -0.961 -3.094 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -3.027 -0.878 -2.521 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.352 -1.132 -2.158 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.643 -1.554 -0.878 1.00 0.00 O ATOM 0 H TYR A 99 -3.718 0.646 -8.926 1.00 0.00 H new ATOM 0 HA TYR A 99 -4.898 -1.204 -6.866 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.437 -0.204 -6.454 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.307 1.289 -6.159 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -5.872 -0.393 -5.117 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.698 -0.257 -4.093 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.406 -1.161 -2.814 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.235 -1.012 -1.799 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.615 -1.597 -0.761 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.717 1.671 -6.227 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.848 2.641 -6.212 1.00 0.00 C ATOM 1534 C HIS A 100 -6.427 3.962 -6.859 1.00 0.00 C ATOM 1535 O HIS A 100 -5.312 4.115 -7.315 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.233 2.826 -4.737 1.00 0.00 C ATOM 1537 CG HIS A 100 -6.074 3.342 -3.927 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -6.073 4.626 -3.371 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -4.894 2.757 -3.520 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -4.931 4.767 -2.667 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.208 3.663 -2.740 1.00 0.00 N ATOM 0 H HIS A 100 -5.028 1.792 -5.485 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.701 2.279 -6.786 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -8.069 3.521 -4.662 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -7.571 1.875 -4.326 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -4.564 1.760 -3.770 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.648 5.655 -2.122 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.302 3.509 -2.297 1.00 0.00 H new ATOM 1549 N SER A 101 -7.322 4.908 -6.932 1.00 0.00 N ATOM 1550 CA SER A 101 -6.989 6.207 -7.584 1.00 0.00 C ATOM 1551 C SER A 101 -6.108 7.093 -6.693 1.00 0.00 C ATOM 1552 O SER A 101 -5.822 8.219 -7.041 1.00 0.00 O ATOM 1553 CB SER A 101 -8.341 6.879 -7.823 1.00 0.00 C ATOM 1554 OG SER A 101 -8.872 6.442 -9.067 1.00 0.00 O ATOM 0 H SER A 101 -8.272 4.838 -6.568 1.00 0.00 H new ATOM 0 HA SER A 101 -6.421 6.052 -8.501 1.00 0.00 H new ATOM 0 HB2 SER A 101 -9.030 6.633 -7.015 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.226 7.963 -7.825 1.00 0.00 H new ATOM 0 HG SER A 101 -9.740 6.871 -9.221 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.674 6.616 -5.559 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.817 7.484 -4.696 1.00 0.00 C ATOM 1562 C ALA A 102 -3.421 6.878 -4.504 1.00 0.00 C ATOM 1563 O ALA A 102 -2.468 7.587 -4.253 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.542 7.586 -3.357 1.00 0.00 C ATOM 0 H ALA A 102 -5.869 5.683 -5.196 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.668 8.462 -5.153 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.964 8.211 -2.677 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.526 8.029 -3.509 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.655 6.591 -2.927 1.00 0.00 H new ATOM 1570 N GLU A 103 -3.281 5.584 -4.619 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.934 4.971 -4.436 1.00 0.00 C ATOM 1572 C GLU A 103 -0.884 5.787 -5.205 1.00 0.00 C ATOM 1573 O GLU A 103 -1.150 6.305 -6.272 1.00 0.00 O ATOM 1574 CB GLU A 103 -2.069 3.557 -5.010 1.00 0.00 C ATOM 1575 CG GLU A 103 -2.832 3.612 -6.335 1.00 0.00 C ATOM 1576 CD GLU A 103 -2.014 2.931 -7.434 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -0.950 3.437 -7.755 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -2.470 1.919 -7.946 1.00 0.00 O ATOM 0 H GLU A 103 -4.035 4.930 -4.830 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.613 4.951 -3.395 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -1.082 3.121 -5.165 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.594 2.915 -4.303 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -3.798 3.118 -6.229 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -3.032 4.648 -6.607 1.00 0.00 H new ATOM 1585 N LEU A 104 0.306 5.918 -4.670 1.00 0.00 N ATOM 1586 CA LEU A 104 1.354 6.713 -5.379 1.00 0.00 C ATOM 1587 C LEU A 104 2.265 