USER MOD reduce.3.24.130724 H: found=0, std=0, add=1042, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1035 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 GLN : amide:sc= -3.41! C(o=-6.4!,f=-5.7!) USER MOD Set 1.2: A 56 THR OG1 : rot 180:sc= -0.808 USER MOD Set 1.3: A 107 MET CE :methyl -145:sc= -2.23 (180deg=-5.93!) USER MOD Set 2.1: A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 1 SER N :NH3+ -121:sc= 0.593 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.233 USER MOD Single : A 6 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -1.53 K(o=-1.5,f=-0.34) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 30:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 145:sc= -1.33! USER MOD Single : A 27 LYS NZ :NH3+ -164:sc= -0.0034 (180deg=-0.0619) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 31 HIS : no HD1:sc= -0.176 X(o=-0.18,f=-0.22) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl 145:sc= -0.0149 (180deg=-1.13) USER MOD Single : A 42 GLN : amide:sc= -0.0035 X(o=-0.0035,f=-0.44) USER MOD Single : A 45 SER OG : rot -106:sc= 0.844 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HE2:sc= -2.15! C(o=-2.1!,f=-3.9!) USER MOD Single : A 60 SER OG : rot 180:sc= 0.078 USER MOD Single : A 61 HIS : no HD1:sc= -0.186 K(o=-0.19,f=-2.7!) USER MOD Single : A 62 THR OG1 : rot 31:sc= 0.0437 USER MOD Single : A 64 SER OG : rot -110:sc= -0.0557 USER MOD Single : A 70 ASN : amide:sc= -0.665 K(o=-0.67,f=-11!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 HIS : no HD1:sc= 0.304 K(o=0.3,f=-2.7!) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot -141:sc= -0.592 USER MOD Single : A 89 ASN : amide:sc= -2.52! C(o=-2.5!,f=-1.5!) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0673 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -0.952 K(o=-0.95,f=-0.0039) USER MOD Single : A 121 LYS NZ :NH3+ 145:sc= 0.0121 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -6.276 -15.764 -11.853 1.00 0.00 N ATOM 2 CA SER A 1 -5.484 -16.316 -10.722 1.00 0.00 C ATOM 3 C SER A 1 -6.369 -16.583 -9.508 1.00 0.00 C ATOM 4 O SER A 1 -6.838 -15.653 -8.853 1.00 0.00 O ATOM 5 CB SER A 1 -4.384 -15.315 -10.363 1.00 0.00 C ATOM 6 OG SER A 1 -4.520 -14.118 -11.109 1.00 0.00 O ATOM 0 H1 SER A 1 -6.189 -16.392 -12.677 1.00 0.00 H new ATOM 0 H2 SER A 1 -7.276 -15.694 -11.575 1.00 0.00 H new ATOM 0 H3 SER A 1 -5.918 -14.819 -12.099 1.00 0.00 H new ATOM 0 HA SER A 1 -5.044 -17.267 -11.023 1.00 0.00 H new ATOM 0 HB2 SER A 1 -4.427 -15.090 -9.297 1.00 0.00 H new ATOM 0 HB3 SER A 1 -3.407 -15.759 -10.556 1.00 0.00 H new ATOM 0 HG SER A 1 -3.806 -13.494 -10.860 1.00 0.00 H new ATOM 14 N GLY A 2 -6.592 -17.861 -9.216 1.00 0.00 N ATOM 15 CA GLY A 2 -7.419 -18.230 -8.081 1.00 0.00 C ATOM 16 C GLY A 2 -6.599 -18.635 -6.873 1.00 0.00 C ATOM 17 O GLY A 2 -7.036 -19.451 -6.063 1.00 0.00 O ATOM 0 H GLY A 2 -6.215 -18.647 -9.745 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -8.061 -17.390 -7.815 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -8.073 -19.054 -8.365 1.00 0.00 H new ATOM 21 N PHE A 3 -5.405 -18.062 -6.753 1.00 0.00 N ATOM 22 CA PHE A 3 -4.518 -18.367 -5.636 1.00 0.00 C ATOM 23 C PHE A 3 -3.987 -17.086 -4.998 1.00 0.00 C ATOM 24 O PHE A 3 -2.800 -16.981 -4.686 1.00 0.00 O ATOM 25 CB PHE A 3 -3.353 -19.239 -6.107 1.00 0.00 C ATOM 26 CG PHE A 3 -3.289 -20.576 -5.426 1.00 0.00 C ATOM 27 CD1 PHE A 3 -4.133 -21.605 -5.808 1.00 0.00 C ATOM 28 CD2 PHE A 3 -2.381 -20.804 -4.403 1.00 0.00 C ATOM 29 CE1 PHE A 3 -4.076 -22.836 -5.184 1.00 0.00 C ATOM 30 CE2 PHE A 3 -2.318 -22.033 -3.775 1.00 0.00 C ATOM 31 CZ PHE A 3 -3.167 -23.051 -4.165 1.00 0.00 C ATOM 0 H PHE A 3 -5.030 -17.384 -7.416 1.00 0.00 H new ATOM 0 HA PHE A 3 -5.091 -18.913 -4.887 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -3.437 -19.392 -7.183 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -2.418 -18.707 -5.933 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -4.845 -21.443 -6.604 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -1.715 -20.012 -4.094 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -4.741 -23.630 -5.492 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -1.606 -22.198 -2.980 1.00 0.00 H new ATOM 0 HZ PHE A 3 -3.121 -24.012 -3.675 1.00 0.00 H new ATOM 41 N VAL A 4 -4.875 -16.114 -4.808 1.00 0.00 N ATOM 42 CA VAL A 4 -4.496 -14.840 -4.208 1.00 0.00 C ATOM 43 C VAL A 4 -4.241 -14.988 -2.712 1.00 0.00 C ATOM 44 O VAL A 4 -4.416 -16.067 -2.146 1.00 0.00 O ATOM 45 CB VAL A 4 -5.581 -13.770 -4.428 1.00 0.00 C ATOM 46 CG1 VAL A 4 -5.621 -13.341 -5.887 1.00 0.00 C ATOM 47 CG2 VAL A 4 -6.940 -14.285 -3.979 1.00 0.00 C ATOM 0 H VAL A 4 -5.861 -16.185 -5.061 1.00 0.00 H new ATOM 0 HA VAL A 4 -3.577 -14.522 -4.700 1.00 0.00 H new ATOM 0 HB VAL A 4 -5.331 -12.898 -3.823 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -6.394 -12.584 -6.023 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -4.654 -12.927 -6.171 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -5.844 -14.204 -6.514 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -7.693 -13.514 -4.143 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -7.200 -15.174 -4.553 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -6.902 -14.536 -2.919 1.00 0.00 H new ATOM 57 N CYS A 5 -3.826 -13.896 -2.078 1.00 0.00 N ATOM 58 CA CYS A 5 -3.545 -13.900 -0.647 1.00 0.00 C ATOM 59 C CYS A 5 -4.708 -13.299 0.138 1.00 0.00 C ATOM 60 O CYS A 5 -5.125 -13.846 1.160 1.00 0.00 O ATOM 61 CB CYS A 5 -2.262 -13.119 -0.358 1.00 0.00 C ATOM 62 SG CYS A 5 -1.573 -13.404 1.305 1.00 0.00 S ATOM 0 H CYS A 5 -3.677 -12.996 -2.534 1.00 0.00 H new ATOM 0 HA CYS A 5 -3.413 -14.934 -0.330 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -1.511 -13.388 -1.101 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -2.463 -12.054 -0.478 1.00 0.00 H new ATOM 67 N ASN A 6 -5.214 -12.165 -0.346 1.00 0.00 N ATOM 68 CA ASN A 6 -6.322 -11.466 0.299 1.00 0.00 C ATOM 69 C ASN A 6 -5.841 -10.793 1.574 1.00 0.00 C ATOM 70 O ASN A 6 -6.496 -10.854 2.614 1.00 0.00 O ATOM 71 CB ASN A 6 -7.474 -12.428 0.607 1.00 0.00 C ATOM 72 CG ASN A 6 -8.726 -12.101 -0.182 1.00 0.00 C ATOM 73 OD1 ASN A 6 -8.842 -12.447 -1.358 1.00 0.00 O ATOM 74 ND2 ASN A 6 -9.673 -11.429 0.462 1.00 0.00 N ATOM 0 H ASN A 6 -4.869 -11.709 -1.191 1.00 0.00 H new ATOM 0 HA ASN A 6 -6.693 -10.705 -0.387 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -7.162 -13.448 0.382 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -7.699 -12.391 1.673 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -10.538 -11.180 -0.018 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -9.536 -11.162 1.437 1.00 0.00 H new ATOM 81 N THR A 7 -4.679 -10.156 1.480 1.00 0.00 N ATOM 82 CA THR A 7 -4.087 -9.473 2.618 1.00 0.00 C ATOM 83 C THR A 7 -4.994 -8.355 3.120 1.00 0.00 C ATOM 84 O THR A 7 -5.084 -8.106 4.322 1.00 0.00 O ATOM 85 CB THR A 7 -2.718 -8.903 2.239 1.00 0.00 C ATOM 86 OG1 THR A 7 -2.148 -8.203 3.331 1.00 0.00 O ATOM 87 CG2 THR A 7 -2.771 -7.951 1.062 1.00 0.00 C ATOM 0 H THR A 7 -4.129 -10.100 0.623 1.00 0.00 H new ATOM 0 HA THR A 7 -3.964 -10.200 3.420 1.00 0.00 H new ATOM 0 HB THR A 7 -2.112 -9.765 1.962 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.273 -7.847 3.070 1.00 0.00 H new ATOM 0 HG21 THR A 7 -1.768 -7.584 0.846 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.162 -8.473 0.189 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.421 -7.110 1.303 1.00 0.00 H new ATOM 95 N CYS A 8 -5.659 -7.682 2.187 1.00 0.00 N ATOM 96 CA CYS A 8 -6.558 -6.582 2.520 1.00 0.00 C ATOM 97 C CYS A 8 -7.815 -7.090 3.230 1.00 0.00 C ATOM 98 O CYS A 8 -8.654 -7.754 2.622 1.00 0.00 O ATOM 99 CB CYS A 8 -6.938 -5.820 1.248 1.00 0.00 C ATOM 100 SG CYS A 8 -5.800 -6.101 -0.151 1.00 0.00 S ATOM 0 H CYS A 8 -5.592 -7.880 1.189 1.00 0.00 H new ATOM 0 HA CYS A 8 -6.039 -5.909 3.202 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -7.945 -6.112 0.949 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -6.968 -4.753 1.471 1.00 0.00 H new ATOM 105 N PRO A 9 -7.955 -6.790 4.538 1.00 0.00 N ATOM 106 CA PRO A 9 -9.094 -7.219 5.337 1.00 0.00 C ATOM 107 C PRO A 9 -10.221 -6.188 5.379 1.00 0.00 C ATOM 108 O PRO A 9 -11.252 -6.359 4.730 1.00 0.00 O ATOM 109 CB PRO A 9 -8.472 -7.397 6.721 1.00 0.00 C ATOM 110 CG PRO A 9 -7.320 -6.437 6.771 1.00 0.00 C ATOM 111 CD PRO A 9 -7.005 -6.021 5.351 1.00 0.00 C ATOM 0 HA PRO A 9 -9.568 -8.114 4.934 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -9.196 -7.182 7.507 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -8.135 -8.423 6.870 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -7.573 -5.567 7.377 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -6.451 -6.906 7.234 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -7.136 -4.948 5.211 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.973 -6.253 5.086 1.00 0.00 H new ATOM 119 N GLU A 10 -10.020 -5.124 6.153 1.00 0.00 N ATOM 120 CA GLU A 10 -11.026 -4.073 6.283 1.00 0.00 C ATOM 121 C GLU A 10 -10.604 -2.822 5.524 1.00 0.00 C ATOM 122 O GLU A 10 -11.071 -2.572 4.413 1.00 0.00 O ATOM 123 CB GLU A 10 -11.265 -3.737 7.759 1.00 0.00 C ATOM 124 CG GLU A 10 -10.769 -4.807 8.719 1.00 0.00 C ATOM 125 CD GLU A 10 -11.808 -5.880 8.982 1.00 0.00 C ATOM 126 OE1 GLU A 10 -12.750 -5.617 9.759 1.00 0.00 O ATOM 127 OE2 GLU A 10 -11.679 -6.983 8.412 1.00 0.00 O ATOM 0 H GLU A 10 -9.172 -4.967 6.698 1.00 0.00 H new ATOM 0 HA GLU A 10 -11.956 -4.442 5.851 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -10.770 -2.795 7.992 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -12.332 -3.584 7.919 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.870 -5.269 8.310 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.486 -4.341 9.663 1.00 0.00 H new ATOM 134 N LYS A 11 -9.710 -2.044 6.124 1.00 0.00 N ATOM 135 CA LYS A 11 -9.216 -0.827 5.494 1.00 0.00 C ATOM 136 C LYS A 11 -8.607 -1.160 4.141 1.00 0.00 C ATOM 137 O LYS A 11 -9.180 -0.849 3.099 1.00 0.00 O ATOM 138 CB LYS A 11 -8.175 -0.146 6.383 1.00 0.00 C ATOM 139 CG LYS A 11 -8.552 -0.118 7.854 1.00 0.00 C ATOM 140 CD LYS A 11 -9.015 1.262 8.286 1.00 0.00 C ATOM 141 CE LYS A 11 -10.321 1.197 9.060 1.00 0.00 C ATOM 142 NZ LYS A 11 -10.942 2.541 9.215 1.00 0.00 N ATOM 0 H LYS A 11 -9.314 -2.235 7.044 1.00 0.00 H new ATOM 0 HA LYS A 11 -10.052 -0.141 5.354 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -7.221 -0.662 6.271 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -8.027 0.876 6.036 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -9.344 -0.843 8.041 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.695 -0.420 8.456 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -8.247 1.727 8.905 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.143 1.895 7.408 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -11.016 0.533 8.545 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.139 0.766 10.