USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1035 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 19 TYR OH : rot -81:sc= 1.23 USER MOD Set 1.2: A 102 THR OG1 : rot 18:sc= 1.59 USER MOD Set 2.1: A 80 CYS SG : rot 94:sc= -0.127 USER MOD Set 2.2: A 82 SER OG : rot -172:sc= 1.05 USER MOD Set 2.3: A 93 HIS : no HE2:sc= -0.534 K(o=1.3,f=0.6) USER MOD Set 2.4: A 95 GLN : amide:sc= 0.88 K(o=1.3,f=-5.4!) USER MOD Set 3.1: A 5 CYS SG : rot 95:sc= 0.0612 USER MOD Set 3.2: A 44 GLN : amide:sc= -0.174 K(o=-0.11,f=-2.6!) USER MOD Set 4.1: A 36 THR OG1 : rot -143:sc= 2.03 USER MOD Set 4.2: A 56 THR OG1 : rot -84:sc= 1.26 USER MOD Single : A 1 VAL N :NH3+ -174:sc= 0 (180deg=-0.0165) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -36:sc= 1.12 USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 13 SER OG : rot 34:sc= 1.02 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= 0.294 X(o=0.29,f=0) USER MOD Single : A 20 MET CE :methyl 146:sc= -0.0386 (180deg=-1.85) USER MOD Single : A 21 LYS NZ :NH3+ 166:sc= 0.604 (180deg=0.498) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0102 USER MOD Single : A 31 GLN : amide:sc= 0.00798 K(o=0.008,f=-1.1) USER MOD Single : A 34 ASN : amide:sc= 1.27 K(o=1.3,f=-2.2!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot -25:sc= 2.11 USER MOD Single : A 48 LYS NZ :NH3+ 174:sc= 0.413 (180deg=0.395) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= -0.0664 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= 0.303 K(o=0.3,f=-0.57) USER MOD Single : A 60 THR OG1 : rot -98:sc= 0 USER MOD Single : A 63 SER OG : rot 33:sc= 0.838 USER MOD Single : A 65 GLN : amide:sc= -0.429 K(o=-0.43,f=-1.5) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 130:sc= -0.327 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ -170:sc= 0.699 (180deg=0.619) USER MOD Single : A 85 SER OG : rot 180:sc= -0.0145 USER MOD Single : A 90 LYS NZ :NH3+ -151:sc= 0.672 (180deg=0.191) USER MOD Single : A 96 LYS NZ :NH3+ -179:sc= 0.811 (180deg=0.81) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0191) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl -176:sc= -0.0957 (180deg=-0.108) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HE2:sc= 0.373 K(o=0.37,f=-1.2) USER MOD Single : A 128 TYR OH : rot 18:sc= 2.24 USER MOD Single : A 130 LYS NZ :NH3+ 176:sc= 0.821 (180deg=0.78) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 0.909 -1.652 -1.817 1.00 0.00 N ATOM 2 CA VAL A 1 1.128 -0.628 -2.885 1.00 0.00 C ATOM 3 C VAL A 1 0.478 0.789 -2.649 1.00 0.00 C ATOM 4 O VAL A 1 0.769 1.716 -3.409 1.00 0.00 O ATOM 5 CB VAL A 1 0.852 -1.285 -4.285 1.00 0.00 C ATOM 6 CG1 VAL A 1 -0.646 -1.429 -4.639 1.00 0.00 C ATOM 7 CG2 VAL A 1 1.610 -0.591 -5.441 1.00 0.00 C ATOM 0 H1 VAL A 1 1.465 -2.504 -2.034 1.00 0.00 H new ATOM 0 H2 VAL A 1 1.210 -1.266 -0.899 1.00 0.00 H new ATOM 0 H3 VAL A 1 -0.100 -1.899 -1.774 1.00 0.00 H new ATOM 0 HA VAL A 1 2.177 -0.336 -2.846 1.00 0.00 H new ATOM 0 HB VAL A 1 1.248 -2.295 -4.174 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -0.745 -1.891 -5.621 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -1.138 -2.053 -3.893 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -1.113 -0.444 -4.653 1.00 0.00 H new ATOM 0 HG21 VAL A 1 1.377 -1.092 -6.381 1.00 0.00 H new ATOM 0 HG22 VAL A 1 1.305 0.454 -5.501 1.00 0.00 H new ATOM 0 HG23 VAL A 1 2.683 -0.645 -5.257 1.00 0.00 H new ATOM 18 N GLU A 2 -0.351 0.996 -1.603 1.00 0.00 N ATOM 19 CA GLU A 2 -1.010 2.308 -1.300 1.00 0.00 C ATOM 20 C GLU A 2 -0.054 3.524 -1.041 1.00 0.00 C ATOM 21 O GLU A 2 -0.316 4.614 -1.554 1.00 0.00 O ATOM 22 CB GLU A 2 -2.017 2.121 -0.129 1.00 0.00 C ATOM 23 CG GLU A 2 -3.238 1.217 -0.441 1.00 0.00 C ATOM 24 CD GLU A 2 -4.181 1.023 0.743 1.00 0.00 C ATOM 25 OE1 GLU A 2 -4.157 0.045 1.483 1.00 0.00 O ATOM 26 OE2 GLU A 2 -5.058 2.056 0.884 1.00 0.00 O ATOM 0 H GLU A 2 -0.590 0.262 -0.936 1.00 0.00 H new ATOM 0 HA GLU A 2 -1.525 2.590 -2.218 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -1.483 1.701 0.723 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -2.381 3.102 0.175 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -3.796 1.651 -1.271 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -2.881 0.242 -0.772 1.00 0.00 H new ATOM 34 N ALA A 3 1.077 3.336 -0.329 1.00 0.00 N ATOM 35 CA ALA A 3 2.203 4.317 -0.311 1.00 0.00 C ATOM 36 C ALA A 3 2.801 4.787 -1.687 1.00 0.00 C ATOM 37 O ALA A 3 3.267 5.925 -1.788 1.00 0.00 O ATOM 38 CB ALA A 3 3.292 3.690 0.581 1.00 0.00 C ATOM 0 H ALA A 3 1.243 2.511 0.247 1.00 0.00 H new ATOM 0 HA ALA A 3 1.795 5.254 0.067 1.00 0.00 H new ATOM 0 HB1 ALA A 3 4.149 4.362 0.636 1.00 0.00 H new ATOM 0 HB2 ALA A 3 2.893 3.528 1.582 1.00 0.00 H new ATOM 0 HB3 ALA A 3 3.606 2.736 0.156 1.00 0.00 H new ATOM 44 N PHE A 4 2.760 3.947 -2.737 1.00 0.00 N ATOM 45 CA PHE A 4 3.094 4.364 -4.130 1.00 0.00 C ATOM 46 C PHE A 4 1.953 5.070 -4.949 1.00 0.00 C ATOM 47 O PHE A 4 2.262 5.590 -6.022 1.00 0.00 O ATOM 48 CB PHE A 4 3.650 3.130 -4.901 1.00 0.00 C ATOM 49 CG PHE A 4 4.987 2.557 -4.396 1.00 0.00 C ATOM 50 CD1 PHE A 4 6.181 3.239 -4.649 1.00 0.00 C ATOM 51 CD2 PHE A 4 5.021 1.354 -3.683 1.00 0.00 C ATOM 52 CE1 PHE A 4 7.389 2.733 -4.180 1.00 0.00 C ATOM 53 CE2 PHE A 4 6.233 0.846 -3.219 1.00 0.00 C ATOM 54 CZ PHE A 4 7.415 1.538 -3.465 1.00 0.00 C ATOM 0 H PHE A 4 2.498 2.965 -2.655 1.00 0.00 H new ATOM 0 HA PHE A 4 3.842 5.150 -4.026 1.00 0.00 H new ATOM 0 HB2 PHE A 4 2.902 2.338 -4.864 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.770 3.406 -5.949 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.165 4.162 -5.210 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.104 0.817 -3.491 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.308 3.268 -4.371 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.255 -0.083 -2.669 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.354 1.148 -3.101 1.00 0.00 H new ATOM 64 N CYS A 5 0.678 5.121 -4.505 1.00 0.00 N ATOM 65 CA CYS A 5 -0.430 5.762 -5.267 1.00 0.00 C ATOM 66 C CYS A 5 -0.381 7.327 -5.267 1.00 0.00 C ATOM 67 O CYS A 5 -0.737 7.976 -4.277 1.00 0.00 O ATOM 68 CB CYS A 5 -1.744 5.223 -4.664 1.00 0.00 C ATOM 69 SG CYS A 5 -3.184 5.870 -5.587 1.00 0.00 S ATOM 0 H CYS A 5 0.383 4.723 -3.613 1.00 0.00 H new ATOM 0 HA CYS A 5 -0.340 5.505 -6.322 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -1.745 4.133 -4.694 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -1.816 5.513 -3.616 1.00 0.00 H new ATOM 0 HG CYS A 5 -3.534 5.014 -6.500 1.00 0.00 H new ATOM 75 N ALA A 6 0.077 7.921 -6.386 1.00 0.00 N ATOM 76 CA ALA A 6 0.243 9.397 -6.537 1.00 0.00 C ATOM 77 C ALA A 6 0.605 9.794 -8.009 1.00 0.00 C ATOM 78 O ALA A 6 1.094 8.985 -8.810 1.00 0.00 O ATOM 79 CB ALA A 6 1.324 9.929 -5.557 1.00 0.00 C ATOM 0 H ALA A 6 0.346 7.397 -7.219 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.714 9.858 -6.294 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.430 11.007 -5.682 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.025 9.711 -4.532 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.277 9.444 -5.768 1.00 0.00 H new ATOM 85 N THR A 7 0.445 11.092 -8.342 1.00 0.00 N ATOM 86 CA THR A 7 1.250 11.729 -9.430 1.00 0.00 C ATOM 87 C THR A 7 2.666 12.064 -8.863 1.00 0.00 C ATOM 88 O THR A 7 2.786 12.762 -7.856 1.00 0.00 O ATOM 89 CB THR A 7 0.499 12.972 -9.994 1.00 0.00 C ATOM 90 OG1 THR A 7 -0.737 12.562 -10.569 1.00 0.00 O ATOM 91 CG2 THR A 7 1.248 13.751 -11.091 1.00 0.00 C ATOM 0 H THR A 7 -0.220 11.718 -7.888 1.00 0.00 H new ATOM 0 HA THR A 7 1.381 11.050 -10.273 1.00 0.00 H new ATOM 0 HB THR A 7 0.385 13.633 -9.135 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.209 13.345 -10.922 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.641 14.596 -11.416 1.00 0.00 H new ATOM 0 HG22 THR A 7 2.196 14.116 -10.696 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.438 13.093 -11.939 1.00 0.00 H new ATOM 99 N TRP A 8 3.738 11.547 -9.478 1.00 0.00 N ATOM 100 CA TRP A 8 5.116 11.725 -8.949 1.00 0.00 C ATOM 101 C TRP A 8 5.900 12.753 -9.822 1.00 0.00 C ATOM 102 O TRP A 8 6.197 12.498 -10.996 1.00 0.00 O ATOM 103 CB TRP A 8 5.823 10.347 -8.860 1.00 0.00 C ATOM 104 CG TRP A 8 5.294 9.380 -7.792 1.00 0.00 C ATOM 105 CD1 TRP A 8 4.379 8.325 -7.990 1.00 0.00 C ATOM 106 CD2 TRP A 8 5.597 9.356 -6.443 1.00 0.00 C ATOM 107 NE1 TRP A 8 4.118 7.630 -6.793 1.00 0.00 N ATOM 108 CE2 TRP A 8 4.886 8.285 -5.850 1.00 0.00 C ATOM 109 CE3 TRP A 8 6.390 10.216 -5.648 1.00 0.00 C ATOM 110 CZ2 TRP A 8 4.966 8.067 -4.456 1.00 0.00 C ATOM 111 CZ3 TRP A 8 6.456 9.983 -4.275 1.00 0.00 C ATOM 112 CH2 TRP A 8 5.765 8.917 -3.688 1.00 0.00 C ATOM 0 H TRP A 8 3.688 11.003 -10.339 1.00 0.00 H new ATOM 0 HA TRP A 8 5.079 12.135 -7.940 1.00 0.00 H new ATOM 0 HB2 TRP A 8 5.746 9.859 -9.832 1.00 0.00 H new ATOM 0 HB3 TRP A 8 6.883 10.518 -8.672 1.00 0.00 H new ATOM 0 HD1 TRP A 8 3.933 8.080 -8.943 1.00 0.00 H new ATOM 0 HE1 TRP A 8 3.503 6.828 -6.654 1.00 0.00 H new ATOM 0 HE3 TRP A 8 6.933 11.036 -6.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 4.420 7.258 -3.993 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 7.051 10.636 -3.654 1.00 0.00 H new ATOM 0 HH2 TRP A 8 5.851 8.749 -2.625 1.00 0.00 H new ATOM 123 N LYS A 9 6.277 13.895 -9.224 1.00 0.00 N ATOM 124 CA LYS A 9 7.087 14.951 -9.896 1.00 0.00 C ATOM 125 C LYS A 9 8.612 14.744 -9.639 1.00 0.00 C ATOM 126 O LYS A 9 9.053 14.580 -8.495 1.00 0.00 O ATOM 127 CB LYS A 9 6.638 16.344 -9.373 1.00 0.00 C ATOM 128 CG LYS A 9 5.331 16.879 -9.996 1.00 0.00 C ATOM 129 CD LYS A 9 4.866 18.190 -9.328 1.00 0.00 C ATOM 130 CE LYS A 9 3.653 18.807 -10.041 1.00 0.00 C ATOM 131 NZ LYS A 9 3.195 19.999 -9.301 1.00 0.00 N ATOM 0 H LYS A 9 6.034 14.122 -8.260 1.00 0.00 H new ATOM 0 HA LYS A 9 6.923 14.888 -10.972 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.512 16.287 -8.292 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.435 17.062 -9.564 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.481 17.049 -11.062 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.549 16.126 -9.900 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.612 17.995 -8.286 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.688 18.906 -9.327 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.919 19.081 -11.062 1.00 0.00 H new ATOM 0 HE3 LYS A 9 2.847 18.076 -10.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.374 20.414 -9.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.924 19.725 -8.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.963 20.699 -9.260 1.00 0.00 H new ATOM 144 N LEU A 10 9.421 14.762 -10.714 1.00 0.00 N ATOM 145 CA LEU A 10 10.895 14.552 -10.613 1.00 0.00 C ATOM 146 C LEU A 10 11.638 15.789 -9.992 1.00 0.00 C ATOM 147 O LEU A 10 11.715 16.862 -10.597 1.00 0.00 O ATOM 148 CB LEU A 10 11.453 14.189 -12.019 1.00 0.00 C ATOM 149 CG LEU A 10 12.687 13.245 -12.055 1.00 0.00 C ATOM 150 CD1 LEU A 10 13.032 12.944 -13.518 1.00 0.00 C ATOM 151 CD2 LEU A 10 13.942 13.772 -11.350 1.00 0.00 C ATOM 0 H LEU A 10 9.089 14.919 -11.666 1.00 0.00 H new ATOM 0 HA LEU A 10 11.081 13.725 -9.927 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.652 13.725 -12.594 1.00 0.00 H new ATOM 0 HB3 LEU A 10 11.717 15.115 -12.530 1.00 0.00 H new ATOM 0 HG LEU A 10 12.392 12.355 -11.499 1.00 0.00 H new ATOM 0 HD11 LEU A 10 13.897 12.282 -13.559 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.182 12.461 -14.000 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.263 13.875 -14.036 1.00 0.00 H new ATOM 0 HD21 LEU A 10 14.742 13.037 -11.434 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.256 14.706 -11.816 1.00 0.00 H new ATOM 0 HD23 LEU A 10 13.721 13.948 -10.297 1.00 0.00 H new ATOM 163 N THR A 11 12.206 15.613 -8.791 1.00 0.00 N ATOM 164 CA THR A 11 12.978 16.678 -8.068 1.00 0.00 C ATOM 165 C THR A 11 14.489 16.776 -8.473 1.00 0.00 C ATOM 166 O THR A 11 14.995 17.883 -8.666 1.00 0.00 O ATOM 167 CB THR A 11 12.807 16.563 -6.514 1.00 0.00 C ATOM 168 OG1 THR A 11 13.450 15.408 -5.986 1.00 0.00 O ATOM 169 CG2 THR A 11 11.367 16.534 -6.008 1.00 0.00 C ATOM 0 H THR A 11 12.153 14.733 -8.278 1.00 0.00 H new ATOM 0 HA THR A 11 12.534 17.618 -8.396 1.00 0.00 H new ATOM 0 HB THR A 11 13.272 17.484 -6.163 1.00 0.00 H new ATOM 0 HG1 THR A 11 13.364 14.667 -6.621 1.00 0.00 H new ATOM 0 HG21 THR A 11 11.365 16.453 -4.921 1.00 0.00 H new ATOM 0 HG22 THR A 11 10.859 17.452 -6.304 1.00 0.00 H new ATOM 0 HG23 THR A 11 10.848 15.677 -6.437 1.00 0.00 H new ATOM 177 N ASN A 12 15.213 15.642 -8.567 1.00 0.00 N ATOM 178 CA ASN A 12 16.668 15.612 -8.887 1.00 0.00 C ATOM 179 C ASN A 12 17.009 14.303 -9.676 1.00 0.00 C ATOM 180 O ASN A 12 16.866 13.196 -9.144 1.00 0.00 O ATOM 181 CB ASN A 12 17.465 15.750 -7.556 1.00 0.00 C ATOM 182 CG ASN A 12 18.994 15.810 -7.684 1.00 0.00 C ATOM 183 OD1 ASN A 12 19.562 16.210 -8.694 1.00 0.00 O ATOM 184 ND2 ASN A 12 19.713 15.423 -6.659 1.00 0.00 N ATOM 0 H ASN A 12 14.811 14.716 -8.424 1.00 0.00 H new ATOM 0 HA ASN A 12 16.950 16.443 -9.533 1.00 0.00 H new ATOM 0 HB2 ASN A 12 17.128 16.653 -7.047 1.00 0.00 H new ATOM 0 HB3 ASN A 12 17.208 14.908 -6.914 1.00 0.00 H new ATOM 0 HD21 ASN A 12 20.731 15.457 -6.708 1.00 0.00 H new ATOM 0 HD22 ASN A 12 19.254 15.088 -5.812 1.00 0.00 H new ATOM 191 N SER A 13 17.480 14.432 -10.931 1.00 0.00 N ATOM 192 CA SER A 13 17.951 13.277 -11.747 1.00 0.00 C ATOM 193 C SER A 13 19.507 13.164 -11.735 1.00 0.00 C ATOM 194 O SER A 13 20.198 13.843 -12.505 1.00 0.00 O ATOM 195 CB SER A 13 17.395 13.392 -13.187 1.00 0.00 C ATOM 196 OG SER A 13 18.007 14.463 -13.909 1.00 0.00 O ATOM 0 H SER A 13 17.548 15.329 -11.412 1.00 0.00 H new ATOM 0 HA SER A 13 17.570 12.358 -11.303 1.00 0.00 H new ATOM 0 HB2 SER A 13 17.562 12.454 -13.717 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.317 13.549 -13.149 1.00 0.00 H new ATOM 0 HG SER A 13 18.941 14.555 -13.628 1.00 0.00 H new ATOM 202 N GLN A 14 20.044 12.282 -10.884 1.00 0.00 N ATOM 203 CA GLN A 14 21.506 12.027 -10.782 1.00 0.00 C ATOM 204 C GLN A 14 21.996 11.072 -11.920 1.00 0.00 C ATOM 205 O GLN A 14 21.501 9.950 -12.035 1.00 0.00 O ATOM 206 CB GLN A 14 21.729 11.434 -9.364 1.00 0.00 C ATOM 207 CG GLN A 14 23.201 11.207 -8.934 1.00 0.00 C ATOM 208 CD GLN A 14 23.346 10.453 -7.607 1.00 0.00 C ATOM 209 OE1 GLN A 14 23.599 9.255 -7.566 1.00 0.00 O ATOM 210 NE2 GLN A 14 23.194 11.114 -6.484 1.00 0.00 N ATOM 0 H GLN A 14 19.486 11.719 -10.242 1.00 0.00 H new ATOM 0 HA GLN A 14 22.090 12.938 -10.912 1.00 0.00 H new ATOM 0 HB2 GLN A 14 21.260 12.099 -8.638 1.00 0.00 H new ATOM 0 HB3 GLN A 14 21.206 10.480 -9.307 1.00 0.00 H new ATOM 0 HG2 GLN A 14 23.717 10.650 -9.716 1.00 0.00 H new ATOM 0 HG3 GLN A 14 23.699 12.173 -8.849 1.00 0.00 H new ATOM 0 HE21 GLN A 14 22.983 12.112 -6.504 1.00 0.00 H new ATOM 0 HE22 GLN A 14 23.287 10.630 -5.591 1.00 0.00 H new ATOM 219 N ASN A 15 22.965 11.514 -12.748 1.00 0.00 N ATOM 220 CA ASN A 15 23.635 10.668 -13.796 1.00 0.00 C ATOM 221 C ASN A 15 22.723 9.945 -14.866 1.00 0.00 C ATOM 222 O ASN A 15 23.010 8.823 -15.302 1.00 0.00 O ATOM 223 CB ASN A 15 24.679 9.747 -13.088 1.00 0.00 C ATOM 224 CG ASN A 15 25.889 9.326 -13.930 1.00 0.00 C ATOM 225 OD1 ASN A 15 26.914 9.995 -13.965 1.00 0.00 O ATOM 226 ND2 ASN A 15 25.816 8.222 -14.628 1.00 0.00 N ATOM 0 H ASN A 15 23.317 12.471 -12.720 1.00 0.00 H new ATOM 0 HA ASN A 15 24.140 11.359 -14.471 1.00 0.00 H new ATOM 0 HB2 ASN A 15 25.043 10.261 -12.198 1.00 0.00 H new ATOM 0 HB3 ASN A 15 24.167 8.846 -12.749 1.00 0.00 H new ATOM 0 HD21 ASN A 15 26.609 7.924 -15.196 1.00 0.00 H new ATOM 0 HD22 ASN A 15 24.966 7.659 -14.604 1.00 0.00 H new ATOM 233 N PHE A 16 21.649 10.605 -15.337 1.00 0.00 N ATOM 234 CA PHE A 16 20.673 9.991 -16.290 1.00 0.00 C ATOM 235 C PHE A 16 21.123 9.943 -17.795 1.00 0.00 C ATOM 236 O PHE A 16 20.847 8.948 -18.469 1.00 0.00 O ATOM 237 CB PHE A 16 19.295 10.670 -16.035 1.00 0.00 C ATOM 238 CG PHE A 16 18.012 10.046 -16.632 1.00 0.00 C ATOM 239 CD1 PHE A 16 17.852 8.666 -16.836 1.00 0.00 C ATOM 240 CD2 PHE A 16 16.935 10.899 -16.906 1.00 0.00 C ATOM 241 CE1 PHE A 16 16.656 8.160 -17.339 1.00 0.00 C ATOM 242 CE2 PHE A 16 15.735 10.390 -17.396 1.00 0.00 C ATOM 243 CZ PHE A 16 15.599 9.023 -17.618 1.00 0.00 C ATOM 0 H PHE A 16 21.425 11.566 -15.079 1.00 0.00 H new ATOM 0 HA PHE A 16 20.602 8.923 -16.085 1.00 0.00 H new ATOM 0 HB2 PHE A 16 19.156 10.730 -14.956 1.00 0.00 H new ATOM 0 HB3 PHE A 16 19.362 11.693 -16.405 1.00 0.00 H new ATOM 0 HD1 PHE A 16 18.662 7.992 -16.601 1.00 0.00 H new ATOM 0 HD2 PHE A 16 17.036 11.961 -16.736 1.00 0.00 H new ATOM 0 HE1 PHE A 16 16.548 7.099 -17.513 1.00 0.00 H new ATOM 0 HE2 PHE A 16 14.910 11.056 -17.604 1.00 0.00 H new ATOM 0 HZ PHE A 16 14.671 8.630 -18.008 1.00 0.00 H new ATOM 253 N ASP A 17 21.849 10.960 -18.308 1.00 0.00 N ATOM 254 CA ASP A 17 22.476 10.955 -19.668 1.00 0.00 C ATOM 255 C ASP A 17 23.338 9.694 -20.031 1.00 0.00 C ATOM 256 O ASP A 17 23.020 8.975 -20.982 1.00 0.00 O ATOM 257 CB ASP A 17 23.303 12.270 -19.760 1.00 0.00 C ATOM 258 CG ASP A 17 23.793 12.654 -21.159 1.00 0.00 C ATOM 259 OD1 ASP A 17 23.189 12.399 -22.197 1.00 0.00 O ATOM 260 OD2 ASP A 17 24.980 13.319 -21.121 1.00 0.00 O ATOM 0 H ASP A 17 22.024 11.822 -17.792 1.00 0.00 H new ATOM 0 HA ASP A 17 21.680 10.901 -20.411 1.00 0.00 H new ATOM 0 HB2 ASP A 17 22.695 13.087 -19.372 1.00 0.00 H new ATOM 0 HB3 ASP A 17 24.169 12.178 -19.105 1.00 0.00 H new ATOM 266 N GLU A 18 24.397 9.422 -19.244 1.00 0.00 N ATOM 267 CA GLU A 18 25.198 8.166 -19.350 1.00 0.00 C ATOM 268 C GLU A 18 24.405 6.835 -19.139 1.00 0.00 C ATOM 269 O GLU A 18 24.677 5.862 -19.842 1.00 0.00 O ATOM 270 CB GLU A 18 26.385 8.279 -18.361 1.00 0.00 C ATOM 271 CG GLU A 18 27.480 7.188 -18.496 1.00 0.00 C ATOM 272 CD GLU A 18 28.506 7.237 -17.365 1.00 0.00 C ATOM 273 OE1 GLU A 18 28.220 7.005 -16.193 1.00 0.00 O ATOM 274 OE2 GLU A 18 29.756 7.566 -17.807 1.00 0.00 O ATOM 0 H GLU A 18 24.728 10.057 -18.517 1.00 0.00 H new ATOM 0 HA GLU A 18 25.537 8.089 -20.383 1.00 0.00 H new ATOM 0 HB2 GLU A 18 26.852 9.255 -18.493 1.00 0.00 H new ATOM 0 HB3 GLU A 18 25.991 8.249 -17.345 1.00 0.00 H new ATOM 0 HG2 GLU A 18 27.008 6.206 -18.510 1.00 0.00 H new ATOM 0 HG3 GLU A 18 27.992 7.309 -19.451 1.00 0.00 H new ATOM 282 N TYR A 19 23.429 6.788 -18.214 1.00 0.00 N ATOM 283 CA TYR A 19 22.473 5.655 -18.113 1.00 0.00 C ATOM 284 C TYR A 19 21.636 5.360 -19.410 1.00 0.00 C ATOM 285 O TYR A 19 21.586 4.214 -19.862 1.00 0.00 O ATOM 286 CB TYR A 19 21.603 5.921 -16.855 1.00 0.00 C ATOM 287 CG TYR A 19 20.830 4.686 -16.401 1.00 0.00 C ATOM 288 CD1 TYR A 19 21.466 3.751 -15.581 1.00 0.00 C ATOM 289 CD2 TYR A 19 19.539 4.429 -16.875 1.00 0.00 C ATOM 290 CE1 TYR A 19 20.826 2.566 -15.258 1.00 0.00 C ATOM 291 CE2 TYR A 19 18.899 3.240 -16.539 1.00 0.00 C ATOM 292 CZ TYR A 19 19.546 2.309 -15.730 1.00 0.00 C ATOM 293 OH TYR A 19 18.879 1.204 -15.286 1.00 0.00 O ATOM 0 H TYR A 19 23.276 7.521 -17.521 1.00 0.00 H new ATOM 0 HA TYR A 19 23.033 4.726 -18.010 1.00 0.00 H new ATOM 0 HB2 TYR A 19 22.243 6.263 -16.042 1.00 0.00 H new ATOM 0 HB3 TYR A 19 20.900 6.726 -17.068 1.00 0.00 H new ATOM 0 HD1 TYR A 19 22.456 3.952 -15.199 1.00 0.00 H new ATOM 0 HD2 TYR A 19 19.039 5.153 -17.501 1.00 0.00 H new ATOM 0 HE1 TYR A 19 21.325 1.838 -14.636 1.00 0.00 H new ATOM 0 HE2 TYR A 19 17.903 3.040 -16.905 1.00 0.00 H new ATOM 0 HH TYR A 19 19.178 0.418 -15.789 1.00 0.00 H new ATOM 303 N MET A 20 21.030 6.392 -20.021 1.00 0.00 N ATOM 304 CA MET A 20 20.438 6.313 -21.389 1.00 0.00 C ATOM 305 C MET A 20 21.448 5.890 -22.506 1.00 0.00 C ATOM 306 O MET A 20 21.163 4.948 -23.251 1.00 0.00 O ATOM 307 CB MET A 20 19.750 7.675 -21.698 1.00 0.00 C ATOM 308 CG MET A 20 18.589 8.128 -20.785 1.00 0.00 C ATOM 309 SD MET A 20 18.683 9.925 -20.604 1.00 0.00 S ATOM 310 CE MET A 20 16.956 10.411 -20.695 1.00 0.00 C ATOM 0 H MET A 20 20.931 7.311 -19.589 1.00 0.00 H new ATOM 0 HA MET A 20 19.703 5.508 -21.394 1.00 0.00 H new ATOM 0 HB2 MET A 20 20.517 8.449 -21.671 1.00 0.00 H new ATOM 0 HB3 MET A 20 19.374 7.634 -22.720 1.00 0.00 H new ATOM 0 HG2 MET A 20 17.631 7.839 -21.216 1.00 0.00 H new ATOM 0 HG3 MET A 20 18.659 7.643 -19.811 1.00 0.00 H new ATOM 0 HE1 MET A 20 16.785 11.270 -20.047 1.00 0.00 H new ATOM 0 HE2 MET A 20 16.706 10.676 -21.722 1.00 0.00 H new ATOM 0 HE3 MET A 20 16.327 9.582 -20.371 1.00 0.00 H new ATOM 320 N LYS A 21 22.635 6.522 -22.590 1.00 0.00 N ATOM 321 CA LYS A 21 23.756 6.042 -23.453 1.00 0.00 C ATOM 322 C LYS A 21 24.187 4.541 -23.272 1.00 0.00 C ATOM 323 O LYS A 21 24.334 3.826 -24.267 1.00 0.00 O ATOM 324 CB LYS A 21 24.935 7.047 -23.299 1.00 0.00 C ATOM 325 CG LYS A 21 25.895 7.125 -24.513 1.00 0.00 C ATOM 326 CD LYS A 21 25.553 8.219 -25.556 1.00 0.00 C ATOM 327 CE LYS A 21 24.247 8.059 -26.357 1.00 0.00 C ATOM 328 NZ LYS A 21 24.323 6.954 -27.335 1.00 0.00 N ATOM 0 H LYS A 21 22.853 7.373 -22.071 1.00 0.00 H new ATOM 0 HA LYS A 21 23.391 6.026 -24.480 1.00 0.00 H new ATOM 0 HB2 LYS A 21 24.524 8.040 -23.116 1.00 0.00 H new ATOM 0 HB3 LYS A 21 25.512 6.773 -22.416 1.00 0.00 H new ATOM 0 HG2 LYS A 21 26.906 7.300 -24.145 1.00 0.00 H new ATOM 0 HG3 LYS A 21 25.901 6.157 -25.014 1.00 0.00 H new ATOM 0 HD2 LYS A 21 25.513 9.177 -25.037 1.00 0.00 H new ATOM 0 HD3 LYS A 21 26.378 8.275 -26.266 1.00 0.00 H new ATOM 0 HE2 LYS A 21 23.421 7.877 -25.669 1.00 0.00 H new ATOM 0 HE3 LYS A 21 24.027 8.990 -26.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 23.368 6.728 -27.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 24.920 7.241 -28.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 24.735 6.115 -26.879 1.00 0.00 H new ATOM 341 N ALA A 22 24.311 4.056 -22.023 1.00 0.00 N ATOM 342 CA ALA A 22 24.501 2.615 -21.710 1.00 0.00 C ATOM 343 C ALA A 22 23.331 1.646 -22.104 1.00 0.00 C ATOM 344 O ALA A 22 23.593 0.569 -22.642 1.00 0.00 O ATOM 345 CB ALA A 22 24.822 2.561 -20.205 1.00 0.00 C ATOM 0 H ALA A 22 24.283 4.650 -21.194 1.00 0.00 H new ATOM 0 HA ALA A 22 25.307 2.231 -22.335 1.00 0.00 H new ATOM 0 HB1 ALA A 22 24.975 1.525 -19.903 1.00 0.00 H new ATOM 0 HB2 ALA A 22 25.727 3.135 -20.005 1.00 0.00 H new ATOM 0 HB3 ALA A 22 23.992 2.985 -19.640 1.00 0.00 H new ATOM 351 N LEU A 23 22.056 2.032 -21.892 1.00 0.00 N ATOM 352 CA LEU A 23 20.863 1.290 -22.415 1.00 0.00 C ATOM 353 C LEU A 23 20.688 1.157 -23.974 1.00 0.00 C ATOM 354 O LEU A 23 19.844 0.371 -24.419 1.00 0.00 O ATOM 355 CB LEU A 23 19.595 1.940 -21.762 1.00 0.00 C ATOM 356 CG LEU A 23 18.978 1.206 -20.544 1.00 0.00 C ATOM 357 CD1 LEU A 23 19.949 1.034 -19.366 1.00 0.00 C ATOM 358 CD2 LEU A 23 17.726 1.955 -20.060 1.00 0.00 C ATOM 0 H LEU A 23 21.812 2.864 -21.355 1.00 0.00 H new ATOM 0 HA LEU A 23 21.020 0.249 -22.132 1.00 0.00 H new ATOM 0 HB2 LEU A 23 19.854 2.952 -21.452 1.00 0.00 H new ATOM 0 HB3 LEU A 23 18.826 2.029 -22.530 1.00 0.00 H new ATOM 0 HG LEU A 23 18.724 0.205 -20.893 1.00 0.00 H new ATOM 0 HD11 LEU A 23 19.445 0.512 -18.552 1.00 0.00 H new ATOM 0 HD12 LEU A 23 20.813 0.454 -19.689 1.00 0.00 H new ATOM 0 HD13 LEU A 23 20.278 2.014 -19.020 1.00 0.00 H new ATOM 0 HD21 LEU A 23 17.298 1.433 -19.204 1.00 0.00 H new ATOM 0 HD22 LEU A 23 17.999 2.969 -19.768 1.00 0.00 H new ATOM 0 HD23 LEU A 23 16.992 1.995 -20.865 1.00 0.00 H new ATOM 370 N GLY A 24 21.441 1.916 -24.788 1.00 0.00 N ATOM 371 CA GLY A 24 21.336 1.889 -26.269 1.00 0.00 C ATOM 372 C GLY A 24 20.359 2.913 -26.880 1.00 0.00 C ATOM 373 O GLY A 24 19.463 2.531 -27.640 1.00 0.00 O ATOM 0 H GLY A 24 22.144 2.570 -24.443 1.00 0.00 H new ATOM 0 HA2 GLY A 24 22.327 2.061 -26.690 1.00 0.00 H new ATOM 0 HA3 GLY A 24 21.028 0.890 -26.577 1.00 0.00 H new ATOM 377 N VAL A 25 20.544 4.208 -26.574 1.00 0.00 N ATOM 378 CA VAL A 25 19.725 5.304 -27.180 1.00 0.00 C ATOM 379 C VAL A 25 20.426 5.949 -28.424 1.00 0.00 C ATOM 380 O VAL A 25 21.650 6.133 -28.449 1.00 0.00 O ATOM 381 CB VAL A 25 19.290 6.378 -26.124 1.00 0.00 C ATOM 382 CG1 VAL A 25 18.468 5.765 -24.962 1.00 0.00 C ATOM 383 CG2 VAL A 25 20.451 7.249 -25.594 1.00 0.00 C ATOM 0 H VAL A 25 21.249 4.535 -25.913 1.00 0.00 H new ATOM 0 HA VAL A 25 18.809 4.839 -27.544 1.00 0.00 H new ATOM 0 HB VAL A 25 18.637 7.056 -26.674 1.00 0.00 H new ATOM 0 HG11 VAL A 25 18.191 6.550 -24.258 1.00 0.00 H new ATOM 0 HG12 VAL A 25 17.566 5.300 -25.360 1.00 0.00 H new ATOM 0 HG13 VAL A 25 19.068 5.013 -24.449 1.00 0.00 H new ATOM 0 HG21 VAL A 25 20.066 7.966 -24.869 1.00 0.00 H new ATOM 0 HG22 VAL A 25 21.195 6.612 -25.115 1.00 0.00 H new ATOM 0 HG23 VAL A 25 20.912 7.784 -26.424 1.00 0.00 H new ATOM 393 N GLY A 26 19.633 6.383 -29.420 1.00 0.00 N ATOM 394 CA GLY A 26 20.156 7.212 -30.542 1.00 0.00 C ATOM 395 C GLY A 26 20.491 8.682 -30.179 1.00 0.00 C ATOM 396 O GLY A 26 19.780 9.320 -29.391 1.00 0.00 O ATOM 0 H GLY A 26 18.635 6.180 -29.479 1.00 0.00 H new ATOM 0 HA2 GLY A 26 21.056 6.738 -30.934 1.00 0.00 H new ATOM 0 HA3 GLY A 26 19.420 7.212 -31.346 1.00 0.00 H new ATOM 400 N PHE A 27 21.548 9.242 -30.800 1.00 0.00 N ATOM 401 CA PHE A 27 21.998 10.649 -30.535 1.00 0.00 C ATOM 402 C PHE A 27 21.138 11.752 -31.264 1.00 0.00 C ATOM 403 O PHE A 27 21.610 12.553 -32.074 1.00 0.00 O ATOM 404 CB PHE A 27 23.525 10.704 -30.841 1.00 0.00 C ATOM 405 CG PHE A 27 24.296 11.829 -30.126 1.00 0.00 C ATOM 406 CD1 PHE A 27 24.709 11.653 -28.800 1.00 0.00 C ATOM 407 CD2 PHE A 27 24.644 13.004 -30.799 1.00 0.00 C ATOM 408 CE1 PHE A 27 25.464 12.633 -28.160 1.00 0.00 C ATOM 409 CE2 PHE A 27 25.405 13.982 -30.161 1.00 0.00 C ATOM 410 CZ PHE A 27 25.817 13.794 -28.843 1.00 0.00 C ATOM 0 H PHE A 27 22.115 8.752 -31.492 1.00 0.00 H new ATOM 0 HA PHE A 27 21.829 10.903 -29.489 1.00 0.00 H new ATOM 0 HB2 PHE A 27 23.970 9.748 -30.565 1.00 0.00 H new ATOM 0 HB3 PHE A 27 23.660 10.819 -31.916 1.00 0.00 H new ATOM 0 HD1 PHE A 27 24.440 10.751 -28.270 1.00 0.00 H new ATOM 0 HD2 PHE A 27 24.321 13.155 -31.819 1.00 0.00 H new ATOM 0 HE1 PHE A 27 25.775 12.493 -27.135 1.00 0.00 H new ATOM 0 HE2 PHE A 27 25.675 14.885 -30.688 1.00 0.00 H new ATOM 0 HZ PHE A 27 26.411 14.550 -28.351 1.00 0.00 H new ATOM 420 N ALA A 28 19.847 11.758 -30.914 1.00 0.00 N ATOM 421 CA ALA A 28 18.818 12.744 -31.347 1.00 0.00 C ATOM 422 C ALA A 28 17.559 12.593 -30.423 1.00 0.00 C ATOM 423 O ALA A 28 17.166 13.536 -29.731 1.00 0.00 O ATOM 424 CB ALA A 28 18.489 12.599 -32.851 1.00 0.00 C ATOM 0 H ALA A 28 19.461 11.048 -30.292 1.00 0.00 H new ATOM 0 HA ALA A 28 19.204 13.757 -31.236 1.00 0.00 H new ATOM 0 HB1 ALA A 28 17.735 13.334 -33.131 1.00 0.00 H new ATOM 0 HB2 ALA A 28 19.392 12.764 -33.439 1.00 0.00 H new ATOM 0 HB3 ALA A 28 18.108 11.596 -33.045 1.00 0.00 H new ATOM 430 N THR A 29 16.999 11.364 -30.335 1.00 0.00 N ATOM 431 CA THR A 29 16.094 10.888 -29.242 1.00 0.00 C ATOM 432 C THR A 29 16.462 11.316 -27.775 1.00 0.00 C ATOM 433 O THR A 29 15.556 11.613 -26.987 1.00 0.00 O ATOM 434 CB THR A 29 16.015 9.329 -29.396 1.00 0.00 C ATOM 435 OG1 THR A 29 15.593 8.970 -30.709 1.00 0.00 O ATOM 436 CG2 THR A 29 15.040 8.593 -28.464 1.00 0.00 C ATOM 0 H THR A 29 17.165 10.647 -31.041 1.00 0.00 H new ATOM 0 HA THR A 29 15.130 11.381 -29.370 1.00 0.00 H new ATOM 0 HB THR A 29 17.032 9.025 -29.146 1.00 0.00 H new ATOM 0 HG1 THR A 29 15.552 7.994 -30.784 1.00 0.00 H new ATOM 0 HG21 THR A 29 15.078 7.523 -28.669 1.00 0.00 H new ATOM 0 HG22 THR A 29 15.321 8.774 -27.427 1.00 0.00 H new ATOM 0 HG23 THR A 29 14.028 8.959 -28.634 1.00 0.00 H new ATOM 444 N ARG A 30 17.755 11.320 -27.388 1.00 0.00 N ATOM 445 CA ARG A 30 18.215 11.859 -26.069 1.00 0.00 C ATOM 446 C ARG A 30 18.704 13.340 -25.973 1.00 0.00 C ATOM 447 O ARG A 30 18.884 13.826 -24.854 1.00 0.00 O ATOM 448 CB ARG A 30 19.116 10.811 -25.362 1.00 0.00 C ATOM 449 CG ARG A 30 18.469 10.230 -24.076 1.00 0.00 C ATOM 450 CD ARG A 30 17.329 9.196 -24.272 1.00 0.00 C ATOM 451 NE ARG A 30 16.057 9.774 -24.794 1.00 0.00 N ATOM 452 CZ ARG A 30 14.828 9.587 -24.324 1.00 0.00 C ATOM 453 NH1 ARG A 30 14.549 8.888 -23.255 1.00 0.00 N ATOM 454 NH2 ARG A 30 13.850 10.158 -24.966 1.00 0.00 N ATOM 0 H ARG A 30 18.511 10.956 -27.967 1.00 0.00 H new ATOM 0 HA ARG A 30 17.296 11.996 -25.498 1.00 0.00 H new ATOM 0 HB2 ARG A 30 19.331 9.997 -26.055 1.00 0.00 H new ATOM 0 HB3 ARG A 30 20.070 11.272 -25.107 1.00 0.00 H new ATOM 0 HG2 ARG A 30 19.254 9.762 -23.483 1.00 0.00 H new ATOM 0 HG3 ARG A 30 18.077 11.060 -23.488 1.00 0.00 H new ATOM 0 HD2 ARG A 30 17.671 8.422 -24.959 1.00 0.00 H new ATOM 0 HD3 ARG A 30 17.128 8.709 -23.318 1.00 0.00 H new ATOM 0 HE ARG A 30 16.140 10.384 -25.607 1.00 0.00 H new ATOM 0 HH11 ARG A 30 15.300 8.445 -22.725 1.00 0.00 H new ATOM 0 HH12 ARG A 30 13.581 8.786 -22.951 1.00 0.00 H new ATOM 0 HH21 ARG A 30 14.044 10.721 -25.794 1.00 0.00 H new ATOM 0 HH22 ARG A 30 12.890 10.042 -24.641 1.00 0.00 H new ATOM 468 N GLN A 31 18.761 14.117 -27.065 1.00 0.00 N ATOM 469 CA GLN A 31 18.598 15.605 -26.995 1.00 0.00 C ATOM 470 C GLN A 31 17.158 16.034 -26.531 1.00 0.00 C ATOM 471 O GLN A 31 17.031 16.826 -25.595 1.00 0.00 O ATOM 472 CB GLN A 31 19.019 16.236 -28.354 1.00 0.00 C ATOM 473 CG GLN A 31 20.544 16.421 -28.589 1.00 0.00 C ATOM 474 CD GLN A 31 21.402 15.150 -28.699 1.00 0.00 C ATOM 475 OE1 GLN A 31 20.992 14.110 -29.198 1.00 0.00 O ATOM 476 NE2 GLN A 31 22.631 15.190 -28.250 1.00 0.00 N ATOM 0 H GLN A 31 18.917 13.758 -28.007 1.00 0.00 H new ATOM 0 HA GLN A 31 19.261 15.994 -26.222 1.00 0.00 H new ATOM 0 HB2 GLN A 31 18.623 15.614 -29.156 1.00 0.00 H new ATOM 0 HB3 GLN A 31 18.540 17.211 -28.441 1.00 0.00 H new ATOM 0 HG2 GLN A 31 20.676 16.997 -29.505 1.00 0.00 H new ATOM 0 HG3 GLN A 31 20.940 17.025 -27.773 1.00 0.00 H new ATOM 0 HE21 GLN A 31 22.993 16.046 -27.830 1.00 0.00 H new ATOM 0 HE22 GLN A 31 23.227 14.365 -28.320 1.00 0.00 H new ATOM 485 N VAL A 32 16.094 15.432 -27.104 1.00 0.00 N ATOM 486 CA VAL A 32 14.719 15.400 -26.501 1.00 0.00 C ATOM 487 C VAL A 32 14.673 14.879 -25.013 1.00 0.00 C ATOM 488 O VAL A 32 14.158 15.580 -24.138 1.00 0.00 O ATOM 489 CB VAL A 32 13.778 14.635 -27.514 1.00 0.00 C ATOM 490 CG1 VAL A 32 12.471 14.063 -26.921 1.00 0.00 C ATOM 491 CG2 VAL A 32 13.372 15.518 -28.718 1.00 0.00 C ATOM 0 H VAL A 32 16.151 14.949 -28.001 1.00 0.00 H new ATOM 0 HA VAL A 32 14.346 16.416 -26.374 1.00 0.00 H new ATOM 0 HB VAL A 32 14.406 13.797 -27.816 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.905 13.560 -27.705 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.711 13.350 -26.132 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.874 14.875 -26.506 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.726 14.948 -29.386 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.838 16.398 -28.360 