USER MOD reduce.3.24.130724 H: found=0, std=0, add=965, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 963 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -120:sc= 0.08 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -2.17! C(o=-2.2!,f=-2.2!) USER MOD Single : A 9 LYS NZ :NH3+ -134:sc= -0.287 (180deg=-2!) USER MOD Single : A 14 THR OG1 : rot 46:sc= -0.171 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -2.08 K(o=-2.1,f=-3.9!) USER MOD Single : A 33 LYS NZ :NH3+ -108:sc= -0.503 (180deg=-4.47!) USER MOD Single : A 35 HIS : no HE2:sc= -0.652 K(o=-0.65,f=-2.2!) USER MOD Single : A 36 SER OG : rot -80:sc= 0.411 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.00921) USER MOD Single : A 50 TYR OH : rot 180:sc= -0.92 USER MOD Single : A 51 THR OG1 : rot 160:sc= -1.07 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot -56:sc= 0.048 USER MOD Single : A 66 ASN : amide:sc= -1.12 X(o=-1.1,f=-1.1) USER MOD Single : A 67 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00127) USER MOD Single : A 69 THR OG1 : rot 180:sc=-0.00725 USER MOD Single : A 73 ASN : amide:sc= -1.12 K(o=-1.1,f=-4.3!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 152:sc= 1.73 USER MOD Single : A 89 THR OG1 : rot -37:sc= 0.256 USER MOD Single : A 91 TYR OH : rot 37:sc= -0.998 USER MOD Single : A 98 ASN : amide:sc= -0.0922 X(o=-0.092,f=0) USER MOD Single : A 99 ASN : amide:sc= 0.0509 K(o=0.051,f=-5.3!) USER MOD Single : A 102 LYS NZ :NH3+ -121:sc=-0.00657 (180deg=-0.63) USER MOD Single : A 109 LYS NZ :NH3+ 167:sc= -0.126 (180deg=-0.439) USER MOD Single : A 114 ASN : amide:sc= -1.02 K(o=-1,f=-0.35) USER MOD Single : A 116 ASN : amide:sc= -1.33 K(o=-1.3,f=-8.4!) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= -0.0128 K(o=-0.013,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.158 -0.158 22.236 1.00 0.00 N ATOM 2 CA GLY A 1 11.669 -0.021 23.595 1.00 0.00 C ATOM 3 C GLY A 1 10.591 1.038 23.719 1.00 0.00 C ATOM 4 O GLY A 1 10.151 1.605 22.720 1.00 0.00 O ATOM 0 H1 GLY A 1 11.990 -1.129 21.903 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.658 0.512 21.618 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.178 0.044 22.212 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.274 -0.979 23.934 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.500 0.232 24.253 1.00 0.00 H new ATOM 8 N SER A 2 10.165 1.304 24.949 1.00 0.00 N ATOM 9 CA SER A 2 9.128 2.298 25.200 1.00 0.00 C ATOM 10 C SER A 2 9.743 3.658 25.514 1.00 0.00 C ATOM 11 O SER A 2 10.759 3.748 26.204 1.00 0.00 O ATOM 12 CB SER A 2 8.233 1.851 26.358 1.00 0.00 C ATOM 13 OG SER A 2 6.929 2.391 26.233 1.00 0.00 O ATOM 0 H SER A 2 10.522 0.845 25.787 1.00 0.00 H new ATOM 0 HA SER A 2 8.524 2.392 24.298 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.179 0.763 26.380 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.672 2.168 27.304 1.00 0.00 H new ATOM 0 HG SER A 2 6.377 2.089 26.984 1.00 0.00 H new ATOM 19 N SER A 3 9.121 4.715 25.002 1.00 0.00 N ATOM 20 CA SER A 3 9.609 6.071 25.223 1.00 0.00 C ATOM 21 C SER A 3 8.548 7.099 24.839 1.00 0.00 C ATOM 22 O SER A 3 7.740 6.868 23.941 1.00 0.00 O ATOM 23 CB SER A 3 10.886 6.314 24.417 1.00 0.00 C ATOM 24 OG SER A 3 11.426 7.595 24.691 1.00 0.00 O ATOM 0 H SER A 3 8.278 4.658 24.431 1.00 0.00 H new ATOM 0 HA SER A 3 9.831 6.182 26.284 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.622 5.547 24.656 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.670 6.227 23.352 1.00 0.00 H new ATOM 0 HG SER A 3 12.242 7.725 24.165 1.00 0.00 H new ATOM 30 N GLY A 4 8.559 8.236 25.528 1.00 0.00 N ATOM 31 CA GLY A 4 7.594 9.283 25.246 1.00 0.00 C ATOM 32 C GLY A 4 7.261 9.382 23.771 1.00 0.00 C ATOM 33 O GLY A 4 6.265 8.821 23.314 1.00 0.00 O ATOM 0 H GLY A 4 9.218 8.451 26.276 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.681 9.092 25.810 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.988 10.239 25.591 1.00 0.00 H new ATOM 37 N SER A 5 8.094 10.099 23.024 1.00 0.00 N ATOM 38 CA SER A 5 7.879 10.275 21.593 1.00 0.00 C ATOM 39 C SER A 5 9.204 10.248 20.837 1.00 0.00 C ATOM 40 O SER A 5 10.171 10.899 21.234 1.00 0.00 O ATOM 41 CB SER A 5 7.151 11.593 21.322 1.00 0.00 C ATOM 42 OG SER A 5 7.013 11.823 19.931 1.00 0.00 O ATOM 0 H SER A 5 8.924 10.568 23.386 1.00 0.00 H new ATOM 0 HA SER A 5 7.262 9.449 21.240 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.167 11.571 21.789 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.702 12.416 21.777 1.00 0.00 H new ATOM 0 HG SER A 5 6.543 12.670 19.785 1.00 0.00 H new ATOM 48 N SER A 6 9.240 9.490 19.746 1.00 0.00 N ATOM 49 CA SER A 6 10.447 9.374 18.935 1.00 0.00 C ATOM 50 C SER A 6 10.098 9.239 17.457 1.00 0.00 C ATOM 51 O SER A 6 9.496 8.251 17.037 1.00 0.00 O ATOM 52 CB SER A 6 11.277 8.170 19.387 1.00 0.00 C ATOM 53 OG SER A 6 11.628 8.278 20.756 1.00 0.00 O ATOM 0 H SER A 6 8.448 8.947 19.403 1.00 0.00 H new ATOM 0 HA SER A 6 11.034 10.282 19.070 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.711 7.253 19.225 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.180 8.099 18.781 1.00 0.00 H new ATOM 0 HG SER A 6 12.156 7.496 21.021 1.00 0.00 H new ATOM 59 N GLY A 7 10.481 10.240 16.670 1.00 0.00 N ATOM 60 CA GLY A 7 10.200 10.215 15.247 1.00 0.00 C ATOM 61 C GLY A 7 9.902 11.593 14.690 1.00 0.00 C ATOM 62 O GLY A 7 10.454 12.589 15.155 1.00 0.00 O ATOM 0 H GLY A 7 10.981 11.068 16.993 1.00 0.00 H new ATOM 0 HA2 GLY A 7 11.053 9.790 14.719 1.00 0.00 H new ATOM 0 HA3 GLY A 7 9.350 9.559 15.059 1.00 0.00 H new ATOM 66 N GLN A 8 9.027 11.649 13.691 1.00 0.00 N ATOM 67 CA GLN A 8 8.660 12.916 13.069 1.00 0.00 C ATOM 68 C GLN A 8 7.146 13.104 13.071 1.00 0.00 C ATOM 69 O GLN A 8 6.389 12.136 13.153 1.00 0.00 O ATOM 70 CB GLN A 8 9.191 12.978 11.636 1.00 0.00 C ATOM 71 CG GLN A 8 10.671 13.318 11.550 1.00 0.00 C ATOM 72 CD GLN A 8 11.223 13.170 10.146 1.00 0.00 C ATOM 73 OE1 GLN A 8 11.104 12.112 9.528 1.00 0.00 O ATOM 74 NE2 GLN A 8 11.831 14.234 9.634 1.00 0.00 N ATOM 0 H GLN A 8 8.560 10.833 13.295 1.00 0.00 H new ATOM 0 HA GLN A 8 9.109 13.721 13.650 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.019 12.017 11.152 1.00 0.00 H new ATOM 0 HB3 GLN A 8 8.623 13.722 11.079 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.825 14.342 11.891 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.229 12.670 12.226 1.00 0.00 H new ATOM 0 HE21 GLN A 8 11.907 15.091 10.182 1.00 0.00 H new ATOM 0 HE22 GLN A 8 12.222 14.194 8.693 1.00 0.00 H new ATOM 83 N LYS A 9 6.710 14.356 12.980 1.00 0.00 N ATOM 84 CA LYS A 9 5.287 14.672 12.971 1.00 0.00 C ATOM 85 C LYS A 9 4.581 13.966 11.818 1.00 0.00 C ATOM 86 O LYS A 9 4.886 14.206 10.650 1.00 0.00 O ATOM 87 CB LYS A 9 5.081 16.185 12.859 1.00 0.00 C ATOM 88 CG LYS A 9 5.115 16.904 14.197 1.00 0.00 C ATOM 89 CD LYS A 9 5.223 18.409 14.018 1.00 0.00 C ATOM 90 CE LYS A 9 3.893 19.017 13.599 1.00 0.00 C ATOM 91 NZ LYS A 9 3.669 18.901 12.131 1.00 0.00 N ATOM 0 H LYS A 9 7.323 15.169 12.911 1.00 0.00 H new ATOM 0 HA LYS A 9 4.856 14.321 13.908 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.853 16.602 12.212 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.123 16.378 12.376 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.213 16.668 14.761 1.00 0.00 H new ATOM 0 HG3 LYS A 9 5.961 16.545 14.783 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.555 18.865 14.951 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.980 18.634 13.267 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.082 18.519 14.131 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.866 20.067 13.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 3.332 19.812 11.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 4.561 18.644 11.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.957 18.166 11.945 1.00 0.00 H new ATOM 105 N ARG A 10 3.634 13.095 12.154 1.00 0.00 N ATOM 106 CA ARG A 10 2.885 12.355 11.147 1.00 0.00 C ATOM 107 C ARG A 10 1.768 13.213 10.560 1.00 0.00 C ATOM 108 O ARG A 10 0.640 13.202 11.050 1.00 0.00 O ATOM 109 CB ARG A 10 2.296 11.080 11.754 1.00 0.00 C ATOM 110 CG ARG A 10 1.953 10.017 10.723 1.00 0.00 C ATOM 111 CD ARG A 10 3.198 9.295 10.232 1.00 0.00 C ATOM 112 NE ARG A 10 3.768 8.427 11.259 1.00 0.00 N ATOM 113 CZ ARG A 10 3.268 7.238 11.577 1.00 0.00 C ATOM 114 NH1 ARG A 10 2.194 6.777 10.950 1.00 0.00 N ATOM 115 NH2 ARG A 10 3.844 6.506 12.523 1.00 0.00 N ATOM 0 H ARG A 10 3.368 12.885 13.116 1.00 0.00 H new ATOM 0 HA ARG A 10 3.572 12.085 10.345 1.00 0.00 H new ATOM 0 HB2 ARG A 10 3.007 10.665 12.468 1.00 0.00 H new ATOM 0 HB3 ARG A 10 1.396 11.336 12.313 1.00 0.00 H new ATOM 0 HG2 ARG A 10 1.261 9.296 11.158 1.00 0.00 H new ATOM 0 HG3 ARG A 10 1.442 10.479 9.878 1.00 0.00 H new ATOM 0 HD2 ARG A 10 2.949 8.701 9.352 1.00 0.00 H new ATOM 0 HD3 ARG A 10 3.943 10.027 9.922 1.00 0.00 H new ATOM 0 HE ARG A 10 4.595 8.752 11.760 1.00 0.00 H new ATOM 0 HH11 ARG A 10 1.750 7.336 10.221 1.00 0.00 H new ATOM 0 HH12 ARG A 10 1.812 5.864 11.196 1.00 0.00 H new ATOM 0 HH21 ARG A 10 4.671 6.856 13.006 1.00 0.00 H new ATOM 0 HH22 ARG A 10 3.459 5.593 12.767 1.00 0.00 H new ATOM 129 N ALA A 11 2.093 13.957 9.507 1.00 0.00 N ATOM 130 CA ALA A 11 1.118 14.820 8.852 1.00 0.00 C ATOM 131 C ALA A 11 0.174 14.011 7.969 1.00 0.00 C ATOM 132 O ALA A 11 -1.046 14.086 8.117 1.00 0.00 O ATOM 133 CB ALA A 11 1.826 15.889 8.032 1.00 0.00 C ATOM 0 H ALA A 11 3.024 13.979 9.090 1.00 0.00 H new ATOM 0 HA ALA A 11 0.522 15.306 9.625 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.086 16.526 7.548 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.453 16.494 8.687 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.447 15.413 7.273 1.00 0.00 H new ATOM 139 N TRP A 12 0.746 13.241 7.051 1.00 0.00 N ATOM 140 CA TRP A 12 -0.046 12.418 6.143 1.00 0.00 C ATOM 141 C TRP A 12 0.197 10.935 6.400 1.00 0.00 C ATOM 142 O TRP A 12 1.342 10.491 6.491 1.00 0.00 O ATOM 143 CB TRP A 12 0.290 12.758 4.690 1.00 0.00 C ATOM 144 CG TRP A 12 1.512 12.056 4.183 1.00 0.00 C ATOM 145 CD1 TRP A 12 2.696 11.890 4.843 1.00 0.00 C ATOM 146 CD2 TRP A 12 1.671 11.426 2.907 1.00 0.00 C ATOM 147 NE1 TRP A 12 3.581 11.195 4.055 1.00 0.00 N ATOM 148 CE2 TRP A 12 2.976 10.898 2.862 1.00 0.00 C ATOM 149 CE3 TRP A 12 0.837 11.254 1.798 1.00 0.00 C ATOM 150 CZ2 TRP A 12 3.465 10.213 1.753 1.00 0.00 C ATOM 151 CZ3 TRP A 12 1.323 10.575 0.698 1.00 0.00 C ATOM 152 CH2 TRP A 12 2.627 10.060 0.682 1.00 0.00 C ATOM 0 H TRP A 12 1.754 13.169 6.915 1.00 0.00 H new ATOM 0 HA TRP A 12 -1.099 12.631 6.325 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -0.559 12.497 4.058 1.00 0.00 H new ATOM 0 HB3 TRP A 12 0.435 13.835 4.601 1.00 0.00 H new ATOM 0 HD1 TRP A 12 2.906 12.252 5.839 1.00 0.00 H new ATOM 0 HE1 TRP A 12 4.534 10.941 4.316 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -0.170 11.645 1.802 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 4.470 9.817 1.738 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 0.688 10.438 -0.165 1.00 0.00 H new ATOM 0 HH2 TRP A 12 2.977 9.532 -0.193 1.00 0.00 H new ATOM 163 N ILE A 13 -0.885 10.174 6.517 1.00 0.00 N ATOM 164 CA ILE A 13 -0.788 8.740 6.762 1.00 0.00 C ATOM 165 C ILE A 13 -1.475 7.946 5.657 1.00 0.00 C ATOM 166 O ILE A 13 -2.054 8.518 4.733 1.00 0.00 O ATOM 167 CB ILE A 13 -1.411 8.358 8.118 1.00 0.00 C ATOM 168 CG1 ILE A 13 -2.893 8.735 8.148 1.00 0.00 C ATOM 169 CG2 ILE A 13 -0.663 9.037 9.255 1.00 0.00 C ATOM 170 CD1 ILE A 13 -3.632 8.189 9.349 1.00 0.00 C ATOM 0 H ILE A 13 -1.840 10.526 6.446 1.00 0.00 H new ATOM 0 HA ILE A 13 0.273 8.493 6.777 1.00 0.00 H new ATOM 0 HB ILE A 13 -1.328 7.279 8.248 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -2.983 9.821 8.139 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -3.371 8.368 7.240 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -1.115 8.757 10.206 1.00 0.00 H new ATOM 0 HG22 ILE A 13 0.381 8.723 9.243 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -0.718 10.119 9.132 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -4.677 8.496 9.304 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.573 7.101 9.348 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -3.179 8.576 10.262 1.00 0.00 H new ATOM 182 N THR A 14 -1.410 6.622 5.760 1.00 0.00 N ATOM 183 CA THR A 14 -2.027 5.747 4.770 1.00 0.00 C ATOM 184 C THR A 14 -2.908 4.698 5.437 1.00 0.00 C ATOM 185 O THR A 14 -3.053 4.680 6.659 1.00 0.00 O ATOM 186 CB THR A 14 -0.965 5.037 3.909 1.00 0.00 C ATOM 187 OG1 THR A 14 -1.599 4.307 2.853 1.00 0.00 O ATOM 188 CG2 THR A 14 -0.126 4.091 4.755 1.00 0.00 C ATOM 0 H THR A 14 -0.936 6.132 6.519 1.00 0.00 H new ATOM 0 HA THR A 14 -2.641 6.379 4.129 1.00 0.00 H new ATOM 0 HB THR A 14 -0.309 5.795 3.482 1.00 0.00 H new ATOM 0 HG1 THR A 14 -2.280 4.870 2.429 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.617 3.601 4.125 1.00 0.00 H new ATOM 0 HG22 THR A 14 0.378 4.655 5.540 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.771 3.338 5.207 1.00 0.00 H new ATOM 196 N ALA A 15 -3.496 3.824 4.626 1.00 0.00 N ATOM 197 CA ALA A 15 -4.361 2.769 5.138 1.00 0.00 C ATOM 198 C ALA A 15 -3.641 1.424 5.150 1.00 0.00 C ATOM 199 O ALA A 15 -2.824 1.123 4.279 1.00 0.00 O ATOM 200 CB ALA A 15 -5.634 2.681 4.309 1.00 0.00 C ATOM 0 H ALA A 15 -3.389 3.826 3.612 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.626 3.018 6.166 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.271 1.889 4.703 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.166 3.631 4.357 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.379 2.460 3.273 1.00 0.00 H new ATOM 206 N PRO A 16 -3.949 0.596 6.159 1.00 0.00 N ATOM 207 CA PRO A 16 -3.341 -0.730 6.307 1.00 0.00 C ATOM 208 C PRO A 16 -3.810 -1.706 5.234 1.00 0.00 C ATOM 209 O PRO A 16 -4.992 -2.041 5.158 1.00 0.00 O ATOM 210 CB PRO A 16 -3.818 -1.185 7.689 1.00 0.00 C ATOM 211 CG PRO A 16 -5.086 -0.437 7.918 1.00 0.00 C ATOM 212 CD PRO A 16 -4.913 0.890 7.232 1.00 0.00 C ATOM 0 HA PRO A 16 -2.256 -0.695 6.204 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -3.983 -2.262 7.716 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -3.080 -0.957 8.458 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -5.938 -0.980 7.509 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -5.274 -0.304 8.983 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.857 1.262 6.833 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -4.534 1.649 7.916 1.00 0.00 H new ATOM 220 N VAL A 17 -2.875 -2.160 4.405 1.00 0.00 N ATOM 221 CA VAL A 17 -3.193 -3.099 3.336 1.00 0.00 