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -11.831 2.453 9.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -10.290 3.167 9.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -11.140 2.942 8.276 1.00 0.00 H new ATOM 155 N TRP A 12 -7.446 -1.811 4.179 1.00 0.00 N ATOM 156 CA TRP A 12 -6.741 -2.223 2.965 1.00 0.00 C ATOM 157 C TRP A 12 -7.742 -2.700 1.912 1.00 0.00 C ATOM 158 O TRP A 12 -8.687 -3.423 2.231 1.00 0.00 O ATOM 159 CB TRP A 12 -5.729 -3.339 3.277 1.00 0.00 C ATOM 160 CG TRP A 12 -4.974 -3.159 4.570 1.00 0.00 C ATOM 161 CD1 TRP A 12 -4.952 -2.053 5.376 1.00 0.00 C ATOM 162 CD2 TRP A 12 -4.118 -4.123 5.200 1.00 0.00 C ATOM 163 NE1 TRP A 12 -4.153 -2.276 6.469 1.00 0.00 N ATOM 164 CE2 TRP A 12 -3.626 -3.537 6.383 1.00 0.00 C ATOM 165 CE3 TRP A 12 -3.726 -5.426 4.880 1.00 0.00 C ATOM 166 CZ2 TRP A 12 -2.761 -4.209 7.243 1.00 0.00 C ATOM 167 CZ3 TRP A 12 -2.866 -6.091 5.735 1.00 0.00 C ATOM 168 CH2 TRP A 12 -2.394 -5.482 6.904 1.00 0.00 C ATOM 0 H TRP A 12 -6.970 -2.066 5.044 1.00 0.00 H new ATOM 0 HA TRP A 12 -6.197 -1.364 2.574 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -6.257 -4.292 3.310 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -5.012 -3.400 2.458 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -5.487 -1.136 5.180 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -3.980 -1.611 7.223 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -4.088 -5.904 3.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -2.393 -3.742 8.145 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -2.553 -7.097 5.497 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -1.726 -6.029 7.552 1.00 0.00 H new ATOM 179 N ILE A 13 -7.554 -2.271 0.666 1.00 0.00 N ATOM 180 CA ILE A 13 -8.475 -2.641 -0.411 1.00 0.00 C ATOM 181 C ILE A 13 -7.756 -3.170 -1.653 1.00 0.00 C ATOM 182 O ILE A 13 -6.868 -2.518 -2.195 1.00 0.00 O ATOM 183 CB ILE A 13 -9.351 -1.442 -0.823 1.00 0.00 C ATOM 184 CG1 ILE A 13 -9.155 -0.272 0.156 1.00 0.00 C ATOM 185 CG2 ILE A 13 -10.808 -1.867 -0.892 1.00 0.00 C ATOM 186 CD1 ILE A 13 -10.437 0.427 0.567 1.00 0.00 C ATOM 0 H ILE A 13 -6.780 -1.672 0.377 1.00 0.00 H new ATOM 0 HA ILE A 13 -9.095 -3.442 -0.009 1.00 0.00 H new ATOM 0 HB ILE A 13 -9.048 -1.100 -1.812 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -8.656 -0.644 1.051 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -8.488 0.459 -0.301 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -11.422 -1.015 -1.184 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -10.920 -2.664 -1.627 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -11.129 -2.228 0.085 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -10.204 1.238 1.257 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -10.929 0.833 -0.317 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -11.100 -0.287 1.056 1.00 0.00 H new ATOM 198 N ASN A 14 -8.170 -4.353 -2.107 1.00 0.00 N ATOM 199 CA ASN A 14 -7.587 -4.979 -3.294 1.00 0.00 C ATOM 200 C ASN A 14 -8.504 -4.813 -4.504 1.00 0.00 C ATOM 201 O ASN A 14 -9.722 -4.702 -4.359 1.00 0.00 O ATOM 202 CB ASN A 14 -7.323 -6.464 -3.044 1.00 0.00 C ATOM 203 CG ASN A 14 -7.065 -7.234 -4.325 1.00 0.00 C ATOM 204 OD1 ASN A 14 -7.816 -8.141 -4.678 1.00 0.00 O ATOM 205 ND2 ASN A 14 -5.997 -6.874 -5.027 1.00 0.00 N ATOM 0 H ASN A 14 -8.911 -4.900 -1.668 1.00 0.00 H new ATOM 0 HA ASN A 14 -6.640 -4.481 -3.503 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -6.464 -6.570 -2.381 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.179 -6.900 -2.529 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -5.772 -7.356 -5.897 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.401 -6.115 -4.696 1.00 0.00 H new ATOM 212 N PHE A 15 -7.912 -4.794 -5.695 1.00 0.00 N ATOM 213 CA PHE A 15 -8.677 -4.641 -6.928 1.00 0.00 C ATOM 214 C PHE A 15 -8.316 -5.737 -7.932 1.00 0.00 C ATOM 215 O PHE A 15 -8.313 -6.920 -7.590 1.00 0.00 O ATOM 216 CB PHE A 15 -8.429 -3.258 -7.538 1.00 0.00 C ATOM 217 CG PHE A 15 -8.338 -2.158 -6.520 1.00 0.00 C ATOM 218 CD1 PHE A 15 -9.476 -1.492 -6.096 1.00 0.00 C ATOM 219 CD2 PHE A 15 -7.113 -1.790 -5.990 1.00 0.00 C ATOM 220 CE1 PHE A 15 -9.393 -0.478 -5.160 1.00 0.00 C ATOM 221 CE2 PHE A 15 -7.023 -0.779 -5.055 1.00 0.00 C ATOM 222 CZ PHE A 15 -8.164 -0.122 -4.638 1.00 0.00 C ATOM 0 H PHE A 15 -6.905 -4.883 -5.832 1.00 0.00 H new ATOM 0 HA PHE A 15 -9.736 -4.735 -6.687 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.504 -3.285 -8.114 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -9.234 -3.029 -8.237 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -10.438 -1.768 -6.501 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -6.217 -2.300 -6.312 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -10.287 0.035 -4.837 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -6.061 -0.502 -4.650 1.00 0.00 H new ATOM 0 HZ PHE A 15 -8.096 0.669 -3.905 1.00 0.00 H new ATOM 232 N GLN A 16 -8.016 -5.340 -9.169 1.00 0.00 N ATOM 233 CA GLN A 16 -7.655 -6.294 -10.214 1.00 0.00 C ATOM 234 C GLN A 16 -6.559 -7.238 -9.734 1.00 0.00 C ATOM 235 O GLN A 16 -6.655 -8.454 -9.904 1.00 0.00 O ATOM 236 CB GLN A 16 -7.196 -5.555 -11.473 1.00 0.00 C ATOM 237 CG GLN A 16 -6.275 -4.380 -11.188 1.00 0.00 C ATOM 238 CD GLN A 16 -6.820 -3.070 -11.723 1.00 0.00 C ATOM 239 OE1 GLN A 16 -7.090 -2.939 -12.918 1.00 0.00 O ATOM 240 NE2 GLN A 16 -6.987 -2.094 -10.840 1.00 0.00 N ATOM 0 H GLN A 16 -8.016 -4.365 -9.470 1.00 0.00 H new ATOM 0 HA GLN A 16 -8.539 -6.886 -10.452 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -6.682 -6.257 -12.129 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -8.072 -5.196 -12.013 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -6.124 -4.294 -10.112 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -5.299 -4.572 -11.633 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -6.750 -2.247 -9.860 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -7.352 -1.191 -11.141 1.00 0.00 H new ATOM 249 N ARG A 17 -5.518 -6.673 -9.129 1.00 0.00 N ATOM 250 CA ARG A 17 -4.409 -7.469 -8.619 1.00 0.00 C ATOM 251 C ARG A 17 -3.544 -6.658 -7.663 1.00 0.00 C ATOM 252 O ARG A 17 -2.568 -7.164 -7.110 1.00 0.00 O ATOM 253 CB ARG A 17 -3.557 -8.001 -9.774 1.00 0.00 C ATOM 254 CG ARG A 17 -3.078 -6.918 -10.726 1.00 0.00 C ATOM 255 CD ARG A 17 -3.761 -7.025 -12.079 1.00 0.00 C ATOM 256 NE ARG A 17 -2.841 -7.474 -13.122 1.00 0.00 N ATOM 257 CZ ARG A 17 -3.225 -8.140 -14.207 1.00 0.00 C ATOM 258 NH1 ARG A 17 -4.504 -8.433 -14.392 1.00 0.00 N ATOM 259 NH2 ARG A 17 -2.327 -8.515 -15.108 1.00 0.00 N ATOM 0 H ARG A 17 -5.420 -5.669 -8.981 1.00 0.00 H new ATOM 0 HA ARG A 17 -4.828 -8.312 -8.069 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -2.692 -8.523 -9.366 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -4.137 -8.735 -10.334 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -3.277 -5.938 -10.293 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -1.998 -6.997 -10.855 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -4.597 -7.721 -12.009 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -4.175 -6.055 -12.354 1.00 0.00 H new ATOM 0 HE ARG A 17 -1.849 -7.265 -13.012 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -5.198 -8.148 -13.701 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -4.795 -8.944 -15.226 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -1.341 -8.293 -14.969 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -2.622 -9.026 -15.940 1.00 0.00 H new ATOM 273 N LYS A 18 -3.917 -5.400 -7.461 1.00 0.00 N ATOM 274 CA LYS A 18 -3.192 -4.521 -6.568 1.00 0.00 C ATOM 275 C LYS A 18 -4.065 -4.172 -5.374 1.00 0.00 C ATOM 276 O LYS A 18 -5.288 -4.248 -5.446 1.00 0.00 O ATOM 277 CB LYS A 18 -2.774 -3.249 -7.299 1.00 0.00 C ATOM 278 CG LYS A 18 -3.898 -2.238 -7.436 1.00 0.00 C ATOM 279 CD LYS A 18 -3.764 -1.425 -8.713 1.00 0.00 C ATOM 280 CE LYS A 18 -3.815 0.068 -8.431 1.00 0.00 C ATOM 281 NZ LYS A 18 -2.719 0.802 -9.121 1.00 0.00 N ATOM 0 H LYS A 18 -4.725 -4.968 -7.910 1.00 0.00 H new ATOM 0 HA LYS A 18 -2.294 -5.032 -6.220 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -1.943 -2.788 -6.765 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -2.408 -3.512 -8.292 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.857 -2.756 -7.432 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -3.894 -1.569 -6.575 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -2.823 -1.671 -9.205 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.564 -1.694 -9.402 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -4.777 0.466 -8.754 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.745 0.237 -7.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.790 1.816 -8.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -1.800 0.441 -8.