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.266 15.831 -29.258 1.00 0.00 H new ATOM 501 N GLY A 33 15.207 13.674 -24.734 1.00 0.00 N ATOM 502 CA GLY A 33 15.264 13.101 -23.356 1.00 0.00 C ATOM 503 C GLY A 33 15.963 13.870 -22.215 1.00 0.00 C ATOM 504 O GLY A 33 15.458 13.855 -21.092 1.00 0.00 O ATOM 0 H GLY A 33 15.611 13.066 -25.446 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.236 12.921 -23.040 1.00 0.00 H new ATOM 0 HA3 GLY A 33 15.749 12.128 -23.432 1.00 0.00 H new ATOM 508 N ASN A 34 17.115 14.504 -22.478 1.00 0.00 N ATOM 509 CA ASN A 34 17.810 15.360 -21.469 1.00 0.00 C ATOM 510 C ASN A 34 17.131 16.736 -21.149 1.00 0.00 C ATOM 511 O ASN A 34 17.215 17.174 -19.999 1.00 0.00 O ATOM 512 CB ASN A 34 19.296 15.536 -21.883 1.00 0.00 C ATOM 513 CG ASN A 34 20.199 14.334 -21.581 1.00 0.00 C ATOM 514 OD1 ASN A 34 20.705 14.172 -20.477 1.00 0.00 O ATOM 515 ND2 ASN A 34 20.455 13.474 -22.535 1.00 0.00 N ATOM 0 H ASN A 34 17.595 14.449 -23.376 1.00 0.00 H new ATOM 0 HA ASN A 34 17.734 14.823 -20.523 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.338 15.743 -22.952 1.00 0.00 H new ATOM 0 HB3 ASN A 34 19.699 16.411 -21.373 1.00 0.00 H new ATOM 0 HD21 ASN A 34 21.070 12.680 -22.355 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.040 13.598 -23.458 1.00 0.00 H new ATOM 522 N VAL A 35 16.464 17.417 -22.106 1.00 0.00 N ATOM 523 CA VAL A 35 15.668 18.658 -21.809 1.00 0.00 C ATOM 524 C VAL A 35 14.348 18.445 -20.980 1.00 0.00 C ATOM 525 O VAL A 35 13.990 19.310 -20.177 1.00 0.00 O ATOM 526 CB VAL A 35 15.429 19.546 -23.082 1.00 0.00 C ATOM 527 CG1 VAL A 35 16.737 20.042 -23.741 1.00 0.00 C ATOM 528 CG2 VAL A 35 14.527 18.929 -24.177 1.00 0.00 C ATOM 0 H VAL A 35 16.452 17.142 -23.088 1.00 0.00 H new ATOM 0 HA VAL A 35 16.318 19.213 -21.133 1.00 0.00 H new ATOM 0 HB VAL A 35 14.885 20.390 -22.658 1.00 0.00 H new ATOM 0 HG11 VAL A 35 16.497 20.649 -24.614 1.00 0.00 H new ATOM 0 HG12 VAL A 35 17.300 20.642 -23.026 1.00 0.00 H new ATOM 0 HG13 VAL A 35 17.337 19.186 -24.048 1.00 0.00 H new ATOM 0 HG21 VAL A 35 14.432 19.629 -25.007 1.00 0.00 H new ATOM 0 HG22 VAL A 35 14.972 18.000 -24.534 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.540 18.722 -23.762 1.00 0.00 H new ATOM 538 N THR A 36 13.621 17.330 -21.178 1.00 0.00 N ATOM 539 CA THR A 36 12.342 17.033 -20.467 1.00 0.00 C ATOM 540 C THR A 36 12.541 16.311 -19.088 1.00 0.00 C ATOM 541 O THR A 36 13.310 15.348 -18.987 1.00 0.00 O ATOM 542 CB THR A 36 11.425 16.231 -21.440 1.00 0.00 C ATOM 543 OG1 THR A 36 10.113 16.131 -20.901 1.00 0.00 O ATOM 544 CG2 THR A 36 11.871 14.798 -21.790 1.00 0.00 C ATOM 0 H THR A 36 13.896 16.601 -21.836 1.00 0.00 H new ATOM 0 HA THR A 36 11.862 17.974 -20.198 1.00 0.00 H new ATOM 0 HB THR A 36 11.479 16.809 -22.363 1.00 0.00 H new ATOM 0 HG1 THR A 36 9.738 15.251 -21.113 1.00 0.00 H new ATOM 0 HG21 THR A 36 11.150 14.349 -22.473 1.00 0.00 H new ATOM 0 HG22 THR A 36 12.851 14.828 -22.266 1.00 0.00 H new ATOM 0 HG23 THR A 36 11.928 14.202 -20.879 1.00 0.00 H new ATOM 552 N LYS A 37 11.792 16.719 -18.041 1.00 0.00 N ATOM 553 CA LYS A 37 11.690 15.929 -16.779 1.00 0.00 C ATOM 554 C LYS A 37 10.474 14.928 -16.836 1.00 0.00 C ATOM 555 O LYS A 37 9.337 15.405 -16.936 1.00 0.00 O ATOM 556 CB LYS A 37 11.713 16.844 -15.516 1.00 0.00 C ATOM 557 CG LYS A 37 10.445 17.658 -15.150 1.00 0.00 C ATOM 558 CD LYS A 37 10.595 18.430 -13.824 1.00 0.00 C ATOM 559 CE LYS A 37 9.301 19.162 -13.434 1.00 0.00 C ATOM 560 NZ LYS A 37 9.480 19.852 -12.141 1.00 0.00 N ATOM 0 H LYS A 37 11.250 17.583 -18.037 1.00 0.00 H new ATOM 0 HA LYS A 37 12.580 15.307 -16.686 1.00 0.00 H new ATOM 0 HB2 LYS A 37 11.958 16.216 -14.660 1.00 0.00 H new ATOM 0 HB3 LYS A 37 12.533 17.551 -15.638 1.00 0.00 H new ATOM 0 HG2 LYS A 37 10.226 18.362 -15.953 1.00 0.00 H new ATOM 0 HG3 LYS A 37 9.593 16.982 -15.078 1.00 0.00 H new ATOM 0 HD2 LYS A 37 10.872 17.736 -13.030 1.00 0.00 H new ATOM 0 HD3 LYS A 37 11.407 19.152 -13.915 1.00 0.00 H new ATOM 0 HE2 LYS A 37 9.035 19.883 -14.207 1.00 0.00 H new ATOM 0 HE3 LYS A 37 8.478 18.451 -13.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 8.600 20.344 -11.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.713 19.155 -11.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 10.253 20.543 -12.221 1.00 0.00 H new ATOM 573 N PRO A 38 10.614 13.568 -16.773 1.00 0.00 N ATOM 574 CA PRO A 38 9.438 12.655 -16.807 1.00 0.00 C ATOM 575 C PRO A 38 8.620 12.568 -15.479 1.00 0.00 C ATOM 576 O PRO A 38 9.164 12.275 -14.410 1.00 0.00 O ATOM 577 CB PRO A 38 10.061 11.315 -17.238 1.00 0.00 C ATOM 578 CG PRO A 38 11.513 11.399 -16.763 1.00 0.00 C ATOM 579 CD PRO A 38 11.892 12.862 -16.995 1.00 0.00 C ATOM 0 HA PRO A 38 8.667 13.015 -17.488 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.542 10.471 -16.783 1.00 0.00 H new ATOM 0 HB3 PRO A 38 10.004 11.179 -18.318 1.00 0.00 H new ATOM 0 HG2 PRO A 38 11.606 11.124 -15.712 1.00 0.00 H new ATOM 0 HG3 PRO A 38 12.158 10.725 -17.327 1.00 0.00 H new ATOM 0 HD2 PRO A 38 12.664 13.195 -16.302 1.00 0.00 H new ATOM 0 HD3 PRO A 38 12.276 13.026 -18.002 1.00 0.00 H new ATOM 587 N THR A 39 7.301 12.784 -15.587 1.00 0.00 N ATOM 588 CA THR A 39 6.351 12.754 -14.435 1.00 0.00 C ATOM 589 C THR A 39 5.631 11.368 -14.405 1.00 0.00 C ATOM 590 O THR A 39 5.006 10.946 -15.384 1.00 0.00 O ATOM 591 CB THR A 39 5.369 13.962 -14.541 1.00 0.00 C ATOM 592 OG1 THR A 39 6.095 15.182 -14.440 1.00 0.00 O ATOM 593 CG2 THR A 39 4.303 14.038 -13.435 1.00 0.00 C ATOM 0 H THR A 39 6.847 12.987 -16.478 1.00 0.00 H new ATOM 0 HA THR A 39 6.876 12.862 -13.486 1.00 0.00 H new ATOM 0 HB THR A 39 4.871 13.814 -15.499 1.00 0.00 H new ATOM 0 HG1 THR A 39 5.475 15.938 -14.509 1.00 0.00 H new ATOM 0 HG21 THR A 39 3.671 14.911 -13.598 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.690 13.137 -13.458 1.00 0.00 H new ATOM 0 HG23 THR A 39 4.791 14.120 -12.464 1.00 0.00 H new ATOM 601 N VAL A 40 5.736 10.651 -13.278 1.00 0.00 N ATOM 602 CA VAL A 40 5.313 9.216 -13.194 1.00 0.00 C ATOM 603 C VAL A 40 3.969 9.112 -12.397 1.00 0.00 C ATOM 604 O VAL A 40 3.969 9.232 -11.173 1.00 0.00 O ATOM 605 CB VAL A 40 6.498 8.353 -12.621 1.00 0.00 C ATOM 606 CG1 VAL A 40 6.144 6.864 -12.413 1.00 0.00 C ATOM 607 CG2 VAL A 40 7.762 8.357 -13.516 1.00 0.00 C ATOM 0 H VAL A 40 6.107 11.026 -12.405 1.00 0.00 H new ATOM 0 HA VAL A 40 5.100 8.802 -14.180 1.00 0.00 H new ATOM 0 HB VAL A 40 6.694 8.841 -11.667 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.011 6.336 -12.016 1.00 0.00 H new ATOM 0 HG12 VAL A 40 5.316 6.782 -11.709 1.00 0.00 H new ATOM 0 HG13 VAL A 40 5.855 6.422 -13.367 1.00 0.00 H new ATOM 0 HG21 VAL A 40 8.535 7.741 -13.056 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.514 7.955 -14.498 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.128 9.378 -13.624 1.00 0.00 H new ATOM 617 N ILE A 41 2.819 8.851 -13.052 1.00 0.00 N ATOM 618 CA ILE A 41 1.518 8.637 -12.332 1.00 0.00 C ATOM 619 C ILE A 41 1.368 7.109 -12.034 1.00 0.00 C ATOM 620 O ILE A 41 1.068 6.330 -12.945 1.00 0.00 O ATOM 621 CB ILE A 41 0.244 9.214 -13.059 1.00 0.00 C ATOM 622 CG1 ILE A 41 0.397 10.645 -13.654 1.00 0.00 C ATOM 623 CG2 ILE A 41 -0.982 9.193 -12.100 1.00 0.00 C ATOM 624 CD1 ILE A 41 -0.702 11.061 -14.650 1.00 0.00 C ATOM 0 H ILE A 41 2.750 8.781 -14.067 1.00 0.00 H new ATOM 0 HA ILE A 41 1.565 9.214 -11.408 1.00 0.00 H new ATOM 0 HB ILE A 41 0.098 8.552 -13.912 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.412 11.363 -12.834 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.363 10.712 -14.154 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -1.854 9.594 -12.616 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.184 8.168 -11.790 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -0.768 9.802 -11.222 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.506 12.072 -15.007 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.707 10.372 -15.495 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.672 11.033 -14.154 1.00 0.00 H new ATOM 636 N ILE A 42 1.535 6.686 -10.767 1.00 0.00 N ATOM 637 CA ILE A 42 1.282 5.270 -10.350 1.00 0.00 C ATOM 638 C ILE A 42 -0.220 5.183 -9.910 1.00 0.00 C ATOM 639 O ILE A 42 -0.614 5.774 -8.898 1.00 0.00 O ATOM 640 CB ILE A 42 2.302 4.785 -9.253 1.00 0.00 C ATOM 641 CG1 ILE A 42 3.791 4.853 -9.717 1.00 0.00 C ATOM 642 CG2 ILE A 42 1.972 3.356 -8.736 1.00 0.00 C ATOM 643 CD1 ILE A 42 4.872 4.540 -8.667 1.00 0.00 C ATOM 0 H ILE A 42 1.843 7.293 -10.007 1.00 0.00 H new ATOM 0 HA ILE A 42 1.449 4.581 -11.178 1.00 0.00 H new ATOM 0 HB ILE A 42 2.185 5.491 -8.430 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.917 4.160 -10.548 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.978 5.854 -10.106 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.702 3.064 -7.981 1.00 0.00 H new ATOM 0 HG22 ILE A 42 0.974 3.349 -8.297 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.008 2.651 -9.567 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.858 4.624 -9.124 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.793 5.247 -7.841 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.732 3.527 -8.291 1.00 0.00 H new ATOM 655 N SER A 43 -1.049 4.465 -10.693 1.00 0.00 N ATOM 656 CA SER A 43 -2.530 4.484 -10.535 1.00 0.00 C ATOM 657 C SER A 43 -3.163 3.061 -10.610 1.00 0.00 C ATOM 658 O SER A 43 -3.063 2.366 -11.621 1.00 0.00 O ATOM 659 CB SER A 43 -3.144 5.438 -11.588 1.00 0.00 C ATOM 660 OG SER A 43 -2.772 5.136 -12.942 1.00 0.00 O ATOM 0 H SER A 43 -0.723 3.860 -11.447 1.00 0.00 H new ATOM 0 HA SER A 43 -2.759 4.854 -9.536 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.230 5.403 -11.505 1.00 0.00 H new ATOM 0 HB3 SER A 43 -2.840 6.459 -11.358 1.00 0.00 H new ATOM 0 HG SER A 43 -1.917 4.657 -12.947 1.00 0.00 H new ATOM 666 N GLN A 44 -3.840 2.635 -9.537 1.00 0.00 N ATOM 667 CA GLN A 44 -4.346 1.241 -9.386 1.00 0.00 C ATOM 668 C GLN A 44 -5.794 1.087 -9.939 1.00 0.00 C ATOM 669 O GLN A 44 -6.735 1.701 -9.425 1.00 0.00 O ATOM 670 CB GLN A 44 -4.260 0.828 -7.893 1.00 0.00 C ATOM 671 CG GLN A 44 -2.825 0.643 -7.333 1.00 0.00 C ATOM 672 CD GLN A 44 -2.059 1.908 -6.910 1.00 0.00 C ATOM 673 OE1 GLN A 44 -2.527 3.040 -6.963 1.00 0.00 O ATOM 674 NE2 GLN A 44 -0.835 1.754 -6.481 1.00 0.00 N ATOM 0 H GLN A 44 -4.059 3.236 -8.743 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.720 0.574 -9.978 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -4.770 1.583 -7.295 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -4.806 -0.106 -7.760 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.884 -0.019 -6.469 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.233 0.128 -8.089 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -0.426 0.821 -6.429 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -0.288 2.567 -6.198 1.00 0.00 H new ATOM 683 N GLU A 45 -5.971 0.260 -10.983 1.00 0.00 N ATOM 684 CA GLU A 45 -7.280 0.106 -11.678 1.00 0.00 C ATOM 685 C GLU A 45 -7.841 -1.341 -11.478 1.00 0.00 C ATOM 686 O GLU A 45 -7.722 -2.207 -12.354 1.00 0.00 O ATOM 687 CB GLU A 45 -7.115 0.527 -13.170 1.00 0.00 C ATOM 688 CG GLU A 45 -6.654 1.985 -13.464 1.00 0.00 C ATOM 689 CD GLU A 45 -7.548 3.097 -12.913 1.00 0.00 C ATOM 690 OE1 GLU A 45 -8.653 3.374 -13.366 1.00 0.00 O ATOM 691 OE2 GLU A 45 -6.978 3.749 -11.862 1.00 0.00 O ATOM 0 H GLU A 45 -5.227 -0.318 -11.373 1.00 0.00 H new ATOM 0 HA GLU A 45 -8.030 0.767 -11.243 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -6.398 -0.151 -13.632 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.071 0.370 -13.670 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -5.652 2.117 -13.056 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -6.578 2.110 -14.544 1.00 0.00 H new ATOM 699 N GLY A 46 -8.453 -1.595 -10.302 1.00 0.00 N ATOM 700 CA GLY A 46 -9.066 -2.912 -9.965 1.00 0.00 C ATOM 701 C GLY A 46 -8.069 -4.063 -9.706 1.00 0.00 C ATOM 702 O GLY A 46 -7.518 -4.189 -8.612 1.00 0.00 O ATOM 0 H GLY A 46 -8.540 -0.902 -9.559 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -9.688 -2.787 -9.079 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -9.728 -3.204 -10.780 1.00 0.00 H new ATOM 706 N ASP A 47 -7.836 -4.879 -10.741 1.00 0.00 N ATOM 707 CA ASP A 47 -6.751 -5.906 -10.742 1.00 0.00 C ATOM 708 C ASP A 47 -5.286 -5.354 -10.842 1.00 0.00 C ATOM 709 O ASP A 47 -4.383 -5.918 -10.219 1.00 0.00 O ATOM 710 CB ASP A 47 -7.020 -6.894 -11.917 1.00 0.00 C ATOM 711 CG ASP A 47 -8.040 -7.997 -11.636 1.00 0.00 C ATOM 712 OD1 ASP A 47 -9.232 -7.773 -11.441 1.00 0.00 O ATOM 713 OD2 ASP A 47 -7.481 -9.249 -11.645 1.00 0.00 O ATOM 0 H ASP A 47 -8.382 -4.858 -11.602 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.793 -6.390 -9.766 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -7.361 -6.320 -12.779 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.076 -7.361 -12.198 1.00 0.00 H new ATOM 719 N LYS A 48 -5.035 -4.342 -11.690 1.00 0.00 N ATOM 720 CA LYS A 48 -3.682 -4.006 -12.194 1.00 0.00 C ATOM 721 C LYS A 48 -3.153 -2.629 -11.681 1.00 0.00 C ATOM 722 O LYS A 48 -3.911 -1.686 -11.427 1.00 0.00 O ATOM 723 CB LYS A 48 -3.785 -4.096 -13.745 1.00 0.00 C ATOM 724 CG LYS A 48 -4.609 -2.984 -14.446 1.00 0.00 C ATOM 725 CD LYS A 48 -5.265 -3.402 -15.778 1.00 0.00 C ATOM 726 CE LYS A 48 -6.541 -4.254 -15.625 1.00 0.00 C ATOM 727 NZ LYS A 48 -7.685 -3.448 -15.138 1.00 0.00 N ATOM 0 H LYS A 48 -5.765 -3.728 -12.050 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.936 -4.702 -11.812 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.776 -4.084 -14.156 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -4.223 -5.060 -14.003 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.389 -2.646 -13.764 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.956 -2.131 -14.631 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.509 -2.504 -16.345 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.538 -3.962 -16.366 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.795 -4.703 -16.585 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.351 -5.072 -14.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -8.547 -4.030 -15.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.493 -3.124 -14.