5.793 -6.197 1.00 0.00 C ATOM 1588 O LEU A 104 2.357 4.610 -5.948 1.00 0.00 O ATOM 1589 CB LEU A 104 2.174 7.402 -4.284 1.00 0.00 C ATOM 1590 CG LEU A 104 1.714 8.848 -4.125 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.402 8.869 -3.342 1.00 0.00 C ATOM 1592 CD2 LEU A 104 2.795 9.647 -3.381 1.00 0.00 C ATOM 0 H LEU A 104 0.594 5.512 -3.780 1.00 0.00 H new ATOM 0 HA LEU A 104 0.904 7.429 -6.066 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.059 6.868 -3.341 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.233 7.374 -4.539 1.00 0.00 H new ATOM 0 HG LEU A 104 1.553 9.302 -5.103 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.065 9.899 -3.223 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.354 8.300 -3.883 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.557 8.423 -2.360 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.469 10.681 -3.266 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.960 9.207 -2.398 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.724 9.621 -3.951 1.00 0.00 H new ATOM 1604 N HIS A 105 2.954 6.343 -7.157 1.00 0.00 N ATOM 1605 CA HIS A 105 3.882 5.516 -7.978 1.00 0.00 C ATOM 1606 C HIS A 105 5.319 5.972 -7.724 1.00 0.00 C ATOM 1607 O HIS A 105 5.596 7.153 -7.628 1.00 0.00 O ATOM 1608 CB HIS A 105 3.492 5.779 -9.432 1.00 0.00 C ATOM 1609 CG HIS A 105 2.013 5.576 -9.614 1.00 0.00 C ATOM 1610 ND1 HIS A 105 1.302 6.191 -10.637 1.00 0.00 N ATOM 1611 CD2 HIS A 105 1.103 4.802 -8.937 1.00 0.00 C ATOM 1612 CE1 HIS A 105 0.027 5.773 -10.550 1.00 0.00 C ATOM 1613 NE2 HIS A 105 -0.151 4.927 -9.530 1.00 0.00 N ATOM 0 H HIS A 105 2.915 7.331 -7.409 1.00 0.00 H new ATOM 0 HA HIS A 105 3.818 4.455 -7.736 1.00 0.00 H new ATOM 0 HB2 HIS A 105 3.765 6.797 -9.712 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.043 5.109 -10.092 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.326 4.190 -8.076 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -0.759 6.083 -11.223 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -1.019 4.471 -9.247 1.00 0.00 H new ATOM 1621 N LEU A 106 6.235 5.054 -7.600 1.00 0.00 N ATOM 1622 CA LEU A 106 7.644 5.448 -7.332 1.00 0.00 C ATOM 1623 C LEU A 106 8.600 4.827 -8.351 1.00 0.00 C ATOM 1624 O LEU A 106 8.428 3.703 -8.770 1.00 0.00 O ATOM 1625 CB LEU A 106 7.950 4.893 -5.954 1.00 0.00 C ATOM 1626 CG LEU A 106 9.363 5.303 -5.560 1.00 0.00 C ATOM 1627 CD1 LEU A 106 9.414 6.820 -5.364 1.00 0.00 C ATOM 1628 CD2 LEU A 106 9.737 4.598 -4.259 1.00 0.00 C ATOM 0 H LEU A 106 6.069 4.050 -7.672 1.00 0.00 H new ATOM 0 HA LEU A 106 7.769 6.529 -7.397 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.231 5.271 -5.227 1.00 0.00 H new ATOM 0 HB3 LEU A 106 7.859 3.807 -5.956 1.00 0.00 H new ATOM 0 HG LEU A 106 10.067 5.021 -6.343 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.424 7.117 -5.082 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.136 7.317 -6.294 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.718 7.109 -4.577 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.747 4.884 -3.967 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.037 4.887 -3.475 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.694 3.519 -4.405 1.00 0.00 H new ATOM 1640 N GLY A 107 9.617 5.545 -8.731 1.00 0.00 N ATOM 1641 CA GLY A 107 10.593 4.983 -9.703 1.00 0.00 C ATOM 1642 C GLY A 107 11.340 3.820 -9.049 1.00 0.00 C ATOM 1643 O GLY A 107 11.423 3.723 -7.841 1.00 0.00 O ATOM 0 H GLY A 107 9.815 6.494 -8.412 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.076 4.641 -10.599 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.298 5.753 -10.016 1.00 0.00 H new ATOM 1647 N ILE A 108 11.885 2.938 -9.837 1.00 0.00 N ATOM 1648 CA ILE A 108 12.628 1.791 -9.278 1.00 0.00 C ATOM 1649 C ILE A 108 13.824 2.288 -8.461 1.00 0.00 C ATOM 1650 O ILE A 108 14.110 1.791 -7.389 1.00 0.00 O ATOM 1651 CB ILE A 108 13.089 1.039 -10.518 1.00 0.00 C ATOM 1652 CG1 ILE A 108 11.879 0.400 -11.203 1.00 0.00 C ATOM 1653 CG2 ILE A 108 14.078 -0.039 -10.113 1.00 0.00 C ATOM 1654 CD1 ILE A 108 12.222 0.091 -12.660 1.00 0.00 C ATOM 0 H ILE A 108 11.843 2.969 -10.856 1.00 0.00 H new ATOM 0 HA ILE A 108 12.035 1.172 -8.605 1.00 0.00 H new ATOM 0 HB ILE A 108 13.571 1.730 -11.209 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.595 -0.515 -10.683 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.023 1.073 -11.155 1.00 0.00 H new ATOM 0 HG21 ILE A 108 