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -2.801 0.662 -10.148 1.00 0.00 H new ATOM 294 N CYS A 19 -3.434 -3.794 -4.283 1.00 0.00 N ATOM 295 CA CYS A 19 -4.160 -3.441 -3.076 1.00 0.00 C ATOM 296 C CYS A 19 -3.703 -2.098 -2.536 1.00 0.00 C ATOM 297 O CYS A 19 -2.648 -1.583 -2.910 1.00 0.00 O ATOM 298 CB CYS A 19 -3.982 -4.528 -2.010 1.00 0.00 C ATOM 299 SG CYS A 19 -4.982 -4.276 -0.504 1.00 0.00 S ATOM 0 H CYS A 19 -2.420 -3.722 -4.204 1.00 0.00 H new ATOM 0 HA CYS A 19 -5.217 -3.363 -3.330 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -4.240 -5.493 -2.446 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -2.930 -4.576 -1.729 1.00 0.00 H new ATOM 304 N TYR A 20 -4.505 -1.554 -1.641 1.00 0.00 N ATOM 305 CA TYR A 20 -4.216 -0.283 -1.009 1.00 0.00 C ATOM 306 C TYR A 20 -4.229 -0.473 0.491 1.00 0.00 C ATOM 307 O TYR A 20 -4.879 -1.374 1.012 1.00 0.00 O ATOM 308 CB TYR A 20 -5.242 0.788 -1.408 1.00 0.00 C ATOM 309 CG TYR A 20 -4.896 1.537 -2.678 1.00 0.00 C ATOM 310 CD1 TYR A 20 -4.332 0.885 -3.767 1.00 0.00 C ATOM 311 CD2 TYR A 20 -5.138 2.902 -2.786 1.00 0.00 C ATOM 312 CE1 TYR A 20 -4.017 1.570 -4.926 1.00 0.00 C ATOM 313 CE2 TYR A 20 -4.826 3.593 -3.941 1.00 0.00 C ATOM 314 CZ TYR A 20 -4.266 2.923 -5.008 1.00 0.00 C ATOM 315 OH TYR A 20 -3.955 3.608 -6.159 1.00 0.00 O ATOM 0 H TYR A 20 -5.377 -1.983 -1.332 1.00 0.00 H new ATOM 0 HA TYR A 20 -3.236 0.059 -1.340 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -6.215 0.314 -1.533 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -5.339 1.504 -0.592 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -4.136 -0.175 -3.707 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -5.577 3.431 -1.953 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -3.578 1.047 -5.763 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.020 4.653 -4.008 1.00 0.00 H new ATOM 0 HH TYR A 20 -4.195 4.552 -6.053 1.00 0.00 H new ATOM 325 N TYR A 21 -3.498 0.374 1.168 1.00 0.00 N ATOM 326 CA TYR A 21 -3.395 0.321 2.612 1.00 0.00 C ATOM 327 C TYR A 21 -3.985 1.571 3.210 1.00 0.00 C ATOM 328 O TYR A 21 -3.520 2.659 2.928 1.00 0.00 O ATOM 329 CB TYR A 21 -1.933 0.216 3.048 1.00 0.00 C ATOM 330 CG TYR A 21 -1.389 -1.188 3.078 1.00 0.00 C ATOM 331 CD1 TYR A 21 -1.513 -1.970 4.214 1.00 0.00 C ATOM 332 CD2 TYR A 21 -0.740 -1.725 1.974 1.00 0.00 C ATOM 333 CE1 TYR A 21 -1.008 -3.250 4.256 1.00 0.00 C ATOM 334 CE2 TYR A 21 -0.231 -3.009 2.003 1.00 0.00 C ATOM 335 CZ TYR A 21 -0.368 -3.769 3.148 1.00 0.00 C ATOM 336 OH TYR A 21 0.138 -5.048 3.185 1.00 0.00 O ATOM 0 H TYR A 21 -2.955 1.123 0.738 1.00 0.00 H new ATOM 0 HA TYR A 21 -3.938 -0.558 2.959 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.322 0.814 2.372 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -1.831 0.653 4.041 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.015 -1.569 5.082 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -0.632 -1.130 1.079 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -1.112 -3.845 5.151 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.270 -3.415 1.137 1.00 0.00 H new ATOM 0 HH TYR A 21 -0.402 -5.596 3.791 1.00 0.00 H new ATOM 346 N PHE A 22 -4.990 1.417 4.045 1.00 0.00 N ATOM 347 CA PHE A 22 -5.604 2.555 4.695 1.00 0.00 C ATOM 348 C PHE A 22 -5.646 2.288 6.190 1.00 0.00 C ATOM 349 O PHE A 22 -6.701 2.353 6.818 1.00 0.00 O ATOM 350 CB PHE A 22 -7.021 2.793 4.159 1.00 0.00 C ATOM 351 CG PHE A 22 -7.093 3.113 2.687 1.00 0.00 C ATOM 352 CD1 PHE A 22 -6.102 3.856 2.069 1.00 0.00 C ATOM 353 CD2 PHE A 22 -8.162 2.670 1.921 1.00 0.00 C ATOM 354 CE1 PHE A 22 -6.172 4.151 0.719 1.00 0.00 C ATOM 355 CE2 PHE A 22 -8.238 2.962 0.569 1.00 0.00 C ATOM 356 CZ PHE A 22 -7.239 3.703 -0.032 1.00 0.00 C ATOM 0 H PHE A 22 -5.399 0.515 4.290 1.00 0.00 H new ATOM 0 HA PHE A 22 -5.018 3.451 4.489 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -7.622 1.905 4.354 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -7.473 3.613 4.718 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.262 4.210 2.649 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -8.946 2.090 2.385 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -5.391 4.733 0.253 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -9.077 2.611 -0.014 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.293 3.931 -1.086 1.00 0.00 H new ATOM 366 N GLY A 23 -4.485 1.957 6.748 1.00 0.00 N ATOM 367 CA GLY A 23 -4.404 1.645 8.156 1.00 0.00 C ATOM 368 C GLY A 23 -4.088 2.861 9.006 1.00 0.00 C ATOM 369 O GLY A 23 -3.896 3.957 8.480 1.00 0.00 O ATOM 0 H GLY A 23 -3.599 1.900 6.245 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -5.350 1.213 8.484 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -3.636 0.887 8.313 1.00 0.00 H new ATOM 373 N LYS A 24 -4.037 2.673 10.322 1.00 0.00 N ATOM 374 CA LYS A 24 -3.746 3.770 11.239 1.00 0.00 C ATOM 375 C LYS A 24 -2.520 3.465 12.095 1.00 0.00 C ATOM 376 O LYS A 24 -2.288 2.319 12.479 1.00 0.00 O ATOM 377 CB LYS A 24 -4.953 4.045 12.137 1.00 0.00 C ATOM 378 CG LYS A 24 -5.507 2.800 12.810 1.00 0.00 C ATOM 379 CD LYS A 24 -6.913 3.031 13.340 1.00 0.00 C ATOM 380 CE LYS A 24 -7.789 1.805 13.149 1.00 0.00 C ATOM 381 NZ LYS A 24 -9.198 2.170 12.837 1.00 0.00 N ATOM 0 H LYS A 24 -4.193 1.773 10.776 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.533 4.657 10.642 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.668 4.766 12.903 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.741 4.507 11.542 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.517 1.974 12.098 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.852 2.506 13.630 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.866 3.285 14.399 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.361 3.883 12.828 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.386 1.193 12.342 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.764 1.197 14.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.762 1.305 12.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -9.592 2.732 13.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -9.226 2.729 11.960 1.00 0.00 H new ATOM 394 N GLY A 25 -1.740 4.501 12.390 1.00 0.00 N ATOM 395 CA GLY A 25 -0.546 4.328 13.199 1.00 0.00 C ATOM 396 C GLY A 25 0.692 4.912 12.543 1.00 0.00 C ATOM 397 O GLY A 25 1.490 4.183 11.954 1.00 0.00 O ATOM 0 H GLY A 25 -1.914 5.458 12.083 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.697 4.802 14.169 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.388 3.266 13.384 1.00 0.00 H new ATOM 401 N THR A 26 0.851 6.228 12.645 1.00 0.00 N ATOM 402 CA THR A 26 2.001 6.907 12.055 1.00 0.00 C ATOM 403 C THR A 26 2.244 8.257 12.728 1.00 0.00 C ATOM 404 O THR A 26 1.785 8.494 13.846 1.00 0.00 O ATOM 405 CB THR A 26 1.788 7.099 10.554 1.00 0.00 C ATOM 406 OG1 THR A 26 0.476 6.716 10.182 1.00 0.00 O ATOM 407 CG2 THR A 26 2.756 6.304 9.706 1.00 0.00 C ATOM 0 H THR A 26 0.199 6.845 13.130 1.00 0.00 H new ATOM 0 HA THR A 26 2.881 6.283 12.213 1.00 0.00 H new ATOM 0 HB THR A 26 1.957 8.160 10.371 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.155 7.302 9.466 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.550 6.486 8.651 1.00 0.00 H new ATOM 0 HG22 THR A 26 3.777 6.611 9.934 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.640 5.242 9.921 1.00 0.00 H new ATOM 415 N LYS A 27 2.971 9.137 12.044 1.00 0.00 N ATOM 416 CA LYS A 27 3.275 10.459 12.583 1.00 0.00 C ATOM 417 C LYS A 27 3.157 11.538 11.509 1.00 0.00 C ATOM 418 O LYS A 27 2.288 12.407 11.584 1.00 0.00 O ATOM 419 CB LYS A 27 4.683 10.475 13.181 1.00 0.00 C ATOM 420 CG LYS A 27 4.703 10.367 14.696 1.00 0.00 C ATOM 421 CD LYS A 27 6.113 10.135 15.219 1.00 0.00 C ATOM 422 CE LYS A 27 6.199 8.858 16.039 1.00 0.00 C ATOM 423 NZ LYS A 27 5.371 8.933 17.274 1.00 0.00 N ATOM 0 H LYS A 27 3.359 8.959 11.118 1.00 0.00 H new ATOM 0 HA LYS A 27 2.547 10.675 13.365 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.257 9.650 12.759 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.184 11.397 12.884 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.297 11.280 15.132 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.057 9.548 15.012 1.00 0.00 H new ATOM 0 HD2 LYS A 27 6.808 10.079 14.381 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.419 10.983 15.831 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.870 8.014 15.432 1.00 0.00 H new ATOM 0 HE3 LYS A 27 7.238 8.670 16.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 5.658 8.179 17.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 5.508 9.858 17.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.368 8.814 17.027 1.00 0.00 H new ATOM 436 N GLN A 28 4.040 11.480 10.516 1.00 0.00 N ATOM 437 CA GLN A 28 4.040 12.453 9.430 1.00 0.00 C ATOM 438 C GLN A 28 4.067 11.752 8.077 1.00 0.00 C ATOM 439 O GLN A 28 3.766 10.563 7.978 1.00 0.00 O ATOM 440 CB GLN A 28 5.243 13.390 9.557 1.00 0.00 C ATOM 441 CG GLN A 28 5.385 14.016 10.934 1.00 0.00 C ATOM 442 CD GLN A 28 6.259 15.255 10.923 1.00 0.00 C ATOM 443 OE1 GLN A 28 5.815 16.346 11.283 1.00 0.00 O ATOM 444 NE2 GLN A 28 7.511 15.093 10.510 1.00 0.00 N ATOM 0 H GLN A 28 4.766 10.767 10.442 1.00 0.00 H new ATOM 0 HA GLN A 28 3.124 13.040 9.498 1.00 0.00 H new ATOM 0 HB2 GLN A 28 6.152 12.834 9.324 1.00 0.00 H new ATOM 0 HB3 GLN A 28 5.155 14.183 8.814 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.397 14.276 11.315 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.809 13.283 11.621 1.00 0.00 H new ATOM 0 HE21 GLN A 28 7.837 14.171 10.221 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.146 15.891 10.482 1.00 0.00 H new ATOM 453 N TRP A 29 4.426 12.497 7.036 1.00 0.00 N ATOM 454 CA TRP A 29 4.490 11.944 5.690 1.00 0.00 C ATOM 455 C TRP A 29 5.590 10.898 5.575 1.00 0.00 C ATOM 456 O TRP A 29 5.364 9.796 5.078 1.00 0.00 O ATOM 457 CB TRP A 29 4.724 13.051 4.666 1.00 0.00 C ATOM 458 CG TRP A 29 4.710 12.542 3.261 1.00 0.00 C ATOM 459 CD1 TRP A 29 3.625 12.425 2.445 1.00 0.00 C ATOM 460 CD2 TRP A 29 5.833 12.064 2.513 1.00 0.00 C ATOM 461 NE1 TRP A 29 4.002 11.903 1.235 1.00 0.00 N ATOM 462 CE2 TRP A 29 5.353 11.676 1.249 1.00 0.00 C ATOM 463 CE3 TRP A 29 7.197 11.930 2.787 1.00 0.00 C ATOM 464 CZ2 TRP A 29 6.187 11.160 0.262 1.00 0.00 C ATOM 465 CZ3 TRP A 29 8.025 11.418 1.806 1.00 0.00 C ATOM 466 CH2 TRP A 29 7.518 11.039 0.557 1.00 0.00 C ATOM 0 H TRP A 29 4.676 13.484 7.100 1.00 0.00 H new ATOM 0 HA TRP A 29 3.533 11.463 5.486 1.00 0.00 H new ATOM 0 HB2 TRP A 29 3.955 13.815 4.780 1.00 0.00 H new ATOM 0 HB3 TRP A 29 5.682 13.530 4.866 1.00 0.00 H new ATOM 0 HD1 TRP A 29 2.616 12.703 2.712 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.378 11.714 0.451 1.00 0.00 H new ATOM 0 HE3 TRP A 29 7.596 12.221 3.