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -7.818 -2.624 -15.759 1.00 0.00 H new ATOM 740 N VAL A 49 -1.822 -2.496 -11.610 1.00 0.00 N ATOM 741 CA VAL A 49 -1.152 -1.181 -11.403 1.00 0.00 C ATOM 742 C VAL A 49 -0.903 -0.560 -12.821 1.00 0.00 C ATOM 743 O VAL A 49 -0.145 -1.104 -13.634 1.00 0.00 O ATOM 744 CB VAL A 49 0.152 -1.324 -10.546 1.00 0.00 C ATOM 745 CG1 VAL A 49 0.814 0.040 -10.242 1.00 0.00 C ATOM 746 CG2 VAL A 49 -0.022 -2.029 -9.178 1.00 0.00 C ATOM 0 H VAL A 49 -1.175 -3.280 -11.692 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.784 -0.507 -10.824 1.00 0.00 H new ATOM 0 HB VAL A 49 0.774 -1.948 -11.188 1.00 0.00 H new ATOM 0 HG11 VAL A 49 1.713 -0.117 -9.646 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.080 0.532 -11.178 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.116 0.668 -9.688 1.00 0.00 H new ATOM 0 HG21 VAL A 49 0.940 -2.075 -8.667 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.730 -1.469 -8.568 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.398 -3.040 -9.335 1.00 0.00 H new ATOM 756 N VAL A 50 -1.551 0.581 -13.109 1.00 0.00 N ATOM 757 CA VAL A 50 -1.344 1.352 -14.368 1.00 0.00 C ATOM 758 C VAL A 50 -0.327 2.493 -14.041 1.00 0.00 C ATOM 759 O VAL A 50 -0.698 3.523 -13.461 1.00 0.00 O ATOM 760 CB VAL A 50 -2.697 1.866 -14.978 1.00 0.00 C ATOM 761 CG1 VAL A 50 -2.501 2.639 -16.304 1.00 0.00 C ATOM 762 CG2 VAL A 50 -3.717 0.741 -15.267 1.00 0.00 C ATOM 0 H VAL A 50 -2.236 1.003 -12.482 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.932 0.716 -15.152 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.086 2.524 -14.201 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.470 2.970 -16.679 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.864 3.506 -16.129 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.031 1.986 -17.040 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.626 1.173 -15.686 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.288 0.035 -15.979 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.957 0.221 -14.340 1.00 0.00 H new ATOM 772 N ILE A 51 0.951 2.300 -14.416 1.00 0.00 N ATOM 773 CA ILE A 51 2.007 3.344 -14.256 1.00 0.00 C ATOM 774 C ILE A 51 2.103 4.136 -15.599 1.00 0.00 C ATOM 775 O ILE A 51 2.534 3.597 -16.623 1.00 0.00 O ATOM 776 CB ILE A 51 3.397 2.792 -13.766 1.00 0.00 C ATOM 777 CG1 ILE A 51 3.295 1.976 -12.445 1.00 0.00 C ATOM 778 CG2 ILE A 51 4.425 3.943 -13.610 1.00 0.00 C ATOM 779 CD1 ILE A 51 4.587 1.329 -11.908 1.00 0.00 C ATOM 0 H ILE A 51 1.288 1.433 -14.834 1.00 0.00 H new ATOM 0 HA ILE A 51 1.714 4.014 -13.447 1.00 0.00 H new ATOM 0 HB ILE A 51 3.743 2.105 -14.538 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.902 2.636 -11.671 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.559 1.186 -12.594 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.378 3.536 -13.270 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.564 4.439 -14.570 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.057 4.663 -12.879 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.369 0.793 -10.984 1.00 0.00 H new ATOM 0 HD12 ILE A 51 4.979 0.632 -12.648 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.328 2.104 -11.711 1.00 0.00 H new ATOM 791 N ARG A 52 1.744 5.427 -15.563 1.00 0.00 N ATOM 792 CA ARG A 52 1.889 6.342 -16.730 1.00 0.00 C ATOM 793 C ARG A 52 3.183 7.197 -16.581 1.00 0.00 C ATOM 794 O ARG A 52 3.208 8.167 -15.817 1.00 0.00 O ATOM 795 CB ARG A 52 0.613 7.219 -16.850 1.00 0.00 C ATOM 796 CG ARG A 52 -0.640 6.495 -17.405 1.00 0.00 C ATOM 797 CD ARG A 52 -1.951 7.277 -17.212 1.00 0.00 C ATOM 798 NE ARG A 52 -2.450 7.130 -15.814 1.00 0.00 N ATOM 799 CZ ARG A 52 -3.461 7.814 -15.282 1.00 0.00 C ATOM 800 NH1 ARG A 52 -4.085 8.787 -15.898 1.00 0.00 N ATOM 801 NH2 ARG A 52 -3.854 7.497 -14.086 1.00 0.00 N ATOM 0 H ARG A 52 1.347 5.874 -14.737 1.00 0.00 H new ATOM 0 HA ARG A 52 1.991 5.768 -17.651 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.374 7.620 -15.865 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.836 8.069 -17.495 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.496 6.304 -18.468 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.732 5.525 -16.917 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.788 8.331 -17.437 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.703 6.914 -17.912 1.00 0.00 H new ATOM 0 HE ARG A 52 -1.979 6.450 -15.217 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.803 9.058 -16.840 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.853 9.273 -15.436 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -3.391 6.742 -13.580 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -4.626 8.003 -13.652 1.00 0.00 H new ATOM 815 N THR A 53 4.257 6.848 -17.318 1.00 0.00 N ATOM 816 CA THR A 53 5.500 7.679 -17.358 1.00 0.00 C ATOM 817 C THR A 53 5.363 8.753 -18.482 1.00 0.00 C ATOM 818 O THR A 53 5.517 8.464 -19.676 1.00 0.00 O ATOM 819 CB THR A 53 6.745 6.756 -17.498 1.00 0.00 C ATOM 820 OG1 THR A 53 6.790 5.841 -16.407 1.00 0.00 O ATOM 821 CG2 THR A 53 8.101 7.480 -17.521 1.00 0.00 C ATOM 0 H THR A 53 4.299 6.006 -17.892 1.00 0.00 H new ATOM 0 HA THR A 53 5.641 8.227 -16.426 1.00 0.00 H new ATOM 0 HB THR A 53 6.614 6.271 -18.465 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.574 5.260 -16.499 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.903 6.748 -17.621 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.131 8.169 -18.365 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.232 8.037 -16.593 1.00 0.00 H new ATOM 829 N LEU A 54 5.052 9.993 -18.073 1.00 0.00 N ATOM 830 CA LEU A 54 4.787 11.116 -19.003 1.00 0.00 C ATOM 831 C LEU A 54 6.082 11.961 -19.175 1.00 0.00 C ATOM 832 O LEU A 54 6.381 12.851 -18.372 1.00 0.00 O ATOM 833 CB LEU A 54 3.602 11.968 -18.458 1.00 0.00 C ATOM 834 CG LEU A 54 2.212 11.285 -18.337 1.00 0.00 C ATOM 835 CD1 LEU A 54 1.223 12.238 -17.647 1.00 0.00 C ATOM 836 CD2 LEU A 54 1.634 10.854 -19.696 1.00 0.00 C ATOM 0 H LEU A 54 4.976 10.251 -17.089 1.00 0.00 H new ATOM 0 HA LEU A 54 4.503 10.739 -19.986 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.881 12.336 -17.471 1.00 0.00 H new ATOM 0 HB3 LEU A 54 3.492 12.839 -19.104 1.00 0.00 H new ATOM 0 HG LEU A 54 2.356 10.382 -17.744 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.250 11.755 -17.564 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.591 12.486 -16.651 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.126 13.150 -18.235 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.662 10.383 -19.545 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.518 11.729 -20.336 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.311 10.144 -20.171 1.00 0.00 H new ATOM 848 N SER A 55 6.843 11.697 -20.248 1.00 0.00 N ATOM 849 CA SER A 55 8.053 12.496 -20.596 1.00 0.00 C ATOM 850 C SER A 55 7.825 13.818 -21.405 1.00 0.00 C ATOM 851 O SER A 55 8.770 14.291 -22.047 1.00 0.00 O ATOM 852 CB SER A 55 9.005 11.491 -21.292 1.00 0.00 C ATOM 853 OG SER A 55 10.273 12.081 -21.547 1.00 0.00 O ATOM 0 H SER A 55 6.650 10.936 -20.899 1.00 0.00 H new ATOM 0 HA SER A 55 8.479 12.919 -19.686 1.00 0.00 H new ATOM 0 HB2 SER A 55 9.130 10.609 -20.664 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.562 11.154 -22.229 1.00 0.00 H new ATOM 0 HG SER A 55 10.856 11.427 -21.985 1.00 0.00 H new ATOM 859 N THR A 56 6.617 14.420 -21.366 1.00 0.00 N ATOM 860 CA THR A 56 6.161 15.526 -22.276 1.00 0.00 C ATOM 861 C THR A 56 6.073 15.135 -23.791 1.00 0.00 C ATOM 862 O THR A 56 4.993 15.128 -24.383 1.00 0.00 O ATOM 863 CB THR A 56 6.753 16.951 -22.011 1.00 0.00 C ATOM 864 OG1 THR A 56 8.112 17.047 -22.412 1.00 0.00 O ATOM 865 CG2 THR A 56 6.673 17.442 -20.557 1.00 0.00 C ATOM 0 H THR A 56 5.903 14.153 -20.688 1.00 0.00 H new ATOM 0 HA THR A 56 5.126 15.650 -21.958 1.00 0.00 H new ATOM 0 HB THR A 56 6.109 17.590 -22.615 1.00 0.00 H new ATOM 0 HG1 THR A 56 8.689 16.714 -21.694 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.110 18.438 -20.485 1.00 0.00 H new ATOM 0 HG22 THR A 56 5.630 17.480 -20.243 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.222 16.757 -19.911 1.00 0.00 H new ATOM 873 N PHE A 57 7.215 14.769 -24.385 1.00 0.00 N ATOM 874 CA PHE A 57 7.317 14.229 -25.771 1.00 0.00 C ATOM 875 C PHE A 57 6.879 12.724 -25.926 1.00 0.00 C ATOM 876 O PHE A 57 6.296 12.375 -26.954 1.00 0.00 O ATOM 877 CB PHE A 57 8.781 14.430 -26.278 1.00 0.00 C ATOM 878 CG PHE A 57 9.370 15.860 -26.257 1.00 0.00 C ATOM 879 CD1 PHE A 57 9.994 16.331 -25.095 1.00 0.00 C ATOM 880 CD2 PHE A 57 9.345 16.674 -27.395 1.00 0.00 C ATOM 881 CE1 PHE A 57 10.572 17.596 -25.067 1.00 0.00 C ATOM 882 CE2 PHE A 57 9.930 17.941 -27.365 1.00 0.00 C ATOM 883 CZ PHE A 57 10.541 18.398 -26.198 1.00 0.00 C ATOM 0 H PHE A 57 8.119 14.836 -23.917 1.00 0.00 H new ATOM 0 HA PHE A 57 6.607 14.788 -26.380 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.432 13.793 -25.679 1.00 0.00 H new ATOM 0 HB3 PHE A 57 8.832 14.064 -27.303 1.00 0.00 H new ATOM 0 HD1 PHE A 57 10.027 15.707 -24.214 1.00 0.00 H new ATOM 0 HD2 PHE A 57 8.872 16.321 -28.299 1.00 0.00 H new ATOM 0 HE1 PHE A 57 11.045 17.954 -24.164 1.00 0.00 H new ATOM 0 HE2 PHE A 57 9.909 18.567 -28.245 1.00 0.00 H new ATOM 0 HZ PHE A 57 10.991 19.379 -26.175 1.00 0.00 H new ATOM 893 N LYS A 58 7.182 11.838 -24.949 1.00 0.00 N ATOM 894 CA LYS A 58 6.850 10.383 -25.011 1.00 0.00 C ATOM 895 C LYS A 58 5.928 9.968 -23.816 1.00 0.00 C ATOM 896 O LYS A 58 6.296 10.122 -22.646 1.00 0.00 O ATOM 897 CB LYS A 58 8.160 9.536 -24.985 1.00 0.00 C ATOM 898 CG LYS A 58 9.101 9.629 -26.211 1.00 0.00 C ATOM 899 CD LYS A 58 8.572 8.929 -27.478 1.00 0.00 C ATOM 900 CE LYS A 58 9.625 8.902 -28.597 1.00 0.00 C ATOM 901 NZ LYS A 58 9.082 8.207 -29.780 1.00 0.00 N ATOM 0 H LYS A 58 7.664 12.106 -24.091 1.00 0.00 H new ATOM 0 HA LYS A 58 6.314 10.195 -25.942 1.00 0.00 H new ATOM 0 HB2 LYS A 58 8.730 9.826 -24.102 1.00 0.00 H new ATOM 0 HB3 LYS A 58 7.881 8.490 -24.855 1.00 0.00 H new ATOM 0 HG2 LYS A 58 9.277 10.680 -26.439 1.00 0.00 H new ATOM 0 HG3 LYS A 58 10.065 9.194 -25.947 1.00 0.00 H new ATOM 0 HD2 LYS A 58 8.276 7.909 -27.233 1.00 0.00 H new ATOM 0 HD3 LYS A 58 7.679 9.444 -27.832 1.00 0.00 H new ATOM 0 HE2 LYS A 58 9.913 9.919 -28.862 1.00 0.00 H new ATOM 0 HE3 LYS A 58 10.526 8.396 -28.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 9.799 8.192 -30.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 8.829 7.231 -29.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 8.235 8.707 -30.118 1.00 0.00 H new ATOM 914 N ASN A 59 4.760 9.365 -24.102 1.00 0.00 N ATOM 915 CA ASN A 59 3.963 8.628 -23.079 1.00 0.00 C ATOM 916 C ASN A 59 4.342 7.112 -23.126 1.00 0.00 C ATOM 917 O ASN A 59 3.910 6.391 -24.032 1.00 0.00 O ATOM 918 CB ASN A 59 2.456 8.908 -23.343 1.00 0.00 C ATOM 919 CG ASN A 59 1.466 8.261 -22.357 1.00 0.00 C ATOM 920 OD1 ASN A 59 1.808 7.739 -21.300 1.00 0.00 O ATOM 921 ND2 ASN A 59 0.195 8.272 -22.675 1.00 0.00 N ATOM 0 H ASN A 59 4.339 9.368 -25.031 1.00 0.00 H new ATOM 0 HA ASN A 59 4.183 8.966 -22.066 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.299 9.987 -23.329 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.214 8.564 -24.348 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.491 7.851 -22.048 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.108 8.701 -23.549 1.00 0.00 H new ATOM 928 N THR A 60 5.133 6.631 -22.149 1.00 0.00 N ATOM 929 CA THR A 60 5.459 5.176 -22.023 1.00 0.00 C ATOM 930 C THR A 60 4.699 4.573 -20.802 1.00 0.00 C ATOM 931 O THR A 60 5.190 4.556 -19.668 1.00 0.00 O ATOM 932 CB THR A 60 6.998 4.934 -22.110 1.00 0.00 C ATOM 933 OG1 THR A 60 7.278 3.541 -22.229 1.00 0.00 O ATOM 934 CG2 THR A 60 7.890 5.474 -20.981 1.00 0.00 C ATOM 0 H THR A 60 5.562 7.216 -21.432 1.00 0.00 H new ATOM 0 HA THR A 60 5.087 4.606 -22.874 1.00 0.00 H new ATOM 0 HB THR A 60 7.259 5.520 -22.991 1.00 0.00 H new ATOM 0 HG1 THR A 60 7.505 3.177 -21.348 1.00 0.00 H new ATOM 0 HG21 THR A 60 8.931 5.225 -21.189 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.782 6.557 -20.918 1.00 0.00 H new ATOM 0 HG23 THR A 60 7.591 5.024 -20.034 1.00 0.00 H new ATOM 942 N GLU A 61 3.451 4.128 -21.042 1.00 0.00 N ATOM 943 CA GLU A 61 2.526 3.677 -19.967 1.00 0.00 C ATOM 944 C GLU A 61 2.331 2.128 -19.904 1.00 0.00 C ATOM 945 O GLU A 61 2.281 1.445 -20.932 1.00 0.00 O ATOM 946 CB GLU A 61 1.190 4.462 -20.055 1.00 0.00 C ATOM 947 CG GLU A 61 0.312 4.276 -21.319 1.00 0.00 C ATOM 948 CD GLU A 61 -1.072 4.909 -21.185 1.00 0.00 C ATOM 949 OE1 GLU A 61 -1.274 6.120 -21.157 1.00 0.00 O ATOM 950 OE2 GLU A 61 -2.060 3.976 -21.090 1.00 0.00 O ATOM 0 H GLU A 61 3.051 4.068 -21.978 1.00 0.00 H new ATOM 0 HA GLU A 61 2.996 3.913 -19.012 1.00 0.00 H new ATOM 0 HB2 GLU A 61 0.587 4.191 -19.188 1.00 0.00 H new ATOM 0 HB3 GLU A 61 1.421 5.523 -19.963 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.823 4.713 -22.177 1.00 0.00 H new ATOM 0 HG3 GLU A 61 0.200 3.211 -21.523 1.00 0.00 H new ATOM 958 N ILE A 62 2.221 1.583 -18.678 1.00 0.00 N ATOM 959 CA ILE A 62 2.274 0.107 -18.433 1.00 0.00 C ATOM 960 C ILE A 62 1.136 -0.360 -17.473 1.00 0.00 C ATOM 961 O ILE A 62 1.040 0.095 -16.331 1.00 0.00 O ATOM 962 CB ILE A 62 3.685 -0.368 -17.932 1.00 0.00 C ATOM 963 CG1 ILE A 62 4.250 0.373 -16.686 1.00 0.00 C ATOM 964 CG2 ILE A 62 4.696 -0.348 -19.097 1.00 0.00 C ATOM 965 CD1 ILE A 62 5.372 -0.368 -15.941 1.00 0.00 C ATOM 0 H ILE A 62 2.094 2.136 -17.830 1.00 0.00 H new ATOM 0 HA ILE A 62 2.107 -0.374 -19.397 1.00 0.00 H new ATOM 0 HB ILE A 62 3.530 -1.388 -17.580 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.625 1.347 -17.001 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.432 0.557 -15.990 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.671 -0.679 -18.739 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.354 -1.016 -19.887 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.779 0.665 -19.490 1.00 0.00 H new ATOM 0 HD11 ILE A 62 5.699 0.228 -15.089 1.00 0.00 H new ATOM 0 HD12 ILE A 62 5.001 -1.331 -15.589 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.213 -0.528 -16.616 1.00 0.00 H new ATOM 977 N SER A 63 0.309 -1.309 -17.940 1.00 0.00 N ATOM 978 CA SER A 63 -0.802 -1.907 -17.144 1.00 0.00 C ATOM 979 C SER A 63 -0.482 -3.389 -16.775 1.00 0.00 C ATOM 980 O SER A 63 -0.516 -4.260 -17.654 1.00 0.00 O ATOM 981 CB SER A 63 -2.114 -1.789 -17.963 1.00 0.00 C ATOM 982 OG SER A 63 -2.108 -2.649 -19.106 1.00 0.00 O ATOM 0 H SER A 63 0.383 -1.692 -18.882 1.00 0.00 H new ATOM 0 HA SER A 63 -0.920 -1.368 -16.204 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.963 -2.037 -17.326 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.249 -0.757 -18.286 1.00 0.00 H new ATOM 0 HG SER A 63 -1.597 -3.460 -18.903 1.00 0.00 H new ATOM 988 N PHE A 64 -0.168 -3.673 -15.500 1.00 0.00 N ATOM 989 CA PHE A 64 0.383 -4.995 -15.072 1.00 0.00 C ATOM 990 C PHE A 64 -0.198 -5.471 -13.700 1.00 0.00 C ATOM 991 O PHE A 64 -0.486 -4.669 -12.806 1.00 0.00 O ATOM 992 CB PHE A 64 1.944 -4.929 -15.062 1.00 0.00 C ATOM 993 CG PHE A 64 2.593 -4.015 -14.002 1.00 0.00 C ATOM 994 CD1 PHE A 64 2.765 -2.654 -14.267 1.00 0.00 C ATOM 995 CD2 PHE A 64 2.900 -4.513 -12.732 1.00 0.00 C ATOM 996 CE1 PHE A 64 3.206 -1.798 -13.265 1.00 0.00 C ATOM 997 CE2 PHE A 64 3.329 -3.651 -11.727 1.00 0.00 C ATOM 998 CZ PHE A 64 3.478 -2.293 -11.993 1.00 0.00 C ATOM 0 H PHE A 64 -0.283 -3.009 -14.735 1.00 0.00 H new ATOM 0 HA PHE A 64 0.069 -5.748 -15.795 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.326 -5.940 -14.919 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.277 -4.598 -16.046 1.00 0.00 H new ATOM 0 HD1 PHE A 64 2.555 -2.266 -15.253 1.00 0.00 H new ATOM 0 HD2 PHE A 64 2.804 -5.570 -12.530 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.338 -0.747 -13.474 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.546 -4.036 -10.741 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.805 -1.623 -11.212 1.00 0.00 H new ATOM 1008 N GLN A 65 -0.289 -6.794 -13.501 1.00 0.00 N ATOM 1009 CA GLN A 65 -0.619 -7.396 -12.175 1.00 0.00 C ATOM 1010 C GLN A 65 0.699 -7.794 -11.430 1.00 0.00 C ATOM 1011 O GLN A 65 1.268 -8.844 -11.720 1.00 0.00 O ATOM 1012 CB GLN A 65 -1.598 -8.585 -12.409 1.00 0.00 C ATOM 1013 CG GLN A 65 -3.049 -8.142 -12.766 1.00 0.00 C ATOM 1014 CD GLN A 65 -4.081 -9.251 -12.996 1.00 0.00 C ATOM 1015 OE1 GLN A 65 -4.930 -9.548 -12.158 1.00 0.00 O ATOM 1016 NE2 GLN A 65 -4.118 -9.824 -14.174 1.00 