14.410 -0.580 -10.999 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.937 0.421 -9.625 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.597 -0.733 -9.424 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.360 -0.364 -13.148 1.00 0.00 H new ATOM 0 HD12 ILE A 108 12.485 1.015 -13.176 1.00 0.00 H new ATOM 0 HD13 ILE A 108 13.066 -0.598 -12.697 1.00 0.00 H new ATOM 1666 N HIS A 109 14.523 3.276 -8.959 1.00 0.00 N ATOM 1667 CA HIS A 109 15.698 3.816 -8.213 1.00 0.00 C ATOM 1668 C HIS A 109 15.247 4.905 -7.233 1.00 0.00 C ATOM 1669 O HIS A 109 16.054 5.559 -6.601 1.00 0.00 O ATOM 1670 CB HIS A 109 16.609 4.425 -9.281 1.00 0.00 C ATOM 1671 CG HIS A 109 15.918 5.608 -9.893 1.00 0.00 C ATOM 1672 ND1 HIS A 109 15.853 6.831 -9.249 1.00 0.00 N ATOM 1673 CD2 HIS A 109 15.238 5.771 -11.075 1.00 0.00 C ATOM 1674 CE1 HIS A 109 15.155 7.669 -10.035 1.00 0.00 C ATOM 1675 NE2 HIS A 109 14.757 7.073 -11.162 1.00 0.00 N ATOM 0 H HIS A 109 14.330 3.732 -9.851 1.00 0.00 H new ATOM 0 HA HIS A 109 16.202 3.042 -7.634 1.00 0.00 H new ATOM 0 HB2 HIS A 109 17.557 4.730 -8.838 1.00 0.00 H new ATOM 0 HB3 HIS A 109 16.839 3.685 -10.047 1.00 0.00 H new ATOM 0 HD1 HIS A 109 16.261 7.056 -8.342 1.00 0.00 H new ATOM 0 HD2 HIS A 109 15.098 5.005 -11.823 1.00 0.00 H new ATOM 0 HE1 HIS A 109 14.942 8.698 -9.786 1.00 0.00 H new ATOM 1683 N GLN A 110 13.965 5.122 -7.107 1.00 0.00 N ATOM 1684 CA GLN A 110 13.485 6.183 -6.171 1.00 0.00 C ATOM 1685 C GLN A 110 12.937 5.559 -4.886 1.00 0.00 C ATOM 1686 O GLN A 110 12.229 6.189 -4.132 1.00 0.00 O ATOM 1687 CB GLN A 110 12.380 6.907 -6.934 1.00 0.00 C ATOM 1688 CG GLN A 110 12.966 7.496 -8.214 1.00 0.00 C ATOM 1689 CD GLN A 110 11.865 8.203 -9.001 1.00 0.00 C ATOM 1690 OE1 GLN A 110 11.825 8.126 -10.212 1.00 0.00 O ATOM 1691 NE2 GLN A 110 10.963 8.889 -8.360 1.00 0.00 N ATOM 0 H GLN A 110 13.234 4.616 -7.607 1.00 0.00 H new ATOM 0 HA GLN A 110 14.285 6.859 -5.870 1.00 0.00 H new ATOM 0 HB2 GLN A 110 11.572 6.216 -7.173 1.00 0.00 H new ATOM 0 HB3 GLN A 110 11.952 7.697 -6.317 1.00 0.00 H new ATOM 0 HG2 GLN A 110 13.763 8.199 -7.972 1.00 0.00 H new ATOM 0 HG3 GLN A 110 13.411 6.706 -8.820 1.00 0.00 H new ATOM 0 HE21 GLN A 110 10.998 8.953 -7.343 1.00 0.00 H new ATOM 0 HE22 GLN A 110 10.221 9.363 -8.875 1.00 0.00 H new ATOM 1700 N LEU A 111 13.263 4.324 -4.633 1.00 0.00 N ATOM 1701 CA LEU A 111 12.759 3.656 -3.396 1.00 0.00 C ATOM 1702 C LEU A 111 13.067 4.496 -2.162 1.00 0.00 C ATOM 1703 O LEU A 111 12.266 4.599 -1.258 1.00 0.00 O ATOM 1704 CB LEU A 111 13.509 2.328 -3.322 1.00 0.00 C ATOM 1705 CG LEU A 111 13.180 1.485 -4.549 1.00 0.00 C ATOM 1706 CD1 LEU A 111 14.095 0.262 -4.601 1.00 0.00 C ATOM 1707 CD2 LEU A 111 11.730 1.028 -4.445 1.00 0.00 C ATOM 0 H LEU A 111 13.857 3.745 -5.227 1.00 0.00 H new ATOM 0 HA LEU A 111 11.678 3.521 -3.427 1.00 0.00 H new ATOM 0 HB2 LEU A 111 14.583 2.508 -3.269 1.00 0.00 H new ATOM 0 HB3 LEU A 111 13.231 1.792 -2.415 1.00 0.00 H new ATOM 0 HG LEU A 111 13.328 2.075 -5.454 1.00 0.00 H new ATOM 0 HD11 LEU A 111 13.854 -0.336 -5.480 1.00 0.00 H new ATOM 0 HD12 LEU A 111 15.134 0.587 -4.657 1.00 0.00 H new ATOM 0 HD13 LEU A 111 13.950 -0.339 -3.703 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.476 0.423 -5.315 1.00 0.00 H new ATOM 0 HD22 LEU A 111 11.599 0.435 -3.540 1.00 0.00 H new ATOM 0 HD23 LEU A 111 11.076 1.899 -4.405 1.00 0.00 H new ATOM 1719 N GLU A 112 14.221 5.094 -2.109 1.00 0.00 N ATOM 1720 CA GLU A 112 14.566 5.915 -0.917 1.00 0.00 C ATOM 1721 C GLU A 112 13.522 7.012 -0.719 1.00 0.00 C ATOM 1722 O GLU A 112 13.443 7.628 0.325 1.00 0.00 O ATOM 1723 CB GLU A 112 15.937 6.520 -1.210 1.00 0.00 C ATOM 1724 CG GLU A 112 15.803 7.609 -2.270 1.00 0.00 C ATOM 1725 CD GLU A 112 17.198 8.046 -2.717 1.00 0.00 C ATOM 1726 OE1 GLU A 112 18.144 7.753 -2.003 1.00 0.00 O ATOM 1727 OE2 GLU A 112 17.299 8.663 -3.763 1.00 0.00 O ATOM 0 H GLU A 112 14.937 5.051 -2.834 1.00 0.00 H new ATOM 0 HA GLU A 112 14.585 5.320 -0.004 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.363 6.938 -0.298 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.621 5.745 -1.556 1.00 0.00 H new ATOM 0 HG2 GLU A 112 15.235 7.236 -3.122 1.00 0.00 H new ATOM 0 HG3 GLU A 112 15.253 8.460 -1.868 1.00 0.00 H new ATOM 1734 N GLN A 113 12.711 7.259 -1.710 1.00 0.00 N ATOM 1735 CA GLN A 113 11.668 8.307 -1.559 1.00 0.00 C ATOM 1736 C GLN A 113 10.448 7.727 -0.859 1.00 0.00 C