C ATOM 222 C VAL A 17 -3.215 -4.533 3.853 1.00 0.00 C ATOM 223 O VAL A 17 -2.170 -5.166 4.003 1.00 0.00 O ATOM 224 CB VAL A 17 -2.179 -2.997 2.180 1.00 0.00 C ATOM 225 CG1 VAL A 17 -2.487 -4.031 1.107 1.00 0.00 C ATOM 226 CG2 VAL A 17 -2.179 -1.593 1.594 1.00 0.00 C ATOM 0 H VAL A 17 -1.892 -1.893 4.453 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.183 -2.834 2.966 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.183 -3.202 2.574 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.761 -3.944 0.299 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.432 -5.030 1.538 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.489 -3.860 0.714 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.457 -1.539 0.779 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.173 -1.357 1.215 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.906 -0.876 2.368 1.00 0.00 H new ATOM 236 N ALA A 18 -4.413 -5.041 4.123 1.00 0.00 N ATOM 237 CA ALA A 18 -4.572 -6.401 4.620 1.00 0.00 C ATOM 238 C ALA A 18 -5.032 -7.341 3.512 1.00 0.00 C ATOM 239 O ALA A 18 -6.213 -7.375 3.162 1.00 0.00 O ATOM 240 CB ALA A 18 -5.556 -6.427 5.780 1.00 0.00 C ATOM 0 H ALA A 18 -5.288 -4.530 4.006 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.601 -6.748 4.974 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.665 -7.449 6.142 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -5.185 -5.795 6.586 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.524 -6.056 5.444 1.00 0.00 H new ATOM 246 N LEU A 19 -4.094 -8.103 2.961 1.00 0.00 N ATOM 247 CA LEU A 19 -4.403 -9.045 1.890 1.00 0.00 C ATOM 248 C LEU A 19 -4.358 -10.482 2.398 1.00 0.00 C ATOM 249 O LEU A 19 -3.496 -10.840 3.202 1.00 0.00 O ATOM 250 CB LEU A 19 -3.420 -8.870 0.731 1.00 0.00 C ATOM 251 CG LEU A 19 -3.389 -7.487 0.080 1.00 0.00 C ATOM 252 CD1 LEU A 19 -2.235 -7.387 -0.905 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.711 -7.193 -0.613 1.00 0.00 C ATOM 0 H LEU A 19 -3.112 -8.087 3.238 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.413 -8.836 1.537 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.418 -9.102 1.093 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.660 -9.606 -0.037 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.239 -6.742 0.862 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.229 -6.396 -1.359 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.294 -7.552 -0.381 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.354 -8.141 -1.683 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.670 -6.204 -1.070 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.892 -7.942 -1.384 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.519 -7.221 0.118 1.00 0.00 H new ATOM 265 N ARG A 20 -5.290 -11.302 1.923 1.00 0.00 N ATOM 266 CA ARG A 20 -5.355 -12.701 2.329 1.00 0.00 C ATOM 267 C ARG A 20 -4.272 -13.520 1.634 1.00 0.00 C ATOM 268 O ARG A 20 -3.862 -13.203 0.517 1.00 0.00 O ATOM 269 CB ARG A 20 -6.733 -13.283 2.009 1.00 0.00 C ATOM 270 CG ARG A 20 -7.165 -14.385 2.962 1.00 0.00 C ATOM 271 CD ARG A 20 -8.646 -14.699 2.816 1.00 0.00 C ATOM 272 NE ARG A 20 -9.485 -13.548 3.141 1.00 0.00 N ATOM 273 CZ ARG A 20 -10.741 -13.415 2.730 1.00 0.00 C ATOM 274 NH1 ARG A 20 -11.302 -14.357 1.984 1.00 0.00 N ATOM 275 NH2 ARG A 20 -11.440 -12.339 3.067 1.00 0.00 N ATOM 0 H ARG A 20 -6.010 -11.022 1.257 1.00 0.00 H new ATOM 0 HA ARG A 20 -5.188 -12.749 3.405 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.471 -12.482 2.035 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.725 -13.676 0.992 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.580 -15.284 2.769 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -6.955 -14.083 3.988 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -8.850 -15.019 1.794 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.906 -15.533 3.469 1.00 0.00 H new ATOM 0 HE ARG A 20 -9.084 -12.806 3.715 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.769 -15.187 1.724 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -12.267 -14.252 1.670 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -11.013 -11.613 3.642 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -12.404 -12.238 2.751 1.00 0.00 H new ATOM 289 N GLU A 21 -3.812 -14.573 2.302 1.00 0.00 N ATOM 290 CA GLU A 21 -2.775 -15.436 1.749 1.00 0.00 C ATOM 291 C GLU A 21 -3.390 -16.651 1.060 1.00 0.00 C ATOM 292 O GLU A 21 -4.498 -17.071 1.390 1.00 0.00 O ATOM 293 CB GLU A 21 -1.817 -15.891 2.851 1.00 0.00 C ATOM 294 CG GLU A 21 -2.478 -16.751 3.915 1.00 0.00 C ATOM 295 CD GLU A 21 -1.483 -17.609 4.673 1.00 0.00 C ATOM 296 OE1 GLU A 21 -0.862 -17.096 5.627 1.00 0.00 O ATOM 297 OE2 GLU A 21 -1.326 -18.794 4.311 1.00 0.00 O ATOM 0 H GLU A 21 -4.141 -14.849 3.227 1.00 0.00 H new ATOM 0 HA GLU A 21 -2.218 -14.863 1.008 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.998 -16.451 2.400 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.379 -15.013 3.326 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.008 -16.109 4.618 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.223 -17.394 3.446 1.00 0.00 H new ATOM 304 N GLY A 22 -2.660 -17.211 0.100 1.00 0.00 N ATOM 305 CA GLY A 22 -3.149 -18.372 -0.622 1.00 0.00 C ATOM 306 C GLY A 22 -4.068 -17.998 -1.768 1.00 0.00 C ATOM 307 O GLY A 22 -4.875 -18.812 -2.214 1.00 0.00 O ATOM 0 H GLY A 22 -1.739 -16.882 -0.191 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.302 -18.938 -1.010 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -3.681 -19.027 0.068 1.00 0.00 H new ATOM 311 N GLU A 23 -3.946 -16.763 -2.243 1.00 0.00 N ATOM 312 CA GLU A 23 -4.775 -16.283 -3.343 1.00 0.00 C ATOM 313 C GLU A 23 -3.992 -15.324 -4.236 1.00 0.00 C ATOM 314 O GLU A 23 -3.295 -14.434 -3.749 1.00 0.00 O ATOM 315 CB GLU A 23 -6.025 -15.587 -2.802 1.00 0.00 C ATOM 316 CG GLU A 23 -7.200 -16.527 -2.587 1.00 0.00 C ATOM 317 CD GLU A 23 -7.889 -16.904 -3.884 1.00 0.00 C ATOM 318 OE1 GLU A 23 -7.356 -17.768 -4.611 1.00 0.00 O ATOM 319 OE2 GLU A 23 -8.964 -16.336 -4.171 1.00 0.00 O ATOM 0 H GLU A 23 -3.282 -16.077 -1.884 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.076 -17.144 -3.940 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -5.780 -15.102 -1.857 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.322 -14.801 -3.496 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -6.851 -17.432 -2.089 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.921 -16.055 -1.920 1.00 0.00 H new ATOM 326 N ASP A 24 -4.113 -15.514 -5.545 1.00 0.00 N ATOM 327 CA ASP A 24 -3.418 -14.666 -6.507 1.00 0.00 C ATOM 328 C ASP A 24 -4.185 -13.369 -6.743 1.00 0.00 C ATOM 329 O ASP A 24 -5.329 -13.387 -7.200 1.00 0.00 O ATOM 330 CB ASP A 24 -3.229 -15.410 -7.831 1.00 0.00 C ATOM 331 CG ASP A 24 -3.066 -16.905 -7.637 1.00 0.00 C ATOM 332 OD1 ASP A 24 -3.996 -17.537 -7.093 1.00 0.00 O ATOM 333 OD2 ASP A 24 -2.010 -17.442 -8.030 1.00 0.00 O ATOM 0 H ASP A 24 -4.685 -16.247 -5.964 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.440 -14.418 -6.095 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.087 -15.222 -8.476 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.352 -15.015 -8.344 1.00 0.00 H new ATOM 338 N LEU A 25 -3.550 -12.246 -6.427 1.00 0.00 N ATOM 339 CA LEU A 25 -4.173 -10.939 -6.604 1.00 0.00 C ATOM 340 C LEU A 25 -3.568 -10.204 -7.795 1.00 0.00 C ATOM 341 O LEU A 25 -2.716 -9.331 -7.631 1.00 0.00 O ATOM 342 CB LEU A 25 -4.010 -10.099 -5.336 1.00 0.00 C ATOM 343 CG LEU A 25 -4.511 -10.738 -4.039 1.00 0.00 C ATOM 344 CD1 LEU A 25 -3.891 -10.051 -2.832 1.00 0.00 C ATOM 345 CD2 LEU A 25 -6.030 -10.678 -3.967 1.00 0.00 C ATOM 0 H LEU A 25 -2.604 -12.214 -6.047 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.235 -11.093 -6.797 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.953 -9.860 -5.216 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.536 -9.155 -5.479 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.208 -11.785 -4.031 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.259 -10.518 -1.919 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.806 -10.146 -2.877 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.163 -8.996 -2.834 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.369 -11.137 -3.038 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.355 -9.638 -3.997 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.456 -11.216 -4.814 1.00 0.00 H new ATOM 357 N SER A 26 -4.016 -10.562 -8.995 1.00 0.00 N ATOM 358 CA SER A 26 -3.517 -9.938 -10.215 1.00 0.00 C ATOM 359 C SER A 26 -4.540 -8.957 -10.780 1.00 0.00 C ATOM 360 O SER A 26 -4.225 -7.797 -11.048 1.00 0.00 O ATOM 361 CB SER A 26 -3.185 -11.004 -11.260 1.00 0.00 C ATOM 362 OG SER A 26 -2.884 -10.414 -12.512 1.00 0.00 O ATOM 0 H SER A 26 -4.723 -11.281 -9.148 1.00 0.00 H new ATOM 0 HA SER A 26 -2.609 -9.388 -9.967 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.336 -11.598 -10.921 1.00 0.00 H new ATOM 0 HB3 SER A 26 -4.028 -11.686 -11.369 1.00 0.00 H new ATOM 0 HG SER A 26 -2.674 -11.116 -13.162 1.00 0.00 H new ATOM 368 N LYS A 27 -5.769 -9.431 -10.959 1.00 0.00 N ATOM 369 CA LYS A 27 -6.841 -8.598 -11.491 1.00 0.00 C ATOM 370 C LYS A 27 -7.223 -7.504 -10.499 1.00 0.00 C ATOM 371 O LYS A 27 -7.231 -6.320 -10.838 1.00 0.00 O ATOM 372 CB LYS A 27 -8.066 -9.455 -11.818 1.00 0.00 C ATOM 373 CG LYS A 27 -9.254 -8.652 -12.317 1.00 0.00 C ATOM 374 CD LYS A 27 -9.217 -8.482 -13.827 1.00 0.00 C ATOM 375 CE LYS A 27 -10.151 -7.372 -14.285 1.00 0.00 C ATOM 376 NZ LYS A 27 -9.912 -6.998 -15.707 1.00 0.00 N ATOM 0 H LYS A 27 -6.047 -10.388 -10.743 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.481 -8.126 -12.405 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.793 -10.191 -12.574 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -8.361 -10.008 -10.926 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.179 -9.151 -12.029 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.259 -7.672 -11.840 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -8.199 -8.256 -14.144 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.500 -9.419 -14.307 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.185 -7.694 -14.163 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.013 -6.496 -13.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -10.568 -6.239 -15.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -8.933 -6.667 -15.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -10.069 -7.827 -16.315 1.00 0.00 H new ATOM 390 N LYS A 28 -7.537 -7.906 -9.273 1.00 0.00 N ATOM 391 CA LYS A 28 -7.917 -6.961 -8.230 1.00 0.00 C ATOM 392 C LYS A 28 -7.067 -5.696 -8.306 1.00 0.00 C ATOM 393 O LYS A 28 -7.588 -4.583 -8.250 1.00 0.00 O ATOM 394 CB LYS A 28 -7.770 -7.605 -6.850 1.00 0.00 C ATOM 395 CG LYS A 28 -8.763 -8.724 -6.592 1.00 0.00 C ATOM 396 CD LYS A 28 -9.042 -8.891 -5.107 1.00 0.00 C ATOM 397 CE LYS A 28 -9.409 -10.327 -4.767 1.00 0.00 C ATOM 398 NZ LYS A 28 -10.131 -10.422 -3.468 1.00 0.00 N ATOM 0 H LYS A 28 -7.536 -8.882 -8.977 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.960 -6.687 -8.386 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.758 -7.998 -6.748 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.893 -6.838 -6.085 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.695 -8.513 -7.117 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.374 -9.658 -6.997 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.163 -8.594 -4.535 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.854 -8.227 -4.811 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -10.032 -10.740 -5.560 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.504 -10.933 -4.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.364 -11.417 -3.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -9.527 -10.051 -2.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -11.008 -9.865 -3.517 1.00 0.00 H new ATOM 412 N ASN A 29 -5.757 -5.877 -8.436 1.00 0.00 N ATOM 413 CA ASN A 29 -4.835 -4.750 -8.521 1.00 0.00 C ATOM 414 C ASN A 29 -5.467 -3.586 -9.279 1.00 0.00 C ATOM 415 O ASN A 29 -6.320 -3.769 -10.148 1.00 0.00 O ATOM 416 CB ASN A 29 -3.537 -5.177 -9.210 1.00 0.00 C ATOM 417 CG ASN A 29 -2.942 -6.430 -8.596 1.00 0.00 C ATOM 418 OD1 ASN A 29 -3.238 -6.774 -7.452 1.00 0.00 O ATOM 419 ND2 ASN A 29 -2.099 -7.118 -9.357 1.00 0.00 N ATOM 0 H ASN A 29 -5.310 -6.793 -8.485 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.609 -4.420 -7.507 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -3.731 -5.351 -10.268 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -2.812 -4.366 -9.148 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -1.667 -7.970 -8.999 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -1.883 -6.795 -10.300 1.00 0.00 H new ATOM 426 N PRO A 30 -5.039 -2.360 -8.944 1.00 0.00 N ATOM 427 CA PRO A 30 -4.025 -2.130 -7.911 1.00 0.00 C ATOM 428 C PRO A 30 -4.544 -2.439 -6.511 1.00 0.00 C ATOM 429 O PRO A 30 -5.741 -2.331 -6.245 1.00 0.00 O ATOM 430 CB PRO A 30 -3.711 -0.638 -8.048 1.00 0.00 C ATOM 431 CG PRO A 30 -4.940 -0.045 -8.646 1.00 0.00 C ATOM 432 CD PRO A 30 -5.513 -1.103 -9.548 1.00 0.00 C ATOM 0 HA PRO A 30 -3.157 -2.776 -8.041 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.486 -0.190 -7.080 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.842 -0.473 -8.685 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -5.654 0.237 -7.872 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.704 0.860 -9.206 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.602 -1.058 -9.579 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.160 -0.992 -10.573 1.00 0.00 H new ATOM 440 N ILE A 31 -3.636 -2.821 -5.619 1.00 0.00 N ATOM 441 CA ILE A 31 -4.003 -3.144 -4.246 1.00 0.00 C ATOM 442 C ILE A 31 -3.728 -1.969 -3.314 1.00 0.00 C ATOM 443 O ILE A 31 -4.292 -1.884 -2.223 1.00 0.00 O ATOM 444 CB ILE A 31 -3.240 -4.380 -3.735 1.00 0.00 C ATOM 445 CG1 ILE A 31 -1.730 -4.157 -3.845 1.00 0.00 C ATOM 446 CG2 ILE A 31 -3.656 -5.619 -4.514 1.00 0.00 C ATOM 447 CD1 ILE A 31 -0.916 -5.089 -2.975 1.00 0.00 C ATOM 0 H ILE A 31 -2.641 -2.914 -5.823 1.00 0.00 H new ATOM 0 HA ILE A 31 -5.071 -3.362 -4.247 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.490 -4.534 -2.685 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -1.427 -4.286 -4.884 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -1.502 -3.127 -3.572 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.108 -6.484 -4.141 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.726 -5.785 -4.389 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.433 -5.476 -5.571 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.145 -4.874 -3.104 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.191 -4.944 -1.930 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.114 -6.121 -3.263 1.00 0.00 H new ATOM 459 N ALA A 32 -2.858 -1.064 -3.751 1.00 0.00 N ATOM 460 CA ALA A 32 -2.511 0.108 -2.958 1.00 0.00 C ATOM 461 C ALA A 32 -2.088 1.270 -3.850 1.00 0.00 C ATOM 462 O ALA A 32 -1.396 1.078 -4.850 1.00 0.00 O ATOM 463 CB ALA A 32 -1.405 -0.232 -1.970 1.00 0.00 C ATOM 0 H ALA A 32 -2.381 -1.121 -4.651 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.397 0.415 -2.403 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.156 0.653 -1.384 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.744 -1.025 -1.303 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -0.522 -0.568 -2.514 1.00 0.00 H new ATOM 469 N LYS A 33 -2.508 2.476 -3.483 1.00 0.00 N ATOM 470 CA LYS A 33 -2.173 3.670 -4.250 1.00 0.00 C ATOM 471 C LYS A 33 -1.929 4.859 -3.326 1.00 0.00 C ATOM 472 O LYS A 33 -2.765 5.181 -2.481 1.00 0.00 O ATOM 473 CB LYS A 33 -3.295 3.999 -5.237 1.00 0.00 C ATOM 474 CG LYS A 33 -3.739 2.809 -6.071 1.00 0.00 C ATOM 475 CD LYS A 33 -2.882 2.649 -7.315 1.00 0.00 C ATOM 476 CE LYS A 33 -3.446 3.438 -8.487 1.00 0.00 C ATOM 477 NZ LYS A 33 -3.114 2.806 -9.793 1.00 0.00 N ATOM 0 H LYS A 33 -3.082 2.652 -2.658 1.00 0.00 H new ATOM 0 HA LYS A 33 -1.257 3.470 -4.805 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.152 4.385 -4.685 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.960 4.794 -5.903 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -3.683 1.901 -5.470 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.782 2.935 -6.361 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.867 2.985 -7.104 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.820 1.594 -7.582 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.529 3.515 -8.386 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -3.051 4.454 -8.