0.00 N ATOM 0 H GLN A 65 -0.140 -7.482 -14.239 1.00 0.00 H new ATOM 0 HA GLN A 65 -1.123 -6.683 -11.522 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -1.210 -9.210 -13.213 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.627 -9.202 -11.511 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -3.414 -7.501 -11.963 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -3.004 -7.530 -13.667 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -3.420 -9.587 -14.879 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -4.845 -10.507 -14.386 1.00 0.00 H new ATOM 1025 N LEU A 66 1.178 -6.938 -10.501 1.00 0.00 N ATOM 1026 CA LEU A 66 2.431 -7.109 -9.678 1.00 0.00 C ATOM 1027 C LEU A 66 3.257 -8.446 -9.749 1.00 0.00 C ATOM 1028 O LEU A 66 2.794 -9.495 -9.292 1.00 0.00 O ATOM 1029 CB LEU A 66 2.043 -6.776 -8.204 1.00 0.00 C ATOM 1030 CG LEU A 66 1.838 -5.271 -7.873 1.00 0.00 C ATOM 1031 CD1 LEU A 66 0.997 -5.096 -6.597 1.00 0.00 C ATOM 1032 CD2 LEU A 66 3.190 -4.554 -7.706 1.00 0.00 C ATOM 0 H LEU A 66 0.694 -6.067 -10.283 1.00 0.00 H new ATOM 0 HA LEU A 66 3.150 -6.430 -10.137 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.123 -7.308 -7.963 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.820 -7.169 -7.548 1.00 0.00 H new ATOM 0 HG LEU A 66 1.303 -4.822 -8.710 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.869 -4.034 -6.388 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.020 -5.558 -6.739 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.505 -5.572 -5.758 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.018 -3.503 -7.475 1.00 0.00 H new ATOM 0 HD22 LEU A 66 3.750 -5.017 -6.893 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.761 -4.634 -8.631 1.00 0.00 H new ATOM 1044 N GLY A 67 4.454 -8.413 -10.364 1.00 0.00 N ATOM 1045 CA GLY A 67 5.196 -9.656 -10.737 1.00 0.00 C ATOM 1046 C GLY A 67 4.947 -10.291 -12.134 1.00 0.00 C ATOM 1047 O GLY A 67 5.780 -11.079 -12.583 1.00 0.00 O ATOM 0 H GLY A 67 4.935 -7.550 -10.617 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.261 -9.439 -10.659 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.969 -10.413 -9.986 1.00 0.00 H new ATOM 1051 N GLU A 68 3.837 -9.972 -12.823 1.00 0.00 N ATOM 1052 CA GLU A 68 3.515 -10.484 -14.183 1.00 0.00 C ATOM 1053 C GLU A 68 4.505 -9.931 -15.263 1.00 0.00 C ATOM 1054 O GLU A 68 4.714 -8.720 -15.380 1.00 0.00 O ATOM 1055 CB GLU A 68 2.024 -10.102 -14.449 1.00 0.00 C ATOM 1056 CG GLU A 68 1.262 -10.748 -15.636 1.00 0.00 C ATOM 1057 CD GLU A 68 1.774 -10.408 -17.031 1.00 0.00 C ATOM 1058 OE1 GLU A 68 1.661 -9.304 -17.556 1.00 0.00 O ATOM 1059 OE2 GLU A 68 2.419 -11.464 -17.599 1.00 0.00 O ATOM 0 H GLU A 68 3.124 -9.344 -12.453 1.00 0.00 H new ATOM 0 HA GLU A 68 3.637 -11.565 -14.245 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.464 -10.328 -13.542 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.985 -9.021 -14.587 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.293 -11.831 -15.514 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.215 -10.450 -15.574 1.00 0.00 H new ATOM 1067 N GLU A 69 5.100 -10.840 -16.054 1.00 0.00 N ATOM 1068 CA GLU A 69 6.014 -10.470 -17.170 1.00 0.00 C ATOM 1069 C GLU A 69 5.252 -10.002 -18.458 1.00 0.00 C ATOM 1070 O GLU A 69 4.375 -10.701 -18.979 1.00 0.00 O ATOM 1071 CB GLU A 69 6.954 -11.670 -17.457 1.00 0.00 C ATOM 1072 CG GLU A 69 8.141 -11.311 -18.388 1.00 0.00 C ATOM 1073 CD GLU A 69 9.162 -12.429 -18.561 1.00 0.00 C ATOM 1074 OE1 GLU A 69 10.227 -12.481 -17.954 1.00 0.00 O ATOM 1075 OE2 GLU A 69 8.767 -13.352 -19.479 1.00 0.00 O ATOM 0 H GLU A 69 4.969 -11.846 -15.947 1.00 0.00 H new ATOM 0 HA GLU A 69 6.603 -9.606 -16.863 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.344 -12.051 -16.513 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.376 -12.475 -17.911 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.749 -11.038 -19.368 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.647 -10.431 -17.990 1.00 0.00 H new ATOM 1083 N PHE A 70 5.620 -8.826 -18.980 1.00 0.00 N ATOM 1084 CA PHE A 70 4.940 -8.198 -20.149 1.00 0.00 C ATOM 1085 C PHE A 70 5.973 -7.586 -21.149 1.00 0.00 C ATOM 1086 O PHE A 70 7.038 -7.094 -20.762 1.00 0.00 O ATOM 1087 CB PHE A 70 3.877 -7.165 -19.654 1.00 0.00 C ATOM 1088 CG PHE A 70 4.391 -5.961 -18.836 1.00 0.00 C ATOM 1089 CD1 PHE A 70 4.876 -4.817 -19.478 1.00 0.00 C ATOM 1090 CD2 PHE A 70 4.468 -6.050 -17.443 1.00 0.00 C ATOM 1091 CE1 PHE A 70 5.458 -3.794 -18.735 1.00 0.00 C ATOM 1092 CE2 PHE A 70 5.062 -5.032 -16.704 1.00 0.00 C ATOM 1093 CZ PHE A 70 5.560 -3.905 -17.352 1.00 0.00 C ATOM 0 H PHE A 70 6.395 -8.273 -18.614 1.00 0.00 H new ATOM 0 HA PHE A 70 4.408 -8.967 -20.710 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.348 -6.780 -20.526 1.00 0.00 H new ATOM 0 HB3 PHE A 70 3.145 -7.698 -19.047 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.799 -4.727 -20.551 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.064 -6.915 -16.937 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.831 -2.912 -19.233 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.137 -5.116 -15.630 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.026 -3.116 -16.780 1.00 0.00 H new ATOM 1103 N ASP A 71 5.626 -7.547 -22.447 1.00 0.00 N ATOM 1104 CA ASP A 71 6.431 -6.805 -23.458 1.00 0.00 C ATOM 1105 C ASP A 71 6.212 -5.258 -23.365 1.00 0.00 C ATOM 1106 O ASP A 71 5.080 -4.768 -23.316 1.00 0.00 O ATOM 1107 CB ASP A 71 6.129 -7.287 -24.897 1.00 0.00 C ATOM 1108 CG ASP A 71 6.563 -8.717 -25.213 1.00 0.00 C ATOM 1109 OD1 ASP A 71 5.824 -9.690 -25.092 1.00 0.00 O ATOM 1110 OD2 ASP A 71 7.863 -8.786 -25.630 1.00 0.00 O ATOM 0 H ASP A 71 4.803 -8.013 -22.828 1.00 0.00 H new ATOM 0 HA ASP A 71 7.475 -7.018 -23.229 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.056 -7.204 -25.072 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.620 -6.613 -25.599 1.00 0.00 H new ATOM 1116 N GLU A 72 7.320 -4.504 -23.377 1.00 0.00 N ATOM 1117 CA GLU A 72 7.296 -3.018 -23.307 1.00 0.00 C ATOM 1118 C GLU A 72 8.241 -2.414 -24.390 1.00 0.00 C ATOM 1119 O GLU A 72 9.468 -2.470 -24.258 1.00 0.00 O ATOM 1120 CB GLU A 72 7.684 -2.556 -21.875 1.00 0.00 C ATOM 1121 CG GLU A 72 7.470 -1.038 -21.627 1.00 0.00 C ATOM 1122 CD GLU A 72 8.005 -0.483 -20.308 1.00 0.00 C ATOM 1123 OE1 GLU A 72 8.250 -1.151 -19.306 1.00 0.00 O ATOM 1124 OE2 GLU A 72 8.164 0.868 -20.364 1.00 0.00 O ATOM 0 H GLU A 72 8.260 -4.896 -23.435 1.00 0.00 H new ATOM 0 HA GLU A 72 6.289 -2.655 -23.515 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.097 -3.119 -21.150 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.731 -2.800 -21.696 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.939 -0.489 -22.444 1.00 0.00 H new ATOM 0 HG3 GLU A 72 6.401 -0.831 -21.676 1.00 0.00 H new ATOM 1132 N THR A 73 7.659 -1.761 -25.410 1.00 0.00 N ATOM 1133 CA THR A 73 8.409 -0.864 -26.340 1.00 0.00 C ATOM 1134 C THR A 73 8.564 0.542 -25.670 1.00 0.00 C ATOM 1135 O THR A 73 7.591 1.277 -25.469 1.00 0.00 O ATOM 1136 CB THR A 73 7.691 -0.831 -27.721 1.00 0.00 C ATOM 1137 OG1 THR A 73 7.639 -2.138 -28.282 1.00 0.00 O ATOM 1138 CG2 THR A 73 8.395 0.028 -28.780 1.00 0.00 C ATOM 0 H THR A 73 6.664 -1.831 -25.622 1.00 0.00 H new ATOM 0 HA THR A 73 9.416 -1.236 -26.530 1.00 0.00 H new ATOM 0 HB THR A 73 6.710 -0.409 -27.502 1.00 0.00 H new ATOM 0 HG1 THR A 73 7.184 -2.104 -29.149 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.828 -0.005 -29.711 1.00 0.00 H new ATOM 0 HG22 THR A 73 8.458 1.058 -28.430 1.00 0.00 H new ATOM 0 HG23 THR A 73 9.399 -0.358 -28.953 1.00 0.00 H new ATOM 1146 N THR A 74 9.800 0.874 -25.274 1.00 0.00 N ATOM 1147 CA THR A 74 10.070 2.013 -24.339 1.00 0.00 C ATOM 1148 C THR A 74 10.133 3.420 -25.034 1.00 0.00 C ATOM 1149 O THR A 74 9.978 3.544 -26.251 1.00 0.00 O ATOM 1150 CB THR A 74 11.351 1.673 -23.502 1.00 0.00 C ATOM 1151 OG1 THR A 74 12.522 1.608 -24.315 1.00 0.00 O ATOM 1152 CG2 THR A 74 11.254 0.380 -22.671 1.00 0.00 C ATOM 0 H THR A 74 10.639 0.380 -25.578 1.00 0.00 H new ATOM 0 HA THR A 74 9.217 2.115 -23.668 1.00 0.00 H new ATOM 0 HB THR A 74 11.425 2.504 -22.801 1.00 0.00 H new ATOM 0 HG1 THR A 74 13.229 2.157 -23.915 1.00 0.00 H new ATOM 0 HG21 THR A 74 12.186 0.227 -22.126 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.429 0.463 -21.963 1.00 0.00 H new ATOM 0 HG23 THR A 74 11.078 -0.467 -23.335 1.00 0.00 H new ATOM 1160 N ALA A 75 10.420 4.500 -24.276 1.00 0.00 N ATOM 1161 CA ALA A 75 10.751 5.838 -24.861 1.00 0.00 C ATOM 1162 C ALA A 75 12.003 5.962 -25.812 1.00 0.00 C ATOM 1163 O ALA A 75 12.103 6.934 -26.563 1.00 0.00 O ATOM 1164 CB ALA A 75 10.849 6.810 -23.670 1.00 0.00 C ATOM 0 H ALA A 75 10.432 4.482 -23.256 1.00 0.00 H new ATOM 0 HA ALA A 75 9.952 6.069 -25.565 1.00 0.00 H new ATOM 0 HB1 ALA A 75 11.090 7.809 -24.034 1.00 0.00 H new ATOM 0 HB2 ALA A 75 9.896 6.836 -23.142 1.00 0.00 H new ATOM 0 HB3 ALA A 75 11.631 6.474 -22.989 1.00 0.00 H new ATOM 1170 N ASP A 76 12.927 4.981 -25.814 1.00 0.00 N ATOM 1171 CA ASP A 76 13.862 4.739 -26.956 1.00 0.00 C ATOM 1172 C ASP A 76 13.275 3.953 -28.193 1.00 0.00 C ATOM 1173 O ASP A 76 13.930 3.920 -29.235 1.00 0.00 O ATOM 1174 CB ASP A 76 15.085 4.008 -26.328 1.00 0.00 C ATOM 1175 CG ASP A 76 16.301 3.755 -27.221 1.00 0.00 C ATOM 1176 OD1 ASP A 76 16.584 4.426 -28.209 1.00 0.00 O ATOM 1177 OD2 ASP A 76 17.061 2.722 -26.753 1.00 0.00 O ATOM 0 H ASP A 76 13.054 4.333 -25.036 1.00 0.00 H new ATOM 0 HA ASP A 76 14.113 5.697 -27.412 1.00 0.00 H new ATOM 0 HB2 ASP A 76 15.417 4.589 -25.467 1.00 0.00 H new ATOM 0 HB3 ASP A 76 14.741 3.045 -25.949 1.00 0.00 H new ATOM 1183 N ASP A 77 12.112 3.277 -28.086 1.00 0.00 N ATOM 1184 CA ASP A 77 11.662 2.190 -29.014 1.00 0.00 C ATOM 1185 C ASP A 77 12.362 0.785 -28.831 1.00 0.00 C ATOM 1186 O ASP A 77 12.190 -0.102 -29.671 1.00 0.00 O ATOM 1187 CB ASP A 77 11.529 2.694 -30.486 1.00 0.00 C ATOM 1188 CG ASP A 77 10.549 1.921 -31.367 1.00 0.00 C ATOM 1189 OD1 ASP A 77 9.334 1.925 -31.201 1.00 0.00 O ATOM 1190 OD2 ASP A 77 11.171 1.233 -32.364 1.00 0.00 O ATOM 0 H ASP A 77 11.439 3.466 -27.343 1.00 0.00 H new ATOM 0 HA ASP A 77 10.649 1.945 -28.695 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.223 3.740 -30.466 1.00 0.00 H new ATOM 0 HB3 ASP A 77 12.513 2.659 -30.953 1.00 0.00 H new ATOM 1196 N ARG A 78 13.074 0.528 -27.709 1.00 0.00 N ATOM 1197 CA ARG A 78 13.647 -0.809 -27.393 1.00 0.00 C ATOM 1198 C ARG A 78 12.553 -1.709 -26.727 1.00 0.00 C ATOM 1199 O ARG A 78 11.958 -1.321 -25.712 1.00 0.00 O ATOM 1200 CB ARG A 78 14.981 -0.643 -26.592 1.00 0.00 C ATOM 1201 CG ARG A 78 14.936 -0.690 -25.046 1.00 0.00 C ATOM 1202 CD ARG A 78 16.147 -0.037 -24.346 1.00 0.00 C ATOM 1203 NE ARG A 78 16.347 -0.621 -23.001 1.00 0.00 N ATOM 1204 CZ ARG A 78 15.633 -0.365 -21.910 1.00 0.00 C ATOM 1205 NH1 ARG A 78 14.739 0.582 -21.828 1.00 0.00 N ATOM 1206 NH2 ARG A 78 15.826 -1.100 -20.861 1.00 0.00 N ATOM 0 H ARG A 78 13.269 1.234 -26.999 1.00 0.00 H new ATOM 0 HA ARG A 78 13.936 -1.345 -28.297 1.00 0.00 H new ATOM 0 HB2 ARG A 78 15.665 -1.423 -26.926 1.00 0.00 H new ATOM 0 HB3 ARG A 78 15.422 0.311 -26.880 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.027 -0.194 -24.707 1.00 0.00 H new ATOM 0 HG3 ARG A 78 14.868 -1.731 -24.729 1.00 0.00 H new ATOM 0 HD2 ARG A 78 17.044 -0.182 -24.948 1.00 0.00 H new ATOM 0 HD3 ARG A 78 15.989 1.038 -24.262 1.00 0.00 H new ATOM 0 HE ARG A 78 17.112 -1.289 -22.901 1.00 0.00 H new ATOM 0 HH11 ARG A 78 14.554 1.180 -22.634 1.00 0.00 H new ATOM 0 HH12 ARG A 78 14.225 0.725 -20.958 1.00 0.00 H new ATOM 0 HH21 ARG A 78 16.513 -1.854 -20.886 1.00 0.00 H new ATOM 0 HH22 ARG A 78 15.291 -0.925 -20.010 1.00 0.00 H new ATOM 1220 N ASN A 79 12.292 -2.890 -27.308 1.00 0.00 N ATOM 1221 CA ASN A 79 11.301 -3.862 -26.768 1.00 0.00 C ATOM 1222 C ASN A 79 11.919 -4.802 -25.679 1.00 0.00 C ATOM 1223 O ASN A 79 12.856 -5.557 -25.956 1.00 0.00 O ATOM 1224 CB ASN A 79 10.570 -4.595 -27.928 1.00 0.00 C ATOM 1225 CG ASN A 79 11.384 -5.533 -28.830 1.00 0.00 C ATOM 1226 OD1 ASN A 79 11.564 -6.712 -28.547 1.00 0.00 O ATOM 1227 ND2 ASN A 79 11.878 -5.061 -29.950 1.00 0.00 N ATOM 0 H ASN A 79 12.754 -3.206 -28.161 1.00 0.00 H new ATOM 0 HA ASN A 79 10.529 -3.314 -26.228 1.00 0.00 H new ATOM 0 HB2 ASN A 79 9.757 -5.176 -27.493 1.00 0.00 H new ATOM 0 HB3 ASN A 79 10.114 -3.836 -28.564 1.00 0.00 H new ATOM 0 HD21 ASN A 79 12.404 -5.673 -30.573 1.00 0.00 H new ATOM 0 HD22 ASN A 79 11.736 -4.082 -30.198 1.00 0.00 H new ATOM 1234 N CYS A 80 11.395 -4.737 -24.442 1.00 0.00 N ATOM 1235 CA CYS A 80 11.877 -5.569 -23.307 1.00 0.00 C ATOM 1236 C CYS A 80 10.764 -6.448 -22.671 1.00 0.00 C ATOM 1237 O CYS A 80 9.621 -6.011 -22.503 1.00 0.00 O ATOM 1238 CB CYS A 80 12.472 -4.622 -22.243 1.00 0.00 C ATOM 1239 SG CYS A 80 11.249 -3.399 -21.668 1.00 0.00 S ATOM 0 H CYS A 80 10.629 -4.111 -24.194 1.00 0.00 H new ATOM 0 HA CYS A 80 12.625 -6.263 -23.690 1.00 0.00 H new ATOM 0 HB2 CYS A 80 12.829 -5.206 -21.395 1.00 0.00 H new ATOM 0 HB3 CYS A 80 13.336 -4.104 -22.659 1.00 0.00 H new ATOM 0 HG CYS A 80 10.661 -3.843 -20.597 1.00 0.00 H new ATOM 1245 N LYS A 81 11.137 -7.655 -22.205 1.00 0.00 N ATOM 1246 CA LYS A 81 10.315 -8.418 -21.225 1.00 0.00 C ATOM 1247 C LYS A 81 10.496 -7.808 -19.797 1.00 0.00 C ATOM 1248 O LYS A 81 11.546 -7.942 -19.160 1.00 0.00 O ATOM 1249 CB LYS A 81 10.686 -9.925 -21.257 1.00 0.00 C ATOM 1250 CG LYS A 81 10.263 -10.731 -22.507 1.00 0.00 C ATOM 1251 CD LYS A 81 8.734 -10.859 -22.702 1.00 0.00 C ATOM 1252 CE LYS A 81 8.301 -11.927 -23.724 1.00 0.00 C ATOM 1253 NZ LYS A 81 8.718 -11.593 -25.102 1.00 0.00 N ATOM 0 H LYS A 81 11.997 -8.127 -22.485 1.00 0.00 H new ATOM 0 HA LYS A 81 9.263 -8.339 -21.498 1.00 0.00 H new ATOM 0 HB2 LYS A 81 11.768 -10.009 -21.151 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.242 -10.401 -20.382 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.691 -10.257 -23.391 1.00 0.00 H new ATOM 0 HG3 LYS A 81 10.693 -11.731 -22.442 1.00 0.00 H new ATOM 0 HD2 LYS A 81 8.277 -11.091 -21.740 1.00 0.00 H new ATOM 0 HD3 LYS A 81 8.340 -9.893 -23.018 1.00 0.00 H new ATOM 0 HE2 LYS A 81 8.728 -12.889 -23.442 1.00 0.00 H new ATOM 0 HE3 LYS A 81 7.217 -12.037 -23.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 8.263 -12.247 -25.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 8.434 -10.617 -25.