ATOM 1737 O GLN A 113 9.456 8.394 -0.660 1.00 0.00 O ATOM 1738 CB GLN A 113 11.298 8.708 -2.978 1.00 0.00 C ATOM 1739 CG GLN A 113 12.438 9.507 -3.592 1.00 0.00 C ATOM 1740 CD GLN A 113 12.065 9.926 -5.014 1.00 0.00 C ATOM 1741 OE1 GLN A 113 10.902 10.026 -5.349 1.00 0.00 O ATOM 1742 NE2 GLN A 113 13.016 10.173 -5.869 1.00 0.00 N ATOM 0 H GLN A 113 12.726 6.783 -2.612 1.00 0.00 H new ATOM 0 HA GLN A 113 12.021 9.152 -0.968 1.00 0.00 H new ATOM 0 HB2 GLN A 113 11.097 7.820 -3.578 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.384 9.302 -2.973 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.645 10.388 -2.985 1.00 0.00 H new ATOM 0 HG3 GLN A 113 13.349 8.908 -3.606 1.00 0.00 H new ATOM 0 HE21 GLN A 113 13.992 10.088 -5.585 1.00 0.00 H new ATOM 0 HE22 GLN A 113 12.785 10.451 -6.823 1.00 0.00 H new ATOM 1751 N LEU A 114 10.504 6.476 -0.508 1.00 0.00 N ATOM 1752 CA LEU A 114 9.341 5.838 0.152 1.00 0.00 C ATOM 1753 C LEU A 114 8.893 6.603 1.405 1.00 0.00 C ATOM 1754 O LEU A 114 7.728 6.866 1.557 1.00 0.00 O ATOM 1755 CB LEU A 114 9.811 4.438 0.505 1.00 0.00 C ATOM 1756 CG LEU A 114 9.560 3.515 -0.682 1.00 0.00 C ATOM 1757 CD1 LEU A 114 10.672 2.476 -0.761 1.00 0.00 C ATOM 1758 CD2 LEU A 114 8.218 2.808 -0.497 1.00 0.00 C ATOM 0 H LEU A 114 11.310 5.867 -0.651 1.00 0.00 H new ATOM 0 HA LEU A 114 8.470 5.830 -0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 114 10.872 4.449 0.755 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.280 4.073 1.384 1.00 0.00 H new ATOM 0 HG LEU A 114 9.543 4.100 -1.602 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.493 1.816 -1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 114 11.631 2.978 -0.888 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.688 1.890 0.158 1.00 0.00 H new ATOM 0 HD21 LEU A 114 8.035 2.147 -1.344 1.00 0.00 H new ATOM 0 HD22 LEU A 114 8.239 2.223 0.422 1.00 0.00 H new ATOM 0 HD23 LEU A 114 7.421 3.550 -0.437 1.00 0.00 H new ATOM 1770 N PRO A 115 9.809 6.937 2.275 1.00 0.00 N ATOM 1771 CA PRO A 115 9.419 7.670 3.506 1.00 0.00 C ATOM 1772 C PRO A 115 8.838 9.034 3.138 1.00 0.00 C ATOM 1773 O PRO A 115 7.824 9.443 3.670 1.00 0.00 O ATOM 1774 CB PRO A 115 10.718 7.750 4.306 1.00 0.00 C ATOM 1775 CG PRO A 115 11.801 7.597 3.287 1.00 0.00 C ATOM 1776 CD PRO A 115 11.250 6.687 2.218 1.00 0.00 C ATOM 0 HA PRO A 115 8.636 7.187 4.090 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.801 8.701 4.832 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.769 6.963 5.059 1.00 0.00 H new ATOM 0 HG2 PRO A 115 12.081 8.564 2.869 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.699 7.172 3.735 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.661 6.924 1.237 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.485 5.642 2.418 1.00 0.00 H new ATOM 1784 N TYR A 116 9.422 9.717 2.198 1.00 0.00 N ATOM 1785 CA TYR A 116 8.833 11.015 1.780 1.00 0.00 C ATOM 1786 C TYR A 116 7.559 10.705 0.991 1.00 0.00 C ATOM 1787 O TYR A 116 6.541 11.357 1.130 1.00 0.00 O ATOM 1788 CB TYR A 116 9.922 11.695 0.935 1.00 0.00 C ATOM 1789 CG TYR A 116 9.464 11.921 -0.488 1.00 0.00 C ATOM 1790 CD1 TYR A 116 8.430 12.825 -0.755 1.00 0.00 C ATOM 1791 CD2 TYR A 116 10.085 11.242 -1.535 1.00 0.00 C ATOM 1792 CE1 TYR A 116 8.020 13.045 -2.077 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.678 11.464 -2.853 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.646 12.365 -3.125 1.00 0.00 C ATOM 1795 OH TYR A 116 8.247 12.581 -4.428 1.00 0.00 O ATOM 0 H TYR A 116 10.271 9.438 1.706 1.00 0.00 H new ATOM 0 HA TYR A 116 8.549 11.677 2.598 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.191 12.650 1.387 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.821 11.078 0.935 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.949 13.352 0.056 1.00 0.00 H new ATOM 0 HD2 TYR A 116 10.882 10.543 -1.327 1.00 0.00 H new ATOM 0 HE1 TYR A 116 7.220 13.740 -2.286 1.00 0.00 H new ATOM 0 HE2 TYR A 116 10.162 10.938 -3.663 1.00 0.00 H new ATOM 0 HH TYR A 116 8.787 12.029 -5.031 1.00 0.00 H new ATOM 1805 N GLN A 117 7.605 9.678 0.189 1.00 0.00 N ATOM 1806 CA GLN A 117 6.402 9.283 -0.585 1.00 0.00 C ATOM 1807 C GLN A 117 5.345 8.748 0.371 1.00 0.00 C ATOM 1808 O GLN A 117 4.183 9.028 0.236 1.00 0.00 O ATOM 1809 CB GLN A 117 6.876 8.190 -1.542 1.00 0.00 C ATOM 1810 CG GLN A 117 7.748 8.822 -2.627 1.00 0.00 C ATOM 1811 CD GLN A 117 6.891 9.117 -3.857 1.00 0.00 C ATOM 