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 5.798 10.866 -0.702 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 9.081 11.308 2.006 1.00 0.00 H new ATOM 0 HH2 TRP A 29 8.191 10.643 -0.189 1.00 0.00 H new ATOM 477 N VAL A 30 6.782 11.257 6.034 1.00 0.00 N ATOM 478 CA VAL A 30 7.927 10.355 5.986 1.00 0.00 C ATOM 479 C VAL A 30 7.602 9.036 6.670 1.00 0.00 C ATOM 480 O VAL A 30 8.109 7.981 6.292 1.00 0.00 O ATOM 481 CB VAL A 30 9.162 10.981 6.655 1.00 0.00 C ATOM 482 CG1 VAL A 30 9.789 12.018 5.743 1.00 0.00 C ATOM 483 CG2 VAL A 30 8.786 11.598 7.992 1.00 0.00 C ATOM 0 H VAL A 30 6.982 12.169 6.445 1.00 0.00 H new ATOM 0 HA VAL A 30 8.151 10.174 4.935 1.00 0.00 H new ATOM 0 HB VAL A 30 9.895 10.195 6.835 1.00 0.00 H new ATOM 0 HG11 VAL A 30 10.662 12.452 6.231 1.00 0.00 H new ATOM 0 HG12 VAL A 30 10.093 11.545 4.809 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.063 12.804 5.532 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.671 12.037 8.452 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.036 12.373 7.837 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.381 10.827 8.647 1.00 0.00 H new ATOM 493 N HIS A 31 6.746 9.108 7.677 1.00 0.00 N ATOM 494 CA HIS A 31 6.340 7.921 8.414 1.00 0.00 C ATOM 495 C HIS A 31 5.438 7.043 7.554 1.00 0.00 C ATOM 496 O HIS A 31 5.406 5.824 7.718 1.00 0.00 O ATOM 497 CB HIS A 31 5.618 8.315 9.704 1.00 0.00 C ATOM 498 CG HIS A 31 6.349 7.911 10.946 1.00 0.00 C ATOM 499 ND1 HIS A 31 7.467 8.572 11.411 1.00 0.00 N ATOM 500 CD2 HIS A 31 6.118 6.905 11.824 1.00 0.00 C ATOM 501 CE1 HIS A 31 7.891 7.991 12.520 1.00 0.00 C ATOM 502 NE2 HIS A 31 7.090 6.978 12.790 1.00 0.00 N ATOM 0 H HIS A 31 6.319 9.975 8.003 1.00 0.00 H new ATOM 0 HA HIS A 31 7.234 7.354 8.673 1.00 0.00 H new ATOM 0 HB2 HIS A 31 5.472 9.395 9.713 1.00 0.00 H new ATOM 0 HB3 HIS A 31 4.628 7.859 9.710 1.00 0.00 H new ATOM 0 HD2 HIS A 31 5.318 6.181 11.773 1.00 0.00 H new ATOM 0 HE1 HIS A 31 8.747 8.294 13.105 1.00 0.00 H new ATOM 0 HE2 HIS A 31 7.179 6.350 13.589 1.00 0.00 H new ATOM 511 N ALA A 32 4.707 7.669 6.634 1.00 0.00 N ATOM 512 CA ALA A 32 3.812 6.934 5.751 1.00 0.00 C ATOM 513 C ALA A 32 4.600 6.118 4.735 1.00 0.00 C ATOM 514 O ALA A 32 4.357 4.925 4.567 1.00 0.00 O ATOM 515 CB ALA A 32 2.866 7.890 5.044 1.00 0.00 C ATOM 0 H ALA A 32 4.718 8.678 6.483 1.00 0.00 H new ATOM 0 HA ALA A 32 3.225 6.245 6.358 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.203 7.327 4.387 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.273 8.428 5.783 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.443 8.602 4.453 1.00 0.00 H new ATOM 521 N ARG A 33 5.558 6.763 4.074 1.00 0.00 N ATOM 522 CA ARG A 33 6.390 6.087 3.089 1.00 0.00 C ATOM 523 C ARG A 33 7.168 4.954 3.744 1.00 0.00 C ATOM 524 O ARG A 33 7.347 3.890 3.152 1.00 0.00 O ATOM 525 CB ARG A 33 7.347 7.072 2.413 1.00 0.00 C ATOM 526 CG ARG A 33 8.086 7.973 3.386 1.00 0.00 C ATOM 527 CD ARG A 33 9.566 7.631 3.448 1.00 0.00 C ATOM 528 NE ARG A 33 10.344 8.383 2.466 1.00 0.00 N ATOM 529 CZ ARG A 33 11.352 9.188 2.784 1.00 0.00 C ATOM 530 NH1 ARG A 33 11.705 9.347 4.052 1.00 0.00 N ATOM 531 NH2 ARG A 33 12.009 9.838 1.833 1.00 0.00 N ATOM 0 H ARG A 33 5.775 7.751 4.204 1.00 0.00 H new ATOM 0 HA ARG A 33 5.739 5.668 2.322 1.00 0.00 H new ATOM 0 HB2 ARG A 33 8.075 6.512 1.826 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.783 7.691 1.715 1.00 0.00 H new ATOM 0 HG2 ARG A 33 7.964 9.013 3.084 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.647 7.876 4.379 1.00 0.00 H new ATOM 0 HD2 ARG A 33 9.945 7.841 4.448 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.699 6.563 3.275 1.00 0.00 H new ATOM 0 HE ARG A 33 10.099 8.284 1.481 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.202 8.850 4.787 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.479 9.966 4.292 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.741 9.720 0.856 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.783 10.456 2.079 1.00 0.00 H new ATOM 545 N TYR A 34 7.609 5.182 4.977 1.00 0.00 N ATOM 546 CA TYR A 34 8.345 4.165 5.715 1.00 0.00 C ATOM 547 C TYR A 34 7.437 2.973 5.979 1.00 0.00 C ATOM 548 O TYR A 34 7.876 1.823 5.951 1.00 0.00 O ATOM 549 CB TYR A 34 8.876 4.731 7.032 1.00 0.00 C ATOM 550 CG TYR A 34 10.382 4.681 7.152 1.00 0.00 C ATOM 551 CD1 TYR A 34 11.036 3.489 7.432 1.00 0.00 C ATOM 552 CD2 TYR A 34 11.150 5.826 6.982 1.00 0.00 C ATOM 553 CE1 TYR A 34 12.413 3.438 7.542 1.00 0.00 C ATOM 554 CE2 TYR A 34 12.528 5.785 7.089 1.00 0.00 C ATOM 555 CZ TYR A 34 13.153 4.588 7.369 1.00 0.00 C ATOM 556 OH TYR A 34 14.525 4.542 7.477 1.00 0.00 O ATOM 0 H TYR A 34 7.470 6.057 5.483 1.00 0.00 H new ATOM 0 HA TYR A 34 9.198 3.843 5.118 1.00 0.00 H new ATOM 0 HB2 TYR A 34 8.547 5.765 7.132 1.00 0.00 H new ATOM 0 HB3 TYR A 34 8.436 4.175 7.860 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.459 2.586 7.566 1.00 0.00 H new ATOM 0 HD2 TYR A 34 10.662 6.764 6.762 1.00 0.00 H new ATOM 0 HE1 TYR A 34 12.906 2.503 7.762 1.00 0.00 H new ATOM 0 HE2 TYR A 34 13.111 6.684 6.954 1.00 0.00 H new ATOM 0 HH TYR A 34 14.895 5.437 7.326 1.00 0.00 H new ATOM 566 N ALA A 35 6.161 3.261 6.212 1.00 0.00 N ATOM 567 CA ALA A 35 5.176 2.218 6.452 1.00 0.00 C ATOM 568 C ALA A 35 4.983 1.397 5.186 1.00 0.00 C ATOM 569 O ALA A 35 4.811 0.180 5.240 1.00 0.00 O ATOM 570 CB ALA A 35 3.857 2.824 6.908 1.00 0.00 C ATOM 0 H ALA A 35 5.787 4.209 6.239 1.00 0.00 H new ATOM 0 HA ALA A 35 5.536 1.563 7.245 1.00 0.00 H new ATOM 0 HB1 ALA A 35 3.132 2.029 7.083 1.00 0.00 H new ATOM 0 HB2 ALA A 35 4.013 3.382 7.831 1.00 0.00 H new ATOM 0 HB3 ALA A 35 3.480 3.496 6.137 1.00 0.00 H new ATOM 576 N CYS A 36 5.032 2.080 4.045 1.00 0.00 N ATOM 577 CA CYS A 36 4.884 1.432 2.755 1.00 0.00 C ATOM 578 C CYS A 36 5.954 0.368 2.583 1.00 0.00 C ATOM 579 O CYS A 36 5.665 -0.771 2.218 1.00 0.00 O ATOM 580 CB CYS A 36 4.999 2.458 1.631 1.00 0.00 C ATOM 581 SG CYS A 36 4.051 3.986 1.913 1.00 0.00 S ATOM 0 H CYS A 36 5.174 3.089 3.993 1.00 0.00 H new ATOM 0 HA CYS A 36 3.900 0.965 2.711 1.00 0.00 H new ATOM 0 HB2 CYS A 36 6.049 2.716 1.496 1.00 0.00 H new ATOM 0 HB3 CYS A 36 4.661 2.001 0.701 1.00 0.00 H new ATOM 586 N ASP A 37 7.192 0.758 2.855 1.00 0.00 N ATOM 587 CA ASP A 37 8.322 -0.151 2.742 1.00 0.00 C ATOM 588 C ASP A 37 8.103 -1.386 3.608 1.00 0.00 C ATOM 589 O ASP A 37 8.486 -2.496 3.237 1.00 0.00 O ATOM 590 CB ASP A 37 9.617 0.554 3.152 1.00 0.00 C ATOM 591 CG ASP A 37 10.460 0.955 1.958 1.00 0.00 C ATOM 592 OD1 ASP A 37 10.083 1.921 1.262 1.00 0.00 O ATOM 593 OD2 ASP A 37 11.498 0.302 1.719 1.00 0.00 O ATOM 0 H ASP A 37 7.439 1.701 3.156 1.00 0.00 H new ATOM 0 HA ASP A 37 8.407 -0.464 1.701 1.00 0.00 H new ATOM 0 HB2 ASP A 37 9.375 1.441 3.737 1.00 0.00 H new ATOM 0 HB3 ASP A 37 10.197 -0.105 3.798 1.00 0.00 H new ATOM 598 N ASP A 38 7.479 -1.183 4.765 1.00 0.00 N ATOM 599 CA ASP A 38 7.200 -2.275 5.689 1.00 0.00 C ATOM 600 C ASP A 38 6.104 -3.185 5.141 1.00 0.00 C ATOM 601 O ASP A 38 6.002 -4.351 5.524 1.00 0.00 O ATOM 602 CB ASP A 38 6.784 -1.722 7.054 1.00 0.00 C ATOM 603 CG ASP A 38 7.863 -1.901 8.103 1.00 0.00 C ATOM 604 OD1 ASP A 38 8.310 -3.049 8.306 1.00 0.00 O ATOM 605 OD2 ASP A 38 8.261 -0.893 8.723 1.00 0.00 O ATOM 0 H ASP A 38 7.157 -0.269 5.084 1.00 0.00 H new ATOM 0 HA ASP A 38 8.111 -2.862 5.804 1.00 0.00 H new ATOM 0 HB2 ASP A 38 6.548 -0.662 6.957 1.00 0.00 H new ATOM 0 HB3 ASP A 38 5.874 -2.223 7.384 1.00 0.00 H new ATOM 610 N MET A 39 5.288 -2.645 4.240 1.00 0.00 N ATOM 611 CA MET A 39 4.203 -3.404 3.633 1.00 0.00 C ATOM 612 C MET A 39 4.602 -3.887 2.244 1.00 0.00 C ATOM 613 O MET A 39 3.875 -4.647 1.605 1.00 0.00 O ATOM 614 CB MET A 39 2.937 -2.549 3.548 1.00 0.00 C ATOM 615 CG MET A 39 2.450 -2.047 4.898 1.00 0.00 C ATOM 616 SD MET A 39 2.055 -3.389 6.036 1.00 0.00 S ATOM 617 CE MET A 39 2.770 -2.767 7.555 1.00 0.00 C ATOM 0 H MET A 39 5.360 -1.681 3.914 1.00 0.00 H new ATOM 0 HA MET A 39 3.999 -4.272 4.259 1.00 0.00 H new ATOM 0 HB2 MET A 39 3.129 -1.694 2.899 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.145 -3.133 3.080 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.216 -1.412 5.343 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.566 -1.426 4.753 1.00 0.00 H new ATOM 0 HE1 MET A 39 2.152 -3.072 8.400 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.775 -3.171 7.676 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.819 -1.679 7.515 1.00 0.00 H new ATOM 627 N GLU A 40 5.766 -3.432 1.794 1.00 0.00 N ATOM 628 CA GLU A 40 6.297 -3.799 0.483 1.00 0.00 C ATOM 629 C GLU A 40 5.448 -3.213 -0.638 1.00 0.00 C ATOM 630 O GLU A 40 5.075 -3.912 -1.580 1.00 0.00 O ATOM 631 CB GLU A 40 6.371 -5.318 0.339 1.00 0.00 C ATOM 632 CG GLU A 40 7.593 -5.934 1.001 1.00 0.00 C ATOM 633 CD GLU A 40 8.859 -5.725 0.194 1.00 0.00 C ATOM 634 OE1 GLU A 40 9.478 -4.648 0.330 1.00 0.00 O ATOM 635 OE2 GLU A 40 9.233 -6.637 -0.572 1.00 0.00 O ATOM 0 H GLU A 40 6.367 -2.801 2.324 1.00 0.00 H new ATOM 0 HA GLU A 40 7.303 -3.386 0.406 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.473 -5.760 0.771 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.374 -5.574 -0.720 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.722 -5.500 1.992 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.427 -7.002 1.140 1.00 0.00 H new ATOM 642 N GLY A 41 5.147 -1.926 -0.528 1.00 0.00 N ATOM 643 CA GLY A 41 4.344 -1.264 -1.537 1.00 0.00 C ATOM 644 C GLY A 41 4.915 0.070 -1.967 1.00 0.00 C ATOM 645 O GLY A 41 6.065 0.158 -2.394 1.00 0.00 O ATOM 0 H GLY A 41 5.445 -1.328 0.243 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.257 -1.913 -2.408 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.336 -1.114 -1.150 1.00 0.00 H new ATOM 649 N GLN A 42 4.093 1.105 -1.871 1.00 0.00 N ATOM 650 CA GLN A 42 4.488 2.448 -2.270 1.00 0.00 C ATOM 651 C GLN A 42 3.568 3.447 -1.616 1.00 0.00 C ATOM 652 O GLN A 42 2.462 3.093 -1.218 1.00 0.00 O ATOM 653 CB GLN A 42 4.398 2.604 -3.788 1.00 0.00 C ATOM 654 CG GLN A 42 4.624 4.030 -4.272 1.00 0.00 C ATOM 655 CD GLN A 42 4.363 4.192 -5.756 1.00 0.00 C ATOM 656 OE1 GLN A 42 5.098 3.661 -6.589 1.00 0.00 O ATOM 657 NE2 GLN A 42 3.310 4.927 -6.093 1.00 0.00 N ATOM 0 H GLN A 42 3.139 1.039 -1.516 1.00 0.00 H new ATOM 0 HA GLN A 42 5.518 2.621 -1.958 1.00 0.00 H new ATOM 0 HB2 GLN A 42 5.134 1.950 -4.256 1.00 0.00 H new ATOM 0 HB3 GLN A 42 3.416 2.268 -4.121 1.00 0.00 H new ATOM 0 HG2 GLN A 42 3.973 4.705 -3.717 1.00 0.00 H new ATOM 0 HG3 GLN A 42 5.650 4.325 -4.053 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.729 5.348 -5.368 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.082 5.071 -7.077 1.00 0.00 H new ATOM 666 N LEU A 43 3.978 4.698 -1.515 1.00 0.00 N ATOM 667 CA LEU A 43 3.092 5.659 -0.922 1.00 0.00 C ATOM 668 C LEU A 43 2.039 5.990 -1.967 1.00 0.00 C ATOM 669 O LEU A 43 2.333 6.569 -3.012 1.00 0.00 O ATOM 670 CB LEU A 43 3.871 6.913 -0.501 1.00 0.00 C ATOM 671 CG LEU A 43 3.285 7.740 0.655 1.00 0.00 C ATOM 672 CD1 LEU A 43 2.535 6.873 1.644 1.00 0.00 C ATOM 673 CD2 LEU A 43 4.389 8.503 1.366 1.00 0.00 C ATOM 0 H LEU A 43 4.882 5.054 -1.824 1.00 0.00 H new ATOM 0 HA LEU A 43 2.622 5.262 -0.022 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.880 6.608 -0.223 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.963 7.563 -1.371 1.00 0.00 H new ATOM 0 HG LEU A 43 2.574 8.446 0.226 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.137 7.496 2.445 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.714 6.367 1.135 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.213 6.131 2.065 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.961 9.085 2.183 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.119 7.799 1.765 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.880 