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.399 3.379 -10.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.739 1.850 -9.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -3.972 2.747 -10.378 1.00 0.00 H new ATOM 491 N ILE A 34 -0.781 5.507 -3.494 1.00 0.00 N ATOM 492 CA ILE A 34 -0.430 6.662 -2.677 1.00 0.00 C ATOM 493 C ILE A 34 -0.386 7.935 -3.514 1.00 0.00 C ATOM 494 O ILE A 34 0.656 8.294 -4.064 1.00 0.00 O ATOM 495 CB ILE A 34 0.932 6.469 -1.985 1.00 0.00 C ATOM 496 CG1 ILE A 34 1.917 5.782 -2.933 1.00 0.00 C ATOM 497 CG2 ILE A 34 0.767 5.660 -0.707 1.00 0.00 C ATOM 498 CD1 ILE A 34 3.364 6.124 -2.652 1.00 0.00 C ATOM 0 H ILE A 34 -0.079 5.252 -4.188 1.00 0.00 H new ATOM 0 HA ILE A 34 -1.205 6.757 -1.916 1.00 0.00 H new ATOM 0 HB ILE A 34 1.332 7.449 -1.723 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.786 4.702 -2.860 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.678 6.063 -3.959 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.738 5.532 -0.229 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.095 6.185 -0.028 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.349 4.682 -0.947 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.006 5.602 -3.362 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.510 7.199 -2.754 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.620 5.817 -1.638 1.00 0.00 H new ATOM 510 N HIS A 35 -1.525 8.616 -3.607 1.00 0.00 N ATOM 511 CA HIS A 35 -1.616 9.852 -4.376 1.00 0.00 C ATOM 512 C HIS A 35 -1.327 11.063 -3.494 1.00 0.00 C ATOM 513 O HIS A 35 -2.064 11.345 -2.550 1.00 0.00 O ATOM 514 CB HIS A 35 -3.003 9.984 -5.006 1.00 0.00 C ATOM 515 CG HIS A 35 -3.442 8.760 -5.749 1.00 0.00 C ATOM 516 ND1 HIS A 35 -4.759 8.358 -5.823 1.00 0.00 N ATOM 517 CD2 HIS A 35 -2.732 7.850 -6.455 1.00 0.00 C ATOM 518 CE1 HIS A 35 -4.839 7.251 -6.541 1.00 0.00 C ATOM 519 NE2 HIS A 35 -3.623 6.923 -6.936 1.00 0.00 N ATOM 0 H HIS A 35 -2.397 8.332 -3.160 1.00 0.00 H new ATOM 0 HA HIS A 35 -0.868 9.815 -5.168 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -3.729 10.204 -4.223 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -3.003 10.833 -5.689 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -5.548 8.839 -5.391 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -1.663 7.852 -6.611 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -5.745 6.708 -6.766 1.00 0.00 H new ATOM 528 N SER A 36 -0.249 11.774 -3.809 1.00 0.00 N ATOM 529 CA SER A 36 0.140 12.952 -3.043 1.00 0.00 C ATOM 530 C SER A 36 -0.966 14.003 -3.063 1.00 0.00 C ATOM 531 O SER A 36 -2.039 13.780 -3.623 1.00 0.00 O ATOM 532 CB SER A 36 1.434 13.547 -3.603 1.00 0.00 C ATOM 533 OG SER A 36 1.169 14.396 -4.705 1.00 0.00 O ATOM 0 H SER A 36 0.370 11.555 -4.589 1.00 0.00 H new ATOM 0 HA SER A 36 0.307 12.644 -2.011 1.00 0.00 H new ATOM 0 HB2 SER A 36 1.947 14.108 -2.822 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.104 12.744 -3.911 1.00 0.00 H new ATOM 0 HG SER A 36 1.034 13.854 -5.510 1.00 0.00 H new ATOM 539 N ASP A 37 -0.696 15.148 -2.446 1.00 0.00 N ATOM 540 CA ASP A 37 -1.667 16.235 -2.393 1.00 0.00 C ATOM 541 C ASP A 37 -1.171 17.446 -3.178 1.00 0.00 C ATOM 542 O ASP A 37 -1.639 18.566 -2.973 1.00 0.00 O ATOM 543 CB ASP A 37 -1.942 16.631 -0.942 1.00 0.00 C ATOM 544 CG ASP A 37 -2.424 15.463 -0.104 1.00 0.00 C ATOM 545 OD1 ASP A 37 -1.662 14.484 0.042 1.00 0.00 O ATOM 546 OD2 ASP A 37 -3.561 15.528 0.406 1.00 0.00 O ATOM 0 H ASP A 37 0.187 15.348 -1.976 1.00 0.00 H new ATOM 0 HA ASP A 37 -2.593 15.884 -2.848 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -1.033 17.040 -0.501 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -2.690 17.423 -0.920 1.00 0.00 H new ATOM 551 N LEU A 38 -0.221 17.212 -4.078 1.00 0.00 N ATOM 552 CA LEU A 38 0.339 18.284 -4.894 1.00 0.00 C ATOM 553 C LEU A 38 0.281 17.927 -6.376 1.00 0.00 C ATOM 554 O LEU A 38 -0.050 18.765 -7.214 1.00 0.00 O ATOM 555 CB LEU A 38 1.785 18.563 -4.481 1.00 0.00 C ATOM 556 CG LEU A 38 1.972 19.382 -3.203 1.00 0.00 C ATOM 557 CD1 LEU A 38 3.431 19.373 -2.772 1.00 0.00 C ATOM 558 CD2 LEU A 38 1.484 20.809 -3.409 1.00 0.00 C ATOM 0 H LEU A 38 0.177 16.291 -4.261 1.00 0.00 H new ATOM 0 HA LEU A 38 -0.258 19.181 -4.732 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.296 17.609 -4.355 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.281 19.085 -5.299 1.00 0.00 H new ATOM 0 HG LEU A 38 1.378 18.926 -2.411 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.545 19.961 -1.861 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.749 18.347 -2.584 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.046 19.805 -3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 38 1.624 21.378 -2.490 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.052 21.275 -4.214 1.00 0.00 H new ATOM 0 HD23 LEU A 38 0.426 20.798 -3.670 1.00 0.00 H new ATOM 570 N ALA A 39 0.604 16.676 -6.691 1.00 0.00 N ATOM 571 CA ALA A 39 0.585 16.207 -8.071 1.00 0.00 C ATOM 572 C ALA A 39 -0.608 16.779 -8.828 1.00 0.00 C ATOM 573 O ALA A 39 -0.443 17.489 -9.820 1.00 0.00 O ATOM 574 CB ALA A 39 0.558 14.686 -8.110 1.00 0.00 C ATOM 0 H ALA A 39 0.882 15.970 -6.009 1.00 0.00 H new ATOM 0 HA ALA A 39 1.494 16.556 -8.561 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.544 14.349 -9.146 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.445 14.293 -7.613 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.334 14.325 -7.599 1.00 0.00 H new ATOM 580 N GLU A 40 -1.810 16.465 -8.355 1.00 0.00 N ATOM 581 CA GLU A 40 -3.031 16.948 -8.990 1.00 0.00 C ATOM 582 C GLU A 40 -3.310 18.397 -8.603 1.00 0.00 C ATOM 583 O GLU A 40 -3.552 19.244 -9.462 1.00 0.00 O ATOM 584 CB GLU A 40 -4.219 16.066 -8.598 1.00 0.00 C ATOM 585 CG GLU A 40 -5.397 16.173 -9.552 1.00 0.00 C ATOM 586 CD GLU A 40 -6.586 15.345 -9.106 1.00 0.00 C ATOM 587 OE1 GLU A 40 -6.895 15.356 -7.896 1.00 0.00 O ATOM 588 OE2 GLU A 40 -7.207 14.686 -9.966 1.00 0.00 O ATOM 0 H GLU A 40 -1.964 15.879 -7.535 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.892 16.899 -10.070 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.891 15.027 -8.554 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.548 16.339 -7.595 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -5.698 17.217 -9.636 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -5.086 15.849 -10.545 1.00 0.00 H new ATOM 595 N GLU A 41 -3.273 18.674 -7.303 1.00 0.00 N ATOM 596 CA GLU A 41 -3.523 20.020 -6.802 1.00 0.00 C ATOM 597 C GLU A 41 -2.862 21.065 -7.696 1.00 0.00 C ATOM 598 O GLU A 41 -3.534 21.923 -8.267 1.00 0.00 O ATOM 599 CB GLU A 41 -3.006 20.159 -5.368 1.00 0.00 C ATOM 600 CG GLU A 41 -4.031 19.780 -4.312 1.00 0.00 C ATOM 601 CD GLU A 41 -4.789 18.514 -4.663 1.00 0.00 C ATOM 602 OE1 GLU A 41 -4.154 17.439 -4.717 1.00 0.00 O ATOM 603 OE2 GLU A 41 -6.015 18.597 -4.883 1.00 0.00 O ATOM 0 H GLU A 41 -3.072 17.984 -6.579 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.600 20.189 -6.810 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.123 19.532 -5.247 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -2.690 21.189 -5.203 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -3.528 19.644 -3.355 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.738 20.600 -4.187 1.00 0.00 H new ATOM 610 N ARG A 42 -1.540 20.985 -7.811 1.00 0.00 N ATOM 611 CA ARG A 42 -0.787 21.924 -8.633 1.00 0.00 C ATOM 612 C ARG A 42 -0.712 21.442 -10.079 1.00 0.00 C ATOM 613 O ARG A 42 -1.296 22.047 -10.977 1.00 0.00 O ATOM 614 CB ARG A 42 0.624 22.109 -8.072 1.00 0.00 C ATOM 615 CG ARG A 42 0.664 22.889 -6.769 1.00 0.00 C ATOM 616 CD ARG A 42 0.820 24.381 -7.017 1.00 0.00 C ATOM 617 NE ARG A 42 -0.465 25.033 -7.260 1.00 0.00 N ATOM 618 CZ ARG A 42 -0.686 26.324 -7.045 1.00 0.00 C ATOM 619 NH1 ARG A 42 0.287 27.099 -6.585 1.00 0.00 N ATOM 620 NH2 ARG A 42 -1.882 26.844 -7.290 1.00 0.00 N ATOM 0 H ARG A 42 -0.969 20.280 -7.345 1.00 0.00 H new ATOM 0 HA ARG A 42 -1.306 22.882 -8.614 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.074 21.129 -7.913 1.00 0.00 H new ATOM 0 HB3 ARG A 42 1.236 22.624 -8.813 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.251 22.706 -6.206 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.492 22.533 -6.156 1.00 0.00 H new ATOM 0 HD2 ARG A 42 1.304 24.843 -6.156 1.00 0.00 H new ATOM 0 HD3 ARG A 42 1.475 24.540 -7.874 1.00 0.00 H new ATOM 0 HE ARG A 42 -1.234 24.465 -7.614 1.00 0.00 H new ATOM 0 HH11 ARG A 42 1.208 26.703 -6.396 1.00 0.00 H new ATOM 0 HH12 ARG A 42 0.114 28.091 -6.421 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -2.633 26.251 -7.644 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -2.050 27.836 -7.124 1.00 0.00 H new ATOM 634 N GLY A 43 0.013 20.348 -10.296 1.00 0.00 N ATOM 635 CA GLY A 43 0.152 19.804 -11.634 1.00 0.00 C ATOM 636 C GLY A 43 1.574 19.380 -11.943 1.00 0.00 C ATOM 637 O GLY A 43 2.098 19.675 -13.018 1.00 0.00 O ATOM 0 H GLY A 43 0.506 19.829 -9.569 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -0.512 18.946 -11.745 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.167 20.550 -12.361 1.00 0.00 H new ATOM 641 N LEU A 44 2.201 18.687 -10.998 1.00 0.00 N ATOM 642 CA LEU A 44 3.573 18.223 -11.174 1.00 0.00 C ATOM 643 C LEU A 44 3.613 16.714 -11.395 1.00 0.00 C ATOM 644 O LEU A 44 2.688 15.995 -11.016 1.00 0.00 O ATOM 645 CB LEU A 44 4.418 18.593 -9.953 1.00 0.00 C ATOM 646 CG LEU A 44 4.474 20.081 -9.603 1.00 0.00 C ATOM 647 CD1 LEU A 44 3.353 20.446 -8.643 1.00 0.00 C ATOM 648 CD2 LEU A 44 5.828 20.436 -9.005 1.00 0.00 C ATOM 0 H LEU A 44 1.782 18.434 -10.103 1.00 0.00 H new ATOM 0 HA LEU A 44 3.986 18.712 -12.056 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.031 18.051 -9.090 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.436 18.241 -10.120 1.00 0.00 H new ATOM 0 HG LEU A 44 4.341 20.656 -10.519 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.409 21.508 -8.405 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.391 20.228 -9.107 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.454 19.864 -7.727 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.851 21.498 -8.762 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.990 19.853 -8.099 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.614 20.212 -9.726 1.00 0.00 H new ATOM 660 N LYS A 45 4.691 16.240 -12.010 1.00 0.00 N ATOM 661 CA LYS A 45 4.855 14.817 -12.280 1.00 0.00 C ATOM 662 C LYS A 45 5.656 14.142 -11.171 1.00 0.00 C ATOM 663 O LYS A 45 6.811 13.763 -11.370 1.00 0.00 O ATOM 664 CB LYS A 45 5.552 14.609 -13.626 1.00 0.00 C ATOM 665 CG LYS A 45 5.506 13.173 -14.119 1.00 0.00 C ATOM 666 CD LYS A 45 5.889 13.074 -15.587 1.00 0.00 C ATOM 667 CE LYS A 45 7.383 13.273 -15.787 1.00 0.00 C ATOM 668 NZ LYS A 45 8.148 12.019 -15.541 1.00 0.00 N ATOM 0 H LYS A 45 5.465 16.822 -12.331 1.00 0.00 H new ATOM 0 HA LYS A 45 3.865 14.363 -12.317 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.087 15.255 -14.370 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.593 14.921 -13.539 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.183 12.561 -13.523 1.00 0.00 H new ATOM 0 HG3 LYS A 45 4.503 12.770 -13.976 1.00 0.00 H new ATOM 0 HD2 LYS A 45 5.595 12.099 -15.976 1.00 0.00 H new ATOM 0 HD3 LYS A 45 5.341 13.823 -16.158 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.570 13.619 -16.803 1.00 0.00 H new ATOM 0 HE3 LYS A 45 7.739 14.053 -15.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.162 12.197 -15.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 7.990 11.702 -14.