1812 OE1 GLN A 117 6.567 8.221 -4.614 1.00 0.00 O ATOM 1813 NE2 GLN A 117 6.499 10.340 -4.095 1.00 0.00 N ATOM 0 H GLN A 117 8.428 9.095 0.038 1.00 0.00 H new ATOM 0 HA GLN A 117 5.958 10.116 -1.130 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.441 7.433 -0.998 1.00 0.00 H new ATOM 0 HB3 GLN A 117 6.020 7.687 -1.992 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.200 9.742 -2.256 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.564 8.149 -2.891 1.00 0.00 H new ATOM 0 HE21 GLN A 117 6.768 11.094 -3.463 1.00 0.00 H new ATOM 0 HE22 GLN A 117 5.924 10.541 -4.913 1.00 0.00 H new ATOM 1822 N VAL A 118 5.751 8.001 1.352 1.00 0.00 N ATOM 1823 CA VAL A 118 4.779 7.465 2.339 1.00 0.00 C ATOM 1824 C VAL A 118 4.087 8.636 3.040 1.00 0.00 C ATOM 1825 O VAL A 118 2.880 8.683 3.137 1.00 0.00 O ATOM 1826 CB VAL A 118 5.627 6.639 3.316 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.900 6.499 4.657 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.869 5.246 2.723 1.00 0.00 C ATOM 0 H VAL A 118 6.722 7.736 1.515 1.00 0.00 H new ATOM 0 HA VAL A 118 3.995 6.854 1.892 1.00 0.00 H new ATOM 0 HB VAL A 118 6.579 7.145 3.478 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.511 5.911 5.342 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.727 7.488 5.082 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.944 5.998 4.502 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.471 4.656 3.414 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.913 4.749 2.559 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.395 5.341 1.773 1.00 0.00 H new ATOM 1838 N ASP A 119 4.830 9.606 3.503 1.00 0.00 N ATOM 1839 CA ASP A 119 4.181 10.774 4.163 1.00 0.00 C ATOM 1840 C ASP A 119 3.234 11.435 3.164 1.00 0.00 C ATOM 1841 O ASP A 119 2.124 11.814 3.478 1.00 0.00 O ATOM 1842 CB ASP A 119 5.325 11.733 4.497 1.00 0.00 C ATOM 1843 CG ASP A 119 6.196 11.139 5.606 1.00 0.00 C ATOM 1844 OD1 ASP A 119 5.648 10.492 6.480 1.00 0.00 O ATOM 1845 OD2 ASP A 119 7.397 11.344 5.560 1.00 0.00 O ATOM 0 H ASP A 119 5.848 9.640 3.453 1.00 0.00 H new ATOM 0 HA ASP A 119 3.612 10.495 5.050 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.928 11.917 3.608 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.923 12.695 4.814 1.00 0.00 H new ATOM 1850 N ALA A 120 3.694 11.558 1.950 1.00 0.00 N ATOM 1851 CA ALA A 120 2.870 12.178 0.881 1.00 0.00 C ATOM 1852 C ALA A 120 1.741 11.233 0.472 1.00 0.00 C ATOM 1853 O ALA A 120 0.629 11.650 0.211 1.00 0.00 O ATOM 1854 CB ALA A 120 3.845 12.366 -0.276 1.00 0.00 C ATOM 0 H ALA A 120 4.619 11.250 1.652 1.00 0.00 H new ATOM 0 HA ALA A 120 2.404 13.112 1.195 1.00 0.00 H new ATOM 0 HB1 ALA A 120 3.326 12.821 -1.119 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.663 13.014 0.039 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.245 11.397 -0.576 1.00 0.00 H new ATOM 1860 N ALA A 121 2.023 9.961 0.411 1.00 0.00 N ATOM 1861 CA ALA A 121 0.978 8.981 0.018 1.00 0.00 C ATOM 1862 C ALA A 121 -0.105 8.952 1.096 1.00 0.00 C ATOM 1863 O ALA A 121 -1.285 8.869 0.808 1.00 0.00 O ATOM 1864 CB ALA A 121 1.706 7.636 -0.078 1.00 0.00 C ATOM 0 H ALA A 121 2.937 9.559 0.618 1.00 0.00 H new ATOM 0 HA ALA A 121 0.490 9.227 -0.925 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.998 6.859 -0.365 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.495 7.702 -0.827 1.00 0.00 H new ATOM 0 HB3 ALA A 121 2.143 7.389 0.889 1.00 0.00 H new ATOM 1870 N LEU A 122 0.296 9.034 2.334 1.00 0.00 N ATOM 1871 CA LEU A 122 -0.694 9.029 3.444 1.00 0.00 C ATOM 1872 C LEU A 122 -1.667 10.199 3.281 1.00 0.00 C ATOM 1873 O LEU A 122 -2.869 10.016 3.201 1.00 0.00 O ATOM 1874 CB LEU A 122 0.151 9.219 4.706 1.00 0.00 C ATOM 1875 CG LEU A 122 1.041 7.994 4.929 1.00 0.00 C ATOM 1876 CD1 LEU A 122 2.233 8.374 5.817 1.00 0.00 C ATOM 1877 CD2 LEU A 122 0.226 6.904 5.616 1.00 0.00 C ATOM 0 H LEU A 122 1.271 9.105 2.625 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.289 8.116 3.473 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.767 10.113 4.610 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.498 9.369 5.569 1.00 0.00 H new ATOM 0 HG LEU A 122 1.409 7.632 3.969 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.864 7.499 5.973 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.814 9.158 5.331 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.869 8.735 6.779 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.854 