9.174 0.661 1.00 0.00 H new ATOM 685 N VAL A 44 0.820 5.564 -1.656 1.00 0.00 N ATOM 686 CA VAL A 44 -0.352 5.727 -2.516 1.00 0.00 C ATOM 687 C VAL A 44 -0.093 6.546 -3.768 1.00 0.00 C ATOM 688 O VAL A 44 0.006 6.002 -4.869 1.00 0.00 O ATOM 689 CB VAL A 44 -1.507 6.362 -1.737 1.00 0.00 C ATOM 690 CG1 VAL A 44 -2.668 5.389 -1.635 1.00 0.00 C ATOM 691 CG2 VAL A 44 -1.036 6.797 -0.361 1.00 0.00 C ATOM 0 H VAL A 44 0.612 5.085 -0.780 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.612 4.720 -2.841 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.852 7.247 -2.272 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.483 5.852 -1.079 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.013 5.128 -2.635 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.342 4.487 -1.117 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.867 7.247 0.183 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -0.669 5.930 0.189 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.233 7.527 -0.465 1.00 0.00 H new ATOM 701 N SER A 45 -0.018 7.854 -3.594 1.00 0.00 N ATOM 702 CA SER A 45 0.193 8.769 -4.711 1.00 0.00 C ATOM 703 C SER A 45 -1.023 8.745 -5.629 1.00 0.00 C ATOM 704 O SER A 45 -0.906 8.540 -6.838 1.00 0.00 O ATOM 705 CB SER A 45 1.454 8.388 -5.493 1.00 0.00 C ATOM 706 OG SER A 45 2.240 9.531 -5.779 1.00 0.00 O ATOM 0 H SER A 45 -0.100 8.312 -2.686 1.00 0.00 H new ATOM 0 HA SER A 45 0.328 9.777 -4.318 1.00 0.00 H new ATOM 0 HB2 SER A 45 2.042 7.674 -4.916 1.00 0.00 H new ATOM 0 HB3 SER A 45 1.174 7.893 -6.423 1.00 0.00 H new ATOM 0 HG SER A 45 2.153 9.758 -6.728 1.00 0.00 H new ATOM 712 N ILE A 46 -2.196 8.940 -5.030 1.00 0.00 N ATOM 713 CA ILE A 46 -3.458 8.926 -5.766 1.00 0.00 C ATOM 714 C ILE A 46 -3.403 9.827 -6.994 1.00 0.00 C ATOM 715 O ILE A 46 -2.817 10.909 -6.962 1.00 0.00 O ATOM 716 CB ILE A 46 -4.654 9.358 -4.884 1.00 0.00 C ATOM 717 CG1 ILE A 46 -4.183 9.864 -3.513 1.00 0.00 C ATOM 718 CG2 ILE A 46 -5.637 8.205 -4.726 1.00 0.00 C ATOM 719 CD1 ILE A 46 -3.870 8.763 -2.520 1.00 0.00 C ATOM 0 H ILE A 46 -2.298 9.111 -4.030 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.607 7.893 -6.081 1.00 0.00 H new ATOM 0 HB ILE A 46 -5.162 10.184 -5.383 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.293 10.478 -3.651 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.954 10.510 -3.092 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -6.473 8.523 -4.103 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -6.008 7.906 -5.706 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -5.134 7.360 -4.255 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.545 9.204 -1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.763 8.162 -2.350 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.077 8.130 -2.917 1.00 0.00 H new ATOM 731 N HIS A 47 -4.022 9.366 -8.077 1.00 0.00 N ATOM 732 CA HIS A 47 -4.056 10.117 -9.326 1.00 0.00 C ATOM 733 C HIS A 47 -5.450 10.080 -9.942 1.00 0.00 C ATOM 734 O HIS A 47 -5.677 10.633 -11.017 1.00 0.00 O ATOM 735 CB HIS A 47 -3.039 9.545 -10.316 1.00 0.00 C ATOM 736 CG HIS A 47 -2.891 8.057 -10.230 1.00 0.00 C ATOM 737 ND1 HIS A 47 -3.800 7.177 -10.778 1.00 0.00 N ATOM 738 CD2 HIS A 47 -1.929 7.294 -9.658 1.00 0.00 C ATOM 739 CE1 HIS A 47 -3.406 5.938 -10.545 1.00 0.00 C ATOM 740 NE2 HIS A 47 -2.274 5.981 -9.869 1.00 0.00 N ATOM 0 H HIS A 47 -4.509 8.471 -8.113 1.00 0.00 H new ATOM 0 HA HIS A 47 -3.799 11.153 -9.106 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.339 9.814 -11.329 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.069 10.009 -10.137 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -1.055 7.651 -9.134 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.923 5.042 -10.855 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -1.741 5.170 -9.554 1.00 0.00 H new ATOM 749 N SER A 48 -6.382 9.426 -9.253 1.00 0.00 N ATOM 750 CA SER A 48 -7.749 9.322 -9.733 1.00 0.00 C ATOM 751 C SER A 48 -8.710 9.925 -8.722 1.00 0.00 C ATOM 752 O SER A 48 -8.762 9.490 -7.573 1.00 0.00 O ATOM 753 CB SER A 48 -8.113 7.860 -9.994 1.00 0.00 C ATOM 754 OG SER A 48 -7.626 7.430 -11.253 1.00 0.00 O ATOM 0 H SER A 48 -6.211 8.962 -8.361 1.00 0.00 H new ATOM 0 HA SER A 48 -7.829 9.875 -10.669 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.697 7.232 -9.206 1.00 0.00 H new ATOM 0 HB3 SER A 48 -9.196 7.740 -9.959 1.00 0.00 H new ATOM 0 HG SER A 48 -7.870 6.492 -11.395 1.00 0.00 H new ATOM 760 N PRO A 49 -9.491 10.940 -9.135 1.00 0.00 N ATOM 761 CA PRO A 49 -10.455 11.593 -8.250 1.00 0.00 C ATOM 762 C PRO A 49 -11.279 10.572 -7.474 1.00 0.00 C ATOM 763 O PRO A 49 -11.722 10.835 -6.356 1.00 0.00 O ATOM 764 CB PRO A 49 -11.330 12.387 -9.218 1.00 0.00 C ATOM 765 CG PRO A 49 -10.424 12.705 -10.357 1.00 0.00 C ATOM 766 CD PRO A 49 -9.499 11.525 -10.490 1.00 0.00 C ATOM 0 HA PRO A 49 -9.982 12.214 -7.490 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -12.191 11.804 -9.545 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -11.717 13.293 -8.752 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -10.991 12.862 -11.275 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -9.864 13.621 -10.167 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -9.860 10.813 -11.232 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -8.500 11.831 -10.801 1.00 0.00 H new ATOM 774 N GLU A 50 -11.461 9.398 -8.073 1.00 0.00 N ATOM 775 CA GLU A 50 -12.209 8.324 -7.438 1.00 0.00 C ATOM 776 C GLU A 50 -11.404 7.701 -6.311 1.00 0.00 C ATOM 777 O GLU A 50 -11.923 7.465 -5.223 1.00 0.00 O ATOM 778 CB GLU A 50 -12.574 7.244 -8.453 1.00 0.00 C ATOM 779 CG GLU A 50 -13.229 6.027 -7.824 1.00 0.00 C ATOM 780 CD GLU A 50 -13.152 4.800 -8.712 1.00 0.00 C ATOM 781 OE1 GLU A 50 -12.137 4.077 -8.637 1.00 0.00 O ATOM 782 OE2 GLU A 50 -14.108 4.563 -9.480 1.00 0.00 O ATOM 0 H GLU A 50 -11.099 9.169 -8.999 1.00 0.00 H new ATOM 0 HA GLU A 50 -13.123 8.755 -7.030 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -13.249 7.667 -9.197 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -11.673 6.931 -8.981 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -12.747 5.812 -6.870 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -14.274 6.251 -7.610 1.00 0.00 H new ATOM 789 N GLU A 51 -10.134 7.425 -6.587 1.00 0.00 N ATOM 790 CA GLU A 51 -9.262 6.818 -5.602 1.00 0.00 C ATOM 791 C GLU A 51 -9.093 7.740 -4.403 1.00 0.00 C ATOM 792 O GLU A 51 -9.213 7.308 -3.257 1.00 0.00 O ATOM 793 CB GLU A 51 -7.905 6.489 -6.224 1.00 0.00 C ATOM 794 CG GLU A 51 -7.970 5.409 -7.291 1.00 0.00 C ATOM 795 CD GLU A 51 -8.228 4.033 -6.713 1.00 0.00 C ATOM 796 OE1 GLU A 51 -7.471 3.617 -5.810 1.00 0.00 O ATOM 797 OE2 GLU A 51 -9.186 3.369 -7.162 1.00 0.00 O ATOM 0 H GLU A 51 -9.691 7.614 -7.486 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.717 5.889 -5.259 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -7.486 7.395 -6.661 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -7.222 6.170 -5.437 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.759 5.654 -8.003 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.032 5.396 -7.847 1.00 0.00 H new ATOM 804 N GLN A 52 -8.832 9.015 -4.673 1.00 0.00 N ATOM 805 CA GLN A 52 -8.669 9.997 -3.612 1.00 0.00 C ATOM 806 C GLN A 52 -9.932 10.056 -2.763 1.00 0.00 C ATOM 807 O GLN A 52 -9.867 10.089 -1.538 1.00 0.00 O ATOM 808 CB GLN A 52 -8.339 11.379 -4.195 1.00 0.00 C ATOM 809 CG GLN A 52 -9.550 12.290 -4.371 1.00 0.00 C ATOM 810 CD GLN A 52 -9.702 13.313 -3.255 1.00 0.00 C ATOM 811 OE1 GLN A 52 -10.398 14.316 -3.416 1.00 0.00 O ATOM 812 NE2 GLN A 52 -9.054 13.072 -2.119 1.00 0.00 N ATOM 0 H GLN A 52 -8.729 9.390 -5.616 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.835 9.694 -2.979 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.619 11.873 -3.543 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.855 11.246 -5.162 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -9.467 12.812 -5.324 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -10.451 11.679 -4.419 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -8.487 12.229 -2.024 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -9.124 13.730 -1.343 1.00 0.00 H new ATOM 821 N ASP A 53 -11.078 10.046 -3.435 1.00 0.00 N ATOM 822 CA ASP A 53 -12.369 10.073 -2.770 1.00 0.00 C ATOM 823 C ASP A 53 -12.585 8.774 -2.014 1.00 0.00 C ATOM 824 O ASP A 53 -13.205 8.749 -0.953 1.00 0.00 O ATOM 825 CB ASP A 53 -13.489 10.279 -3.791 1.00 0.00 C ATOM 826 CG ASP A 53 -14.813 10.625 -3.138 1.00 0.00 C ATOM 827 OD1 ASP A 53 -14.797 11.208 -2.033 1.00 0.00 O ATOM 828 OD2 ASP A 53 -15.867 10.313 -3.732 1.00 0.00 O ATOM 0 H ASP A 53 -11.135 10.019 -4.453 1.00 0.00 H new ATOM 0 HA ASP A 53 -12.385 10.904 -2.065 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.207 11.076 -4.479 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -13.606 9.373 -4.385 1.00 0.00 H new ATOM 833 N PHE A 54 -12.081 7.690 -2.592 1.00 0.00 N ATOM 834 CA PHE A 54 -12.213 6.368 -2.012 1.00 0.00 C ATOM 835 C PHE A 54 -11.575 6.310 -0.629 1.00 0.00 C ATOM 836 O PHE A 54 -12.206 5.887 0.340 1.00 0.00 O ATOM 837 CB PHE A 54 -11.527 5.363 -2.932 1.00 0.00 C ATOM 838 CG PHE A 54 -12.446 4.322 -3.489 1.00 0.00 C ATOM 839 CD1 PHE A 54 -12.692 3.155 -2.791 1.00 0.00 C ATOM 840 CD2 PHE A 54 -13.055 4.510 -4.716 1.00 0.00 C ATOM 841 CE1 PHE A 54 -13.534 2.189 -3.306 1.00 0.00 C ATOM 842 CE2 PHE A 54 -13.898 3.551 -5.240 1.00 0.00 C ATOM 843 CZ PHE A 54 -14.139 2.387 -4.535 1.00 0.00 C ATOM 0 H PHE A 54 -11.571 7.707 -3.475 1.00 0.00 H new ATOM 0 HA PHE A 54 -13.272 6.131 -1.906 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -11.061 5.901 -3.758 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.727 4.869 -2.381 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -12.221 2.997 -1.832 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.869 5.418 -5.271 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -13.720 1.281 -2.751 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -14.368 3.710 -6.199 1.00 0.00 H new ATOM 0 HZ PHE A 54 -14.798 1.634 -4.942 1.00 0.00 H new ATOM 853 N LEU A 55 -10.331 6.755 -0.545 1.00 0.00 N ATOM 854 CA LEU A 55 -9.610 6.775 0.720 1.00 0.00 C ATOM 855 C LEU A 55 -10.127 7.896 1.607 1.00 0.00 C ATOM 856 O LEU A 55 -10.235 7.745 2.823 1.00 0.00 O ATOM 857 CB LEU A 55 -8.116 6.950 0.484 1.00 0.00 C ATOM 858 CG LEU A 55 -7.756 7.864 -0.679 1.00 0.00 C ATOM 859 CD1 LEU A 55 -7.251 9.198 -0.165 1.00 0.00 C ATOM 860 CD2 LEU A 55 -6.722 7.197 -1.568 1.00 0.00 C ATOM 0 H LEU A 55 -9.798 7.108 -1.340 