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.827 11.281 -16.200 1.00 0.00 H new ATOM 682 N ILE A 46 5.036 13.994 -10.005 1.00 0.00 N ATOM 683 CA ILE A 46 5.691 13.363 -8.867 1.00 0.00 C ATOM 684 C ILE A 46 5.877 11.867 -9.100 1.00 0.00 C ATOM 685 O ILE A 46 4.960 11.178 -9.546 1.00 0.00 O ATOM 686 CB ILE A 46 4.890 13.573 -7.568 1.00 0.00 C ATOM 687 CG1 ILE A 46 4.736 15.066 -7.274 1.00 0.00 C ATOM 688 CG2 ILE A 46 5.571 12.866 -6.406 1.00 0.00 C ATOM 689 CD1 ILE A 46 4.376 15.365 -5.836 1.00 0.00 C ATOM 0 H ILE A 46 4.081 14.303 -9.824 1.00 0.00 H new ATOM 0 HA ILE A 46 6.667 13.837 -8.763 1.00 0.00 H new ATOM 0 HB ILE A 46 3.897 13.143 -7.697 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.668 15.574 -7.520 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.966 15.479 -7.926 1.00 0.00 H new ATOM 0 HG21 ILE A 46 4.993 13.024 -5.495 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.633 11.798 -6.616 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.575 13.269 -6.273 1.00 0.00 H new ATOM 0 HD11 ILE A 46 4.283 16.443 -5.701 1.00 0.00 H new ATOM 0 HD12 ILE A 46 3.428 14.886 -5.591 1.00 0.00 H new ATOM 0 HD13 ILE A 46 5.157 14.983 -5.178 1.00 0.00 H new ATOM 701 N THR A 47 7.071 11.370 -8.793 1.00 0.00 N ATOM 702 CA THR A 47 7.378 9.956 -8.968 1.00 0.00 C ATOM 703 C THR A 47 7.259 9.200 -7.649 1.00 0.00 C ATOM 704 O THR A 47 7.630 9.713 -6.593 1.00 0.00 O ATOM 705 CB THR A 47 8.796 9.755 -9.535 1.00 0.00 C ATOM 706 OG1 THR A 47 8.993 10.602 -10.673 1.00 0.00 O ATOM 707 CG2 THR A 47 9.019 8.303 -9.933 1.00 0.00 C ATOM 0 H THR A 47 7.841 11.926 -8.422 1.00 0.00 H new ATOM 0 HA THR A 47 6.651 9.560 -9.678 1.00 0.00 H new ATOM 0 HB THR A 47 9.515 10.017 -8.758 1.00 0.00 H new ATOM 0 HG1 THR A 47 9.897 10.470 -11.027 1.00 0.00 H new ATOM 0 HG21 THR A 47 10.027 8.185 -10.331 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.897 7.663 -9.059 1.00 0.00 H new ATOM 0 HG23 THR A 47 8.293 8.019 -10.695 1.00 0.00 H new ATOM 715 N TYR A 48 6.741 7.979 -7.717 1.00 0.00 N ATOM 716 CA TYR A 48 6.572 7.153 -6.528 1.00 0.00 C ATOM 717 C TYR A 48 7.601 6.027 -6.495 1.00 0.00 C ATOM 718 O TYR A 48 7.991 5.495 -7.535 1.00 0.00 O ATOM 719 CB TYR A 48 5.159 6.568 -6.484 1.00 0.00 C ATOM 720 CG TYR A 48 4.073 7.592 -6.726 1.00 0.00 C ATOM 721 CD1 TYR A 48 3.893 8.662 -5.858 1.00 0.00 C ATOM 722 CD2 TYR A 48 3.225 7.488 -7.822 1.00 0.00 C ATOM 723 CE1 TYR A 48 2.902 9.599 -6.075 1.00 0.00 C ATOM 724 CE2 TYR A 48 2.231 8.421 -8.047 1.00 0.00 C ATOM 725 CZ TYR A 48 2.074 9.474 -7.171 1.00 0.00 C ATOM 726 OH TYR A 48 1.084 10.405 -7.392 1.00 0.00 O ATOM 0 H TYR A 48 6.431 7.539 -8.583 1.00 0.00 H new ATOM 0 HA TYR A 48 6.724 7.786 -5.654 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.077 5.780 -7.233 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.998 6.102 -5.512 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.539 8.763 -4.999 1.00 0.00 H new ATOM 0 HD2 TYR A 48 3.345 6.664 -8.510 1.00 0.00 H new ATOM 0 HE1 TYR A 48 2.776 10.425 -5.391 1.00 0.00 H new ATOM 0 HE2 TYR A 48 1.581 8.326 -8.904 1.00 0.00 H new ATOM 0 HH TYR A 48 0.591 10.172 -8.206 1.00 0.00 H new ATOM 736 N LYS A 49 8.038 5.669 -5.293 1.00 0.00 N ATOM 737 CA LYS A 49 9.021 4.606 -5.121 1.00 0.00 C ATOM 738 C LYS A 49 8.634 3.690 -3.964 1.00 0.00 C ATOM 739 O LYS A 49 7.804 4.046 -3.128 1.00 0.00 O ATOM 740 CB LYS A 49 10.409 5.201 -4.872 1.00 0.00 C ATOM 741 CG LYS A 49 11.519 4.165 -4.849 1.00 0.00 C ATOM 742 CD LYS A 49 12.884 4.815 -4.694 1.00 0.00 C ATOM 743 CE LYS A 49 14.006 3.835 -5.002 1.00 0.00 C ATOM 744 NZ LYS A 49 14.178 3.630 -6.467 1.00 0.00 N ATOM 0 H LYS A 49 7.727 6.100 -4.422 1.00 0.00 H new ATOM 0 HA LYS A 49 9.045 4.016 -6.037 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.625 5.935 -5.648 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.401 5.734 -3.921 1.00 0.00 H new ATOM 0 HG2 LYS A 49 11.351 3.468 -4.028 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.494 3.583 -5.770 1.00 0.00 H new ATOM 0 HD2 LYS A 49 12.957 5.674 -5.361 1.00 0.00 H new ATOM 0 HD3 LYS A 49 12.996 5.190 -3.677 1.00 0.00 H new ATOM 0 HE2 LYS A 49 14.938 4.205 -4.575 1.00 0.00 H new ATOM 0 HE3 LYS A 49 13.794 2.879 -4.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 15.005 3.023 -6.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 13.328 3.175 -6.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 14.322 4.549 -6.932 1.00 0.00 H new ATOM 758 N TYR A 50 9.243 2.510 -3.921 1.00 0.00 N ATOM 759 CA TYR A 50 8.962 1.542 -2.867 1.00 0.00 C ATOM 760 C TYR A 50 10.222 0.772 -2.484 1.00 0.00 C ATOM 761 O TYR A 50 10.912 0.220 -3.342 1.00 0.00 O ATOM 762 CB TYR A 50 7.872 0.568 -3.317 1.00 0.00 C ATOM 763 CG TYR A 50 6.513 1.212 -3.477 1.00 0.00 C ATOM 764 CD1 TYR A 50 5.704 1.456 -2.374 1.00 0.00 C ATOM 765 CD2 TYR A 50 6.038 1.576 -4.731 1.00 0.00 C ATOM 766 CE1 TYR A 50 4.462 2.043 -2.516 1.00 0.00 C ATOM 767 CE2 TYR A 50 4.798 2.165 -4.882 1.00 0.00 C ATOM 768 CZ TYR A 50 4.013 2.396 -3.771 1.00 0.00 C ATOM 769 OH TYR A 50 2.776 2.982 -3.916 1.00 0.00 O ATOM 0 H TYR A 50 9.935 2.201 -4.604 1.00 0.00 H new ATOM 0 HA TYR A 50 8.612 2.088 -1.991 1.00 0.00 H new ATOM 0 HB2 TYR A 50 8.166 0.120 -4.266 1.00 0.00 H new ATOM 0 HB3 TYR A 50 7.798 -0.242 -2.591 1.00 0.00 H new ATOM 0 HD1 TYR A 50 6.052 1.182 -1.389 1.00 0.00 H new ATOM 0 HD2 TYR A 50 6.649 1.395 -5.603 1.00 0.00 H new ATOM 0 HE1 TYR A 50 3.845 2.225 -1.648 1.00 0.00 H new ATOM 0 HE2 TYR A 50 4.445 2.443 -5.864 1.00 0.00 H new ATOM 0 HH TYR A 50 2.612 3.169 -4.864 1.00 0.00 H new ATOM 779 N THR A 51 10.516 0.738 -1.188 1.00 0.00 N ATOM 780 CA THR A 51 11.692 0.036 -0.689 1.00 0.00 C ATOM 781 C THR A 51 11.327 -0.906 0.452 1.00 0.00 C ATOM 782 O THR A 51 10.711 -0.497 1.435 1.00 0.00 O ATOM 783 CB THR A 51 12.770 1.023 -0.201 1.00 0.00 C ATOM 784 OG1 THR A 51 12.230 1.874 0.816 1.00 0.00 O ATOM 785 CG2 THR A 51 13.291 1.869 -1.353 1.00 0.00 C ATOM 0 H THR A 51 9.956 1.189 -0.465 1.00 0.00 H new ATOM 0 HA THR A 51 12.091 -0.544 -1.521 1.00 0.00 H new ATOM 0 HB THR A 51 13.599 0.447 0.210 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.962 2.264 1.339 1.00 0.00 H new ATOM 0 HG21 THR A 51 14.051 2.558 -0.984 1.00 0.00 H new ATOM 0 HG22 THR A 51 13.728 1.220 -2.112 1.00 0.00 H new ATOM 0 HG23 THR A 51 12.468 2.436 -1.789 1.00 0.00 H new ATOM 793 N GLY A 52 11.713 -2.171 0.315 1.00 0.00 N ATOM 794 CA GLY A 52 11.418 -3.152 1.343 1.00 0.00 C ATOM 795 C GLY A 52 11.426 -4.571 0.810 1.00 0.00 C ATOM 796 O GLY A 52 11.725 -4.801 -0.362 1.00 0.00 O ATOM 0 H GLY A 52 12.225 -2.534 -0.489 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.151 -3.064 2.145 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.442 -2.936 1.778 1.00 0.00 H new ATOM 800 N LYS A 53 11.098 -5.527 1.673 1.00 0.00 N ATOM 801 CA LYS A 53 11.068 -6.932 1.283 1.00 0.00 C ATOM 802 C LYS A 53 10.288 -7.121 -0.014 1.00 0.00 C ATOM 803 O LYS A 53 9.248 -6.497 -0.220 1.00 0.00 O ATOM 804 CB LYS A 53 10.443 -7.777 2.395 1.00 0.00 C ATOM 805 CG LYS A 53 10.288 -9.243 2.030 1.00 0.00 C ATOM 806 CD LYS A 53 11.583 -10.010 2.240 1.00 0.00 C ATOM 807 CE LYS A 53 11.879 -10.210 3.719 1.00 0.00 C ATOM 808 NZ LYS A 53 12.898 -11.273 3.941 1.00 0.00 N ATOM 0 H LYS A 53 10.849 -5.354 2.647 1.00 0.00 H new ATOM 0 HA LYS A 53 12.094 -7.260 1.119 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.059 -7.697 3.291 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.464 -7.368 2.644 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.498 -9.688 2.635 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.978 -9.329 0.989 1.00 0.00 H new ATOM 0 HD2 LYS A 53 11.517 -10.980 1.747 1.00 0.00 H new ATOM 0 HD3 LYS A 53 12.407 -9.470 1.773 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.232 -9.273 4.149 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.959 -10.474 4.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.072 -11.379 4.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.551 -12.173 3.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 13.784 -11.010 3.464 1.00 0.00 H new ATOM 822 N GLY A 54 10.797 -7.987 -0.885 1.00 0.00 N ATOM 823 CA GLY A 54 10.134 -8.243 -2.150 1.00 0.00 C ATOM 824 C GLY A 54 10.748 -7.462 -3.295 1.00 0.00 C ATOM 825 O GLY A 54 10.836 -7.960 -4.418 1.00 0.00 O ATOM 0 H GLY A 54 11.657 -8.516 -0.737 1.00 0.00 H new ATOM 0 HA2 GLY A 54 10.184 -9.309 -2.373 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.079 -7.984 -2.062 1.00 0.00 H new ATOM 829 N ILE A 55 11.172 -6.235 -3.012 1.00 0.00 N ATOM 830 CA ILE A 55 11.779 -5.384 -4.027 1.00 0.00 C ATOM 831 C ILE A 55 13.287 -5.277 -3.824 1.00 0.00 C ATOM 832 O ILE A 55 14.061 -5.362 -4.778 1.00 0.00 O ATOM 833 CB ILE A 55 11.170 -3.970 -4.015 1.00 0.00 C ATOM 834 CG1 ILE A 55 9.653 -4.044 -4.205 1.00 0.00 C ATOM 835 CG2 ILE A 55 11.803 -3.111 -5.099 1.00 0.00 C ATOM 836 CD1 ILE A 55 8.939 -2.752 -3.871 1.00 0.00 C ATOM 0 H ILE A 55 11.106 -5.808 -2.088 1.00 0.00 H new ATOM 0 HA ILE A 55 11.576 -5.850 -4.991 1.00 0.00 H new ATOM 0 HB ILE A 55 11.375 -3.510 -3.048 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.437 -4.312 -5.239 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.255 -4.842 -3.579 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.362 -2.115 -5.078 1.00 0.00 H new ATOM 0 HG22 ILE A 55 12.876 -3.037 -4.924 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.625 -3.566 -6.074 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.868 -2.877 -4.028 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.125 -2.493 -2.829 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.310 -1.954 -4.515 1.00 0.00 H new ATOM 848 N THR A 56 13.699 -5.091 -2.574 1.00 0.00 N ATOM 849 CA THR A 56 15.114 -4.974 -2.245 1.00 0.00 C ATOM 850 C THR A 56 15.671 -6.297 -1.734 1.00 0.00 C ATOM 851 O THR A 56 16.795 -6.676 -2.063 1.00 0.00 O ATOM 852 CB THR A 56 15.354 -3.884 -1.183 1.00 0.00 C ATOM 853 OG1 THR A 56 14.685 -4.230 0.035 1.00 0.00 O ATOM 854 CG2 THR A 56 14.859 -2.532 -1.673 1.00 0.00 C ATOM 0 H THR A 56 13.072 -5.018 -1.772 1.00 0.00 H new ATOM 0 HA THR A 56 15.631 -4.697 -3.164 1.00 0.00 H new ATOM 0 HB THR A 56 16.427 -3.816 -1.001 1.00 0.00 H new ATOM 0 HG1 THR A 56 13.732 -4.370 -0.144 1.00 0.00 H new ATOM 0 HG21 THR A 56 15.039 -1.779 -0.906 1.00 0.00 H new ATOM 0 HG22 THR A 56 15.392 -2.258 -2.583 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.791 -2.589 -1.881 1.00 0.00 H new ATOM 862 N GLU A 57 14.878 -6.996 -0.927 1.00 0.00 N ATOM 863 CA GLU A 57 15.295 -8.278 -0.371 1.00 0.00 C ATOM 864 C GLU A 57 14.434 -9.414 -0.917 1.00 0.00 C ATOM 865 O GLU A 57 13.241 -9.252 -1.176 1.00 0.00 O ATOM 866 CB GLU A 57 15.211 -8.248 1.156 1.00 0.00 C ATOM 867 CG GLU A 57 16.222 -7.317 1.803 1.00 0.00 C ATOM 868 CD GLU A 57 16.349 -7.542 3.298 1.00 0.00 C ATOM 869 OE1 GLU A 57 15.370 -8.016 3.911 1.00 0.00 O ATOM 870 OE2 GLU A 57 17.427 -7.243 3.853 1.00 0.00 O ATOM 0 H GLU A 57 13.945 -6.696 -0.644 1.00 0.00 H new ATOM 0 HA GLU A 57 16.329 -8.455 -0.667 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.207 -7.942 1.450 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.361 -9.257 1.540 1.00 0.00 H new ATOM 0 HG2 GLU A 57 17.195 -7.461 1.334 1.00 0.00 H new ATOM 0 HG3 GLU A 57 15.929 -6.284 1.618 1.00 0.00 H new ATOM 877 N PRO A 58 15.051 -10.591 -1.096 1.00 0.00 N ATOM 878 CA PRO A 58 14.361 -11.776 -1.613 1.00 0.00 C ATOM 879 C PRO A 58 13.358 -12.344 -0.614 1.00 0.00 C ATOM 880 O PRO A 58 13.457 -12.126 0.594 1.00 0.00 O ATOM 881 CB PRO A 58 15.498 -12.772 -1.853 1.00 0.00 C ATOM 882 CG PRO A 58 16.575 -12.351 -0.913 1.00 0.00 C ATOM 883 CD PRO A 58 16.471 -10.855 -0.808 1.00 0.00 C ATOM 0 HA PRO A 58 13.777 -11.551 -2.506 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.177 -13.795 -1.655 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.840 -12.740 -2.887 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.447 -12.821 0.062 1.00 0.00 H new ATOM 0 HG3 PRO A 58 17.556 -12.649 -1.284 1.00 0.00 H new ATOM 0 HD2 PRO A 58 16.752 -10.501 0.184 1.00 0.00 H new ATOM 0 HD3 PRO A 58 17.126 -10.355 -1.522 1.00 0.00 H new ATOM 891 N PRO A 59 12.368 -13.089 -1.128 1.00 0.00 N ATOM 892 CA PRO A 59 12.240 -13.354 -2.564 1.00 0.00 C ATOM 893 C PRO A 59 11.842 -12.109 -3.350 1.00 0.00 C ATOM 894 O PRO A 59 11.199 -11.205 -2.816 1.00 0.00 O ATOM 895 CB PRO A 59 11.130 -14.407 -2.632 1.00 0.00 C ATOM 896 CG PRO A 59 10.326 -14.191 -1.397 1.00 0.00 C ATOM 897 CD PRO A 59 11.297 -13.730 -0.346 1.00 0.00 C ATOM 0 HA PRO A 59 13.183 -13.679 -3.005 1.00 0.00 H new ATOM 0 HB2 PRO A 59 10.521 -14.283 -3.527 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.543 -15.415 -2.664 1.00 0.00 H new ATOM 0 HG2 PRO A 59 9.548 -13.446 -1.563 1.00 0.00 H new ATOM 0 HG3 PRO A 59 9.827 -15.110 -1.091 1.00 0.00 H new ATOM 0 HD2 PRO A 59 10.834 -13.030 0.350 1.00 0.00 H new ATOM 0 HD3 PRO A 59 11.675 -14.564 0.245 1.00 0.00 H new ATOM 905 N PHE A 60 12.229 -12.069 -4.620 1.00 0.00 N ATOM 906 CA PHE A 60 11.913 -10.934 -5.480 1.00 0.00 C ATOM 907 C PHE A 60 10.792 -11.285 -6.455 1.00 0.00 C ATOM 908 O PHE A 60 10.359 -12.434 -6.531 1.00 0.00 O ATOM 909 CB PHE A 60 13.156 -10.491 -6.253 1.00 0.00 C ATOM 910 CG PHE A 60 14.253 -9.963 -5.373 1.00 0.00 C ATOM 911 CD1 PHE A 60 15.111 -10.831 -4.717 1.00 0.00 C ATOM 912 CD2 PHE A 60 14.425 -8.599 -5.202 1.00 0.00 C ATOM 913 CE1 PHE A 60 16.122 -10.349 -3.907 1.00 0.00 C ATOM 914 CE2 PHE A 60 15.434 -8.111 -4.393 1.00 0.00 C ATOM 915 CZ PHE A 60 16.283 -8.987 -3.744 1.00 0.00 C ATOM 0 H PHE A 60 12.762 -12.809 -5.077 1.00 0.00 H new ATOM 0 HA PHE A 60 11.576 -10.113 -4.847 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.537 -11.335 -6.828 1.00 0.00 H new ATOM 0 HB3 PHE A 60 12.873 -9.720 -6.969 1.00 0.00 H new ATOM 0 HD1 PHE A 60 14.988 -11.897 -4.840 1.00 0.00 H new ATOM 0 HD2 PHE A 60 13.764 -7.910 -5.706 1.00 0.00 H new ATOM 0 HE1 PHE A 60 16.785 -11.036 -3.402 1.00 0.00 H new ATOM 0 HE2 PHE A 60 15.559 -7.046 -4.268 1.00 0.00 H new ATOM 0 HZ PHE A 60 17.071 -8.607 -3.110 1.00 0.00 H new ATOM 925 N GLY A 61 10.327 -10.286 -7.198 1.00 0.00 N ATOM 926 CA GLY A 61 9.261 -10.508 -8.157 1.00 0.00 C ATOM 927 C GLY A 61 7.916 -10.718 -7.491 1.00 0.00 C ATOM 928 O GLY A 61 7.187 -11.651 -7.829 1.00 0.00 O ATOM 0 H GLY A 61 10.670 -9.326 -7.153 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.200 -9.654 -8.831 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.501 -11.379 -8.767 1.00 0.00 H new ATOM 932 N ILE A 62 7.586 -9.850 -6.540 1.00 0.00 N ATOM 933 CA ILE A 62 6.320 -9.946 -5.825 1.00 0.00 C ATOM 934 C ILE A 62 5.479 -8.689 -6.024 1.00 0.00 C ATOM 935 O ILE A 62 4.280 -8.767 -6.291 1.00 0.00 O ATOM 936 CB ILE A 62 6.541 -10.168 -4.317 1.00 0.00 C ATOM 937 CG1 ILE A 62 7.466 -11.365 -4.085 1.00 0.00 C ATOM 938 CG2 ILE A 62 5.209 -10.377 -3.611 1.00 0.00 C ATOM 939 CD1 ILE A 62 7.922 -11.507 -2.650 1.00 0.00 C ATOM 0 H ILE A 62 8.178 -9.073 -6.247 1.00 0.00 H new ATOM 0 HA ILE A 62 5.789 -10.804 -6.237 1.00 0.00 H new ATOM 0 HB ILE A 62 7.016 -9.280 -3.900 1.00 0.00 H new ATOM 0 HG12 ILE A 62 6.949 -12.277 -4.385 1.00 0.00 H new ATOM 0 HG13 ILE A 62 8.341 -11.268 -4.728 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.382 -10.533 -2.546 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.581 -9.498 -3.752 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.709 -11.251 -4.029 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.574 -12.376 -2.560 1.00 0.00 H new ATOM 0 HD12 ILE A 62 8.467 -10.612 -2.351 1.00 0.00 