6.028 5.778 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.138 7.272 6.575 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -0.621 6.632 4.986 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.154 11.398 3.225 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.044 12.580 3.062 1.00 0.00 C ATOM 1891 C ALA A 123 -2.752 12.501 1.716 1.00 0.00 C ATOM 1892 O ALA A 123 -3.921 12.816 1.596 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.112 13.787 3.110 1.00 0.00 C ATOM 0 H ALA A 123 -0.158 11.609 3.285 1.00 0.00 H new ATOM 0 HA ALA A 123 -2.814 12.637 3.831 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.695 14.701 2.996 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.590 13.806 4.067 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.385 13.717 2.301 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.059 12.072 0.701 1.00 0.00 N ATOM 1900 CA GLU A 124 -2.708 11.963 -0.624 1.00 0.00 C ATOM 1901 C GLU A 124 -3.830 10.922 -0.549 1.00 0.00 C ATOM 1902 O GLU A 124 -4.907 11.118 -1.086 1.00 0.00 O ATOM 1903 CB GLU A 124 -1.600 11.528 -1.586 1.00 0.00 C ATOM 1904 CG GLU A 124 -2.121 11.592 -3.024 1.00 0.00 C ATOM 1905 CD GLU A 124 -1.266 12.561 -3.847 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -0.086 12.293 -4.010 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -1.808 13.555 -4.304 1.00 0.00 O ATOM 0 H GLU A 124 -1.078 11.795 0.734 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.160 12.898 -0.956 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.731 12.176 -1.473 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -1.275 10.515 -1.350 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.095 10.599 -3.474 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.161 11.917 -3.029 1.00 0.00 H new ATOM 1914 N PHE A 125 -3.608 9.821 0.131 1.00 0.00 N ATOM 1915 CA PHE A 125 -4.691 8.798 0.236 1.00 0.00 C ATOM 1916 C PHE A 125 -5.860 9.343 1.055 1.00 0.00 C ATOM 1917 O PHE A 125 -7.005 9.216 0.671 1.00 0.00 O ATOM 1918 CB PHE A 125 -4.066 7.595 0.943 1.00 0.00 C ATOM 1919 CG PHE A 125 -5.150 6.591 1.279 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -6.001 6.820 2.369 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -5.304 5.435 0.504 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -7.003 5.893 2.681 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -6.306 4.510 0.815 1.00 0.00 C ATOM 1924 CZ PHE A 125 -7.156 4.739 1.905 1.00 0.00 C ATOM 0 H PHE A 125 -2.737 9.591 0.610 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.081 8.528 -0.746 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.313 7.134 0.304 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.558 7.917 1.852 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -5.884 7.711 2.968 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -4.648 5.257 -0.335 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -7.658 6.069 3.521 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.424 3.620 0.215 1.00 0.00 H new ATOM 0 HZ PHE A 125 -7.929 4.025 2.146 1.00 0.00 H new ATOM 1934 N LEU A 126 -5.595 9.939 2.187 1.00 0.00 N ATOM 1935 CA LEU A 126 -6.716 10.469 3.012 1.00 0.00 C ATOM 1936 C LEU A 126 -7.513 11.515 2.227 1.00 0.00 C ATOM 1937 O LEU A 126 -8.725 11.559 2.291 1.00 0.00 O ATOM 1938 CB LEU A 126 -6.052 11.080 4.247 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.346 9.967 5.026 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -4.641 10.544 6.257 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.385 8.938 5.471 1.00 0.00 C ATOM 0 H LEU A 126 -4.661 10.080 2.572 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.429 9.692 3.289 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.336 11.847 3.951 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.798 11.566 4.875 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.601 9.496 4.385 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.143 9.741 6.801 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.902 11.281 5.941 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.375 11.022 6.906 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.892 8.140 6.027 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -7.125 9.421 6.109 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.879 8.518 4.595 1.00 0.00 H new ATOM 1953 N ARG A 127 -6.850 12.352 1.479 1.00 0.00 N ATOM 1954 CA