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.776 5.821 1.221 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.663 7.346 1.393 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.673 5.970 0.308 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.651 8.048 -1.274 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.998 9.841 -1.008 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.027 9.675 0.434 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.365 9.039 0.449 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.472 7.860 -2.396 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.824 6.988 -0.987 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.127 6.264 -1.960 1.00 0.00 H new ATOM 872 N THR A 56 -10.443 9.023 0.979 1.00 0.00 N ATOM 873 CA THR A 56 -10.948 10.185 1.687 1.00 0.00 C ATOM 874 C THR A 56 -12.248 9.829 2.394 1.00 0.00 C ATOM 875 O THR A 56 -12.494 10.252 3.524 1.00 0.00 O ATOM 876 CB THR A 56 -11.152 11.345 0.701 1.00 0.00 C ATOM 877 OG1 THR A 56 -10.133 12.317 0.849 1.00 0.00 O ATOM 878 CG2 THR A 56 -12.480 12.055 0.839 1.00 0.00 C ATOM 0 H THR A 56 -10.356 9.153 -0.029 1.00 0.00 H new ATOM 0 HA THR A 56 -10.225 10.501 2.439 1.00 0.00 H new ATOM 0 HB THR A 56 -11.122 10.875 -0.282 1.00 0.00 H new ATOM 0 HG1 THR A 56 -10.281 13.046 0.211 1.00 0.00 H new ATOM 0 HG21 THR A 56 -12.541 12.859 0.106 1.00 0.00 H new ATOM 0 HG22 THR A 56 -13.291 11.347 0.669 1.00 0.00 H new ATOM 0 HG23 THR A 56 -12.567 12.472 1.842 1.00 0.00 H new ATOM 886 N LYS A 57 -13.065 9.025 1.725 1.00 0.00 N ATOM 887 CA LYS A 57 -14.327 8.579 2.287 1.00 0.00 C ATOM 888 C LYS A 57 -14.060 7.534 3.360 1.00 0.00 C ATOM 889 O LYS A 57 -14.759 7.469 4.371 1.00 0.00 O ATOM 890 CB LYS A 57 -15.228 7.997 1.197 1.00 0.00 C ATOM 891 CG LYS A 57 -16.064 9.042 0.476 1.00 0.00 C ATOM 892 CD LYS A 57 -17.165 8.401 -0.353 1.00 0.00 C ATOM 893 CE LYS A 57 -16.654 7.966 -1.717 1.00 0.00 C ATOM 894 NZ LYS A 57 -16.997 6.548 -2.013 1.00 0.00 N ATOM 0 H LYS A 57 -12.872 8.669 0.789 1.00 0.00 H new ATOM 0 HA LYS A 57 -14.839 9.433 2.730 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.610 7.472 0.468 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -15.892 7.257 1.643 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -16.505 9.722 1.205 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -15.422 9.640 -0.171 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -17.566 7.538 0.178 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -17.985 9.108 -0.479 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -17.079 8.610 -2.486 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -15.572 8.094 -1.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -16.631 6.291 -2.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -16.570 5.930 -1.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -18.030 6.431 -2.001 1.00 0.00 H new ATOM 907 N HIS A 58 -13.028 6.724 3.132 1.00 0.00 N ATOM 908 CA HIS A 58 -12.649 5.687 4.079 1.00 0.00 C ATOM 909 C HIS A 58 -12.084 6.310 5.350 1.00 0.00 C ATOM 910 O HIS A 58 -12.190 5.736 6.434 1.00 0.00 O ATOM 911 CB HIS A 58 -11.619 4.745 3.454 1.00 0.00 C ATOM 912 CG HIS A 58 -11.707 3.340 3.964 1.00 0.00 C ATOM 913 ND1 HIS A 58 -12.377 2.337 3.296 1.00 0.00 N ATOM 914 CD2 HIS A 58 -11.203 2.771 5.086 1.00 0.00 C ATOM 915 CE1 HIS A 58 -12.283 1.212 3.984 1.00 0.00 C ATOM 916 NE2 HIS A 58 -11.576 1.449 5.073 1.00 0.00 N ATOM 0 H HIS A 58 -12.442 6.769 2.299 1.00 0.00 H new ATOM 0 HA HIS A 58 -13.539 5.113 4.335 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -11.753 4.739 2.372 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -10.619 5.132 3.649 1.00 0.00 H new ATOM 0 HD1 HIS A 58 -12.869 2.446 2.409 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -10.618 3.265 5.848 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -12.712 0.261 3.703 1.00 0.00 H new ATOM 925 N ALA A 59 -11.485 7.491 5.209 1.00 0.00 N ATOM 926 CA ALA A 59 -10.908 8.192 6.349 1.00 0.00 C ATOM 927 C ALA A 59 -12.001 8.774 7.241 1.00 0.00 C ATOM 928 O ALA A 59 -12.555 9.833 6.950 1.00 0.00 O ATOM 929 CB ALA A 59 -9.972 9.292 5.872 1.00 0.00 C ATOM 0 H ALA A 59 -11.388 7.979 4.319 1.00 0.00 H new ATOM 0 HA ALA A 59 -10.336 7.474 6.937 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -9.548 9.808 6.733 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -9.169 8.855 5.279 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -10.528 10.003 5.261 1.00 0.00 H new ATOM 935 N SER A 60 -12.309 8.069 8.325 1.00 0.00 N ATOM 936 CA SER A 60 -13.340 8.509 9.259 1.00 0.00 C ATOM 937 C SER A 60 -12.992 9.868 9.859 1.00 0.00 C ATOM 938 O SER A 60 -13.471 10.903 9.394 1.00 0.00 O ATOM 939 CB SER A 60 -13.522 7.476 10.373 1.00 0.00 C ATOM 940 OG SER A 60 -12.310 6.792 10.639 1.00 0.00 O ATOM 0 H SER A 60 -11.859 7.190 8.579 1.00 0.00 H new ATOM 0 HA SER A 60 -14.275 8.608 8.707 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.870 7.972 11.279 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.292 6.760 10.086 1.00 0.00 H new ATOM 0 HG SER A 60 -12.453 6.139 11.356 1.00 0.00 H new ATOM 946 N HIS A 61 -12.158 9.858 10.895 1.00 0.00 N ATOM 947 CA HIS A 61 -11.750 11.091 11.560 1.00 0.00 C ATOM 948 C HIS A 61 -10.292 11.418 11.255 1.00 0.00 C ATOM 949 O HIS A 61 -9.891 12.582 11.262 1.00 0.00 O ATOM 950 CB HIS A 61 -11.952 10.972 13.071 1.00 0.00 C ATOM 951 CG HIS A 61 -13.389 10.843 13.473 1.00 0.00 C ATOM 952 ND1 HIS A 61 -14.162 9.744 13.163 1.00 0.00 N ATOM 953 CD2 HIS A 61 -14.194 11.684 14.167 1.00 0.00 C ATOM 954 CE1 HIS A 61 -15.380 9.914 13.648 1.00 0.00 C ATOM 955 NE2 HIS A 61 -15.425 11.082 14.260 1.00 0.00 N ATOM 0 H HIS A 61 -11.752 9.011 11.292 1.00 0.00 H new ATOM 0 HA HIS A 61 -12.372 11.901 11.180 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -11.402 10.105 13.436 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -11.524 11.849 13.557 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -13.919 12.647 14.571 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -16.199 9.216 13.558 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -16.242 11.475 14.727 1.00 0.00 H new ATOM 964 N THR A 62 -9.502 10.382 10.989 1.00 0.00 N ATOM 965 CA THR A 62 -8.087 10.558 10.682 1.00 0.00 C ATOM 966 C THR A 62 -7.862 10.646 9.177 1.00 0.00 C ATOM 967 O THR A 62 -8.367 9.821 8.416 1.00 0.00 O ATOM 968 CB THR A 62 -7.270 9.405 11.266 1.00 0.00 C ATOM 969 OG1 THR A 62 -7.790 8.157 10.842 1.00 0.00 O ATOM 970 CG2 THR A 62 -7.239 9.399 12.779 1.00 0.00 C ATOM 0 H THR A 62 -9.818 9.412 10.980 1.00 0.00 H new ATOM 0 HA THR A 62 -7.757 11.493 11.134 1.00 0.00 H new ATOM 0 HB THR A 62 -6.255 9.556 10.899 1.00 0.00 H new ATOM 0 HG1 THR A 62 -8.182 8.252 9.949 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.643 8.556 13.127 1.00 0.00 H new ATOM 0 HG22 THR A 62 -6.797 10.329 13.138 1.00 0.00 H new ATOM 0 HG23 THR A 62 -8.255 9.308 13.163 1.00 0.00 H new ATOM 978 N GLY A 63 -7.099 11.649 8.756 1.00 0.00 N ATOM 979 CA GLY A 63 -6.816 11.829 7.343 1.00 0.00 C ATOM 980 C GLY A 63 -5.983 10.701 6.769 1.00 0.00 C ATOM 981 O GLY A 63 -5.813 9.660 7.403 1.00 0.00 O ATOM 0 H GLY A 63 -6.670 12.342 9.369 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -7.755 11.899 6.794 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.291 12.773 7.198 1.00 0.00 H new ATOM 985 N SER A 64 -5.464 10.908 5.564 1.00 0.00 N ATOM 986 CA SER A 64 -4.648 9.898 4.902 1.00 0.00 C ATOM 987 C SER A 64 -3.394 10.519 4.293 1.00 0.00 C ATOM 988 O SER A 64 -3.388 11.691 3.915 1.00 0.00 O ATOM 989 CB SER A 64 -5.463 9.192 3.818 1.00 0.00 C ATOM 990 OG SER A 64 -5.199 9.744 2.539 1.00 0.00 O ATOM 0 H SER A 64 -5.594 11.765 5.026 1.00 0.00 H new ATOM 0 HA SER A 64 -4.338 9.168 5.650 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.225 8.128 3.815 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.526 9.280 4.043 1.00 0.00 H new ATOM 0 HG SER A 64 -5.986 10.237 2.226 1.00 0.00 H new ATOM 996 N TRP A 65 -2.338 9.718 4.187 1.00 0.00 N ATOM 997 CA TRP A 65 -1.079 10.174 3.613 1.00 0.00 C ATOM 998 C TRP A 65 -0.943 9.648 2.197 1.00 0.00 C ATOM 999 O TRP A 65 -1.176 8.470 1.939 1.00 0.00 O ATOM 1000 CB TRP A 65 0.098 9.698 4.465 1.00 0.00 C ATOM 1001 CG TRP A 65 0.457 10.643 5.571 1.00 0.00 C ATOM 1002 CD1 TRP A 65 1.004 11.886 5.441 1.00 0.00 C ATOM 1003 CD2 TRP A 65 0.294 10.421 6.976 1.00 0.00 C ATOM 1004 NE1 TRP A 65 1.191 12.449 6.679 1.00 0.00 N ATOM 1005 CE2 TRP A 65 0.763 11.570 7.638 1.00 0.00 C ATOM 1006 CE3 TRP A 65 -0.203 9.362 7.739 1.00 0.00 C ATOM 1007 CZ2 TRP A 65 0.748 11.691 9.024 1.00 0.00 C ATOM 1008 CZ3 TRP A 65 -0.217 9.482 9.116 1.00 0.00 C ATOM 1009 CH2 TRP A 65 0.255 10.639 9.747 1.00 0.00 C ATOM 0 H TRP A 65 -2.331 8.745 4.493 1.00 0.00 H new ATOM 0 HA TRP A 65 -1.074 11.264 3.593 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -0.144 8.725 4.893 1.00 0.00 H new ATOM 0 HB3 TRP A 65 0.967 9.556 3.823 1.00 0.00 H new ATOM 0 HD1 TRP A 65 1.253 12.358 4.502 1.00 0.00 H new ATOM 0 HE1 TRP A 65 1.585 13.373 6.856 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -0.570 8.465 7.262 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 1.112 12.583 9.512 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -0.599 8.669 9.716 1.00 0.00 H new ATOM 0 HH2 TRP A 65 0.230 10.703 10.825 1.00 0.00 H new ATOM 1020 N ILE A 66 -0.577 10.527 1.279 1.00 0.00 N ATOM 1021 CA ILE A 66 -0.429 10.143 -0.117 1.00 0.00 C ATOM 1022 C ILE A 66 1.020 10.213 -0.566 1.00 0.00 C ATOM 1023 O ILE A 66 1.869 10.768 0.126 1.00 0.00 O ATOM 1024 CB ILE A 66 -1.293 11.017 -1.040 1.00 0.00 C ATOM 1025 CG1 ILE A 66 -0.615 12.364 -1.288 1.00 0.00 C ATOM 1026 CG2 ILE A 66 -2.678 11.206 -0.435 1.00 0.00 C ATOM 1027 CD1 ILE A 66 -1.545 13.422 -1.830 1.00 0.00 C ATOM 0 H ILE A 66 -0.377 11.508 1.473 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.770 9.110 -0.191 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.404 10.515 -2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.180 12.719 -0.354 1.00 0.00 H new ATOM 0 HG13 ILE A 66 0.208 12.223 -1.989 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.282 11.827 -1.097 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.157 10.235 -0.311 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.587 11.692 0.536 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.993 14.350 -1.980 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.960 13.089 -2.781 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.355 13.593 -1.120 1.00 0.00 H new ATOM 1039 N GLY A 67 1.287 9.634 -1.729 