H new ATOM 0 HD13 ILE A 62 7.054 -11.636 -2.003 1.00 0.00 H new ATOM 951 N PHE A 63 6.117 -7.530 -5.894 1.00 0.00 N ATOM 952 CA PHE A 63 5.429 -6.256 -6.061 1.00 0.00 C ATOM 953 C PHE A 63 6.019 -5.467 -7.226 1.00 0.00 C ATOM 954 O PHE A 63 7.220 -5.197 -7.263 1.00 0.00 O ATOM 955 CB PHE A 63 5.518 -5.432 -4.775 1.00 0.00 C ATOM 956 CG PHE A 63 5.095 -6.187 -3.548 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.804 -6.678 -3.431 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.988 -6.407 -2.511 1.00 0.00 C ATOM 959 CE1 PHE A 63 3.412 -7.373 -2.303 1.00 0.00 C ATOM 960 CE2 PHE A 63 5.601 -7.102 -1.381 1.00 0.00 C ATOM 961 CZ PHE A 63 4.312 -7.586 -1.277 1.00 0.00 C ATOM 0 H PHE A 63 7.109 -7.448 -5.673 1.00 0.00 H new ATOM 0 HA PHE A 63 4.382 -6.463 -6.280 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.544 -5.088 -4.644 1.00 0.00 H new ATOM 0 HB3 PHE A 63 4.894 -4.544 -4.878 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.097 -6.515 -4.231 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.998 -6.031 -2.587 1.00 0.00 H new ATOM 0 HE1 PHE A 63 2.403 -7.749 -2.224 1.00 0.00 H new ATOM 0 HE2 PHE A 63 6.306 -7.266 -0.580 1.00 0.00 H new ATOM 0 HZ PHE A 63 4.008 -8.130 -0.395 1.00 0.00 H new ATOM 971 N VAL A 64 5.166 -5.101 -8.178 1.00 0.00 N ATOM 972 CA VAL A 64 5.602 -4.343 -9.345 1.00 0.00 C ATOM 973 C VAL A 64 5.092 -2.907 -9.289 1.00 0.00 C ATOM 974 O VAL A 64 3.917 -2.664 -9.013 1.00 0.00 O ATOM 975 CB VAL A 64 5.117 -4.998 -10.652 1.00 0.00 C ATOM 976 CG1 VAL A 64 5.856 -6.304 -10.900 1.00 0.00 C ATOM 977 CG2 VAL A 64 3.614 -5.225 -10.608 1.00 0.00 C ATOM 0 H VAL A 64 4.169 -5.317 -8.164 1.00 0.00 H new ATOM 0 HA VAL A 64 6.692 -4.339 -9.332 1.00 0.00 H new ATOM 0 HB VAL A 64 5.334 -4.323 -11.480 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.500 -6.753 -11.828 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.925 -6.108 -10.978 1.00 0.00 H new ATOM 0 HG13 VAL A 64 5.673 -6.989 -10.072 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.289 -5.688 -11.539 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.369 -5.880 -9.772 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.105 -4.269 -10.481 1.00 0.00 H new ATOM 987 N PHE A 65 5.984 -1.958 -9.553 1.00 0.00 N ATOM 988 CA PHE A 65 5.625 -0.545 -9.533 1.00 0.00 C ATOM 989 C PHE A 65 6.439 0.238 -10.559 1.00 0.00 C ATOM 990 O PHE A 65 7.620 -0.034 -10.768 1.00 0.00 O ATOM 991 CB PHE A 65 5.847 0.039 -8.136 1.00 0.00 C ATOM 992 CG PHE A 65 7.258 0.492 -7.893 1.00 0.00 C ATOM 993 CD1 PHE A 65 7.654 1.778 -8.221 1.00 0.00 C ATOM 994 CD2 PHE A 65 8.190 -0.370 -7.336 1.00 0.00 C ATOM 995 CE1 PHE A 65 8.952 2.198 -7.998 1.00 0.00 C ATOM 996 CE2 PHE A 65 9.489 0.044 -7.111 1.00 0.00 C ATOM 997 CZ PHE A 65 9.871 1.329 -7.443 1.00 0.00 C ATOM 0 H PHE A 65 6.961 -2.142 -9.783 1.00 0.00 H new ATOM 0 HA PHE A 65 4.570 -0.460 -9.792 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.173 0.884 -7.993 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.581 -0.711 -7.391 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.940 2.461 -8.656 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.898 -1.376 -7.075 1.00 0.00 H new ATOM 0 HE1 PHE A 65 9.247 3.204 -8.257 1.00 0.00 H new ATOM 0 HE2 PHE A 65 10.205 -0.637 -6.676 1.00 0.00 H new ATOM 0 HZ PHE A 65 10.886 1.654 -7.269 1.00 0.00 H new ATOM 1007 N ASN A 66 5.797 1.211 -11.197 1.00 0.00 N ATOM 1008 CA ASN A 66 6.460 2.033 -12.203 1.00 0.00 C ATOM 1009 C ASN A 66 6.486 3.498 -11.777 1.00 0.00 C ATOM 1010 O ASN A 66 5.997 3.853 -10.704 1.00 0.00 O ATOM 1011 CB ASN A 66 5.752 1.895 -13.552 1.00 0.00 C ATOM 1012 CG ASN A 66 6.699 2.075 -14.723 1.00 0.00 C ATOM 1013 OD1 ASN A 66 7.805 1.534 -14.730 1.00 0.00 O ATOM 1014 ND2 ASN A 66 6.267 2.837 -15.721 1.00 0.00 N ATOM 0 H ASN A 66 4.819 1.450 -11.035 1.00 0.00 H new ATOM 0 HA ASN A 66 7.488 1.683 -12.302 1.00 0.00 H new ATOM 0 HB2 ASN A 66 5.284 0.913 -13.615 1.00 0.00 H new ATOM 0 HB3 ASN A 66 4.953 2.634 -13.617 1.00 0.00 H new ATOM 0 HD21 ASN A 66 6.859 2.994 -16.536 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.343 3.266 -15.672 1.00 0.00 H new ATOM 1021 N LYS A 67 7.058 4.345 -12.626 1.00 0.00 N ATOM 1022 CA LYS A 67 7.147 5.772 -12.340 1.00 0.00 C ATOM 1023 C LYS A 67 6.192 6.564 -13.226 1.00 0.00 C ATOM 1024 O LYS A 67 5.763 7.661 -12.867 1.00 0.00 O ATOM 1025 CB LYS A 67 8.581 6.266 -12.549 1.00 0.00 C ATOM 1026 CG LYS A 67 9.023 6.255 -14.002 1.00 0.00 C ATOM 1027 CD LYS A 67 10.215 7.170 -14.229 1.00 0.00 C ATOM 1028 CE LYS A 67 10.217 7.744 -15.637 1.00 0.00 C ATOM 1029 NZ LYS A 67 10.405 6.684 -16.667 1.00 0.00 N ATOM 0 H LYS A 67 7.467 4.068 -13.518 1.00 0.00 H new ATOM 0 HA LYS A 67 6.863 5.928 -11.299 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.667 7.280 -12.160 1.00 0.00 H new ATOM 0 HB3 LYS A 67 9.260 5.642 -11.967 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.282 5.238 -14.297 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.195 6.570 -14.638 1.00 0.00 H new ATOM 0 HD2 LYS A 67 10.194 7.983 -13.504 1.00 0.00 H new ATOM 0 HD3 LYS A 67 11.138 6.616 -14.060 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.277 8.264 -15.819 1.00 0.00 H new ATOM 0 HE3 LYS A 67 11.013 8.483 -15.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.418 7.117 -17.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 11.306 6.193 -16.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.623 6.001 -16.609 1.00 0.00 H new ATOM 1043 N ASP A 68 5.860 6.002 -14.383 1.00 0.00 N ATOM 1044 CA ASP A 68 4.952 6.655 -15.319 1.00 0.00 C ATOM 1045 C ASP A 68 3.501 6.473 -14.885 1.00 0.00 C ATOM 1046 O ASP A 68 2.741 7.438 -14.800 1.00 0.00 O ATOM 1047 CB ASP A 68 5.150 6.096 -16.729 1.00 0.00 C ATOM 1048 CG ASP A 68 3.935 6.308 -17.611 1.00 0.00 C ATOM 1049 OD1 ASP A 68 3.773 7.428 -18.139 1.00 0.00 O ATOM 1050 OD2 ASP A 68 3.148 5.352 -17.774 1.00 0.00 O ATOM 0 H ASP A 68 6.206 5.095 -14.695 1.00 0.00 H new ATOM 0 HA ASP A 68 5.180 7.721 -15.324 1.00 0.00 H new ATOM 0 HB2 ASP A 68 6.016 6.573 -17.188 1.00 0.00 H new ATOM 0 HB3 ASP A 68 5.369 5.030 -16.667 1.00 0.00 H new ATOM 1055 N THR A 69 3.122 5.228 -14.612 1.00 0.00 N ATOM 1056 CA THR A 69 1.762 4.919 -14.190 1.00 0.00 C ATOM 1057 C THR A 69 1.602 5.088 -12.683 1.00 0.00 C ATOM 1058 O THR A 69 0.578 5.577 -12.209 1.00 0.00 O ATOM 1059 CB THR A 69 1.366 3.481 -14.578 1.00 0.00 C ATOM 1060 OG1 THR A 69 2.191 2.541 -13.881 1.00 0.00 O ATOM 1061 CG2 THR A 69 1.502 3.269 -16.078 1.00 0.00 C ATOM 0 H THR A 69 3.738 4.418 -14.676 1.00 0.00 H new ATOM 0 HA THR A 69 1.105 5.621 -14.704 1.00 0.00 H new ATOM 0 HB THR A 69 0.324 3.326 -14.298 1.00 0.00 H new ATOM 0 HG1 THR A 69 1.932 1.630 -14.132 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.217 2.247 -16.328 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.851 3.967 -16.605 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.536 3.441 -16.378 1.00 0.00 H new ATOM 1069 N GLY A 70 2.623 4.681 -11.935 1.00 0.00 N ATOM 1070 CA GLY A 70 2.576 4.798 -10.489 1.00 0.00 C ATOM 1071 C GLY A 70 1.481 3.949 -9.875 1.00 0.00 C ATOM 1072 O GLY A 70 0.359 4.416 -9.683 1.00 0.00 O ATOM 0 H GLY A 70 3.482 4.272 -12.304 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.538 4.502 -10.072 1.00 0.00 H new ATOM 0 HA3 GLY A 70 2.418 5.842 -10.217 1.00 0.00 H new ATOM 1076 N GLU A 71 1.806 2.697 -9.567 1.00 0.00 N ATOM 1077 CA GLU A 71 0.840 1.780 -8.974 1.00 0.00 C ATOM 1078 C GLU A 71 1.540 0.562 -8.379 1.00 0.00 C ATOM 1079 O GLU A 71 2.580 0.126 -8.874 1.00 0.00 O ATOM 1080 CB GLU A 71 -0.183 1.335 -10.021 1.00 0.00 C ATOM 1081 CG GLU A 71 0.423 0.533 -11.160 1.00 0.00 C ATOM 1082 CD GLU A 71 -0.627 -0.152 -12.014 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -1.756 -0.352 -11.520 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -0.318 -0.489 -13.176 1.00 0.00 O ATOM 0 H GLU A 71 2.731 2.295 -9.718 1.00 0.00 H new ATOM 0 HA GLU A 71 0.322 2.306 -8.172 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -0.952 0.735 -9.534 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.678 2.216 -10.431 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.021 1.194 -11.787 1.00 0.00 H new ATOM 0 HG3 GLU A 71 1.100 -0.217 -10.751 1.00 0.00 H new ATOM 1091 N LEU A 72 0.962 0.016 -7.315 1.00 0.00 N ATOM 1092 CA LEU A 72 1.529 -1.152 -6.651 1.00 0.00 C ATOM 1093 C LEU A 72 0.690 -2.396 -6.926 1.00 0.00 C ATOM 1094 O LEU A 72 -0.294 -2.658 -6.236 1.00 0.00 O ATOM 1095 CB LEU A 72 1.624 -0.911 -5.143 1.00 0.00 C ATOM 1096 CG LEU A 72 2.353 -1.986 -4.336 1.00 0.00 C ATOM 1097 CD1 LEU A 72 3.859 -1.846 -4.498 1.00 0.00 C ATOM 1098 CD2 LEU A 72 1.963 -1.906 -2.867 1.00 0.00 C ATOM 0 H LEU A 72 0.101 0.364 -6.894 1.00 0.00 H new ATOM 0 HA LEU A 72 2.530 -1.315 -7.051 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.127 0.042 -4.979 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.613 -0.811 -4.747 1.00 0.00 H new ATOM 0 HG LEU A 72 2.057 -2.963 -4.718 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.361 -2.619 -3.917 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.123 -1.954 -5.550 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.173 -0.864 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.491 -2.678 -2.308 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.230 -0.926 -2.473 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.888 -2.057 -2.767 1.00 0.00 H new ATOM 1110 N ASN A 73 1.088 -3.160 -7.939 1.00 0.00 N ATOM 1111 CA ASN A 73 0.374 -4.377 -8.305 1.00 0.00 C ATOM 1112 C ASN A 73 1.139 -5.615 -7.848 1.00 0.00 C ATOM 1113 O ASN A 73 2.289 -5.826 -8.235 1.00 0.00 O ATOM 1114 CB ASN A 73 0.154 -4.429 -9.818 1.00 0.00 C ATOM 1115 CG ASN A 73 -0.757 -3.320 -10.308 1.00 0.00 C ATOM 1116 OD1 ASN A 73 -0.807 -2.239 -9.722 1.00 0.00 O ATOM 1117 ND2 ASN A 73 -1.482 -3.584 -11.389 1.00 0.00 N ATOM 0 H ASN A 73 1.901 -2.957 -8.520 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.594 -4.365 -7.804 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.116 -4.356 -10.325 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.276 -5.394 -10.087 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -2.112 -2.876 -11.766 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -1.408 -4.495 -11.843 1.00 0.00 H new ATOM 1124 N VAL A 74 0.493 -6.433 -7.022 1.00 0.00 N ATOM 1125 CA VAL A 74 1.112 -7.651 -6.514 1.00 0.00 C ATOM 1126 C VAL A 74 0.954 -8.802 -7.501 1.00 0.00 C ATOM 1127 O VAL A 74 -0.105 -8.974 -8.107 1.00 0.00 O ATOM 1128 CB VAL A 74 0.507 -8.065 -5.159 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -0.972 -8.389 -5.312 1.00 0.00 C ATOM 1130 CG2 VAL A 74 1.263 -9.249 -4.577 1.00 0.00 C ATOM 0 H VAL A 74 -0.459 -6.274 -6.691 1.00 0.00 H new ATOM 0 HA VAL A 74 2.172 -7.434 -6.380 1.00 0.00 H new ATOM 0 HB VAL A 74 0.602 -7.228 -4.467 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.383 -8.679 -4.345 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.501 -7.510 -5.682 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.093 -9.210 -6.019 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.822 -9.528 -3.620 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.202 -10.093 -5.264 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.308 -8.976 -4.429 1.00 0.00 H new ATOM 1140 N THR A 75 2.013 -9.589 -7.660 1.00 0.00 N ATOM 1141 CA THR A 75 1.993 -10.723 -8.574 1.00 0.00 C ATOM 1142 C THR A 75 2.500 -11.988 -7.892 1.00 0.00 C ATOM 1143 O THR A 75 3.144 -12.828 -8.521 1.00 0.00 O ATOM 1144 CB THR A 75 2.848 -10.450 -9.827 1.00 0.00 C ATOM 1145 OG1 THR A 75 4.209 -10.217 -9.449 1.00 0.00 O ATOM 1146 CG2 THR A 75 2.316 -9.249 -10.594 1.00 0.00 C ATOM 0 H THR A 75 2.897 -9.461 -7.167 1.00 0.00 H new ATOM 0 HA THR A 75 0.956 -10.868 -8.876 1.00 0.00 H new ATOM 0 HB THR A 75 2.796 -11.326 -10.474 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.746 -10.046 -10.250 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.935 -9.076 -11.474 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.289 -9.442 -10.905 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.342 -8.368 -9.953 1.00 0.00 H new ATOM 1154 N SER A 76 2.206 -12.119 -6.603 1.00 0.00 N ATOM 1155 CA SER A 76 2.635 -13.282 -5.834 1.00 0.00 C ATOM 1156 C SER A 76 1.617 -13.622 -4.750 1.00 0.00 C ATOM 1157 O SER A 76 0.843 -12.767 -4.320 1.00 0.00 O ATOM 1158 CB SER A 76 4.004 -13.024 -5.202 1.00 0.00 C ATOM 1159 OG SER A 76 4.703 -14.238 -4.986 1.00 0.00 O ATOM 0 H SER A 76 1.672 -11.434 -6.068 1.00 0.00 H new ATOM 0 HA SER A 76 2.711 -14.130 -6.515 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.591 -12.373 -5.851 1.00 0.00 H new ATOM 0 HB3 SER A 76 3.878 -12.500 -4.255 1.00 0.00 H new ATOM 0 HG SER A 76 5.575 -14.046 -4.583 1.00 0.00 H new ATOM 1165 N ILE A 77 1.625 -14.877 -4.314 1.00 0.00 N ATOM 1166 CA ILE A 77 0.704 -15.331 -3.279 1.00 0.00 C ATOM 1167 C ILE A 77 1.324 -15.196 -1.893 1.00 0.00 C ATOM 1168 O ILE A 77 2.027 -16.093 -1.425 1.00 0.00 O ATOM 1169 CB ILE A 77 0.286 -16.797 -3.502 1.00 0.00 C ATOM 1170 CG1 ILE A 77 -0.458 -16.942 -4.831 1.00 0.00 C ATOM 1171 CG2 ILE A 77 -0.581 -17.281 -2.349 1.00 0.00 C ATOM 1172 CD1 ILE A 77 0.460 -17.122 -6.020 1.00 0.00 C ATOM 0 H ILE A 77 2.258 -15.597 -4.661 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.180 -14.696 -3.342 1.00 0.00 H new ATOM 0 HB ILE A 77 1.184 -17.413 -3.541 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.132 -17.797 -4.770 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -1.077 -16.059 -4.990 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.869 -18.318 -2.521 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.020 -17.209 -1.417 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.476 -16.663 -2.282 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.135 -17.218 -6.928 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.117 -16.256 -6.107 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.061 -18.021 -5.883 1.00 0.00 H new ATOM 1184 N LEU A 78 1.058 -14.070 -1.239 1.00 0.00 N ATOM 1185 CA LEU A 78 1.589 -13.818 0.096 1.00 0.00 C ATOM 1186 C LEU A 78 1.576 -15.090 0.937 1.00 0.00 C ATOM 1187 O LEU A 78 0.757 -15.983 0.717 1.00 0.00 O ATOM 1188 CB LEU A 78 0.775 -12.725 0.791 1.00 0.00 C ATOM 1189 CG LEU A 78 0.602 -11.419 0.014 1.00 0.00 C ATOM 1190 CD1 LEU A 78 -0.407 -10.516 0.705 1.00 0.00 C ATOM 1191 CD2 LEU A 78 1.939 -10.709 -0.140 1.00 0.00 C ATOM 0 H LEU A 78 0.478 -13.318 -1.611 1.00 0.00 H new ATOM 0 HA LEU A 78 2.621 -13.484 -0.007 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.214 -13.124 1.016 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.251 -12.497 1.745 1.00 0.00 H new ATOM 0 HG LEU A 78 0.223 -11.658 -0.980 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.517 -9.592 0.138 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.370 -11.023 0.762 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.059 -10.285 1.712 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.797 -9.782 -0.695 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.347 -10.483 0.845 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.633 -11.353 -0.681 1.00 0.00 H new ATOM 1203 N ASP A 79 2.486 -15.165 1.901 1.00 0.00 N ATOM 1204 CA ASP A 79 2.577 -16.326 2.778 1.00 0.00 C ATOM 1205 C ASP A 79 3.102 -15.928 4.154 1.00 0.00 C ATOM 1206 O ASP A 79 4.161 -15.311 4.271 1.00 0.00 O ATOM 1207 CB ASP A 79 3.487 -17.389 2.160 1.00 0.00 C ATOM 1208 CG ASP A 79 3.123 -18.792 2.603 1.00 0.00 C ATOM 1209 OD1 ASP A 79 2.278 -18.927 3.513 1.00 0.00 O ATOM 1210 OD2 ASP A 79 3.682 -19.756 2.040 1.00 0.00 O ATOM 0 H ASP A 79 3.172 -14.435 2.095 1.00 0.00 H new ATOM 0 HA ASP A 79 1.576 -16.740 2.896 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.427 -17.327 1.073 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.521 -17.182 2.434 1.00 0.00 H new ATOM 1215 N ARG A 80 2.354 -16.286 5.193 1.00 0.00 N ATOM 1216 CA ARG A 80 2.743 -15.964 6.561 1.00 0.00 C ATOM 1217 C ARG A 80 4.043 -16.668 6.937 1.00 0.00 C ATOM 1218 O ARG A 80 5.055 -16.020 7.204 1.00 0.00 O ATOM 1219 CB ARG A 80 1.634 -16.364 7.536 1.00 0.00 C ATOM 1220 CG ARG A 80 1.592 -15.511 8.794 1.00 0.00 C ATOM 1221 CD ARG A 80 0.264 -15.655 9.521 1.00 0.00 C ATOM 1222 NE ARG A 80 0.406 -15.468 10.962 1.00 0.00 N ATOM 1223 CZ ARG A 80 -0.457 -15.944 11.853 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -1.517 -16.631 11.453 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -0.259 -15.732 13.148 1.00 0.00 N ATOM 0 H ARG A 80 1.476 -16.799 5.114 1.00 0.00 H new ATOM 0 HA ARG A 80 2.902 -14.887 6.623 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.672 -16.294 7.028 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.770 -17.408 7.819 1.00 0.00 H new ATOM 0 HG2 ARG A 80 2.405 -15.801 9.459 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.753 -14.465 8.531 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.445 -14.926 9.129 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.152 -16.643 9.323 1.00 0.00 H new ATOM 0 HE ARG A 80 1.211 -14.943 11.303 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -1.672 -16.796 10.458 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -2.178 -16.995 12.140 1.00 0.00 H new ATOM 0 HH21 ARG A 80 0.556 -15.203 13.460 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -0.922 -16.098 13.832 1.00 0.00 H new ATOM 1239 N GLU A 81 4.008 -17.996 6.954 1.00 0.00 N ATOM 1240 CA GLU A 81 5.184 -18.787 7.299 1.00 0.00 C ATOM 1241 C GLU A 81 6.436 -18.214 6.641 1.00 0.00 C ATOM 1242 O GLU A 81 7.442 -17.970 7.306 1.00 0.00 O ATOM 1243 CB GLU A 81 4.990 -20.243 6.870 1.00 0.00 C ATOM 1244 CG GLU A 81 4.900 -20.428 5.365 1.00 0.00 C ATOM 1245 CD GLU A 81 4.532 -21.846 4.972 1.00 0.00 C ATOM 1246 OE1 GLU A 81 3.445 -22.309 5.377 1.00 0.00 O ATOM 1247 OE2 GLU A 81 5.330 -22.491 4.261 1.00 0.00 O ATOM 0 H GLU A 81 3.179 -18.547 6.733 1.00 0.00 H new ATOM 0 HA GLU A 81 5.312 -18.749 8.381 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.819 -20.839 7.252 1.00 0.00 H new ATOM 0 HB3 GLU A 81 4.081 -20.630 7.330 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.158 -19.739 4.962 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.857 -20.166 4.913 1.00 0.00 H new ATOM 1254 N GLU A 82 6.365 -18.003 5.330 1.00 0.00 N ATOM 1255 CA GLU A 82 7.493 -17.461 4.582 1.00 0.00 C ATOM 1256 C GLU A 82 7.830 -16.049 5.053 1.00 0.00 C ATOM 1257 O GLU A 82 8.895 -15.808 5.622 1.00 0.00 O ATOM 1258 CB GLU A 82 7.183 -17.450 3.084 1.00 0.00 C ATOM 1259 CG GLU A 82 8.423 -17.436 2.206 1.00 0.00 C ATOM 1260 CD GLU A 82 9.224 -18.719 2.307 1.00 0.00 C ATOM 1261 OE1 GLU A 82 8.673 -19.791 1.980 1.00 0.00 O ATOM 1262 OE2 GLU A 82 10.403 -18.651 2.713 1.00 0.00 O ATOM 0 H GLU A 82 5.539 -18.199 4.765 1.00 0.00 H new ATOM 0 HA GLU A 82 8.356 -18.102 4.762 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.584 -18.327 2.839 1.00 0.00 H new ATOM 0 HB3 GLU A 82 6.575 -16.575 2.854 1.00 0.00 H new ATOM 0 HG2 GLU A 82 8.127 -17.277 1.169 1.00 0.00 H new ATOM 0 HG3 GLU A 82 9.055 -16.594 2.490 1.00 0.00 H new ATOM 1269 N THR A 83 6.913 -15.116 4.812 1.00 0.00 N ATOM 1270 CA THR A 83 7.112 -13.728 5.208 1.00 0.00 C ATOM 1271 C THR A 83 5.952 -13.229 6.063 1.00 0.00 C ATOM 1272 O THR A 83 4.794 -13.233 5.644 1.00 0.00 O ATOM 1273 CB THR A 83 7.263 -12.810 3.981 1.00 0.00 C ATOM 1274 OG1 THR A 83 6.195 -13.046 3.058 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.599 -13.044 3.291 1.00 0.00 C ATOM 0 H THR A 83 6.025 -15.298 4.344 1.00 0.00 H new ATOM 0 HA THR A 83 8.031 -13.694 5.792 1.00 0.00 H new ATOM 0 HB THR A 83 7.225 -11.775 4.322 1.00 0.00 H new ATOM 0 HG1 THR A 83 6.022 -12.231 2.543 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.683 -12.384 2.427 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.410 -12.834 3.988 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.662 -14.081 2.963 1.00 0.00 H new ATOM 1283 N PRO A 84 6.267 -12.788 7.289 1.00 0.00 N ATOM 1284 CA PRO A 84 5.264 -12.276 8.228 1.00 0.00 C ATOM 1285 C PRO A 84 4.688 -10.934 7.786 1.00 0.00 C ATOM 1286 O PRO A 84 3.494 -10.679 7.940 1.00 0.00 O ATOM 1287 CB PRO A 84 6.048 -12.117 9.533 1.00 0.00 C ATOM 1288 CG PRO A 84 7.463 -11.935 9.105 1.00 0.00 C ATOM 1289 CD PRO A 84 7.626 -12.754 7.855 1.00 0.00 C ATOM 0 HA PRO A 84 4.405 -12.942 8.309 1.00 0.00 H new ATOM 0 HB2 PRO A 84 5.694 -11.260 10.105 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.937 -12.994 10.171 1.00 0.00 H new ATOM 0 HG2 PRO A 84 7.681 -10.884 8.914 1.00 0.00 H new ATOM 0 HG3 PRO A 84 8.152 -12.267 9.882 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.337 -12.298 7.166 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.994 -13.756 8.076 1.00 0.00 H new ATOM 1297 N PHE A 85 5.545 -10.080 7.236 1.00 0.00 N ATOM 1298 CA PHE A 85 5.121 -8.764 6.773 1.00 0.00 C ATOM 1299 C PHE A 85 6.101 -8.209 5.743 1.00 0.00 C ATOM 1300 O PHE A 85 7.313 -8.383 5.866 1.00 0.00 O ATOM 1301 CB PHE A 85 5.002 -7.798 7.953 1.00 0.00 C ATOM 1302 CG PHE A 85 6.306 -7.541 8.652 1.00 0.00 C ATOM 1303 CD1 PHE A 85 6.823 -8.466 9.545 1.00 0.00 C ATOM 1304 CD2 PHE A 85 7.016 -6.375 8.415 1.00 0.00 C ATOM 1305 CE1 PHE A 85 8.023 -8.231 10.189 1.00 0.00 C ATOM 1306 CE2 PHE A 85 8.216 -6.135 9.056 1.00 0.00 C ATOM 1307 CZ PHE A 85 8.721 -7.065 9.944 1.00 0.00 C ATOM 0 H PHE A 85 6.537 -10.276 7.100 1.00 0.00 H new ATOM 0 HA PHE A 85 4.145 -8.870 6.300 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.597 -6.851 7.597 1.00 0.00 H new ATOM 0 HB3 PHE A 85 4.287 -8.201 8.671 1.00 0.00 H new ATOM 0 HD1 PHE A 85 6.282 -9.380 9.740 1.00 0.00 H new ATOM 0 HD2 PHE A 85 6.627 -5.645 7.721 1.00 0.00 H new ATOM 0 HE1 PHE A 85 8.415 -8.959 10.884 1.00 0.00 H new ATOM 0 HE2 PHE A 85 8.759 -5.221 8.863 1.00 0.00 H new ATOM 0 HZ PHE A 85 9.660 -6.881 10.445 1.00 0.00 H new ATOM 1317 N PHE A 86 5.566 -7.539 4.728 1.00 0.00 N ATOM 1318 CA PHE A 86 6.392 -6.959 3.675 1.00 0.00 C ATOM 1319 C PHE A 86 6.552 -5.455 3.876 1.00 0.00 C ATOM 1320 O PHE A 86 6.173 -4.658 3.017 1.00 0.00 O ATOM 1321 CB PHE A 86 5.777 -7.238 2.302 1.00 0.00 C ATOM 1322 CG PHE A 86 6.018 -8.637 1.811 1.00 0.00 C ATOM 1323 CD1 PHE A 86 7.288 -9.046 1.438 1.00 0.00 C ATOM 1324 CD2 PHE A 86 4.973 -9.544 1.723 1.00 0.00 C ATOM 1325 CE1 PHE A 86 7.512 -10.333 0.986 1.00 0.00 C ATOM 1326 CE2 PHE A 86 5.192 -10.832 1.273 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.463 -11.226 0.902 1.00 0.00 C ATOM 0 H PHE A 86 4.565 -7.384 4.612 1.00 0.00 H new ATOM 0 HA PHE A 86 7.377 -7.422 3.725 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.703 -7.058 2.350 1.00 0.00 H new ATOM 0 HB3 PHE A 86 6.186 -6.532 1.579 1.00 0.00 H new ATOM 0 HD1 PHE A 86 8.113 -8.351 1.501 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.977 -9.240 2.009 1.00 0.00 H new ATOM 0 HE1 PHE A 86 8.507 -10.639 0.699 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.370 -11.530 1.211 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.636 -12.231 0.547 1.00 0.00 H new ATOM 1337 N LEU A 87 7.115 -5.073 5.018 1.00 0.00 N ATOM 1338 CA LEU A 87 7.325 -3.665 5.334 1.00 0.00 C ATOM 1339 C LEU A 87 7.899 -2.917 4.135 1.00 0.00 C ATOM 1340 O LEU A 87 8.933 -3.302 3.587 1.00 0.00 O ATOM 1341 CB LEU A 87 8.264 -3.526 6.533 1.00 0.00 C ATOM 1342 CG LEU A 87 8.024 -2.316 7.437 1.00 0.00 C ATOM 1343 CD1 LEU A 87 6.916 -2.608 8.437 1.00 0.00 C ATOM 1344 CD2 LEU A 87 9.306 -1.925 8.158 1.00 0.00 C ATOM 0 H LEU A 87 7.434 -5.719 5.740 1.00 0.00 H new ATOM 0 HA LEU A 87 6.359 -3.226 5.584 1.00 0.00 H new ATOM 0 HB2 LEU A 87 8.183 -4.429 7.139 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.288 -3.481 6.163 1.00 0.00 H new ATOM 0 HG LEU A 87 7.712 -1.478 6.814 1.00 0.00 H new ATOM 0 HD11 LEU A 87 6.759 -1.736 9.072 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.994 -2.838 7.902 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.199 -3.460 9.055 1.00 0.00 H new ATOM 0 HD21 LEU A 87 9.116 -1.062 8.796 1.00 0.00 H new ATOM 0 HD22 LEU A 87 9.649 -2.760 8.769 1.00 0.00 H new ATOM 0 HD23 LEU A 87 10.073 -1.672 7.426 1.00 0.00 H new ATOM 1356 N LEU A 88 7.224 -1.846 3.733 1.00 0.00 N ATOM 1357 CA LEU A 88 7.668 -1.043 2.599 1.00 0.00 C ATOM 1358 C LEU A 88 7.924 0.400 3.022 1.00 0.00 C ATOM 1359 O LEU A 88 7.841 0.737 4.204 1.00 0.00 O ATOM 1360 CB LEU A 88 6.624 -1.080 1.482 1.00 0.00 C ATOM 1361 CG LEU A 88 6.063 -2.460 1.134 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.114 -2.367 -0.051 1.00 0.00 C ATOM 1363 CD2 LEU A 88 7.193 -3.436 0.840 1.00 0.00 C ATOM 0 H LEU A 88 6.367 -1.513 4.175 1.00 0.00 H new ATOM 0 HA LEU A 88 8.602 -1.466 2.229 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.794 -0.433 1.766 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.068 -0.653 0.583 1.00 0.00 H new ATOM 0 HG LEU A 88 5.503 -2.831 1.993 1.00 0.00 H new ATOM 0 HD11 LEU A 88 4.725 -3.358 -0.284 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.287 -1.701 0.196 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.649 -1.975 -0.916 1.00 0.00 H new ATOM 0 HD21 LEU A 88 6.776 -4.413 0.594 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.780 -3.070 -0.002 1.00 0.00 H new ATOM 0 HD23 LEU A 88 7.834 -3.526 1.717 1.00 0.00 H new ATOM 1375 N THR A 89 8.235 1.251 2.049 1.00 0.00 N ATOM 1376 CA THR A 89 8.503 2.658 2.320 1.00 0.00 C ATOM 1377 C THR A 89 8.357 3.498 1.056 1.00 0.00 C ATOM 1378 O THR A 89 9.172 3.404 0.139 1.00 0.00 O ATOM 1379 CB THR A 89 9.916 2.860 2.897 1.00 0.00 C ATOM 1380 OG1 THR A 89 10.222 1.811 3.823 1.00 0.00 O ATOM 1381 CG2 THR A 89 10.029 4.208 3.593 1.00 0.00 C ATOM 0 H THR A 89 8.307 0.990 1.066 1.00 0.00 H new ATOM 0 HA THR A 89 7.769 2.984 3.057 1.00 0.00 H new ATOM 0 HB THR A 89 10.628 2.835 2.072 1.00 0.00 H new ATOM 0 HG1 THR A 89 9.415 1.572 4.325 1.00 0.00 H new ATOM 0 HG21 THR A 89 11.036 4.328 3.993 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.825 5.005 2.878 1.00 0.00 H new ATOM 0 HG23 THR A 89 9.307 4.258 4.408 1.00 0.00 H new ATOM 1389 N GLY A 90 7.314 4.321 1.015 1.00 0.00 N ATOM 1390 CA GLY A 90 7.081 5.167 -0.141 1.00 0.00 C ATOM 1391 C GLY A 90 7.788 6.503 -0.033 1.00 0.00 C ATOM 1392 O GLY A 90 7.643 7.211 0.964 1.00 0.00 O ATOM 0 H GLY A 90 6.626 4.417 1.762 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.421 4.651 -1.039 1.00 0.00 H new ATOM 0 HA3 GLY A 90 6.010 5.334 -0.255 1.00 0.00 H new ATOM 1396 N TYR A 91 8.555 6.850 -1.060 1.00 0.00 N ATOM 1397 CA TYR A 91 9.290 8.109 -1.075 1.00 0.00 C ATOM 1398 C TYR A 91 8.844 8.987 -2.240 1.00 0.00 C ATOM 1399 O TYR A 91 9.168 8.717 -3.396 1.00 0.00 O ATOM 1400 CB TYR A 91 10.794 7.845 -1.168 1.00 0.00 C ATOM 1401 CG TYR A 91 11.367 7.166 0.056 1.00 0.00 C ATOM 1402 CD1 TYR A 91 11.735 7.904 1.174 1.00 0.00 C ATOM 1403 CD2 TYR A 91 11.541 5.788 0.093 1.00 0.00 C ATOM 1404 CE1 TYR A 91 12.259 7.288 2.295 1.00 0.00 C ATOM 1405 CE2 TYR A 91 12.063 5.164 1.210 1.00 0.00 C ATOM 1406 CZ TYR A 91 12.421 5.918 2.308 1.00 0.00 C ATOM 1407 OH TYR A 91 12.942 5.301 3.421 1.00 0.00 O ATOM 0 H TYR A 91 8.684 6.277 -1.894 1.00 0.00 H new ATOM 0 HA TYR A 91 9.077 8.635 -0.145 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.992 7.226 -2.043 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.312 8.792 -1.324 1.00 0.00 H new ATOM 0 HD1 TYR A 91 11.610 8.977 1.167 1.00 0.00 H new ATOM 0 HD2 TYR A 91 11.264 5.195 -0.766 1.00 0.00 H new ATOM 0 HE1 TYR A 91 12.540 7.876 3.156 1.00 0.00 H new ATOM 0 HE2 TYR A 91 12.190 4.092 1.223 1.00 0.00 H new ATOM 0 HH TYR A 91 12.615 5.751 4.228 1.00 0.00 H new ATOM 1417 N ALA A 92 8.098 10.041 -1.925 1.00 0.00 N ATOM 1418 CA ALA A 92 7.608 10.962 -2.944 1.00 0.00 C ATOM 1419 C ALA A 92 8.733 11.846 -3.471 1.00 0.00 C ATOM 1420 O ALA A 92 9.056 12.877 -2.880 1.00 0.00 O ATOM 1421 CB ALA A 92 6.481 11.817 -2.385 1.00 0.00 C ATOM 0 H ALA A 92 7.820 10.278 -0.973 1.00 0.00 H new ATOM 0 HA ALA A 92 7.223 10.373 -3.776 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.125 12.500 -3.157 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.662 11.174 -2.063 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.847 12.391 -1.534 1.00 0.00 H new ATOM 1427 N LEU A 93 9.328 11.436 -4.586 1.00 0.00 N ATOM 1428 CA LEU A 93 10.419 12.191 -5.194 1.00 0.00 C ATOM 1429 C LEU A 93 9.889 13.164 -6.242 1.00 0.00 C ATOM 1430 O LEU A 93 8.918 12.873 -6.940 1.00 0.00 O ATOM 1431 CB LEU A 93 11.431 11.238 -5.831 1.00 0.00 C ATOM 1432 CG LEU A 93 11.971 10.129 -4.927 1.00 0.00 C ATOM 1433 CD1 LEU A 93 12.856 9.179 -5.718 1.00 0.00 C ATOM 1434 CD2 LEU A 93 12.737 10.723 -3.754 1.00 0.00 C ATOM 0 H LEU A 93 9.074 10.585 -5.088 1.00 0.00 H new ATOM 0 HA LEU A 93 10.913 12.764 -4.410 1.00 0.00 H new ATOM 0 HB2 LEU A 93 10.966 10.775 -6.701 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.274 11.826 -6.195 1.00 0.00 H new ATOM 0 HG LEU A 93 11.126 9.563 -4.534 1.00 0.00 H new ATOM 0 HD11 LEU A 93 13.231 8.397 -5.058 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.277 8.728 -6.523 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.696 9.731 -6.140 1.00 0.00 H new ATOM 0 HD21 LEU A 93 13.114 9.919 -3.121 1.00 