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 9.751 -11.680 -25.183 1.00 0.00 H new ATOM 1266 N SER A 82 9.469 -7.078 -19.345 1.00 0.00 N ATOM 1267 CA SER A 82 9.498 -6.326 -18.067 1.00 0.00 C ATOM 1268 C SER A 82 8.778 -7.088 -16.916 1.00 0.00 C ATOM 1269 O SER A 82 7.601 -7.442 -17.032 1.00 0.00 O ATOM 1270 CB SER A 82 8.851 -4.947 -18.309 1.00 0.00 C ATOM 1271 OG SER A 82 9.584 -4.168 -19.253 1.00 0.00 O ATOM 0 H SER A 82 8.588 -6.987 -19.851 1.00 0.00 H new ATOM 0 HA SER A 82 10.533 -6.208 -17.746 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.831 -5.084 -18.667 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.788 -4.406 -17.365 1.00 0.00 H new ATOM 0 HG SER A 82 9.219 -3.259 -19.281 1.00 0.00 H new ATOM 1277 N VAL A 83 9.495 -7.306 -15.801 1.00 0.00 N ATOM 1278 CA VAL A 83 8.939 -7.938 -14.565 1.00 0.00 C ATOM 1279 C VAL A 83 8.938 -6.840 -13.450 1.00 0.00 C ATOM 1280 O VAL A 83 10.005 -6.336 -13.078 1.00 0.00 O ATOM 1281 CB VAL A 83 9.773 -9.201 -14.141 1.00 0.00 C ATOM 1282 CG1 VAL A 83 9.225 -9.892 -12.869 1.00 0.00 C ATOM 1283 CG2 VAL A 83 9.881 -10.297 -15.225 1.00 0.00 C ATOM 0 H VAL A 83 10.480 -7.053 -15.718 1.00 0.00 H new ATOM 0 HA VAL A 83 7.925 -8.299 -14.740 1.00 0.00 H new ATOM 0 HB VAL A 83 10.760 -8.775 -13.960 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.844 -10.756 -12.629 1.00 0.00 H new ATOM 0 HG12 VAL A 83 9.244 -9.189 -12.036 1.00 0.00 H new ATOM 0 HG13 VAL A 83 8.200 -10.218 -13.045 1.00 0.00 H new ATOM 0 HG21 VAL A 83 10.473 -11.129 -14.844 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.883 -10.651 -15.485 1.00 0.00 H new ATOM 0 HG23 VAL A 83 10.362 -9.885 -16.112 1.00 0.00 H new ATOM 1293 N VAL A 84 7.759 -6.462 -12.915 1.00 0.00 N ATOM 1294 CA VAL A 84 7.647 -5.289 -11.991 1.00 0.00 C ATOM 1295 C VAL A 84 7.097 -5.776 -10.612 1.00 0.00 C ATOM 1296 O VAL A 84 5.883 -5.910 -10.420 1.00 0.00 O ATOM 1297 CB VAL A 84 6.846 -4.115 -12.654 1.00 0.00 C ATOM 1298 CG1 VAL A 84 6.841 -2.847 -11.771 1.00 0.00 C ATOM 1299 CG2 VAL A 84 7.379 -3.686 -14.039 1.00 0.00 C ATOM 0 H VAL A 84 6.875 -6.938 -13.097 1.00 0.00 H new ATOM 0 HA VAL A 84 8.629 -4.857 -11.795 1.00 0.00 H new ATOM 0 HB VAL A 84 5.843 -4.526 -12.769 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.275 -2.059 -12.269 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.379 -3.074 -10.810 1.00 0.00 H new ATOM 0 HG13 VAL A 84 7.866 -2.512 -11.610 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.769 -2.870 -14.427 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.413 -3.353 -13.944 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.332 -4.532 -14.725 1.00 0.00 H new ATOM 1309 N SER A 85 8.011 -6.052 -9.664 1.00 0.00 N ATOM 1310 CA SER A 85 7.688 -6.733 -8.380 1.00 0.00 C ATOM 1311 C SER A 85 7.890 -5.783 -7.159 1.00 0.00 C ATOM 1312 O SER A 85 8.955 -5.179 -6.988 1.00 0.00 O ATOM 1313 CB SER A 85 8.602 -7.978 -8.249 1.00 0.00 C ATOM 1314 OG SER A 85 8.309 -8.955 -9.250 1.00 0.00 O ATOM 0 H SER A 85 8.998 -5.812 -9.759 1.00 0.00 H new ATOM 0 HA SER A 85 6.639 -7.028 -8.385 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.645 -7.674 -8.331 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.476 -8.420 -7.261 1.00 0.00 H new ATOM 0 HG SER A 85 8.904 -9.725 -9.139 1.00 0.00 H new ATOM 1320 N LEU A 86 6.888 -5.693 -6.265 1.00 0.00 N ATOM 1321 CA LEU A 86 7.037 -4.981 -4.963 1.00 0.00 C ATOM 1322 C LEU A 86 7.654 -5.934 -3.886 1.00 0.00 C ATOM 1323 O LEU A 86 7.003 -6.874 -3.421 1.00 0.00 O ATOM 1324 CB LEU A 86 5.668 -4.382 -4.535 1.00 0.00 C ATOM 1325 CG LEU A 86 5.701 -3.121 -3.633 1.00 0.00 C ATOM 1326 CD1 LEU A 86 4.268 -2.630 -3.382 1.00 0.00 C ATOM 1327 CD2 LEU A 86 6.391 -3.315 -2.276 1.00 0.00 C ATOM 0 H LEU A 86 5.965 -6.101 -6.412 1.00 0.00 H new ATOM 0 HA LEU A 86 7.733 -4.149 -5.071 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.108 -4.138 -5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.108 -5.157 -4.013 1.00 0.00 H new ATOM 0 HG LEU A 86 6.296 -2.391 -4.182 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.293 -1.744 -2.748 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.796 -2.383 -4.333 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.696 -3.415 -2.887 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.364 -2.380 -1.717 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.872 -4.090 -1.712 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.427 -3.614 -2.434 1.00 0.00 H new ATOM 1339 N ASP A 87 8.916 -5.689 -3.500 1.00 0.00 N ATOM 1340 CA ASP A 87 9.661 -6.559 -2.537 1.00 0.00 C ATOM 1341 C ASP A 87 9.555 -6.197 -1.006 1.00 0.00 C ATOM 1342 O ASP A 87 9.876 -7.046 -0.171 1.00 0.00 O ATOM 1343 CB ASP A 87 11.112 -6.599 -3.095 1.00 0.00 C ATOM 1344 CG ASP A 87 12.086 -7.569 -2.424 1.00 0.00 C ATOM 1345 OD1 ASP A 87 13.045 -7.199 -1.753 1.00 0.00 O ATOM 1346 OD2 ASP A 87 11.779 -8.876 -2.676 1.00 0.00 O ATOM 0 H ASP A 87 9.457 -4.892 -3.836 1.00 0.00 H new ATOM 0 HA ASP A 87 9.199 -7.545 -2.498 1.00 0.00 H new ATOM 0 HB2 ASP A 87 11.061 -6.849 -4.155 1.00 0.00 H new ATOM 0 HB3 ASP A 87 11.530 -5.595 -3.024 1.00 0.00 H new ATOM 1352 N GLY A 88 9.112 -4.987 -0.630 1.00 0.00 N ATOM 1353 CA GLY A 88 8.903 -4.607 0.795 1.00 0.00 C ATOM 1354 C GLY A 88 8.466 -3.136 0.914 1.00 0.00 C ATOM 1355 O GLY A 88 7.272 -2.842 0.847 1.00 0.00 O ATOM 0 H GLY A 88 8.887 -4.243 -1.291 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.146 -5.252 1.240 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.825 -4.763 1.356 1.00 0.00 H new ATOM 1359 N ASP A 89 9.432 -2.210 1.000 1.00 0.00 N ATOM 1360 CA ASP A 89 9.199 -0.769 0.654 1.00 0.00 C ATOM 1361 C ASP A 89 9.749 -0.342 -0.763 1.00 0.00 C ATOM 1362 O ASP A 89 10.209 0.795 -0.920 1.00 0.00 O ATOM 1363 CB ASP A 89 9.730 0.099 1.837 1.00 0.00 C ATOM 1364 CG ASP A 89 11.244 0.122 2.087 1.00 0.00 C ATOM 1365 OD1 ASP A 89 11.775 -0.399 3.063 1.00 0.00 O ATOM 1366 OD2 ASP A 89 11.920 0.778 1.096 1.00 0.00 O ATOM 0 H ASP A 89 10.384 -2.415 1.303 1.00 0.00 H new ATOM 0 HA ASP A 89 8.129 -0.599 0.538 1.00 0.00 H new ATOM 0 HB2 ASP A 89 9.403 1.125 1.672 1.00 0.00 H new ATOM 0 HB3 ASP A 89 9.245 -0.247 2.750 1.00 0.00 H new ATOM 1372 N LYS A 90 9.753 -1.250 -1.761 1.00 0.00 N ATOM 1373 CA LYS A 90 10.614 -1.138 -2.973 1.00 0.00 C ATOM 1374 C LYS A 90 9.868 -1.729 -4.214 1.00 0.00 C ATOM 1375 O LYS A 90 9.643 -2.943 -4.284 1.00 0.00 O ATOM 1376 CB LYS A 90 11.962 -1.898 -2.761 1.00 0.00 C ATOM 1377 CG LYS A 90 12.872 -1.437 -1.595 1.00 0.00 C ATOM 1378 CD LYS A 90 14.257 -2.119 -1.527 1.00 0.00 C ATOM 1379 CE LYS A 90 14.251 -3.609 -1.131 1.00 0.00 C ATOM 1380 NZ LYS A 90 14.106 -4.489 -2.310 1.00 0.00 N ATOM 0 H LYS A 90 9.163 -2.082 -1.756 1.00 0.00 H new ATOM 0 HA LYS A 90 10.829 -0.084 -3.147 1.00 0.00 H new ATOM 0 HB2 LYS A 90 11.732 -2.953 -2.611 1.00 0.00 H new ATOM 0 HB3 LYS A 90 12.537 -1.825 -3.684 1.00 0.00 H new ATOM 0 HG2 LYS A 90 13.020 -0.360 -1.675 1.00 0.00 H new ATOM 0 HG3 LYS A 90 12.350 -1.618 -0.655 1.00 0.00 H new ATOM 0 HD2 LYS A 90 14.737 -2.023 -2.501 1.00 0.00 H new ATOM 0 HD3 LYS A 90 14.875 -1.575 -0.812 1.00 0.00 H new ATOM 0 HE2 LYS A 90 15.177 -3.850 -0.609 1.00 0.00 H new ATOM 0 HE3 LYS A 90 13.434 -3.797 -0.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 13.629 -5.370 -2.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 13.541 -4.005 -3.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 15.046 -4.712 -2.695 1.00 0.00 H new ATOM 1393 N LEU A 91 9.524 -0.892 -5.210 1.00 0.00 N ATOM 1394 CA LEU A 91 8.954 -1.345 -6.514 1.00 0.00 C ATOM 1395 C LEU A 91 10.115 -1.605 -7.534 1.00 0.00 C ATOM 1396 O LEU A 91 10.697 -0.665 -8.084 1.00 0.00 O ATOM 1397 CB LEU A 91 7.905 -0.293 -7.024 1.00 0.00 C ATOM 1398 CG LEU A 91 6.416 -0.731 -7.053 1.00 0.00 C ATOM 1399 CD1 LEU A 91 5.514 0.443 -7.476 1.00 0.00 C ATOM 1400 CD2 LEU A 91 6.146 -1.905 -8.012 1.00 0.00 C ATOM 0 H LEU A 91 9.629 0.120 -5.144 1.00 0.00 H new ATOM 0 HA LEU A 91 8.422 -2.289 -6.394 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.984 0.594 -6.396 1.00 0.00 H new ATOM 0 HB3 LEU A 91 8.189 0.005 -8.033 1.00 0.00 H new ATOM 0 HG LEU A 91 6.187 -1.057 -6.038 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.474 0.116 -7.490 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.627 1.263 -6.766 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.801 0.782 -8.471 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.087 -2.161 -7.984 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.423 -1.618 -9.026 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.736 -2.768 -7.705 1.00 0.00 H new ATOM 1412 N VAL A 92 10.478 -2.878 -7.765 1.00 0.00 N ATOM 1413 CA VAL A 92 11.700 -3.252 -8.543 1.00 0.00 C ATOM 1414 C VAL A 92 11.269 -3.629 -9.998 1.00 0.00 C ATOM 1415 O VAL A 92 10.708 -4.702 -10.247 1.00 0.00 O ATOM 1416 CB VAL A 92 12.517 -4.368 -7.797 1.00 0.00 C ATOM 1417 CG1 VAL A 92 13.830 -4.732 -8.532 1.00 0.00 C ATOM 1418 CG2 VAL A 92 12.909 -4.003 -6.341 1.00 0.00 C ATOM 0 H VAL A 92 9.946 -3.680 -7.426 1.00 0.00 H new ATOM 0 HA VAL A 92 12.388 -2.410 -8.620 1.00 0.00 H new ATOM 0 HB VAL A 92 11.827 -5.212 -7.784 1.00 0.00 H new ATOM 0 HG11 VAL A 92 14.356 -5.507 -7.975 1.00 0.00 H new ATOM 0 HG12 VAL A 92 13.598 -5.098 -9.532 1.00 0.00 H new ATOM 0 HG13 VAL A 92 14.462 -3.847 -8.607 1.00 0.00 H new ATOM 0 HG21 VAL A 92 13.470 -4.826 -5.898 1.00 0.00 H new ATOM 0 HG22 VAL A 92 13.526 -3.104 -6.345 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.007 -3.822 -5.756 1.00 0.00 H new ATOM 1428 N HIS A 93 11.544 -2.722 -10.952 1.00 0.00 N ATOM 1429 CA HIS A 93 11.202 -2.913 -12.388 1.00 0.00 C ATOM 1430 C HIS A 93 12.423 -3.497 -13.164 1.00 0.00 C ATOM 1431 O HIS A 93 13.341 -2.760 -13.525 1.00 0.00 O ATOM 1432 CB HIS A 93 10.726 -1.525 -12.901 1.00 0.00 C ATOM 1433 CG HIS A 93 10.162 -1.411 -14.323 1.00 0.00 C ATOM 1434 ND1 HIS A 93 10.529 -2.189 -15.413 1.00 0.00 N ATOM 1435 CD2 HIS A 93 9.177 -0.484 -14.699 1.00 0.00 C ATOM 1436 CE1 HIS A 93 9.694 -1.660 -16.358 1.00 0.00 C ATOM 1437 NE2 HIS A 93 8.884 -0.607 -16.043 1.00 0.00 N ATOM 0 H HIS A 93 12.009 -1.835 -10.758 1.00 0.00 H new ATOM 0 HA HIS A 93 10.406 -3.642 -12.543 1.00 0.00 H new ATOM 0 HB2 HIS A 93 9.961 -1.165 -12.214 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.570 -0.839 -12.826 1.00 0.00 H new ATOM 0 HD1 HIS A 93 11.219 -2.936 -15.487 1.00 0.00 H new ATOM 0 HD2 HIS A 93 8.713 0.226 -14.031 1.00 0.00 H new ATOM 0 HE1 HIS A 93 9.675 -2.076 -17.355 1.00 0.00 H new ATOM 1445 N ILE A 94 12.410 -4.811 -13.430 1.00 0.00 N ATOM 1446 CA ILE A 94 13.476 -5.517 -14.207 1.00 0.00 C ATOM 1447 C ILE A 94 13.099 -5.481 -15.727 1.00 0.00 C ATOM 1448 O ILE A 94 12.053 -6.019 -16.091 1.00 0.00 O ATOM 1449 CB ILE A 94 13.641 -6.991 -13.671 1.00 0.00 C ATOM 1450 CG1 ILE A 94 14.093 -7.087 -12.181 1.00 0.00 C ATOM 1451 CG2 ILE A 94 14.605 -7.839 -14.545 1.00 0.00 C ATOM 1452 CD1 ILE A 94 13.795 -8.436 -11.499 1.00 0.00 C ATOM 0 H ILE A 94 11.662 -5.430 -13.117 1.00 0.00 H new ATOM 0 HA ILE A 94 14.437 -5.019 -14.081 1.00 0.00 H new ATOM 0 HB ILE A 94 12.633 -7.400 -13.737 1.00 0.00 H new ATOM 0 HG12 ILE A 94 15.165 -6.899 -12.129 1.00 0.00 H new ATOM 0 HG13 ILE A 94 13.603 -6.294 -11.616 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.682 -8.844 -14.131 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.220 -7.894 -15.563 1.00 0.00 H new ATOM 0 HG23 ILE A 94 15.591 -7.374 -14.555 1.00 0.00 H new ATOM 0 HD11 ILE A 94 14.145 -8.407 -10.467 1.00 0.00 H new ATOM 0 HD12 ILE A 94 12.721 -8.621 -11.513 1.00 0.00 H new ATOM 0 HD13 ILE A 94 14.308 -9.235 -12.034 1.00 0.00 H new ATOM 1464 N GLN A 95 13.959 -4.937 -16.611 1.00 0.00 N ATOM 1465 CA GLN A 95 13.742 -4.979 -18.092 1.00 0.00 C ATOM 1466 C GLN A 95 14.796 -5.908 -18.780 1.00 0.00 C ATOM 1467 O GLN A 95 16.004 -5.682 -18.655 1.00 0.00 O ATOM 1468 CB GLN A 95 13.792 -3.547 -18.695 1.00 0.00 C ATOM 1469 CG GLN A 95 12.673 -2.585 -18.227 1.00 0.00 C ATOM 1470 CD GLN A 95 12.592 -1.247 -18.975 1.00 0.00 C ATOM 1471 OE1 GLN A 95 13.583 -0.589 -19.284 1.00 0.00 O ATOM 1472 NE2 GLN A 95 11.410 -0.778 -19.289 1.00 0.00 N ATOM 0 H GLN A 95 14.817 -4.459 -16.335 1.00 0.00 H new ATOM 0 HA GLN A 95 12.751 -5.393 -18.280 1.00 0.00 H new ATOM 0 HB2 GLN A 95 14.756 -3.102 -18.448 1.00 0.00 H new ATOM 0 HB3 GLN A 95 13.747 -3.628 -19.781 1.00 0.00 H new ATOM 0 HG2 GLN A 95 11.715 -3.095 -18.327 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.816 -2.379 -17.166 1.00 0.00 H new ATOM 0 HE21 GLN A 95 10.571 -1.304 -19.044 1.00 0.00 H new ATOM 0 HE22 GLN A 95 11.328 0.113 -19.778 1.00 0.00 H new ATOM 1481 N LYS A 96 14.327 -6.925 -19.526 1.00 0.00 N ATOM 1482 CA LYS A 96 15.197 -7.944 -20.191 1.00 0.00 C ATOM 1483 C LYS A 96 15.099 -7.790 -21.748 1.00 0.00 C ATOM 1484 O LYS A 96 14.013 -7.955 -22.316 1.00 0.00 O ATOM 1485 CB LYS A 96 14.705 -9.361 -19.767 1.00 0.00 C ATOM 1486 CG LYS A 96 14.713 -9.718 -18.258 1.00 0.00 C ATOM 1487 CD LYS A 96 13.810 -10.934 -17.952 1.00 0.00 C ATOM 1488 CE LYS A 96 13.594 -11.230 -16.458 1.00 0.00 C ATOM 1489 NZ LYS A 96 14.769 -11.870 -15.837 1.00 0.00 N ATOM 0 H LYS A 96 13.332 -7.074 -19.692 1.00 0.00 H new ATOM 0 HA LYS A 96 16.236 -7.804 -19.892 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.685 -9.483 -20.133 1.00 0.00 H new ATOM 0 HB3 LYS A 96 15.320 -10.096 -20.286 1.00 0.00 H new ATOM 0 HG2 LYS A 96 15.733 -9.934 -17.941 1.00 0.00 H new ATOM 0 HG3 LYS A 96 14.374 -8.859 -17.679 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.838 -10.771 -18.418 1.00 0.00 H new ATOM 0 HD3 LYS A 96 14.245 -11.816 -18.422 1.00 0.00 H new ATOM 0 HE2 LYS A 96 13.371 -10.300 -15.935 1.00 0.00 H new ATOM 0 HE3 LYS A 96 12.726 -11.878 -16.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 14.569 -12.065 -14.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 14.978 -12.762 -16.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 15.589 -11.234 -15.909 1.00 0.00 H new ATOM 1502 N TRP A 97 16.204 -7.473 -22.455 1.00 0.00 N ATOM 1503 CA TRP A 97 16.173 -7.192 -23.924 1.00 0.00 C ATOM 1504 C TRP A 97 17.523 -7.574 -24.608 1.00 0.00 C ATOM 1505 O TRP A 97 18.582 -7.105 -24.188 1.00 0.00 O ATOM 1506 CB TRP A 97 15.740 -5.718 -24.214 1.00 0.00 C ATOM 1507 CG TRP A 97 16.773 -4.590 -24.059 1.00 0.00 C ATOM 1508 CD1 TRP A 97 17.343 -3.890 -25.142 1.00 0.00 C ATOM 1509 CD2 TRP A 97 17.391 -4.089 -22.925 1.00 0.00 C ATOM 1510 NE1 TRP A 97 18.282 -2.935 -24.712 1.00 0.00 N ATOM 1511 CE2 TRP A 97 18.327 -3.110 -23.341 1.00 0.00 C ATOM 1512 CE3 TRP A 97 17.223 -4.374 -21.546 1.00 0.00 C ATOM 1513 CZ2 TRP A 97 19.068 -2.385 -22.385 1.00 0.00 C ATOM 1514 CZ3 TRP A 97 18.003 -3.683 -20.621 1.00 0.00 C ATOM 1515 CH2 TRP A 97 18.913 -2.700 -21.032 1.00 0.00 C ATOM 0 H TRP A 97 17.134 -7.403 -22.041 1.00 0.00 H new ATOM 0 HA TRP A 97 15.412 -7.830 -24.372 1.00 0.00 H new ATOM 0 HB2 TRP A 97 15.365 -5.681 -25.237 1.00 0.00 H new ATOM 0 HB3 TRP A 97 14.901 -5.487 -23.558 1.00 0.00 H new ATOM 0 HD1 TRP A 97 17.089 -4.066 -26.177 1.00 0.00 H new ATOM 0 HE1 TRP A 97 18.807 -2.269 -25.279 1.00 0.00 H new ATOM 0 HE3 TRP A 97 16.505 -5.112 -21.219 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 19.743 -1.600 -22.693 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 17.905 -3.909 -19.569 1.00 0.00 H new ATOM 0 HH2 TRP A 97 19.503 -2.178 -20.293 1.00 0.00 H new ATOM 1526 N ASP A 98 17.506 -8.391 -25.682 1.00 0.00 N ATOM 1527 CA ASP A 98 18.740 -8.728 -26.482 1.00 0.00 C ATOM 1528 C ASP A 98 19.958 -9.365 -25.703 1.00 0.00 C ATOM 1529 O ASP A 98 21.120 -9.125 -26.046 1.00 0.00 O ATOM 1530 CB ASP A 98 19.151 -7.491 -27.345 1.00 0.00 C ATOM 1531 CG ASP A 98 18.176 -7.129 -28.464 1.00 0.00 C ATOM 1532 OD1 ASP A 98 18.128 -7.715 -29.540 1.00 0.00 O ATOM 1533 OD2 ASP A 98 17.354 -6.096 -28.128 1.00 0.00 O ATOM 0 H ASP A 98 16.658 -8.839 -26.029 1.00 0.00 H new ATOM 0 HA ASP A 98 18.446 -9.559 -27.123 1.00 0.00 H new ATOM 0 HB2 ASP A 98 19.261 -6.629 -26.687 1.00 0.00 H new ATOM 0 HB3 ASP A 98 20.130 -7.683 -27.785 1.00 0.00 H new ATOM 1539 N GLY A 99 19.708 -10.161 -24.643 1.00 0.00 N ATOM 1540 CA GLY A 99 20.763 -10.496 -23.638 1.00 0.00 C ATOM 1541 C GLY A 99 21.015 -9.501 -22.469 1.00 0.00 C ATOM 1542 O GLY A 99 21.490 -9.923 -21.414 1.00 0.00 O ATOM 0 H GLY A 99 18.799 -10.584 -24.453 1.00 0.00 H new ATOM 0 HA2 GLY A 99 20.511 -11.463 -23.202 1.00 0.00 H new ATOM 0 HA3 GLY A 99 21.704 -10.623 -24.174 1.00 0.00 H new ATOM 1546 N LYS A 100 20.739 -8.199 -22.648 1.00 0.00 N ATOM 1547 CA LYS A 100 20.966 -7.147 -21.624 1.00 0.00 C ATOM 1548 C LYS A 100 19.817 -7.096 -20.567 1.00 0.00 C ATOM 1549 O LYS A 100 18.629 -7.230 -20.886 1.00 0.00 O ATOM 1550 CB LYS A 100 21.094 -5.777 -22.348 1.00 0.00 C ATOM 1551 CG LYS A 100 22.348 -5.596 -23.239 1.00 0.00 C ATOM 1552 CD LYS A 100 22.353 -4.281 -24.052 1.00 0.00 C ATOM 1553 CE LYS A 100 21.486 -4.299 -25.328 1.00 0.00 C ATOM 1554 NZ LYS A 100 22.101 -5.103 -26.407 1.00 0.00 N ATOM 0 H LYS A 100 20.347 -7.835 -23.516 1.00 0.00 H new ATOM 0 HA LYS A 100 21.882 -7.381 -21.081 1.00 0.00 H new ATOM 0 HB2 LYS A 100 20.209 -5.631 -22.967 1.00 0.00 H new ATOM 0 HB3 LYS A 100 21.090 -4.989 -21.595 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.237 -5.626 -22.609 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.417 -6.438 -23.928 1.00 0.00 H new ATOM 0 HD2 LYS A 100 22.008 -3.472 -23.408 1.00 0.00 H new ATOM 0 HD3 LYS A 100 23.380 -4.049 -24.332 1.00 0.00 H new ATOM 0 HE2 LYS A 100 20.502 -4.703 -25.091 1.00 0.00 H new ATOM 0 HE3 LYS A 100 21.336 -3.278 -25.