1.00 0.00 N ATOM 1040 CA GLY A 67 2.630 9.626 -2.274 1.00 0.00 C ATOM 1041 C GLY A 67 3.041 10.969 -2.842 1.00 0.00 C ATOM 1042 O GLY A 67 3.434 11.061 -4.004 1.00 0.00 O ATOM 0 H GLY A 67 0.591 9.166 -2.309 1.00 0.00 H new ATOM 0 HA2 GLY A 67 3.333 9.337 -1.492 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.695 8.870 -3.057 1.00 0.00 H new ATOM 1046 N LEU A 68 2.950 12.016 -2.027 1.00 0.00 N ATOM 1047 CA LEU A 68 3.317 13.351 -2.473 1.00 0.00 C ATOM 1048 C LEU A 68 4.362 14.000 -1.572 1.00 0.00 C ATOM 1049 O LEU A 68 4.184 14.106 -0.358 1.00 0.00 O ATOM 1050 CB LEU A 68 2.083 14.252 -2.539 1.00 0.00 C ATOM 1051 CG LEU A 68 2.244 15.501 -3.409 1.00 0.00 C ATOM 1052 CD1 LEU A 68 3.152 16.522 -2.738 1.00 0.00 C ATOM 1053 CD2 LEU A 68 2.793 15.123 -4.770 1.00 0.00 C ATOM 0 H LEU A 68 2.627 11.964 -1.061 1.00 0.00 H new ATOM 0 HA LEU A 68 3.752 13.238 -3.466 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.244 13.668 -2.918 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.823 14.563 -1.527 1.00 0.00 H new ATOM 0 HG LEU A 68 1.261 15.955 -3.537 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.249 17.399 -3.378 1.00 0.00 H new ATOM 0 HD12 LEU A 68 2.723 16.817 -1.781 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.136 16.082 -2.574 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.903 16.020 -5.380 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.765 14.644 -4.650 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.106 14.433 -5.260 1.00 0.00 H new ATOM 1065 N ARG A 69 5.431 14.471 -2.200 1.00 0.00 N ATOM 1066 CA ARG A 69 6.507 15.165 -1.508 1.00 0.00 C ATOM 1067 C ARG A 69 6.966 16.351 -2.354 1.00 0.00 C ATOM 1068 O ARG A 69 7.391 16.173 -3.494 1.00 0.00 O ATOM 1069 CB ARG A 69 7.673 14.210 -1.238 1.00 0.00 C ATOM 1070 CG ARG A 69 8.993 14.912 -0.959 1.00 0.00 C ATOM 1071 CD ARG A 69 10.051 14.537 -1.984 1.00 0.00 C ATOM 1072 NE ARG A 69 11.325 14.198 -1.356 1.00 0.00 N ATOM 1073 CZ ARG A 69 12.034 13.115 -1.663 1.00 0.00 C ATOM 1074 NH1 ARG A 69 11.596 12.270 -2.588 1.00 0.00 N ATOM 1075 NH2 ARG A 69 13.183 12.876 -1.046 1.00 0.00 N ATOM 0 H ARG A 69 5.576 14.382 -3.206 1.00 0.00 H new ATOM 0 HA ARG A 69 6.144 15.530 -0.547 1.00 0.00 H new ATOM 0 HB2 ARG A 69 7.422 13.578 -0.386 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.797 13.552 -2.098 1.00 0.00 H new ATOM 0 HG2 ARG A 69 8.842 15.991 -0.969 1.00 0.00 H new ATOM 0 HG3 ARG A 69 9.343 14.649 0.039 1.00 0.00 H new ATOM 0 HD2 ARG A 69 9.701 13.690 -2.573 1.00 0.00 H new ATOM 0 HD3 ARG A 69 10.197 15.367 -2.675 1.00 0.00 H new ATOM 0 HE ARG A 69 11.692 14.827 -0.642 1.00 0.00 H new ATOM 0 HH11 ARG A 69 10.713 12.450 -3.066 1.00 0.00 H new ATOM 0 HH12 ARG A 69 12.142 11.441 -2.821 1.00 0.00 H new ATOM 0 HH21 ARG A 69 13.524 13.523 -0.335 1.00 0.00 H new ATOM 0 HH22 ARG A 69 13.726 12.045 -1.282 1.00 0.00 H new ATOM 1089 N ASN A 70 6.878 17.558 -1.807 1.00 0.00 N ATOM 1090 CA ASN A 70 7.286 18.746 -2.547 1.00 0.00 C ATOM 1091 C ASN A 70 8.742 19.097 -2.264 1.00 0.00 C ATOM 1092 O ASN A 70 9.180 19.093 -1.114 1.00 0.00 O ATOM 1093 CB ASN A 70 6.377 19.929 -2.205 1.00 0.00 C ATOM 1094 CG ASN A 70 6.462 21.040 -3.235 1.00 0.00 C ATOM 1095 OD1 ASN A 70 7.540 21.361 -3.732 1.00 0.00 O ATOM 1096 ND2 ASN A 70 5.319 21.632 -3.560 1.00 0.00 N ATOM 0 H ASN A 70 6.532 17.739 -0.865 1.00 0.00 H new ATOM 0 HA ASN A 70 7.191 18.528 -3.611 1.00 0.00 H new ATOM 0 HB2 ASN A 70 5.346 19.583 -2.132 1.00 0.00 H new ATOM 0 HB3 ASN A 70 6.651 20.323 -1.226 1.00 0.00 H new ATOM 0 HD21 ASN A 70 5.312 22.386 -4.247 1.00 0.00 H new ATOM 0 HD22 ASN A 70 4.447 21.333 -3.122 1.00 0.00 H new ATOM 1103 N LEU A 71 9.487 19.394 -3.326 1.00 0.00 N ATOM 1104 CA LEU A 71 10.898 19.743 -3.201 1.00 0.00 C ATOM 1105 C LEU A 71 11.092 20.880 -2.202 1.00 0.00 C ATOM 1106 O LEU A 71 11.950 20.809 -1.323 1.00 0.00 O ATOM 1107 CB LEU A 71 11.470 20.143 -4.563 1.00 0.00 C ATOM 1108 CG LEU A 71 11.804 18.975 -5.493 1.00 0.00 C ATOM 1109 CD1 LEU A 71 10.825 18.921 -6.655 1.00 0.00 C ATOM 1110 CD2 LEU A 71 13.233 19.092 -6.002 1.00 0.00 C ATOM 0 H LEU A 71 9.136 19.400 -4.284 1.00 0.00 H new ATOM 0 HA LEU A 71 11.431 18.866 -2.834 1.00 0.00 H new ATOM 0 HB2 LEU A 71 10.753 20.793 -5.064 1.00 0.00 H new ATOM 0 HB3 LEU A 71 12.374 20.730 -4.402 1.00 0.00 H new ATOM 0 HG LEU A 71 11.715 18.048 -4.927 1.00 0.00 H new ATOM 0 HD11 LEU A 71 11.078 18.084 -7.306 1.00 0.00 H new ATOM 0 HD12 LEU A 71 9.813 18.790 -6.272 1.00 0.00 H new ATOM 0 HD13 LEU A 71 10.881 19.851 -7.221 1.00 0.00 H new ATOM 0 HD21 LEU A 71 13.454 18.253 -6.662 1.00 0.00 H new ATOM 0 HD22 LEU A 71 13.348 20.026 -6.551 1.00 0.00 H new ATOM 0 HD23 LEU A 71 13.922 19.080 -5.158 1.00 0.00 H new ATOM 1122 N ASP A 72 10.283 21.924 -2.343 1.00 0.00 N ATOM 1123 CA ASP A 72 10.358 23.076 -1.454 1.00 0.00 C ATOM 1124 C ASP A 72 8.962 23.595 -1.126 1.00 0.00 C ATOM 1125 O ASP A 72 7.963 23.043 -1.588 1.00 0.00 O ATOM 1126 CB ASP A 72 11.192 24.189 -2.093 1.00 0.00 C ATOM 1127 CG ASP A 72 11.980 24.982 -1.070 1.00 0.00 C ATOM 1128 OD1 ASP A 72 12.641 24.356 -0.215 1.00 0.00 O ATOM 1129 OD2 ASP A 72 11.938 26.229 -1.123 1.00 0.00 O ATOM 0 H ASP A 72 9.567 21.996 -3.066 1.00 0.00 H new ATOM 0 HA ASP A 72 10.839 22.760 -0.528 1.00 0.00 H new ATOM 0 HB2 ASP A 72 11.879 23.753 -2.818 1.00 0.00 H new ATOM 0 HB3 ASP A 72 10.534 24.863 -2.642 1.00 0.00 H new ATOM 1134 N LEU A 73 8.901 24.657 -0.329 1.00 0.00 N ATOM 1135 CA LEU A 73 7.626 25.250 0.057 1.00 0.00 C ATOM 1136 C LEU A 73 6.797 25.599 -1.175 1.00 0.00 C ATOM 1137 O LEU A 73 5.810 24.931 -1.481 1.00 0.00 O ATOM 1138 CB LEU A 73 7.857 26.505 0.901 1.00 0.00 C ATOM 1139 CG LEU A 73 8.964 26.387 1.950 1.00 0.00 C ATOM 1140 CD1 LEU A 73 10.239 27.051 1.455 1.00 0.00 C ATOM 1141 CD2 LEU A 73 8.517 27.002 3.268 1.00 0.00 C ATOM 0 H LEU A 73 9.719 25.124 0.062 1.00 0.00 H new ATOM 0 HA LEU A 73 7.077 24.518 0.650 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.097 27.333 0.234 1.00 0.00 H new ATOM 0 HB3 LEU A 73 6.925 26.761 1.406 1.00 0.00 H new ATOM 0 HG LEU A 73 9.170 25.330 2.117 1.00 0.00 H new ATOM 0 HD11 LEU A 73 11.016 26.958 2.214 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.569 26.566 0.536 1.00 0.00 H new ATOM 0 HD13 LEU A 73 10.048 28.106 1.260 1.00 0.00 H new ATOM 0 HD21 LEU A 73 9.317 26.909 4.003 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.284 28.056 3.117 1.00 0.00 H new ATOM 0 HD23 LEU A 73 7.630 26.482 3.630 1.00 0.00 H new ATOM 1153 N LYS A 74 7.210 26.647 -1.880 1.00 0.00 N ATOM 1154 CA LYS A 74 6.511 27.086 -3.082 1.00 0.00 C ATOM 1155 C LYS A 74 7.045 26.359 -4.313 1.00 0.00 C ATOM 1156 O LYS A 74 6.697 26.699 -5.445 1.00 0.00 O ATOM 1157 CB LYS A 74 6.656 28.598 -3.262 1.00 0.00 C ATOM 1158 CG LYS A 74 8.097 29.080 -3.235 1.00 0.00 C ATOM 1159 CD LYS A 74 8.188 30.575 -3.498 1.00 0.00 C ATOM 1160 CE LYS A 74 9.561 31.121 -3.144 1.00 0.00 C ATOM 1161 NZ LYS A 74 9.514 32.015 -1.954 1.00 0.00 N ATOM 0 H LYS A 74 8.027 27.209 -1.639 1.00 0.00 H new ATOM 0 HA LYS A 74 5.454 26.845 -2.968 1.00 0.00 H new ATOM 0 HB2 LYS A 74 6.203 28.887 -4.210 1.00 0.00 H new ATOM 0 HB3 LYS A 74 6.098 29.104 -2.474 1.00 0.00 H new ATOM 0 HG2 LYS A 74 8.540 28.852 -2.266 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.676 28.541 -3.985 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.976 30.774 -4.549 1.00 0.00 H new ATOM 0 HD3 LYS A 74 7.427 31.095 -2.915 1.00 0.00 H new ATOM 0 HE2 LYS A 74 10.242 30.292 -2.949 1.00 0.00 H new ATOM 0 HE3 LYS A 74 9.964 31.670 -3.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 10.470 32.366 -1.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 8.884 32.820 -2.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 9.154 31.484 -1.135 1.00 0.00 H new ATOM 1174 N GLY A 75 7.897 25.364 -4.082 1.00 0.00 N ATOM 1175 CA GLY A 75 8.474 24.604 -5.177 1.00 0.00 C ATOM 1176 C GLY A 75 7.440 23.808 -5.952 1.00 0.00 C ATOM 1177 O GLY A 75 6.316 24.266 -6.155 1.00 0.00 O ATOM 0 H GLY A 75 8.199 25.070 -3.153 1.00 0.00 H new ATOM 0 HA2 GLY A 75 8.984 25.286 -5.857 1.00 0.00 H new ATOM 0 HA3 GLY A 75 9.228 23.923 -4.782 1.00 0.00 H new ATOM 1181 N GLU A 76 7.823 22.613 -6.392 1.00 0.00 N ATOM 1182 CA GLU A 76 6.924 21.757 -7.155 1.00 0.00 C ATOM 1183 C GLU A 76 6.705 20.418 -6.456 1.00 0.00 C ATOM 1184 O GLU A 76 7.659 19.758 -6.039 1.00 0.00 O ATOM 1185 CB GLU A 76 7.479 21.523 -8.562 1.00 0.00 C ATOM 1186 CG GLU A 76 8.255 22.706 -9.117 1.00 0.00 C ATOM 1187 CD GLU A 76 7.398 23.613 -9.979 1.00 0.00 C ATOM 1188 OE1 GLU A 76 6.904 23.144 -11.025 1.00 0.00 O ATOM 1189 OE2 GLU A 76 7.221 24.791 -9.606 1.00 0.00 O ATOM 0 H GLU A 76 8.749 22.217 -6.233 1.00 0.00 H new ATOM 0 HA GLU A 76 5.963 22.266 -7.227 1.00 0.00 H new ATOM 0 HB2 GLU A 76 8.129 20.649 -8.546 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.653 21.293 -9.235 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.671 23.283 -8.291 1.00 0.00 H new ATOM 0 HG3 GLU A 76 9.096 22.340 -9.706 1.00 0.00 H new ATOM 1196 N PHE A 77 5.440 20.026 -6.334 1.00 0.00 N ATOM 1197 CA PHE A 77 5.080 18.773 -5.695 1.00 0.00 C ATOM 1198 C PHE A 77 5.440 17.574 -6.570 1.00 0.00 C ATOM 1199 O PHE A 77 4.965 17.437 -7.696 1.00 0.00 O ATOM 1200 CB PHE A 77 3.582 18.747 -5.358 1.00 0.00 C ATOM 1201 CG PHE A 77 2.647 19.195 -6.462 1.00 0.00 C ATOM 1202 CD1 PHE A 77 3.116 19.546 -7.725 1.00 0.00 C ATOM 1203 CD2 PHE A 77 1.280 19.248 -6.231 1.00 0.00 C ATOM 1204 CE1 PHE A 77 2.247 19.941 -8.723 1.00 0.00 C ATOM 1205 CE2 PHE A 77 0.409 19.641 -7.232 1.00 0.00 C ATOM 1206 CZ PHE A 77 0.893 19.989 -8.475 1.00 0.00 C ATOM 0 H PHE A 77 4.644 20.566 -6.674 1.00 0.00 H new ATOM 0 HA PHE A 77 5.653 18.702 -4.770 1.00 0.00 H new ATOM 0 HB2 PHE A 77 3.312 17.731 -5.070 1.00 0.00 H new ATOM 0 HB3 PHE A 77 3.414 19.381 -4.487 1.00 0.00 H new ATOM 0 HD1 PHE A 77 4.176 19.509 -7.927 1.00 0.00 H new ATOM 0 HD2 PHE A 77 0.891 18.980 -5.260 1.00 0.00 H new ATOM 0 HE1 PHE A 77 2.628 20.212 -9.696 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -0.653 19.675 -7.039 1.00 0.00 H new ATOM 0 HZ PHE A 77 0.211 20.299 -9.253 1.00 0.00 H new ATOM 1216 N ILE A 78 6.282 16.707 -6.030 1.00 0.00 N ATOM 1217 CA ILE A 78 6.715 15.511 -6.732 1.00 0.00 C ATOM 1218 C ILE A 78 6.282 14.266 -5.967 1.00 0.00 C ATOM 1219 O ILE A 78 6.324 14.240 -4.740 1.00 0.00 O ATOM 1220 CB ILE A 78 8.246 15.503 -6.933 1.00 0.00 C ATOM 1221 CG1 ILE A 78 8.576 15.795 -8.406 1.00 0.00 C ATOM 1222 CG2 ILE A 78 8.855 14.183 -6.463 1.00 0.00 C ATOM 1223 CD1 ILE A 78 9.403 14.727 -9.096 1.00 0.00 C