0.00 H new ATOM 0 HD22 LEU A 93 13.573 11.314 -4.127 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.073 11.362 -3.172 1.00 0.00 H new ATOM 1446 N ASP A 94 10.535 14.320 -6.348 1.00 0.00 N ATOM 1447 CA ASP A 94 10.132 15.336 -7.313 1.00 0.00 C ATOM 1448 C ASP A 94 10.926 15.199 -8.609 1.00 0.00 C ATOM 1449 O ASP A 94 11.822 14.363 -8.714 1.00 0.00 O ATOM 1450 CB ASP A 94 10.327 16.735 -6.726 1.00 0.00 C ATOM 1451 CG ASP A 94 9.100 17.228 -5.986 1.00 0.00 C ATOM 1452 OD1 ASP A 94 8.005 16.673 -6.216 1.00 0.00 O ATOM 1453 OD2 ASP A 94 9.234 18.169 -5.176 1.00 0.00 O ATOM 0 H ASP A 94 11.340 14.577 -5.777 1.00 0.00 H new ATOM 0 HA ASP A 94 9.075 15.190 -7.537 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.178 16.725 -6.046 1.00 0.00 H new ATOM 0 HB3 ASP A 94 10.568 17.432 -7.528 1.00 0.00 H new ATOM 1458 N ALA A 95 10.588 16.026 -9.593 1.00 0.00 N ATOM 1459 CA ALA A 95 11.270 15.998 -10.882 1.00 0.00 C ATOM 1460 C ALA A 95 12.782 15.920 -10.701 1.00 0.00 C ATOM 1461 O ALA A 95 13.471 15.227 -11.450 1.00 0.00 O ATOM 1462 CB ALA A 95 10.897 17.224 -11.703 1.00 0.00 C ATOM 0 H ALA A 95 9.847 16.723 -9.523 1.00 0.00 H new ATOM 0 HA ALA A 95 10.948 15.105 -11.417 1.00 0.00 H new ATOM 0 HB1 ALA A 95 11.413 17.190 -12.662 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.820 17.236 -11.870 1.00 0.00 H new ATOM 0 HB3 ALA A 95 11.190 18.125 -11.165 1.00 0.00 H new ATOM 1468 N ARG A 96 13.292 16.636 -9.704 1.00 0.00 N ATOM 1469 CA ARG A 96 14.723 16.649 -9.427 1.00 0.00 C ATOM 1470 C ARG A 96 15.169 15.327 -8.809 1.00 0.00 C ATOM 1471 O ARG A 96 16.246 14.818 -9.118 1.00 0.00 O ATOM 1472 CB ARG A 96 15.073 17.806 -8.490 1.00 0.00 C ATOM 1473 CG ARG A 96 15.319 19.121 -9.211 1.00 0.00 C ATOM 1474 CD ARG A 96 14.958 20.312 -8.338 1.00 0.00 C ATOM 1475 NE ARG A 96 16.027 20.649 -7.402 1.00 0.00 N ATOM 1476 CZ ARG A 96 15.849 21.405 -6.324 1.00 0.00 C ATOM 1477 NH1 ARG A 96 14.651 21.900 -6.048 1.00 0.00 N ATOM 1478 NH2 ARG A 96 16.872 21.667 -5.520 1.00 0.00 N ATOM 0 H ARG A 96 12.735 17.215 -9.075 1.00 0.00 H new ATOM 0 HA ARG A 96 15.249 16.785 -10.372 1.00 0.00 H new ATOM 0 HB2 ARG A 96 14.262 17.940 -7.774 1.00 0.00 H new ATOM 0 HB3 ARG A 96 15.963 17.543 -7.918 1.00 0.00 H new ATOM 0 HG2 ARG A 96 16.367 19.187 -9.502 1.00 0.00 H new ATOM 0 HG3 ARG A 96 14.731 19.150 -10.128 1.00 0.00 H new ATOM 0 HD2 ARG A 96 14.745 21.174 -8.971 1.00 0.00 H new ATOM 0 HD3 ARG A 96 14.046 20.091 -7.783 1.00 0.00 H new ATOM 0 HE ARG A 96 16.962 20.284 -7.586 1.00 0.00 H new ATOM 0 HH11 ARG A 96 13.863 21.701 -6.664 1.00 0.00 H new ATOM 0 HH12 ARG A 96 14.517 22.480 -5.220 1.00 0.00 H new ATOM 0 HH21 ARG A 96 17.795 21.288 -5.730 1.00 0.00 H new ATOM 0 HH22 ARG A 96 16.735 22.247 -4.693 1.00 0.00 H new ATOM 1492 N GLY A 97 14.333 14.777 -7.934 1.00 0.00 N ATOM 1493 CA GLY A 97 14.659 13.520 -7.285 1.00 0.00 C ATOM 1494 C GLY A 97 15.040 13.700 -5.829 1.00 0.00 C ATOM 1495 O GLY A 97 15.865 12.958 -5.300 1.00 0.00 O ATOM 0 H GLY A 97 13.436 15.179 -7.663 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.804 12.847 -7.353 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.483 13.043 -7.816 1.00 0.00 H new ATOM 1499 N ASN A 98 14.437 14.691 -5.180 1.00 0.00 N ATOM 1500 CA ASN A 98 14.718 14.968 -3.776 1.00 0.00 C ATOM 1501 C ASN A 98 13.505 14.656 -2.906 1.00 0.00 C ATOM 1502 O ASN A 98 12.385 15.056 -3.218 1.00 0.00 O ATOM 1503 CB ASN A 98 15.126 16.432 -3.596 1.00 0.00 C ATOM 1504 CG ASN A 98 16.460 16.744 -4.246 1.00 0.00 C ATOM 1505 OD1 ASN A 98 17.510 16.307 -3.776 1.00 0.00 O ATOM 1506 ND2 ASN A 98 16.424 17.506 -5.333 1.00 0.00 N ATOM 0 H ASN A 98 13.751 15.315 -5.604 1.00 0.00 H new ATOM 0 HA ASN A 98 15.542 14.326 -3.463 1.00 0.00 H new ATOM 0 HB2 ASN A 98 14.357 17.076 -4.023 1.00 0.00 H new ATOM 0 HB3 ASN A 98 15.180 16.663 -2.532 1.00 0.00 H new ATOM 0 HD21 ASN A 98 17.290 17.751 -5.813 1.00 0.00 H new ATOM 0 HD22 ASN A 98 15.530 17.846 -5.688 1.00 0.00 H new ATOM 1513 N ASN A 99 13.738 13.938 -1.812 1.00 0.00 N ATOM 1514 CA ASN A 99 12.664 13.572 -0.895 1.00 0.00 C ATOM 1515 C ASN A 99 12.101 14.805 -0.196 1.00 0.00 C ATOM 1516 O ASN A 99 12.414 15.071 0.965 1.00 0.00 O ATOM 1517 CB ASN A 99 13.171 12.569 0.144 1.00 0.00 C ATOM 1518 CG ASN A 99 14.440 13.039 0.828 1.00 0.00 C ATOM 1519 OD1 ASN A 99 15.401 13.441 0.171 1.00 0.00 O ATOM 1520 ND2 ASN A 99 14.449 12.990 2.155 1.00 0.00 N ATOM 0 H ASN A 99 14.660 13.598 -1.539 1.00 0.00 H new ATOM 0 HA ASN A 99 11.866 13.110 -1.476 1.00 0.00 H new ATOM 0 HB2 ASN A 99 12.397 12.404 0.894 1.00 0.00 H new ATOM 0 HB3 ASN A 99 13.356 11.610 -0.340 1.00 0.00 H new ATOM 0 HD21 ASN A 99 15.275 13.293 2.671 1.00 0.00 H new ATOM 0 HD22 ASN A 99 13.630 12.650 2.658 1.00 0.00 H new ATOM 1527 N VAL A 100 11.268 15.556 -0.910 1.00 0.00 N ATOM 1528 CA VAL A 100 10.660 16.760 -0.358 1.00 0.00 C ATOM 1529 C VAL A 100 9.565 16.413 0.644 1.00 0.00 C ATOM 1530 O VAL A 100 9.216 17.223 1.502 1.00 0.00 O ATOM 1531 CB VAL A 100 10.064 17.647 -1.467 1.00 0.00 C ATOM 1532 CG1 VAL A 100 11.162 18.175 -2.377 1.00 0.00 C ATOM 1533 CG2 VAL A 100 9.024 16.874 -2.265 1.00 0.00 C ATOM 0 H VAL A 100 10.999 15.351 -1.872 1.00 0.00 H new ATOM 0 HA VAL A 100 11.452 17.310 0.150 1.00 0.00 H new ATOM 0 HB VAL A 100 9.571 18.500 -1.001 1.00 0.00 H new ATOM 0 HG11 VAL A 100 10.721 18.799 -3.154 1.00 0.00 H new ATOM 0 HG12 VAL A 100 11.866 18.766 -1.792 1.00 0.00 H new ATOM 0 HG13 VAL A 100 11.686 17.338 -2.838 1.00 0.00 H new ATOM 0 HG21 VAL A 100 8.613 17.515 -3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 100 9.491 16.001 -2.722 1.00 0.00 H new ATOM 0 HG23 VAL A 100 8.222 16.551 -1.601 1.00 0.00 H new ATOM 1543 N GLU A 101 9.026 15.203 0.529 1.00 0.00 N ATOM 1544 CA GLU A 101 7.970 14.749 1.425 1.00 0.00 C ATOM 1545 C GLU A 101 8.417 13.525 2.217 1.00 0.00 C ATOM 1546 O GLU A 101 9.164 12.684 1.715 1.00 0.00 O ATOM 1547 CB GLU A 101 6.703 14.422 0.632 1.00 0.00 C ATOM 1548 CG GLU A 101 5.425 14.555 1.443 1.00 0.00 C ATOM 1549 CD GLU A 101 4.998 15.998 1.627 1.00 0.00 C ATOM 1550 OE1 GLU A 101 4.603 16.631 0.626 1.00 0.00 O ATOM 1551 OE2 GLU A 101 5.059 16.494 2.772 1.00 0.00 O ATOM 0 H GLU A 101 9.304 14.520 -0.176 1.00 0.00 H new ATOM 0 HA GLU A 101 7.753 15.555 2.126 1.00 0.00 H new ATOM 0 HB2 GLU A 101 6.645 15.083 -0.232 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.776 13.404 0.250 1.00 0.00 H new ATOM 0 HG2 GLU A 101 4.626 14.004 0.947 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.570 14.096 2.421 1.00 0.00 H new ATOM 1558 N LYS A 102 7.956 13.430 3.460 1.00 0.00 N ATOM 1559 CA LYS A 102 8.306 12.309 4.323 1.00 0.00 C ATOM 1560 C LYS A 102 7.567 11.044 3.900 1.00 0.00 C ATOM 1561 O LYS A 102 6.414 11.084 3.471 1.00 0.00 O ATOM 1562 CB LYS A 102 7.979 12.640 5.781 1.00 0.00 C ATOM 1563 CG LYS A 102 9.109 13.341 6.514 1.00 0.00 C ATOM 1564 CD LYS A 102 8.678 13.798 7.898 1.00 0.00 C ATOM 1565 CE LYS A 102 8.112 15.209 7.868 1.00 0.00 C ATOM 1566 NZ LYS A 102 6.637 15.211 7.660 1.00 0.00 N ATOM 0 H LYS A 102 7.338 14.117 3.892 1.00 0.00 H new ATOM 0 HA LYS A 102 9.377 12.131 4.228 1.00 0.00 H new ATOM 0 HB2 LYS A 102 7.091 13.271 5.811 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.733 11.718 6.308 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.961 12.666 6.602 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.442 14.201 5.933 1.00 0.00 H new ATOM 0 HD2 LYS A 102 7.928 13.112 8.291 1.00 0.00 H new ATOM 0 HD3 LYS A 102 9.530 13.761 8.576 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.347 15.715 8.805 1.00 0.00 H new ATOM 0 HE3 LYS A 102 8.592 15.776 7.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 6.409 15.745 6.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.299 14.232 7.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 6.172 15.657 8.477 1.00 0.00 H new ATOM 1580 N PRO A 103 8.244 9.892 4.023 1.00 0.00 N ATOM 1581 CA PRO A 103 7.669 8.593 3.660 1.00 0.00 C ATOM 1582 C PRO A 103 6.565 8.160 4.618 1.00 0.00 C ATOM 1583 O PRO A 103 6.389 8.748 5.685 1.00 0.00 O ATOM 1584 CB PRO A 103 8.863 7.639 3.753 1.00 0.00 C ATOM 1585 CG PRO A 103 9.792 8.288 4.719 1.00 0.00 C ATOM 1586 CD PRO A 103 9.622 9.770 4.526 1.00 0.00 C ATOM 0 HA PRO A 103 7.199 8.615 2.677 1.00 0.00 H new ATOM 0 HB2 PRO A 103 8.556 6.653 4.101 1.00 0.00 H new ATOM 0 HB3 PRO A 103 9.336 7.501 2.781 1.00 0.00 H new ATOM 0 HG2 PRO A 103 9.555 7.998 5.743 1.00 0.00 H new ATOM 0 HG3 PRO A 103 10.823 7.986 4.532 1.00 0.00 H new ATOM 0 HD2 PRO A 103 9.759 10.315 5.460 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.346 10.168 3.815 1.00 0.00 H new ATOM 1594 N LEU A 104 5.824 7.128 4.230 1.00 0.00 N ATOM 1595 CA LEU A 104 4.736 6.615 5.055 1.00 0.00 C ATOM 1596 C LEU A 104 5.018 5.184 5.500 1.00 0.00 C ATOM 1597 O LEU A 104 4.137 4.501 6.022 1.00 0.00 O ATOM 1598 CB LEU A 104 3.415 6.670 4.285 1.00 0.00 C ATOM 1599 CG LEU A 104 3.521 6.564 2.763 1.00 0.00 C ATOM 1600 CD1 LEU A 104 3.731 5.118 2.342 1.00 0.00 C ATOM 1601 CD2 LEU A 104 2.277 7.139 2.101 1.00 0.00 C ATOM 0 H LEU A 104 5.957 6.630 3.350 1.00 0.00 H new ATOM 0 HA LEU A 104 4.659 7.244 5.942 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.776 5.863 4.642 1.00 0.00 H new ATOM 0 HB3 LEU A 104 2.913 7.606 4.530 1.00 0.00 H new ATOM 0 HG LEU A 104 4.384 7.145 2.436 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.804 5.062 1.256 1.00 0.00 H new ATOM 0 HD12 LEU A 104 4.651 4.739 2.788 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.889 4.515 2.680 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.369 7.055 1.018 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.399 6.586 2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.170 8.188 2.376 1.00 0.00 H new ATOM 1613 N GLU A 105 6.253 4.737 5.292 1.00 0.00 N ATOM 1614 CA GLU A 105 6.651 3.387 5.673 1.00 0.00 C ATOM 1615 C GLU A 105 5.490 2.411 5.508 1.00 0.00 C ATOM 1616 O GLU A 105 5.196 1.620 6.406 1.00 0.00 O ATOM 1617 CB GLU A 105 7.146 3.368 7.121 1.00 0.00 C ATOM 1618 CG GLU A 105 7.801 2.057 7.522 1.00 0.00 C ATOM 1619 CD GLU A 105 8.492 2.138 8.870 1.00 0.00 C ATOM 1620 OE1 GLU A 105 9.022 3.220 9.199 1.00 0.00 O ATOM 1621 OE2 GLU A 105 8.502 1.121 9.594 1.00 0.00 O ATOM 0 H GLU A 105 6.994 5.290 4.862 1.00 0.00 H new ATOM 0 HA GLU A 105 7.462 3.075 5.015 1.00 0.00 H new ATOM 0 HB2 GLU A 105 7.860 4.180 7.263 1.00 0.00 H new ATOM 0 HB3 GLU A 105 6.305 3.563 7.786 1.00 0.00 H new ATOM 0 HG2 GLU A 105 7.045 1.272 7.552 1.00 0.00 H new ATOM 0 HG3 GLU A 105 8.528 1.771 6.762 1.00 0.00 H new ATOM 1628 N LEU A 106 4.833 2.471 4.355 1.00 0.00 N ATOM 1629 CA LEU A 106 3.703 1.593 4.071 1.00 0.00 C ATOM 1630 C LEU A 106 4.011 0.158 4.486 1.00 0.00 C ATOM 1631 O LEU A 106 4.885 -0.491 3.912 1.00 0.00 O ATOM 1632 CB LEU A 106 3.356 1.642 2.582 1.00 0.00 C ATOM 1633 CG LEU A 106 2.363 0.589 2.089 1.00 0.00 C ATOM 1634 CD1 LEU A 106 0.970 0.877 2.626 1.00 0.00 C ATOM 1635 CD2 LEU A 106 2.352 0.537 0.569 1.00 0.00 C ATOM 0 H LEU A 106 5.063 3.119 3.601 1.00 0.00 H new ATOM 0 HA LEU A 106 2.848 1.943 4.649 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.951 2.628 2.356 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.279 1.538 2.011 1.00 0.00 H new ATOM 0 HG LEU A 106 2.679 -0.385 2.463 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.277 0.117 2.265 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.990 0.862 3.716 1.00 0.00 H new ATOM 0 HD13 LEU A 106 0.644 1.859 2.283 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.640 -0.218 0.236 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.061 1.510 0.174 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.348 0.281 0.206 1.00 0.00 H new ATOM 1647 N ARG A 107 3.286 -0.331 5.486 1.00 0.00 N ATOM 1648 CA ARG A 107 3.480 -1.690 5.978 1.00 0.00 C ATOM 1649 C ARG A 107 2.324 -2.591 5.557 1.00 0.00 C ATOM 1650 O ARG A 107 1.164 -2.178 5.575 1.00 0.00 O ATOM 1651 CB ARG A 107 3.612 -1.689 7.502 1.00 0.00 C ATOM 1652 CG ARG A 107 2.311 -1.383 8.226 1.00 0.00 C ATOM 1653 CD ARG A 107 2.520 -1.284 9.729 1.00 0.00 C ATOM 1654 NE ARG A 107 3.468 -0.230 10.082 1.00 0.00 N ATOM 1655 CZ ARG A 107 3.652 0.207 11.322 1.00 0.00 C ATOM 1656 NH1 ARG A 107 2.957 -0.316 12.323 1.00 0.00 N ATOM 1657 NH2 ARG A 107 4.534 1.169 11.564 1.00 0.00 N ATOM 0 H ARG A 107 2.559 0.193 5.972 1.00 0.00 H new ATOM 0 HA ARG A 107 4.399 -2.080 5.541 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.978 -2.663 7.827 1.00 0.00 H new ATOM 0 HB3 ARG A 107 4.362 -0.953 7.793 1.00 0.00 H new ATOM 0 HG2 ARG A 107 1.897 -0.446 7.853 1.00 0.00 H new ATOM 0 HG3 ARG A 107 1.581 -2.163 8.010 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.564 -1.090 10.216 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.883 -2.239 10.108 1.00 0.00 H new ATOM 0 HE ARG A 107 4.019 0.193 9.335 1.00 0.00 H new ATOM 0 HH11 ARG A 107 2.279 -1.056 12.141 1.00 0.00 H new ATOM 0 HH12 ARG A 107 3.100 0.022 13.275 1.00 0.00 H new ATOM 0 HH21 ARG A 107 5.071 1.573 10.797 1.00 0.00 H new ATOM 0 HH22 ARG A 107 4.675 1.504 12.517 1.00 0.00 H new ATOM 1671 N ILE A 108 2.648 -3.823 5.179 1.00 0.00 N ATOM 1672 CA ILE A 108 1.636 -4.783 4.754 1.00 0.00 C ATOM 1673 C ILE A 108 1.644 -6.020 5.645 1.00 0.00 C ATOM 1674 O ILE A 108 2.701 -6.573 5.950 1.00 0.00 O ATOM 1675 CB ILE A 108 1.849 -5.215 3.292 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.817 -3.997 2.367 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.791 -6.228 2.879 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.326 -4.284 0.971 1.00 0.00 C ATOM 0 H ILE A 108 3.603 -4.180 5.158 1.00 0.00 H new ATOM 0 HA ILE A 108 0.671 -4.283 4.839 1.00 0.00 H new ATOM 0 HB ILE A 108 2.828 -5.686 3.207 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.794 -3.627 2.303 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.417 -3.201 2.807 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.955 -6.524 1.843 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.857 -7.106 3.522 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.198 -5.781 2.976 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.274 -3.376 0.371 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.360 -4.626 1.024 1.00 0.00 H new ATOM 0 HD13 ILE A 108 1.711 -5.058 0.511 1.00 0.00 H new ATOM 1690 N LYS A 109 0.457 -6.452 6.058 1.00 0.00 N ATOM 1691 CA LYS A 109 0.325 -7.627 6.912 1.00 0.00 C ATOM 1692 C LYS A 109 -0.203 -8.819 6.119 1.00 0.00 C ATOM 1693 O LYS A 109 -1.003 -8.659 5.198 1.00 0.00 O ATOM 1694 CB LYS A 109 -0.610 -7.327 8.086 1.00 0.00 C ATOM 1695 CG LYS A 109 -0.670 -8.441 9.116 1.00 0.00 C ATOM 1696 CD LYS A 109 -1.976 -8.415 9.892 1.00 0.00 C ATOM 1697 CE LYS A 109 -2.365 -9.803 10.376 1.00 0.00 C ATOM 1698 NZ LYS A 109 -3.714 -9.813 11.006 1.00 0.00 N ATOM 0 H LYS A 109 -0.428 -6.006 5.815 1.00 0.00 H new ATOM 0 HA LYS A 109 1.313 -7.878 7.298 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.283 -6.409 8.575 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.614 -7.144 7.702 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -0.561 -9.404 8.618 1.00 0.00 H new ATOM 0 HG3 LYS A 109 0.167 -8.343 9.808 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -1.880 -7.745 10.746 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -2.768 -8.014 9.260 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -2.351 -10.498 9.536 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -1.626 -10.157 11.