ARG A 127 -7.594 13.388 0.697 1.00 0.00 C ATOM 1955 C ARG A 127 -8.570 12.730 -0.289 1.00 0.00 C ATOM 1956 O ARG A 127 -9.559 13.319 -0.670 1.00 0.00 O ATOM 1957 CB ARG A 127 -6.531 14.189 -0.060 1.00 0.00 C ATOM 1958 CG ARG A 127 -7.064 15.604 -0.302 1.00 0.00 C ATOM 1959 CD ARG A 127 -6.026 16.437 -1.057 1.00 0.00 C ATOM 1960 NE ARG A 127 -5.990 15.846 -2.421 1.00 0.00 N ATOM 1961 CZ ARG A 127 -7.005 15.994 -3.228 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -8.049 16.686 -2.856 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -6.978 15.442 -4.410 1.00 0.00 N ATOM 0 H ARG A 127 -5.836 12.367 1.373 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.187 14.026 1.352 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -5.606 14.227 0.515 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -6.298 13.706 -1.009 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -7.991 15.559 -0.874 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -7.300 16.079 0.650 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -6.309 17.489 -1.088 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -5.049 16.384 -0.576 1.00 0.00 H new ATOM 0 HE ARG A 127 -5.169 15.323 -2.727 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -8.074 17.114 -1.931 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -8.839 16.798 -3.491 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -6.166 14.897 -4.700 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -7.769 15.555 -5.044 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.301 11.524 -0.716 1.00 0.00 N ATOM 1978 CA LEU A 128 -9.227 10.861 -1.685 1.00 0.00 C ATOM 1979 C LEU A 128 -10.075 9.793 -0.996 1.00 0.00 C ATOM 1980 O LEU A 128 -10.886 9.142 -1.623 1.00 0.00 O ATOM 1981 CB LEU A 128 -8.321 10.221 -2.732 1.00 0.00 C ATOM 1982 CG LEU A 128 -8.580 10.862 -4.093 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -8.085 12.314 -4.086 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -7.837 10.056 -5.161 1.00 0.00 C ATOM 0 H LEU A 128 -7.489 10.973 -0.440 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.924 11.576 -2.122 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.276 10.350 -2.451 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -8.508 9.148 -2.782 1.00 0.00 H new ATOM 0 HG LEU A 128 -9.648 10.862 -4.310 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -8.272 12.767 -5.060 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -8.615 12.875 -3.317 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.015 12.333 -3.877 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.012 10.501 -6.140 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -6.769 10.063 -4.945 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.200 9.028 -5.160 1.00 0.00 H new ATOM 1996 N ALA A 129 -9.906 9.606 0.280 1.00 0.00 N ATOM 1997 CA ALA A 129 -10.718 8.575 0.985 1.00 0.00 C ATOM 1998 C ALA A 129 -12.144 9.100 1.219 1.00 0.00 C ATOM 1999 O ALA A 129 -12.320 10.244 1.599 1.00 0.00 O ATOM 2000 CB ALA A 129 -10.005 8.349 2.317 1.00 0.00 C ATOM 0 H ALA A 129 -9.245 10.118 0.865 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.806 7.652 0.411 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.545 7.600 2.896 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.989 8.001 2.131 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -9.972 9.285 2.875 1.00 0.00 H new ATOM 2006 N PRO A 130 -13.124 8.257 0.983 1.00 0.00 N ATOM 2007 CA PRO A 130 -12.865 6.873 0.519 1.00 0.00 C ATOM 2008 C PRO A 130 -12.460 6.886 -0.958 1.00 0.00 C ATOM 2009 O PRO A 130 -12.850 7.761 -1.709 1.00 0.00 O ATOM 2010 CB PRO A 130 -14.203 6.169 0.723 1.00 0.00 C ATOM 2011 CG PRO A 130 -15.229 7.258 0.676 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.560 8.530 1.127 1.00 0.00 C ATOM 0 HA PRO A 130 -12.054 6.378 1.052 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -14.380 5.427 -0.055 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -14.230 5.643 1.677 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.624 7.370 -0.334 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -16.073 7.018 1.323 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -14.867 9.379 0.516 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -14.818 8.771 2.158 1.00 0.00 H new ATOM 2020 N VAL A 131 -11.673 5.933 -1.378 1.00 0.00 N ATOM 2021 CA VAL A 131 -11.233 5.903 -2.806 1.00 0.00 C ATOM 2022 