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 21.485 -5.088 -27.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 23.029 -4.703 -26.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 22.221 -6.084 -26.083 1.00 0.00 H new ATOM 1567 N GLU A 101 20.194 -6.879 -19.299 1.00 0.00 N ATOM 1568 CA GLU A 101 19.233 -6.791 -18.166 1.00 0.00 C ATOM 1569 C GLU A 101 19.531 -5.525 -17.307 1.00 0.00 C ATOM 1570 O GLU A 101 20.653 -5.328 -16.828 1.00 0.00 O ATOM 1571 CB GLU A 101 19.291 -8.111 -17.351 1.00 0.00 C ATOM 1572 CG GLU A 101 18.180 -8.250 -16.279 1.00 0.00 C ATOM 1573 CD GLU A 101 18.166 -9.601 -15.571 1.00 0.00 C ATOM 1574 OE1 GLU A 101 17.335 -10.474 -15.804 1.00 0.00 O ATOM 1575 OE2 GLU A 101 19.173 -9.715 -14.656 1.00 0.00 O ATOM 0 H GLU A 101 21.168 -6.759 -19.020 1.00 0.00 H new ATOM 0 HA GLU A 101 18.213 -6.678 -18.533 1.00 0.00 H new ATOM 0 HB2 GLU A 101 19.222 -8.953 -18.040 1.00 0.00 H new ATOM 0 HB3 GLU A 101 20.262 -8.179 -16.861 1.00 0.00 H new ATOM 0 HG2 GLU A 101 18.306 -7.463 -15.535 1.00 0.00 H new ATOM 0 HG3 GLU A 101 17.211 -8.089 -16.752 1.00 0.00 H new ATOM 1583 N THR A 102 18.502 -4.693 -17.089 1.00 0.00 N ATOM 1584 CA THR A 102 18.566 -3.536 -16.150 1.00 0.00 C ATOM 1585 C THR A 102 17.460 -3.651 -15.055 1.00 0.00 C ATOM 1586 O THR A 102 16.419 -4.279 -15.283 1.00 0.00 O ATOM 1587 CB THR A 102 18.530 -2.196 -16.948 1.00 0.00 C ATOM 1588 OG1 THR A 102 19.076 -1.196 -16.114 1.00 0.00 O ATOM 1589 CG2 THR A 102 17.177 -1.676 -17.456 1.00 0.00 C ATOM 0 H THR A 102 17.599 -4.793 -17.552 1.00 0.00 H new ATOM 0 HA THR A 102 19.514 -3.548 -15.612 1.00 0.00 H new ATOM 0 HB THR A 102 19.086 -2.418 -17.859 1.00 0.00 H new ATOM 0 HG1 THR A 102 19.586 -1.616 -15.390 1.00 0.00 H new ATOM 0 HG21 THR A 102 17.325 -0.737 -17.989 1.00 0.00 H new ATOM 0 HG22 THR A 102 16.735 -2.410 -18.129 1.00 0.00 H new ATOM 0 HG23 THR A 102 16.510 -1.511 -16.610 1.00 0.00 H new ATOM 1597 N ASN A 103 17.648 -3.011 -13.884 1.00 0.00 N ATOM 1598 CA ASN A 103 16.562 -2.896 -12.863 1.00 0.00 C ATOM 1599 C ASN A 103 16.416 -1.472 -12.233 1.00 0.00 C ATOM 1600 O ASN A 103 17.396 -0.736 -12.067 1.00 0.00 O ATOM 1601 CB ASN A 103 16.588 -4.080 -11.857 1.00 0.00 C ATOM 1602 CG ASN A 103 17.697 -4.106 -10.804 1.00 0.00 C ATOM 1603 OD1 ASN A 103 17.591 -3.507 -9.741 1.00 0.00 O ATOM 1604 ND2 ASN A 103 18.772 -4.817 -11.044 1.00 0.00 N ATOM 0 H ASN A 103 18.526 -2.568 -13.614 1.00 0.00 H new ATOM 0 HA ASN A 103 15.617 -3.000 -13.397 1.00 0.00 H new ATOM 0 HB2 ASN A 103 15.632 -4.095 -11.334 1.00 0.00 H new ATOM 0 HB3 ASN A 103 16.652 -5.004 -12.431 1.00 0.00 H new ATOM 0 HD21 ASN A 103 19.515 -4.869 -10.347 1.00 0.00 H new ATOM 0 HD22 ASN A 103 18.865 -5.318 -11.928 1.00 0.00 H new ATOM 1611 N PHE A 104 15.166 -1.085 -11.903 1.00 0.00 N ATOM 1612 CA PHE A 104 14.841 0.271 -11.379 1.00 0.00 C ATOM 1613 C PHE A 104 14.205 0.094 -9.968 1.00 0.00 C ATOM 1614 O PHE A 104 13.051 -0.335 -9.855 1.00 0.00 O ATOM 1615 CB PHE A 104 13.902 1.083 -12.331 1.00 0.00 C ATOM 1616 CG PHE A 104 14.137 1.090 -13.861 1.00 0.00 C ATOM 1617 CD1 PHE A 104 15.417 1.213 -14.413 1.00 0.00 C ATOM 1618 CD2 PHE A 104 13.036 0.987 -14.722 1.00 0.00 C ATOM 1619 CE1 PHE A 104 15.591 1.228 -15.795 1.00 0.00 C ATOM 1620 CE2 PHE A 104 13.212 1.002 -16.102 1.00 0.00 C ATOM 1621 CZ PHE A 104 14.489 1.129 -16.637 1.00 0.00 C ATOM 0 H PHE A 104 14.353 -1.695 -11.989 1.00 0.00 H new ATOM 0 HA PHE A 104 15.758 0.857 -11.316 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.887 0.721 -12.165 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.929 2.121 -11.998 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.276 1.297 -13.763 1.00 0.00 H new ATOM 0 HD2 PHE A 104 12.042 0.895 -14.310 1.00 0.00 H new ATOM 0 HE1 PHE A 104 16.583 1.317 -16.213 1.00 0.00 H new ATOM 0 HE2 PHE A 104 12.358 0.915 -16.757 1.00 0.00 H new ATOM 0 HZ PHE A 104 14.625 1.151 -17.708 1.00 0.00 H new ATOM 1631 N VAL A 105 14.952 0.415 -8.901 1.00 0.00 N ATOM 1632 CA VAL A 105 14.508 0.189 -7.493 1.00 0.00 C ATOM 1633 C VAL A 105 13.768 1.475 -7.005 1.00 0.00 C ATOM 1634 O VAL A 105 14.395 2.459 -6.602 1.00 0.00 O ATOM 1635 CB VAL A 105 15.722 -0.230 -6.589 1.00 0.00 C ATOM 1636 CG1 VAL A 105 15.334 -0.442 -5.105 1.00 0.00 C ATOM 1637 CG2 VAL A 105 16.442 -1.519 -7.058 1.00 0.00 C ATOM 0 H VAL A 105 15.878 0.837 -8.975 1.00 0.00 H new ATOM 0 HA VAL A 105 13.807 -0.643 -7.429 1.00 0.00 H new ATOM 0 HB VAL A 105 16.398 0.620 -6.686 1.00 0.00 H new ATOM 0 HG11 VAL A 105 16.218 -0.730 -4.535 1.00 0.00 H new ATOM 0 HG12 VAL A 105 14.927 0.484 -4.700 1.00 0.00 H new ATOM 0 HG13 VAL A 105 14.584 -1.230 -5.034 1.00 0.00 H new ATOM 0 HG21 VAL A 105 17.268 -1.741 -6.382 1.00 0.00 H new ATOM 0 HG22 VAL A 105 15.737 -2.351 -7.055 1.00 0.00 H new ATOM 0 HG23 VAL A 105 16.828 -1.374 -8.067 1.00 0.00 H new ATOM 1647 N ARG A 106 12.428 1.455 -7.056 1.00 0.00 N ATOM 1648 CA ARG A 106 11.570 2.622 -6.708 1.00 0.00 C ATOM 1649 C ARG A 106 11.188 2.533 -5.205 1.00 0.00 C ATOM 1650 O ARG A 106 10.284 1.774 -4.851 1.00 0.00 O ATOM 1651 CB ARG A 106 10.333 2.585 -7.657 1.00 0.00 C ATOM 1652 CG ARG A 106 10.645 2.851 -9.149 1.00 0.00 C ATOM 1653 CD ARG A 106 9.503 2.475 -10.109 1.00 0.00 C ATOM 1654 NE ARG A 106 10.014 2.650 -11.496 1.00 0.00 N ATOM 1655 CZ ARG A 106 9.276 2.753 -12.598 1.00 0.00 C ATOM 1656 NH1 ARG A 106 7.976 2.624 -12.609 1.00 0.00 N ATOM 1657 NH2 ARG A 106 9.879 2.992 -13.727 1.00 0.00 N ATOM 0 H ARG A 106 11.897 0.632 -7.339 1.00 0.00 H new ATOM 0 HA ARG A 106 12.081 3.575 -6.846 1.00 0.00 H new ATOM 0 HB2 ARG A 106 9.856 1.609 -7.570 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.609 3.325 -7.315 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.879 3.908 -9.277 1.00 0.00 H new ATOM 0 HG3 ARG A 106 11.538 2.291 -9.427 1.00 0.00 H new ATOM 0 HD2 ARG A 106 9.185 1.445 -9.944 1.00 0.00 H new ATOM 0 HD3 ARG A 106 8.633 3.108 -9.937 1.00 0.00 H new ATOM 0 HE ARG A 106 11.026 2.695 -11.613 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.475 2.434 -11.741 1.00 0.00 H new ATOM 0 HH12 ARG A 106 7.462 2.713 -13.486 1.00 0.00 H new ATOM 0 HH21 ARG A 106 10.893 3.095 -13.751 1.00 0.00 H new ATOM 0 HH22 ARG A 106 9.337 3.076 -14.587 1.00 0.00 H new ATOM 1671 N GLU A 107 11.900 3.248 -4.315 1.00 0.00 N ATOM 1672 CA GLU A 107 11.771 3.042 -2.842 1.00 0.00 C ATOM 1673 C GLU A 107 11.233 4.298 -2.092 1.00 0.00 C ATOM 1674 O GLU A 107 11.750 5.405 -2.262 1.00 0.00 O ATOM 1675 CB GLU A 107 13.097 2.443 -2.286 1.00 0.00 C ATOM 1676 CG GLU A 107 14.371 3.329 -2.205 1.00 0.00 C ATOM 1677 CD GLU A 107 14.552 4.168 -0.934 1.00 0.00 C ATOM 1678 OE1 GLU A 107 13.812 4.120 0.045 1.00 0.00 O ATOM 1679 OE2 GLU A 107 15.658 4.964 -1.016 1.00 0.00 O ATOM 0 H GLU A 107 12.569 3.972 -4.578 1.00 0.00 H new ATOM 0 HA GLU A 107 10.991 2.306 -2.647 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.892 2.076 -1.280 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.343 1.575 -2.898 1.00 0.00 H new ATOM 0 HG2 GLU A 107 15.242 2.682 -2.311 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.369 4.005 -3.060 1.00 0.00 H new ATOM 1687 N ILE A 108 10.207 4.120 -1.233 1.00 0.00 N ATOM 1688 CA ILE A 108 9.679 5.218 -0.360 1.00 0.00 C ATOM 1689 C ILE A 108 10.684 5.462 0.817 1.00 0.00 C ATOM 1690 O ILE A 108 10.826 4.607 1.697 1.00 0.00 O ATOM 1691 CB ILE A 108 8.213 4.919 0.130 1.00 0.00 C ATOM 1692 CG1 ILE A 108 7.163 4.676 -0.997 1.00 0.00 C ATOM 1693 CG2 ILE A 108 7.651 5.990 1.104 1.00 0.00 C ATOM 1694 CD1 ILE A 108 6.977 5.808 -2.027 1.00 0.00 C ATOM 0 H ILE A 108 9.721 3.231 -1.117 1.00 0.00 H new ATOM 0 HA ILE A 108 9.604 6.140 -0.937 1.00 0.00 H new ATOM 0 HB ILE A 108 8.349 3.976 0.660 1.00 0.00 H new ATOM 0 HG12 ILE A 108 7.444 3.770 -1.534 1.00 0.00 H new ATOM 0 HG13 ILE A 108 6.199 4.482 -0.527 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.638 5.718 1.399 1.00 0.00 H new ATOM 0 HG22 ILE A 108 8.284 6.045 1.989 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.636 6.961 0.608 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.221 5.516 -2.756 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.657 6.716 -1.516 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.922 5.993 -2.538 1.00 0.00 H new ATOM 1706 N LYS A 109 11.370 6.621 0.818 1.00 0.00 N ATOM 1707 CA LYS A 109 12.453 6.907 1.800 1.00 0.00 C ATOM 1708 C LYS A 109 11.871 7.664 3.038 1.00 0.00 C ATOM 1709 O LYS A 109 11.383 7.018 3.968 1.00 0.00 O ATOM 1710 CB LYS A 109 13.624 7.558 1.003 1.00 0.00 C ATOM 1711 CG LYS A 109 14.926 7.876 1.778 1.00 0.00 C ATOM 1712 CD LYS A 109 15.690 6.659 2.351 1.00 0.00 C ATOM 1713 CE LYS A 109 15.344 6.333 3.816 1.00 0.00 C ATOM 1714 NZ LYS A 109 16.166 5.203 4.289 1.00 0.00 N ATOM 0 H LYS A 109 11.200 7.377 0.155 1.00 0.00 H new ATOM 0 HA LYS A 109 12.886 6.024 2.271 1.00 0.00 H new ATOM 0 HB2 LYS A 109 13.878 6.894 0.176 1.00 0.00 H new ATOM 0 HB3 LYS A 109 13.258 8.487 0.565 1.00 0.00 H new ATOM 0 HG2 LYS A 109 15.597 8.421 1.113 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.680 8.546 2.602 1.00 0.00 H new ATOM 0 HD2 LYS A 109 15.475 5.786 1.735 1.00 0.00 H new ATOM 0 HD3 LYS A 109 16.761 6.847 2.275 1.00 0.00 H new ATOM 0 HE2 LYS A 109 15.518 7.208 4.443 1.00 0.00 H new ATOM 0 HE3 LYS A 109 14.286 6.085 3.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 15.926 4.990 5.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 15.979 4.367 3.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 17.173 5.455 4.223 1.00 0.00 H new ATOM 1727 N ASP A 110 11.854 9.010 3.040 1.00 0.00 N ATOM 1728 CA ASP A 110 11.029 9.809 3.991 1.00 0.00 C ATOM 1729 C ASP A 110 9.791 10.385 3.226 1.00 0.00 C ATOM 1730 O ASP A 110 9.729 11.591 2.958 1.00 0.00 O ATOM 1731 CB ASP A 110 11.981 10.872 4.607 1.00 0.00 C ATOM 1732 CG ASP A 110 11.389 11.748 5.713 1.00 0.00 C ATOM 1733 OD1 ASP A 110 11.758 11.698 6.882 1.00 0.00 O ATOM 1734 OD2 ASP A 110 10.426 12.597 5.243 1.00 0.00 O ATOM 0 H ASP A 110 12.402 9.578 2.394 1.00 0.00 H new ATOM 0 HA ASP A 110 10.608 9.229 4.812 1.00 0.00 H new ATOM 0 HB2 ASP A 110 12.855 10.358 5.008 1.00 0.00 H new ATOM 0 HB3 ASP A 110 12.333 11.522 3.806 1.00 0.00 H new ATOM 1740 N GLY A 111 8.830 9.523 2.844 1.00 0.00 N ATOM 1741 CA GLY A 111 7.727 9.922 1.919 1.00 0.00 C ATOM 1742 C GLY A 111 8.003 9.884 0.391 1.00 0.00 C ATOM 1743 O GLY A 111 7.114 9.515 -0.378 1.00 0.00 O ATOM 0 H GLY A 111 8.786 8.552 3.153 1.00 0.00 H new ATOM 0 HA2 GLY A 111 6.873 9.275 2.120 1.00 0.00 H new ATOM 0 HA3 GLY A 111 7.425 10.937 2.178 1.00 0.00 H new ATOM 1747 N LYS A 112 9.200 10.302 -0.049 1.00 0.00 N ATOM 1748 CA LYS A 112 9.540 10.448 -1.490 1.00 0.00 C ATOM 1749 C LYS A 112 10.012 9.115 -2.150 1.00 0.00 C ATOM 1750 O LYS A 112 10.709 8.301 -1.533 1.00 0.00 O ATOM 1751 CB LYS A 112 10.608 11.566 -1.653 1.00 0.00 C ATOM 1752 CG LYS A 112 10.117 13.004 -1.341 1.00 0.00 C ATOM 1753 CD LYS A 112 10.722 14.109 -2.234 1.00 0.00 C ATOM 1754 CE LYS A 112 12.174 14.540 -1.977 1.00 0.00 C ATOM 1755 NZ LYS A 112 13.158 13.561 -2.484 1.00 0.00 N ATOM 0 H LYS A 112 9.966 10.551 0.577 1.00 0.00 H new ATOM 0 HA LYS A 112 8.628 10.727 -2.018 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.451 11.338 -1.000 1.00 0.00 H new ATOM 0 HB3 LYS A 112 10.982 11.542 -2.677 1.00 0.00 H new ATOM 0 HG2 LYS A 112 9.032 13.031 -1.441 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.347 13.232 -0.300 1.00 0.00 H new ATOM 0 HD2 LYS A 112 10.653 13.775 -3.269 1.00 0.00 H new ATOM 0 HD3 LYS A 112 10.091 14.993 -2.142 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.351 15.506 -2.451 1.00 0.00 H new ATOM 0 HE3 LYS A 112 12.324 14.678 -0.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.120 13.924 -2.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.043 12.660 -1.