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -4.036 -10.795 11.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -3.666 -9.352 11.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -4.384 -9.299 10.399 1.00 0.00 H new ATOM 1712 N VAL A 110 0.249 -10.014 6.485 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.179 -11.233 5.810 1.00 0.00 C ATOM 1714 C VAL A 110 -1.225 -11.978 6.632 1.00 0.00 C ATOM 1715 O VAL A 110 -0.895 -12.666 7.600 1.00 0.00 O ATOM 1716 CB VAL A 110 1.011 -12.173 5.540 1.00 0.00 C ATOM 1717 CG1 VAL A 110 0.526 -13.498 4.971 1.00 0.00 C ATOM 1718 CG2 VAL A 110 2.008 -11.512 4.600 1.00 0.00 C ATOM 0 H VAL A 110 0.912 -10.164 7.246 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.616 -10.931 4.858 1.00 0.00 H new ATOM 0 HB VAL A 110 1.516 -12.374 6.485 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.380 -14.149 4.787 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.147 -13.975 5.683 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.003 -13.320 4.035 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.843 -12.190 4.420 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.518 -11.280 3.654 1.00 0.00 H new ATOM 0 HG23 VAL A 110 2.379 -10.592 5.052 1.00 0.00 H new ATOM 1728 N LEU A 111 -2.487 -11.837 6.241 1.00 0.00 N ATOM 1729 CA LEU A 111 -3.582 -12.498 6.942 1.00 0.00 C ATOM 1730 C LEU A 111 -3.465 -14.015 6.830 1.00 0.00 C ATOM 1731 O LEU A 111 -2.508 -14.532 6.253 1.00 0.00 O ATOM 1732 CB LEU A 111 -4.927 -12.036 6.377 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.304 -10.580 6.649 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.548 -10.195 5.862 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.522 -10.354 8.138 1.00 0.00 C ATOM 0 H LEU A 111 -2.777 -11.271 5.443 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.523 -12.225 7.996 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.919 -12.193 5.298 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -5.709 -12.675 6.786 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.481 -9.945 6.322 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.802 -9.155 6.068 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.356 -10.317 4.796 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.378 -10.836 6.157 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.790 -9.312 8.312 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.327 -10.999 8.490 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -4.606 -10.589 8.680 1.00 0.00 H new ATOM 1747 N ASP A 112 -4.444 -14.721 7.384 1.00 0.00 N ATOM 1748 CA ASP A 112 -4.452 -16.179 7.343 1.00 0.00 C ATOM 1749 C ASP A 112 -5.512 -16.690 6.372 1.00 0.00 C ATOM 1750 O ASP A 112 -6.502 -16.008 6.104 1.00 0.00 O ATOM 1751 CB ASP A 112 -4.706 -16.748 8.740 1.00 0.00 C ATOM 1752 CG ASP A 112 -4.078 -15.904 9.832 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -2.964 -15.385 9.612 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -4.700 -15.765 10.906 1.00 0.00 O ATOM 0 H ASP A 112 -5.242 -14.308 7.867 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.475 -16.513 6.995 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.780 -16.817 8.911 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -4.308 -17.761 8.794 1.00 0.00 H new ATOM 1759 N ILE A 113 -5.296 -17.891 5.847 1.00 0.00 N ATOM 1760 CA ILE A 113 -6.233 -18.492 4.906 1.00 0.00 C ATOM 1761 C ILE A 113 -7.624 -18.617 5.518 1.00 0.00 C ATOM 1762 O ILE A 113 -8.631 -18.548 4.815 1.00 0.00 O ATOM 1763 CB ILE A 113 -5.757 -19.884 4.450 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -6.752 -20.486 3.455 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -5.579 -20.802 5.650 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -6.727 -19.819 2.098 1.00 0.00 C ATOM 0 H ILE A 113 -4.481 -18.467 6.057 1.00 0.00 H new ATOM 0 HA ILE A 113 -6.279 -17.831 4.040 1.00 0.00 H new ATOM 0 HB ILE A 113 -4.793 -19.778 3.952 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -6.535 -21.547 3.333 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.758 -20.412 3.869 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -5.242 -21.782 5.312 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -4.837 -20.377 6.326 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -6.530 -20.906 6.173 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -7.457 -20.297 1.444 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -6.974 -18.763 2.207 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.732 -19.916 1.663 1.00 0.00 H new ATOM 1778 N ASN A 114 -7.670 -18.801 6.834 1.00 0.00 N ATOM 1779 CA ASN A 114 -8.938 -18.935 7.542 1.00 0.00 C ATOM 1780 C ASN A 114 -9.629 -17.582 7.680 1.00 0.00 C ATOM 1781 O ASN A 114 -10.772 -17.410 7.254 1.00 0.00 O ATOM 1782 CB ASN A 114 -8.711 -19.548 8.925 1.00 0.00 C ATOM 1783 CG ASN A 114 -7.635 -20.616 8.915 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -6.653 -20.530 9.652 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -7.814 -21.629 8.075 1.00 0.00 N ATOM 0 H ASN A 114 -6.845 -18.861 7.431 1.00 0.00 H new ATOM 0 HA ASN A 114 -9.583 -19.595 6.961 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -8.432 -18.762 9.626 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -9.645 -19.980 9.285 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -7.122 -22.376 8.023 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -8.644 -21.660 7.482 1.00 0.00 H new ATOM 1792 N ASP A 115 -8.929 -16.625 8.278 1.00 0.00 N ATOM 1793 CA ASP A 115 -9.474 -15.286 8.471 1.00 0.00 C ATOM 1794 C ASP A 115 -10.245 -14.830 7.237 1.00 0.00 C ATOM 1795 O ASP A 115 -9.763 -14.952 6.112 1.00 0.00 O ATOM 1796 CB ASP A 115 -8.351 -14.295 8.781 1.00 0.00 C ATOM 1797 CG ASP A 115 -7.806 -14.459 10.186 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -7.418 -15.591 10.543 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -7.768 -13.456 10.930 1.00 0.00 O ATOM 0 H ASP A 115 -7.983 -16.751 8.638 1.00 0.00 H new ATOM 0 HA ASP A 115 -10.162 -15.319 9.316 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -7.542 -14.430 8.063 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -8.723 -13.278 8.655 1.00 0.00 H new ATOM 1804 N ASN A 116 -11.446 -14.304 7.456 1.00 0.00 N ATOM 1805 CA ASN A 116 -12.285 -13.831 6.361 1.00 0.00 C ATOM 1806 C ASN A 116 -13.021 -12.553 6.752 1.00 0.00 C ATOM 1807 O ASN A 116 -13.763 -12.529 7.734 1.00 0.00 O ATOM 1808 CB ASN A 116 -13.293 -14.911 5.960 1.00 0.00 C ATOM 1809 CG ASN A 116 -14.148 -14.493 4.779 1.00 0.00 C ATOM 1810 OD1 ASN A 116 -14.346 -13.303 4.532 1.00 0.00 O ATOM 1811 ND2 ASN A 116 -14.660 -15.473 4.044 1.00 0.00 N ATOM 0 H ASN A 116 -11.860 -14.195 8.382 1.00 0.00 H new ATOM 0 HA ASN A 116 -11.640 -13.612 5.511 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -12.759 -15.828 5.712 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -13.937 -15.137 6.810 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -15.244 -15.254 3.237 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -14.469 -16.445 4.286 1.00 0.00 H new ATOM 1818 N GLU A 117 -12.810 -11.494 5.977 1.00 0.00 N ATOM 1819 CA GLU A 117 -13.453 -10.213 6.243 1.00 0.00 C ATOM 1820 C GLU A 117 -14.439 -9.858 5.133 1.00 0.00 C ATOM 1821 O GLU A 117 -14.188 -10.086 3.949 1.00 0.00 O ATOM 1822 CB GLU A 117 -12.403 -9.109 6.380 1.00 0.00 C ATOM 1823 CG GLU A 117 -11.609 -9.181 7.674 1.00 0.00 C ATOM 1824 CD GLU A 117 -10.950 -7.863 8.029 1.00 0.00 C ATOM 1825 OE1 GLU A 117 -11.645 -6.979 8.573 1.00 0.00 O ATOM 1826 OE2 GLU A 117 -9.739 -7.715 7.763 1.00 0.00 O ATOM 0 H GLU A 117 -12.199 -11.498 5.160 1.00 0.00 H new ATOM 0 HA GLU A 117 -14.003 -10.299 7.180 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -11.714 -9.168 5.537 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -12.898 -8.139 6.321 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -12.271 -9.482 8.486 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -10.844 -9.952 7.584 1.00 0.00 H new ATOM 1833 N PRO A 118 -15.588 -9.286 5.523 1.00 0.00 N ATOM 1834 CA PRO A 118 -16.634 -8.887 4.577 1.00 0.00 C ATOM 1835 C PRO A 118 -16.218 -7.696 3.721 1.00 0.00 C ATOM 1836 O PRO A 118 -15.190 -7.068 3.971 1.00 0.00 O ATOM 1837 CB PRO A 118 -17.807 -8.510 5.485 1.00 0.00 C ATOM 1838 CG PRO A 118 -17.177 -8.122 6.778 1.00 0.00 C ATOM 1839 CD PRO A 118 -15.953 -8.985 6.917 1.00 0.00 C ATOM 0 HA PRO A 118 -16.865 -9.680 3.866 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -18.385 -7.687 5.064 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -18.492 -9.348 5.614 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -16.912 -7.065 6.781 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -17.863 -8.281 7.610 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -15.151 -8.463 7.439 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -16.163 -9.893 7.482 1.00 0.00 H new ATOM 1847 N VAL A 119 -17.025 -7.390 2.709 1.00 0.00 N ATOM 1848 CA VAL A 119 -16.741 -6.273 1.817 1.00 0.00 C ATOM 1849 C VAL A 119 -17.312 -4.971 2.367 1.00 0.00 C ATOM 1850 O VAL A 119 -18.525 -4.830 2.526 1.00 0.00 O ATOM 1851 CB VAL A 119 -17.316 -6.518 0.409 1.00 0.00 C ATOM 1852 CG1 VAL A 119 -16.681 -7.748 -0.220 1.00 0.00 C ATOM 1853 CG2 VAL A 119 -18.830 -6.662 0.471 1.00 0.00 C ATOM 0 H VAL A 119 -17.880 -7.900 2.487 1.00 0.00 H new ATOM 0 HA VAL A 119 -15.656 -6.191 1.749 1.00 0.00 H new ATOM 0 HB VAL A 119 -17.080 -5.657 -0.217 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -17.099 -7.905 -1.214 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -15.604 -7.601 -0.299 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -16.884 -8.620 0.401 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -19.220 -6.835 -0.532 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -19.089 -7.505 1.111 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -19.266 -5.750 0.878 1.00 0.00 H new ATOM 1863 N PHE A 120 -16.430 -4.020 2.657 1.00 0.00 N ATOM 1864 CA PHE A 120 -16.846 -2.728 3.191 1.00 0.00 C ATOM 1865 C PHE A 120 -16.751 -1.642 2.123 1.00 0.00 C ATOM 1866 O PHE A 120 -16.201 -1.862 1.043 1.00 0.00 O ATOM 1867 CB PHE A 120 -15.984 -2.349 4.397 1.00 0.00 C ATOM 1868 CG PHE A 120 -16.423 -3.003 5.676 1.00 0.00 C ATOM 1869 CD1 PHE A 120 -17.667 -2.726 6.220 1.00 0.00 C ATOM 1870 CD2 PHE A 120 -15.591 -3.893 6.336 1.00 0.00 C ATOM 1871 CE1 PHE A 120 -18.074 -3.326 7.397 1.00 0.00 C ATOM 1872 CE2 PHE A 120 -15.993 -4.496 7.513 1.00 0.00 C ATOM 1873 CZ PHE A 120 -17.235 -4.211 8.044 1.00 0.00 C ATOM 0 H PHE A 120 -15.423 -4.120 2.531 1.00 0.00 H new ATOM 0 HA PHE A 120 -17.886 -2.812 3.508 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -14.949 -2.624 4.194 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -16.008 -1.267 4.525 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -18.326 -2.033 5.718 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -14.617 -4.118 5.926 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -19.047 -3.103 7.810 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -15.336 -5.190 8.017 1.00 0.00 H new ATOM 0 HZ PHE A 120 -17.550 -4.680 8.965 1.00 0.00 H new ATOM 1883 N THR A 121 -17.293 -0.468 2.431 1.00 0.00 N ATOM 1884 CA THR A 121 -17.272 0.652 1.499 1.00 0.00 C ATOM 1885 C THR A 121 -17.115 1.977 2.236 1.00 0.00 C ATOM 1886 O THR A 121 -17.706 2.182 3.296 1.00 0.00 O ATOM 1887 CB THR A 121 -18.556 0.699 0.649 1.00 0.00 C ATOM 1888 OG1 THR A 121 -18.450 1.728 -0.341 1.00 0.00 O ATOM 1889 CG2 THR A 121 -19.775 0.953 1.523 1.00 0.00 C ATOM 0 H THR A 121 -17.752 -0.268 3.320 1.00 0.00 H new ATOM 0 HA THR A 121 -16.415 0.501 0.842 1.00 0.00 H new ATOM 0 HB THR A 121 -18.676 -0.267 0.158 1.00 0.00 H new ATOM 0 HG1 THR A 121 -19.269 1.751 -0.878 1.00 0.00 H new ATOM 0 HG21 THR A 121 -20.669 0.982 0.901 1.00 0.00 H new ATOM 0 HG22 THR A 121 -19.870 0.153 2.257 1.00 0.00 H new ATOM 0 HG23 THR A 121 -19.661 1.907 2.039 1.00 0.00 H new ATOM 1897 N GLN A 122 -16.316 2.874 1.667 1.00 0.00 N ATOM 1898 CA GLN A 122 -16.082 4.180 2.270 1.00 0.00 C ATOM 1899 C GLN A 122 -16.450 5.301 1.304 1.00 0.00 C ATOM 1900 O GLN A 122 -16.611 5.072 0.105 1.00 0.00 O ATOM 1901 CB GLN A 122 -14.618 4.316 2.692 1.00 0.00 C ATOM 1902 CG GLN A 122 -13.635 4.127 1.548 1.00 0.00 C ATOM 1903 CD GLN A 122 -12.227 4.556 1.911 1.00 0.00 C ATOM 1904 OE1 GLN A 122 -12.025 5.592 2.546 1.00 0.00 O ATOM 1905 NE2 GLN A 122 -11.243 3.760 1.509 1.00 0.00 N ATOM 0 H GLN A 122 -15.820 2.720 0.789 1.00 0.00 H new ATOM 0 HA GLN A 122 -16.717 4.262 3.152 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -14.465 5.301 3.132 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -14.403 3.583 3.470 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -13.626 3.078 1.251 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -13.974 4.700 0.685 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -11.456 2.911 0.985 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -10.275 3.998 1.724 1.00 0.00 H new ATOM 1914 N ASP A 123 -16.584 6.512 1.833 1.00 0.00 N ATOM 1915 CA ASP A 123 -16.933 7.669 1.017 1.00 0.00 C ATOM 1916 C ASP A 123 -15.952 7.834 -0.139 1.00 0.00 C ATOM 1917 O ASP A 123 -16.232 8.544 -1.106 1.00 0.00 O ATOM 1918 CB ASP A 123 -16.951 8.937 1.873 1.00 0.00 C ATOM 1919 CG ASP A 123 -15.635 9.171 2.588 1.00 0.00 C ATOM 1920 OD1 ASP A 123 -14.589 9.212 1.907 1.00 0.00 O ATOM 1921 OD2 ASP A 123 -15.651 9.311 3.829 1.00 0.00 O ATOM 0 H ASP A 123 -16.456 6.718 2.824 1.00 0.00 H new ATOM 0 HA ASP A 123 -17.928 7.505 0.604 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -17.175 9.796 1.240 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -17.753 8.864 2.608 1.00 0.00 H new TER 1926 ASP A 123