C VAL A 131 -12.065 4.887 -3.588 1.00 0.00 C ATOM 2023 O VAL A 131 -12.648 3.985 -3.026 1.00 0.00 O ATOM 2024 CB VAL A 131 -9.764 5.465 -2.786 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -9.044 6.066 -3.994 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -9.079 5.942 -1.501 1.00 0.00 C ATOM 0 H VAL A 131 -11.315 5.175 -0.797 1.00 0.00 H new ATOM 0 HA VAL A 131 -11.358 6.875 -3.283 1.00 0.00 H new ATOM 0 HB VAL A 131 -9.720 4.377 -2.825 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.999 5.758 -3.985 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.518 5.716 -4.911 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -9.102 7.153 -3.948 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -8.037 5.622 -1.504 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -9.125 7.030 -1.447 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.588 5.514 -0.637 1.00 0.00 H new ATOM 2036 N GLU A 132 -12.116 5.022 -4.883 1.00 0.00 N ATOM 2037 CA GLU A 132 -12.902 4.056 -5.698 1.00 0.00 C ATOM 2038 C GLU A 132 -12.037 2.838 -6.043 1.00 0.00 C ATOM 2039 O GLU A 132 -11.245 2.870 -6.963 1.00 0.00 O ATOM 2040 CB GLU A 132 -13.275 4.839 -6.959 1.00 0.00 C ATOM 2041 CG GLU A 132 -14.127 3.967 -7.881 1.00 0.00 C ATOM 2042 CD GLU A 132 -14.384 4.721 -9.186 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -13.419 5.062 -9.850 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -15.541 4.944 -9.498 1.00 0.00 O ATOM 0 H GLU A 132 -11.648 5.758 -5.412 1.00 0.00 H new ATOM 0 HA GLU A 132 -13.782 3.676 -5.178 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.824 5.741 -6.688 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.372 5.159 -7.479 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.617 3.025 -8.085 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -15.072 3.720 -7.397 1.00 0.00 H new ATOM 2051 N THR A 133 -12.182 1.760 -5.314 1.00 0.00 N ATOM 2052 CA THR A 133 -11.366 0.543 -5.609 1.00 0.00 C ATOM 2053 C THR A 133 -12.236 -0.536 -6.270 1.00 0.00 C ATOM 2054 O THR A 133 -12.795 -1.386 -5.605 1.00 0.00 O ATOM 2055 CB THR A 133 -10.854 0.048 -4.253 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.769 0.421 -3.234 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.478 0.646 -3.968 1.00 0.00 C ATOM 0 H THR A 133 -12.828 1.670 -4.530 1.00 0.00 H new ATOM 0 HA THR A 133 -10.548 0.765 -6.294 1.00 0.00 H new ATOM 0 HB THR A 133 -10.767 -1.038 -4.274 1.00 0.00 H new ATOM 0 HG1 THR A 133 -11.630 -0.145 -2.446 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.120 0.290 -3.002 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.780 0.342 -4.748 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.551 1.733 -3.950 1.00 0.00 H new ATOM 2065 N MET A 134 -12.360 -0.510 -7.571 1.00 0.00 N ATOM 2066 CA MET A 134 -13.200 -1.536 -8.259 1.00 0.00 C ATOM 2067 C MET A 134 -12.385 -2.800 -8.566 1.00 0.00 C ATOM 2068 O MET A 134 -12.916 -3.785 -9.046 1.00 0.00 O ATOM 2069 CB MET A 134 -13.658 -0.879 -9.560 1.00 0.00 C ATOM 2070 CG MET A 134 -14.615 0.276 -9.254 1.00 0.00 C ATOM 2071 SD MET A 134 -15.451 0.767 -10.782 1.00 0.00 S ATOM 2072 CE MET A 134 -13.971 0.881 -11.817 1.00 0.00 C ATOM 0 H MET A 134 -11.918 0.174 -8.185 1.00 0.00 H new ATOM 0 HA MET A 134 -14.038 -1.846 -7.635 1.00 0.00 H new ATOM 0 HB2 MET A 134 -12.795 -0.510 -10.114 1.00 0.00 H new ATOM 0 HB3 MET A 134 -14.153 -1.615 -10.194 1.00 0.00 H new ATOM 0 HG2 MET A 134 -15.346 -0.029 -8.506 1.00 0.00 H new ATOM 0 HG3 MET A 134 -14.066 1.120 -8.837 1.00 0.00 H new ATOM 0 HE1 MET A 134 -14.162 1.555 -12.652 1.00 0.00 H new ATOM 0 HE2 MET A 134 -13.141 1.264 -11.224 1.00 0.00 H new ATOM 0 HE3 MET A 134 -13.718 -0.108 -12.200 1.00 0.00 H new ATOM 2082 N ALA A 135 -11.109 -2.787 -8.296 1.00 0.00 N ATOM 2083 CA ALA A 135 -10.281 -3.998 -8.574 1.00 0.00 C ATOM 2084 C ALA A 135 -10.609 -4.574 -9.959 1.00 0.00 C ATOM 2085 O ALA A 135 -10.878 -3.793 -10.856 1.00 0.00 O ATOM 2086 CB ALA A 135 -10.670 -4.991 -7.482 1.00 0.00 C ATOM 2087 OXT ALA A 135 -10.580 -5.788 -10.097 1.00 0.00 O ATOM 0 H ALA A 135 -10.604 -1.996 -7.897 1.00 0.00 H new ATOM 0 HA ALA A 135 -9.214 -3.774 -8.574 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -10.105 -5.914 -7.612 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -10.446 -4.563 -6.505 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -11.737 -5.206 -7.549 1.00 0.00 H new TER 2093 ALA A 135