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.004 13.409 -3.501 1.00 0.00 H new ATOM 1768 N MET A 113 9.652 8.928 -3.433 1.00 0.00 N ATOM 1769 CA MET A 113 10.057 7.732 -4.218 1.00 0.00 C ATOM 1770 C MET A 113 11.482 7.940 -4.821 1.00 0.00 C ATOM 1771 O MET A 113 11.675 8.605 -5.843 1.00 0.00 O ATOM 1772 CB MET A 113 8.945 7.442 -5.260 1.00 0.00 C ATOM 1773 CG MET A 113 9.151 6.181 -6.123 1.00 0.00 C ATOM 1774 SD MET A 113 7.719 5.928 -7.194 1.00 0.00 S ATOM 1775 CE MET A 113 8.114 7.008 -8.583 1.00 0.00 C ATOM 0 H MET A 113 9.079 9.590 -3.956 1.00 0.00 H new ATOM 0 HA MET A 113 10.147 6.845 -3.592 1.00 0.00 H new ATOM 0 HB2 MET A 113 7.995 7.349 -4.734 1.00 0.00 H new ATOM 0 HB3 MET A 113 8.859 8.303 -5.922 1.00 0.00 H new ATOM 0 HG2 MET A 113 10.053 6.286 -6.726 1.00 0.00 H new ATOM 0 HG3 MET A 113 9.295 5.311 -5.482 1.00 0.00 H new ATOM 0 HE1 MET A 113 7.317 6.954 -9.324 1.00 0.00 H new ATOM 0 HE2 MET A 113 8.212 8.034 -8.229 1.00 0.00 H new ATOM 0 HE3 MET A 113 9.053 6.689 -9.036 1.00 0.00 H new ATOM 1785 N VAL A 114 12.494 7.352 -4.174 1.00 0.00 N ATOM 1786 CA VAL A 114 13.902 7.394 -4.658 1.00 0.00 C ATOM 1787 C VAL A 114 14.066 6.221 -5.678 1.00 0.00 C ATOM 1788 O VAL A 114 14.157 5.050 -5.298 1.00 0.00 O ATOM 1789 CB VAL A 114 14.884 7.368 -3.438 1.00 0.00 C ATOM 1790 CG1 VAL A 114 16.375 7.304 -3.838 1.00 0.00 C ATOM 1791 CG2 VAL A 114 14.728 8.586 -2.491 1.00 0.00 C ATOM 0 H VAL A 114 12.374 6.833 -3.304 1.00 0.00 H new ATOM 0 HA VAL A 114 14.150 8.317 -5.182 1.00 0.00 H new ATOM 0 HB VAL A 114 14.598 6.451 -2.923 1.00 0.00 H new ATOM 0 HG11 VAL A 114 16.992 7.289 -2.940 1.00 0.00 H new ATOM 0 HG12 VAL A 114 16.557 6.400 -4.419 1.00 0.00 H new ATOM 0 HG13 VAL A 114 16.629 8.178 -4.438 1.00 0.00 H new ATOM 0 HG21 VAL A 114 15.439 8.501 -1.669 1.00 0.00 H new ATOM 0 HG22 VAL A 114 14.921 9.505 -3.045 1.00 0.00 H new ATOM 0 HG23 VAL A 114 13.714 8.609 -2.092 1.00 0.00 H new ATOM 1801 N MET A 115 14.062 6.549 -6.980 1.00 0.00 N ATOM 1802 CA MET A 115 14.246 5.558 -8.068 1.00 0.00 C ATOM 1803 C MET A 115 15.765 5.364 -8.349 1.00 0.00 C ATOM 1804 O MET A 115 16.376 6.187 -9.034 1.00 0.00 O ATOM 1805 CB MET A 115 13.432 6.068 -9.290 1.00 0.00 C ATOM 1806 CG MET A 115 13.441 5.147 -10.529 1.00 0.00 C ATOM 1807 SD MET A 115 12.847 6.020 -11.995 1.00 0.00 S ATOM 1808 CE MET A 115 11.085 6.177 -11.657 1.00 0.00 C ATOM 0 H MET A 115 13.932 7.504 -7.314 1.00 0.00 H new ATOM 0 HA MET A 115 13.874 4.568 -7.803 1.00 0.00 H new ATOM 0 HB2 MET A 115 12.398 6.218 -8.978 1.00 0.00 H new ATOM 0 HB3 MET A 115 13.821 7.043 -9.582 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.452 4.780 -10.706 1.00 0.00 H new ATOM 0 HG3 MET A 115 12.814 4.275 -10.342 1.00 0.00 H new ATOM 0 HE1 MET A 115 10.589 6.633 -12.514 1.00 0.00 H new ATOM 0 HE2 MET A 115 10.660 5.190 -11.475 1.00 0.00 H new ATOM 0 HE3 MET A 115 10.938 6.803 -10.777 1.00 0.00 H new ATOM 1818 N THR A 116 16.359 4.272 -7.841 1.00 0.00 N ATOM 1819 CA THR A 116 17.774 3.905 -8.145 1.00 0.00 C ATOM 1820 C THR A 116 17.794 2.974 -9.399 1.00 0.00 C ATOM 1821 O THR A 116 17.358 1.820 -9.352 1.00 0.00 O ATOM 1822 CB THR A 116 18.465 3.286 -6.894 1.00 0.00 C ATOM 1823 OG1 THR A 116 18.509 4.240 -5.840 1.00 0.00 O ATOM 1824 CG2 THR A 116 19.927 2.862 -7.122 1.00 0.00 C ATOM 0 H THR A 116 15.889 3.618 -7.215 1.00 0.00 H new ATOM 0 HA THR A 116 18.358 4.793 -8.387 1.00 0.00 H new ATOM 0 HB THR A 116 17.868 2.405 -6.660 1.00 0.00 H new ATOM 0 HG1 THR A 116 18.943 3.842 -5.057 1.00 0.00 H new ATOM 0 HG21 THR A 116 20.332 2.442 -6.201 1.00 0.00 H new ATOM 0 HG22 THR A 116 19.969 2.113 -7.912 1.00 0.00 H new ATOM 0 HG23 THR A 116 20.517 3.731 -7.414 1.00 0.00 H new ATOM 1832 N LEU A 117 18.302 3.494 -10.523 1.00 0.00 N ATOM 1833 CA LEU A 117 18.335 2.776 -11.819 1.00 0.00 C ATOM 1834 C LEU A 117 19.760 2.175 -12.022 1.00 0.00 C ATOM 1835 O LEU A 117 20.731 2.933 -12.069 1.00 0.00 O ATOM 1836 CB LEU A 117 17.963 3.739 -12.988 1.00 0.00 C ATOM 1837 CG LEU A 117 16.673 4.604 -12.930 1.00 0.00 C ATOM 1838 CD1 LEU A 117 16.898 5.955 -12.225 1.00 0.00 C ATOM 1839 CD2 LEU A 117 16.148 4.908 -14.345 1.00 0.00 C ATOM 0 H LEU A 117 18.706 4.430 -10.567 1.00 0.00 H new ATOM 0 HA LEU A 117 17.601 1.970 -11.813 1.00 0.00 H new ATOM 0 HB2 LEU A 117 18.801 4.423 -13.117 1.00 0.00 H new ATOM 0 HB3 LEU A 117 17.902 3.135 -13.893 1.00 0.00 H new ATOM 0 HG LEU A 117 15.951 4.015 -12.363 1.00 0.00 H new ATOM 0 HD11 LEU A 117 15.965 6.519 -12.213 1.00 0.00 H new ATOM 0 HD12 LEU A 117 17.230 5.780 -11.202 1.00 0.00 H new ATOM 0 HD13 LEU A 117 17.658 6.523 -12.761 1.00 0.00 H new ATOM 0 HD21 LEU A 117 15.245 5.514 -14.276 1.00 0.00 H new ATOM 0 HD22 LEU A 117 16.908 5.452 -14.906 1.00 0.00 H new ATOM 0 HD23 LEU A 117 15.919 3.973 -14.857 1.00 0.00 H new ATOM 1851 N THR A 118 19.903 0.843 -12.153 1.00 0.00 N ATOM 1852 CA THR A 118 21.241 0.164 -12.164 1.00 0.00 C ATOM 1853 C THR A 118 21.452 -0.735 -13.433 1.00 0.00 C ATOM 1854 O THR A 118 20.643 -1.625 -13.717 1.00 0.00 O ATOM 1855 CB THR A 118 21.466 -0.571 -10.806 1.00 0.00 C ATOM 1856 OG1 THR A 118 22.777 -1.128 -10.773 1.00 0.00 O ATOM 1857 CG2 THR A 118 20.492 -1.709 -10.456 1.00 0.00 C ATOM 0 H THR A 118 19.116 0.203 -12.254 1.00 0.00 H new ATOM 0 HA THR A 118 22.023 0.918 -12.252 1.00 0.00 H new ATOM 0 HB THR A 118 21.296 0.214 -10.069 1.00 0.00 H new ATOM 0 HG1 THR A 118 22.916 -1.587 -9.919 1.00 0.00 H new ATOM 0 HG21 THR A 118 20.761 -2.133 -9.488 1.00 0.00 H new ATOM 0 HG22 THR A 118 19.476 -1.317 -10.411 1.00 0.00 H new ATOM 0 HG23 THR A 118 20.548 -2.484 -11.220 1.00 0.00 H new ATOM 1865 N PHE A 119 22.538 -0.488 -14.199 1.00 0.00 N ATOM 1866 CA PHE A 119 22.879 -1.259 -15.427 1.00 0.00 C ATOM 1867 C PHE A 119 24.412 -1.572 -15.470 1.00 0.00 C ATOM 1868 O PHE A 119 25.217 -0.753 -15.928 1.00 0.00 O ATOM 1869 CB PHE A 119 22.405 -0.473 -16.690 1.00 0.00 C ATOM 1870 CG PHE A 119 22.603 -1.225 -18.024 1.00 0.00 C ATOM 1871 CD1 PHE A 119 21.968 -2.448 -18.261 1.00 0.00 C ATOM 1872 CD2 PHE A 119 23.510 -0.737 -18.967 1.00 0.00 C ATOM 1873 CE1 PHE A 119 22.249 -3.179 -19.411 1.00 0.00 C ATOM 1874 CE2 PHE A 119 23.795 -1.467 -20.118 1.00 0.00 C ATOM 1875 CZ PHE A 119 23.166 -2.690 -20.338 1.00 0.00 C ATOM 0 H PHE A 119 23.207 0.252 -13.987 1.00 0.00 H new ATOM 0 HA PHE A 119 22.358 -2.216 -15.413 1.00 0.00 H new ATOM 0 HB2 PHE A 119 21.348 -0.232 -16.577 1.00 0.00 H new ATOM 0 HB3 PHE A 119 22.944 0.473 -16.737 1.00 0.00 H new ATOM 0 HD1 PHE A 119 21.254 -2.828 -17.546 1.00 0.00 H new ATOM 0 HD2 PHE A 119 23.994 0.214 -18.802 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.757 -4.124 -19.585 1.00 0.00 H new ATOM 0 HE2 PHE A 119 24.503 -1.085 -20.839 1.00 0.00 H new ATOM 0 HZ PHE A 119 23.390 -3.259 -21.228 1.00 0.00 H new ATOM 1885 N GLY A 120 24.812 -2.780 -15.033 1.00 0.00 N ATOM 1886 CA GLY A 120 26.206 -3.280 -15.211 1.00 0.00 C ATOM 1887 C GLY A 120 27.222 -2.675 -14.223 1.00 0.00 C ATOM 1888 O GLY A 120 27.353 -3.147 -13.093 1.00 0.00 O ATOM 0 H GLY A 120 24.196 -3.436 -14.552 1.00 0.00 H new ATOM 0 HA2 GLY A 120 26.209 -4.364 -15.100 1.00 0.00 H new ATOM 0 HA3 GLY A 120 26.531 -3.063 -16.228 1.00 0.00 H new ATOM 1892 N ASP A 121 27.899 -1.600 -14.649 1.00 0.00 N ATOM 1893 CA ASP A 121 28.580 -0.658 -13.709 1.00 0.00 C ATOM 1894 C ASP A 121 28.170 0.841 -13.982 1.00 0.00 C ATOM 1895 O ASP A 121 29.024 1.733 -13.950 1.00 0.00 O ATOM 1896 CB ASP A 121 30.104 -0.973 -13.807 1.00 0.00 C ATOM 1897 CG ASP A 121 31.000 -0.431 -12.690 1.00 0.00 C ATOM 1898 OD1 ASP A 121 31.620 -1.156 -11.917 1.00 0.00 O ATOM 1899 OD2 ASP A 121 31.051 0.933 -12.673 1.00 0.00 O ATOM 0 H ASP A 121 27.998 -1.349 -15.633 1.00 0.00 H new ATOM 0 HA ASP A 121 28.267 -0.799 -12.675 1.00 0.00 H new ATOM 0 HB2 ASP A 121 30.224 -2.056 -13.842 1.00 0.00 H new ATOM 0 HB3 ASP A 121 30.471 -0.581 -14.756 1.00 0.00 H new ATOM 1905 N VAL A 122 26.872 1.124 -14.225 1.00 0.00 N ATOM 1906 CA VAL A 122 26.355 2.488 -14.557 1.00 0.00 C ATOM 1907 C VAL A 122 25.042 2.673 -13.730 1.00 0.00 C ATOM 1908 O VAL A 122 24.076 1.917 -13.896 1.00 0.00 O ATOM 1909 CB VAL A 122 26.126 2.684 -16.102 1.00 0.00 C ATOM 1910 CG1 VAL A 122 25.569 4.084 -16.462 1.00 0.00 C ATOM 1911 CG2 VAL A 122 27.414 2.518 -16.944 1.00 0.00 C ATOM 0 H VAL A 122 26.141 0.414 -14.198 1.00 0.00 H new ATOM 0 HA VAL A 122 27.086 3.252 -14.294 1.00 0.00 H new ATOM 0 HB VAL A 122 25.406 1.901 -16.341 1.00 0.00 H new ATOM 0 HG11 VAL A 122 25.434 4.155 -17.541 1.00 0.00 H new ATOM 0 HG12 VAL A 122 24.610 4.233 -15.965 1.00 0.00 H new ATOM 0 HG13 VAL A 122 26.271 4.850 -16.133 1.00 0.00 H new ATOM 0 HG21 VAL A 122 27.181 2.667 -17.998 1.00 0.00 H new ATOM 0 HG22 VAL A 122 28.153 3.255 -16.628 1.00 0.00 H new ATOM 0 HG23 VAL A 122 27.817 1.516 -16.799 1.00 0.00 H new ATOM 1921 N VAL A 123 25.011 3.678 -12.836 1.00 0.00 N ATOM 1922 CA VAL A 123 23.862 3.904 -11.907 1.00 0.00 C ATOM 1923 C VAL A 123 23.334 5.368 -12.080 1.00 0.00 C ATOM 1924 O VAL A 123 24.101 6.333 -12.010 1.00 0.00 O ATOM 1925 CB VAL A 123 24.227 3.558 -10.416 1.00 0.00 C ATOM 1926 CG1 VAL A 123 23.026 3.710 -9.449 1.00 0.00 C ATOM 1927 CG2 VAL A 123 24.764 2.120 -10.211 1.00 0.00 C ATOM 0 H VAL A 123 25.766 4.355 -12.729 1.00 0.00 H new ATOM 0 HA VAL A 123 23.056 3.219 -12.169 1.00 0.00 H new ATOM 0 HB VAL A 123 25.010 4.282 -10.190 1.00 0.00 H new ATOM 0 HG11 VAL A 123 23.340 3.458 -8.436 1.00 0.00 H new ATOM 0 HG12 VAL A 123 22.668 4.739 -9.472 1.00 0.00 H new ATOM 0 HG13 VAL A 123 22.223 3.040 -9.757 1.00 0.00 H new ATOM 0 HG21 VAL A 123 24.991 1.963 -9.157 1.00 0.00 H new ATOM 0 HG22 VAL A 123 24.010 1.401 -10.530 1.00 0.00 H new ATOM 0 HG23 VAL A 123 25.670 1.982 -10.802 1.00 0.00 H new ATOM 1937 N ALA A 124 22.007 5.521 -12.237 1.00 0.00 N ATOM 1938 CA ALA A 124 21.312 6.822 -12.049 1.00 0.00 C ATOM 1939 C ALA A 124 20.373 6.823 -10.799 1.00 0.00 C ATOM 1940 O ALA A 124 19.911 5.770 -10.347 1.00 0.00 O ATOM 1941 CB ALA A 124 20.535 7.109 -13.347 1.00 0.00 C ATOM 0 H ALA A 124 21.383 4.756 -12.496 1.00 0.00 H new ATOM 0 HA ALA A 124 22.041 7.609 -11.855 1.00 0.00 H new ATOM 0 HB1 ALA A 124 20.008 8.058 -13.253 1.00 0.00 H new ATOM 0 HB2 ALA A 124 21.231 7.162 -14.184 1.00 0.00 H new ATOM 0 HB3 ALA A 124 19.815 6.310 -13.524 1.00 0.00 H new ATOM 1947 N VAL A 125 20.064 8.011 -10.245 1.00 0.00 N ATOM 1948 CA VAL A 125 19.103 8.141 -9.099 1.00 0.00 C ATOM 1949 C VAL A 125 18.088 9.292 -9.413 1.00 0.00 C ATOM 1950 O VAL A 125 18.444 10.474 -9.385 1.00 0.00 O ATOM 1951 CB VAL A 125 19.778 8.290 -7.688 1.00 0.00 C ATOM 1952 CG1 VAL A 125 18.741 8.178 -6.545 1.00 0.00 C ATOM 1953 CG2 VAL A 125 20.880 7.251 -7.377 1.00 0.00 C ATOM 0 H VAL A 125 20.456 8.898 -10.560 1.00 0.00 H new ATOM 0 HA VAL A 125 18.567 7.196 -9.015 1.00 0.00 H new ATOM 0 HB VAL A 125 20.234 9.279 -7.737 1.00 0.00 H new ATOM 0 HG11 VAL A 125 19.245 8.286 -5.585 1.00 0.00 H new ATOM 0 HG12 VAL A 125 17.994 8.964 -6.653 1.00 0.00 H new ATOM 0 HG13 VAL A 125 18.253 7.205 -6.591 1.00 0.00 H new ATOM 0 HG21 VAL A 125 21.285 7.436 -6.382 1.00 0.00 H new ATOM 0 HG22 VAL A 125 20.455 6.248 -7.415 1.00 0.00 H new ATOM 0 HG23 VAL A 125 21.678 7.335 -8.115 1.00 0.00 H new ATOM 1963 N ARG A 126 16.816 8.948 -9.688 1.00 0.00 N ATOM 1964 CA ARG A 126 15.730 9.944 -9.918 1.00 0.00 C ATOM 1965 C ARG A 126 14.855 10.115 -8.635 1.00 0.00 C ATOM 1966 O ARG A 126 14.158 9.195 -8.195 1.00 0.00 O ATOM 1967 CB ARG A 126 14.902 9.517 -11.160 1.00 0.00 C ATOM 1968 CG ARG A 126 15.552 9.843 -12.530 1.00 0.00 C ATOM 1969 CD ARG A 126 15.026 9.046 -13.741 1.00 0.00 C ATOM 1970 NE ARG A 126 13.553 9.147 -13.968 1.00 0.00 N ATOM 1971 CZ ARG A 126 12.852 8.333 -14.765 1.00 0.00 C ATOM 1972 NH1 ARG A 126 13.398 7.432 -15.542 1.00 0.00 N ATOM 1973 NH2 ARG A 126 11.557 8.432 -14.781 1.00 0.00 N ATOM 0 H ARG A 126 16.504 7.979 -9.759 1.00 0.00 H new ATOM 0 HA ARG A 126 16.160 10.924 -10.124 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.724 8.443 -11.107 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.928 10.004 -11.113 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.411 10.905 -12.732 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.626 9.673 -12.449 1.00 0.00 H new ATOM 0 HD2 ARG A 126 15.542 9.392 -14.637 1.00 0.00 H new ATOM 0 HD3 ARG A 126 15.287 7.996 -13.608 1.00 0.00 H new ATOM 0 HE ARG A 126 13.047 9.887 -13.482 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.412 7.322 -15.561 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.810 6.840 -16.128 1.00 0.00 H new ATOM 0 HH21 ARG A 126 11.091 9.122 -14.192 1.00 0.00 H new ATOM 0 HH22 ARG A 126 11.006 7.820 -15.383 1.00 0.00 H new ATOM 1987 N HIS A 127 14.899 11.314 -8.035 1.00 0.00 N ATOM 1988 CA HIS A 127 14.299 11.579 -6.696 1.00 0.00 C ATOM 1989 C HIS A 127 12.866 12.182 -6.858 1.00 0.00 C ATOM 1990 O HIS A 127 12.722 13.349 -7.232 1.00 0.00 O ATOM 1991 CB HIS A 127 15.243 12.541 -5.914 1.00 0.00 C ATOM 1992 CG HIS A 127 16.654 12.037 -5.594 1.00 0.00 C ATOM 1993 ND1 HIS A 127 17.723 12.141 -6.462 1.00 0.00 N ATOM 1994 CD2 HIS A 127 17.084 11.479 -4.379 1.00 0.00 C ATOM 1995 CE1 HIS A 127 18.720 11.616 -5.688 1.00 0.00 C ATOM 1996 NE2 HIS A 127 18.442 11.191 -4.414 1.00 0.00 N ATOM 0 H HIS A 127 15.346 12.130 -8.452 1.00 0.00 H new ATOM 0 HA HIS A 127 14.196 10.651 -6.134 1.00 0.00 H new ATOM 0 HB2 HIS A 127 15.337 13.462 -6.489 1.00 0.00 H new ATOM 0 HB3 HIS A 127 14.756 12.800 -4.974 1.00 0.00 H new ATOM 0 HD1 HIS A 127 17.759 12.507 -7.413 1.00 0.00 H new ATOM 0 HD2 HIS A 127 16.443 11.298 -3.529 1.00 0.00 H new ATOM 0 HE1 HIS A 127 19.724 11.536 -6.079 1.00 0.00 H new ATOM 2004 N TYR A 128 11.804 11.408 -6.594 1.00 0.00 N ATOM 2005 CA TYR A 128 10.408 11.799 -6.941 1.00 0.00 C ATOM 2006 C TYR A 128 9.560 12.239 -5.702 1.00 0.00 C ATOM 2007 O TYR A 128 9.418 11.501 -4.725 1.00 0.00 O ATOM 2008 CB TYR A 128 9.756 10.598 -7.679 1.00 0.00 C ATOM 2009 CG TYR A 128 9.997 10.526 -9.189 1.00 0.00 C ATOM 2010 CD1 TYR A 128 9.183 11.284 -10.025 1.00 0.00 C ATOM 2011 CD2 TYR A 128 10.984 9.708 -9.751 1.00 0.00 C ATOM 2012 CE1 TYR A 128 9.339 11.242 -11.402 1.00 0.00 C ATOM 2013 CE2 TYR A 128 11.145 9.669 -11.137 1.00 0.00 C ATOM 2014 CZ TYR A 128 10.333 10.443 -11.959 1.00 0.00 C ATOM 2015 OH TYR A 128 10.535 10.494 -13.310 1.00 0.00 O ATOM 0 H TYR A 128 11.875 10.498 -6.138 1.00 0.00 H new ATOM 0 HA TYR A 128 10.438 12.680 -7.583 1.00 0.00 H new ATOM 0 HB2 TYR A 128 10.125 9.677 -7.228 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.681 10.630 -7.504 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.419 11.914 -9.595 1.00 0.00 H new ATOM 0 HD2 TYR A 128 11.619 9.109 -9.115 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.692 11.827 -12.039 1.00 0.00 H new ATOM 0 HE2 TYR A 128 11.903 9.035 -11.573 1.00 0.00 H new ATOM 0 HH TYR A 128 10.121 11.305 -13.672 1.00 0.00 H new ATOM 2025 N GLU A 129 8.932 13.423 -5.795 1.00 0.00 N ATOM 2026 CA GLU A 129 7.968 13.943 -4.775 1.00 0.00 C ATOM 2027 C GLU A 129 6.471 13.732 -5.173 1.00 0.00 C ATOM 2028 O GLU A 129 6.148 13.649 -6.363 1.00 0.00 O ATOM 2029 CB GLU A 129 8.304 15.441 -4.511 1.00 0.00 C ATOM 2030 CG GLU A 129 7.919 16.469 -5.605 1.00 0.00 C ATOM 2031 CD GLU A 129 8.157 17.941 -5.263 1.00 0.00 C ATOM 2032 OE1 GLU A 129 8.928 18.342 -4.396 1.00 0.00 O ATOM 2033 OE2 GLU A 129 7.422 18.771 -6.055 1.00 0.00 O ATOM 0 H GLU A 129 9.071 14.060 -6.580 1.00 0.00 H new ATOM 0 HA GLU A 129 8.085 13.369 -3.856 1.00 0.00 H new ATOM 0 HB2 GLU A 129 7.812 15.737 -3.585 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.378 15.519 -4.340 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.479 16.233 -6.510 1.00 0.00 H new ATOM 0 HG3 GLU A 129 6.863 16.339 -5.841 1.00 0.00 H new ATOM 2041 N LYS A 130 5.544 13.700 -4.195 1.00 0.00 N ATOM 2042 CA LYS A 130 4.086 13.582 -4.496 1.00 0.00 C ATOM 2043 C LYS A 130 3.441 14.928 -4.972 1.00 0.00 C ATOM 2044 O LYS A 130 3.559 15.967 -4.315 1.00 0.00 O ATOM 2045 CB LYS A 130 3.281 13.036 -3.281 1.00 0.00 C ATOM 2046 CG LYS A 130 3.532 11.560 -2.907 1.00 0.00 C ATOM 2047 CD LYS A 130 2.576 11.043 -1.816 1.00 0.00 C ATOM 2048 CE LYS A 130 2.865 9.585 -1.417 1.00 0.00 C ATOM 2049 NZ LYS A 130 2.213 8.608 -2.313 1.00 0.00 N ATOM 0 H LYS A 130 5.765 13.753 -3.201 1.00 0.00 H new ATOM 0 HA LYS A 130 4.029 12.869 -5.319 1.00 0.00 H new ATOM 0 HB2 LYS A 130 3.510 13.654 -2.412 1.00 0.00 H new ATOM 0 HB3 LYS A 130 2.218 13.161 -3.490 1.00 0.00 H new ATOM 0 HG2 LYS A 130 3.425 10.942 -3.798 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.560 11.448 -2.564 1.00 0.00 H new ATOM 0 HD2 LYS A 130 2.658 11.680 -0.935 1.00 0.00 H new ATOM 0 HD3 LYS A 130 1.549 11.121 -2.172 1.00 0.00 H new ATOM 0 HE2 LYS A 130 3.942 9.417 -1.426 1.00 0.00 H new ATOM 0 HE3 LYS A 130 2.524 9.418 -0.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 2.495 7.645 -2.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 1.180 8.701 -2.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 2.504 8.789 -3.295 1.00 0.00 H new ATOM 2062 N ALA A 131 2.713 14.858 -6.093 1.00 0.00 N ATOM 2063 CA ALA A 131 1.735 15.880 -6.521 1.00 0.00 C ATOM 2064 C ALA A 131 0.279 15.370 -6.324 1.00 0.00 C ATOM 2065 O ALA A 131 -0.534 16.129 -5.751 1.00 0.00 O ATOM 2066 CB ALA A 131 2.007 16.163 -8.002 1.00 0.00 C ATOM 2067 OXT ALA A 131 -0.065 14.234 -6.744 1.00 0.00 O ATOM 0 H ALA A 131 2.785 14.076 -6.744 1.00 0.00 H new ATOM 0 HA ALA A 131 1.840 16.786 -5.924 1.00 0.00 H new ATOM 0 HB1 ALA A 131 1.306 16.915 -8.363 1.00 0.00 H new ATOM 0 HB2 ALA A 131 3.026 16.530 -8.121 1.00 0.00 H new ATOM 0 HB3 ALA A 131 1.883 15.245 -8.577 1.00 0.00 H new TER 2073 ALA A 131