ATOM 0 H ILE A 78 6.682 16.812 -5.098 1.00 0.00 H new ATOM 0 HA ILE A 78 6.244 15.510 -7.715 1.00 0.00 H new ATOM 0 HB ILE A 78 8.690 16.289 -6.322 1.00 0.00 H new ATOM 0 HG12 ILE A 78 7.643 15.923 -8.954 1.00 0.00 H new ATOM 0 HG13 ILE A 78 9.112 16.743 -8.463 1.00 0.00 H new ATOM 0 HG21 ILE A 78 9.934 14.205 -6.616 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.642 14.041 -5.404 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.424 13.360 -7.033 1.00 0.00 H new ATOM 0 HD11 ILE A 78 9.586 15.020 -10.130 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.355 14.613 -8.578 1.00 0.00 H new ATOM 0 HD13 ILE A 78 8.863 13.780 -9.077 1.00 0.00 H new ATOM 1235 N TRP A 79 5.867 13.238 -6.690 1.00 0.00 N ATOM 1236 CA TRP A 79 5.426 12.004 -6.056 1.00 0.00 C ATOM 1237 C TRP A 79 6.619 11.224 -5.520 1.00 0.00 C ATOM 1238 O TRP A 79 7.720 11.306 -6.060 1.00 0.00 O ATOM 1239 CB TRP A 79 4.657 11.124 -7.049 1.00 0.00 C ATOM 1240 CG TRP A 79 3.370 11.722 -7.537 1.00 0.00 C ATOM 1241 CD1 TRP A 79 2.853 12.943 -7.218 1.00 0.00 C ATOM 1242 CD2 TRP A 79 2.438 11.118 -8.442 1.00 0.00 C ATOM 1243 NE1 TRP A 79 1.656 13.134 -7.866 1.00 0.00 N ATOM 1244 CE2 TRP A 79 1.381 12.028 -8.624 1.00 0.00 C ATOM 1245 CE3 TRP A 79 2.398 9.894 -9.116 1.00 0.00 C ATOM 1246 CZ2 TRP A 79 0.296 11.753 -9.452 1.00 0.00 C ATOM 1247 CZ3 TRP A 79 1.320 9.621 -9.938 1.00 0.00 C ATOM 1248 CH2 TRP A 79 0.282 10.547 -10.100 1.00 0.00 C ATOM 0 H TRP A 79 5.826 13.232 -7.709 1.00 0.00 H new ATOM 0 HA TRP A 79 4.766 12.273 -5.231 1.00 0.00 H new ATOM 0 HB2 TRP A 79 5.297 10.920 -7.907 1.00 0.00 H new ATOM 0 HB3 TRP A 79 4.442 10.166 -6.576 1.00 0.00 H new ATOM 0 HD1 TRP A 79 3.317 13.656 -6.553 1.00 0.00 H new ATOM 0 HE1 TRP A 79 1.068 13.965 -7.794 1.00 0.00 H new ATOM 0 HE3 TRP A 79 3.195 9.175 -8.997 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -0.506 12.465 -9.579 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 1.278 8.678 -10.464 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -0.546 10.305 -10.749 1.00 0.00 H new ATOM 1259 N VAL A 80 6.386 10.465 -4.456 1.00 0.00 N ATOM 1260 CA VAL A 80 7.436 9.657 -3.847 1.00 0.00 C ATOM 1261 C VAL A 80 7.981 8.657 -4.861 1.00 0.00 C ATOM 1262 O VAL A 80 9.115 8.189 -4.749 1.00 0.00 O ATOM 1263 CB VAL A 80 6.901 8.902 -2.614 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.518 8.349 -2.898 1.00 0.00 C ATOM 1265 CG2 VAL A 80 7.853 7.791 -2.190 1.00 0.00 C ATOM 0 H VAL A 80 5.478 10.392 -3.996 1.00 0.00 H new ATOM 0 HA VAL A 80 8.237 10.324 -3.528 1.00 0.00 H new ATOM 0 HB VAL A 80 6.831 9.608 -1.786 1.00 0.00 H new ATOM 0 HG11 VAL A 80 5.151 7.818 -2.020 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.840 9.169 -3.136 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.567 7.662 -3.743 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.448 7.277 -1.318 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.970 7.080 -3.008 1.00 0.00 H new ATOM 0 HG23 VAL A 80 8.824 8.219 -1.940 1.00 0.00 H new ATOM 1275 N ASP A 81 7.160 8.341 -5.858 1.00 0.00 N ATOM 1276 CA ASP A 81 7.548 7.403 -6.905 1.00 0.00 C ATOM 1277 C ASP A 81 8.477 8.074 -7.910 1.00 0.00 C ATOM 1278 O ASP A 81 9.008 7.426 -8.812 1.00 0.00 O ATOM 1279 CB ASP A 81 6.309 6.859 -7.618 1.00 0.00 C ATOM 1280 CG ASP A 81 6.610 5.618 -8.435 1.00 0.00 C ATOM 1281 OD1 ASP A 81 7.346 4.742 -7.935 1.00 0.00 O ATOM 1282 OD2 ASP A 81 6.109 5.522 -9.575 1.00 0.00 O ATOM 0 H ASP A 81 6.220 8.722 -5.962 1.00 0.00 H new ATOM 0 HA ASP A 81 8.080 6.573 -6.440 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.541 6.627 -6.880 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.901 7.630 -8.271 1.00 0.00 H new ATOM 1287 N GLY A 82 8.669 9.377 -7.740 1.00 0.00 N ATOM 1288 CA GLY A 82 9.535 10.124 -8.627 1.00 0.00 C ATOM 1289 C GLY A 82 8.808 10.662 -9.845 1.00 0.00 C ATOM 1290 O GLY A 82 9.389 10.758 -10.926 1.00 0.00 O ATOM 0 H GLY A 82 8.237 9.930 -6.999 1.00 0.00 H new ATOM 0 HA2 GLY A 82 9.979 10.955 -8.079 1.00 0.00 H new ATOM 0 HA3 GLY A 82 10.354 9.483 -8.953 1.00 0.00 H new ATOM 1294 N SER A 83 7.536 11.014 -9.675 1.00 0.00 N ATOM 1295 CA SER A 83 6.743 11.543 -10.781 1.00 0.00 C ATOM 1296 C SER A 83 5.987 12.806 -10.370 1.00 0.00 C ATOM 1297 O SER A 83 5.222 12.795 -9.413 1.00 0.00 O ATOM 1298 CB SER A 83 5.756 10.486 -11.277 1.00 0.00 C ATOM 1299 OG SER A 83 6.422 9.470 -12.007 1.00 0.00 O ATOM 0 H SER A 83 7.035 10.943 -8.789 1.00 0.00 H new ATOM 0 HA SER A 83 7.429 11.804 -11.587 1.00 0.00 H new ATOM 0 HB2 SER A 83 5.233 10.045 -10.428 1.00 0.00 H new ATOM 0 HB3 SER A 83 5.001 10.956 -11.907 1.00 0.00 H new ATOM 0 HG SER A 83 5.770 8.805 -12.312 1.00 0.00 H new ATOM 1305 N HIS A 84 6.205 13.892 -11.107 1.00 0.00 N ATOM 1306 CA HIS A 84 5.537 15.158 -10.817 1.00 0.00 C ATOM 1307 C HIS A 84 4.021 14.997 -10.870 1.00 0.00 C ATOM 1308 O HIS A 84 3.495 14.232 -11.678 1.00 0.00 O ATOM 1309 CB HIS A 84 5.985 16.234 -11.808 1.00 0.00 C ATOM 1310 CG HIS A 84 5.807 15.840 -13.241 1.00 0.00 C ATOM 1311 ND1 HIS A 84 6.532 14.831 -13.841 1.00 0.00 N ATOM 1312 CD2 HIS A 84 4.981 16.325 -14.198 1.00 0.00 C ATOM 1313 CE1 HIS A 84 6.160 14.715 -15.103 1.00 0.00 C ATOM 1314 NE2 HIS A 84 5.221 15.608 -15.345 1.00 0.00 N ATOM 0 H HIS A 84 6.837 13.921 -11.907 1.00 0.00 H new ATOM 0 HA HIS A 84 5.816 15.466 -9.809 1.00 0.00 H new ATOM 0 HB2 HIS A 84 5.422 17.148 -11.618 1.00 0.00 H new ATOM 0 HB3 HIS A 84 7.036 16.464 -11.631 1.00 0.00 H new ATOM 0 HD2 HIS A 84 4.266 17.126 -14.081 1.00 0.00 H new ATOM 0 HE1 HIS A 84 6.558 14.008 -15.816 1.00 0.00 H new ATOM 0 HE2 HIS A 84 4.749 15.744 -16.239 1.00 0.00 H new ATOM 1323 N VAL A 85 3.326 15.721 -9.997 1.00 0.00 N ATOM 1324 CA VAL A 85 1.869 15.660 -9.932 1.00 0.00 C ATOM 1325 C VAL A 85 1.232 15.989 -11.278 1.00 0.00 C ATOM 1326 O VAL A 85 1.780 16.761 -12.065 1.00 0.00 O ATOM 1327 CB VAL A 85 1.329 16.616 -8.853 1.00 0.00 C ATOM 1328 CG1 VAL A 85 -0.176 16.478 -8.697 1.00 0.00 C ATOM 1329 CG2 VAL A 85 2.028 16.341 -7.541 1.00 0.00 C ATOM 0 H VAL A 85 3.750 16.359 -9.323 1.00 0.00 H new ATOM 0 HA VAL A 85 1.602 14.637 -9.669 1.00 0.00 H new ATOM 0 HB VAL A 85 1.533 17.641 -9.162 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.527 17.166 -7.928 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.663 16.713 -9.643 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.420 15.456 -8.408 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.646 17.018 -6.776 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.842 15.310 -7.239 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.100 16.497 -7.660 1.00 0.00 H new ATOM 1339 N ASP A 86 0.078 15.381 -11.540 1.00 0.00 N ATOM 1340 CA ASP A 86 -0.630 15.592 -12.796 1.00 0.00 C ATOM 1341 C ASP A 86 -1.957 16.314 -12.583 1.00 0.00 C ATOM 1342 O ASP A 86 -2.177 17.397 -13.126 1.00 0.00 O ATOM 1343 CB ASP A 86 -0.881 14.249 -13.484 1.00 0.00 C ATOM 1344 CG ASP A 86 0.405 13.570 -13.912 1.00 0.00 C ATOM 1345 OD1 ASP A 86 1.160 13.115 -13.028 1.00 0.00 O ATOM 1346 OD2 ASP A 86 0.659 13.493 -15.134 1.00 0.00 O ATOM 0 H ASP A 86 -0.386 14.738 -10.898 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.003 16.221 -13.428 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -1.427 13.593 -12.806 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.515 14.404 -14.357 1.00 0.00 H new ATOM 1351 N TYR A 87 -2.846 15.701 -11.807 1.00 0.00 N ATOM 1352 CA TYR A 87 -4.158 16.283 -11.548 1.00 0.00 C ATOM 1353 C TYR A 87 -4.197 17.048 -10.229 1.00 0.00 C ATOM 1354 O TYR A 87 -4.721 18.160 -10.165 1.00 0.00 O ATOM 1355 CB TYR A 87 -5.231 15.189 -11.538 1.00 0.00 C ATOM 1356 CG TYR A 87 -6.014 15.097 -12.828 1.00 0.00 C ATOM 1357 CD1 TYR A 87 -7.048 15.983 -13.102 1.00 0.00 C ATOM 1358 CD2 TYR A 87 -5.719 14.121 -13.773 1.00 0.00 C ATOM 1359 CE1 TYR A 87 -7.766 15.901 -14.279 1.00 0.00 C ATOM 1360 CE2 TYR A 87 -6.432 14.033 -14.954 1.00 0.00 C ATOM 1361 CZ TYR A 87 -7.454 14.924 -15.202 1.00 0.00 C ATOM 1362 OH TYR A 87 -8.167 14.840 -16.376 1.00 0.00 O ATOM 0 H TYR A 87 -2.682 14.805 -11.348 1.00 0.00 H new ATOM 0 HA TYR A 87 -4.359 16.991 -12.352 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.756 14.228 -11.342 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -5.922 15.377 -10.716 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -7.295 16.749 -12.382 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -4.920 13.420 -13.581 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -8.567 16.598 -14.476 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -6.189 13.270 -15.679 1.00 0.00 H new ATOM 0 HH TYR A 87 -7.821 14.099 -16.917 1.00 0.00 H new ATOM 1372 N SER A 88 -3.661 16.437 -9.178 1.00 0.00 N ATOM 1373 CA SER A 88 -3.655 17.048 -7.848 1.00 0.00 C ATOM 1374 C SER A 88 -5.084 17.308 -7.385 1.00 0.00 C ATOM 1375 O SER A 88 -6.023 17.271 -8.181 1.00 0.00 O ATOM 1376 CB SER A 88 -2.850 18.352 -7.832 1.00 0.00 C ATOM 1377 OG SER A 88 -2.255 18.611 -9.092 1.00 0.00 O ATOM 0 H SER A 88 -3.223 15.517 -9.219 1.00 0.00 H new ATOM 0 HA SER A 88 -3.175 16.351 -7.162 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.504 19.181 -7.560 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.075 18.293 -7.068 1.00 0.00 H new ATOM 0 HG SER A 88 -1.359 18.985 -8.960 1.00 0.00 H new ATOM 1383 N ASN A 89 -5.251 17.550 -6.095 1.00 0.00 N ATOM 1384 CA ASN A 89 -6.577 17.795 -5.544 1.00 0.00 C ATOM 1385 C ASN A 89 -6.660 19.164 -4.870 1.00 0.00 C ATOM 1386 O ASN A 89 -7.704 19.812 -4.919 1.00 0.00 O ATOM 1387 CB ASN A 89 -6.952 16.668 -4.579 1.00 0.00 C ATOM 1388 CG ASN A 89 -7.720 15.565 -5.274 1.00 0.00 C ATOM 1389 OD1 ASN A 89 -8.546 15.824 -6.150 1.00 0.00 O ATOM 1390 ND2 ASN A 89 -7.452 14.328 -4.888 1.00 0.00 N ATOM 0 H ASN A 89 -4.493 17.582 -5.413 1.00 0.00 H new ATOM 0 HA ASN A 89 -7.298 17.805 -6.362 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -6.047 16.255 -4.133 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.553 17.072 -3.765 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.938 13.542 -5.320 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -6.760 14.160 -4.158 1.00 0.00 H new ATOM 1397 N TRP A 90 -5.546 19.600 -4.268 1.00 0.00 N ATOM 1398 CA TRP A 90 -5.457 20.908 -3.600 1.00 0.00 C ATOM 1399 C TRP A 90 -6.826 21.439 -3.167 1.00 0.00 C ATOM 1400 O TRP A 90 -7.550 22.031 -3.969 1.00 0.00 O ATOM 1401 CB TRP A 90 -4.803 21.929 -4.535 1.00 0.00 C ATOM 1402 CG TRP A 90 -3.357 21.662 -4.840 1.00 0.00 C ATOM 1403 CD1 TRP A 90 -2.727 20.450 -4.875 1.00 0.00 C ATOM 1404 CD2 TRP A 90 -2.360 22.638 -5.168 1.00 0.00 C ATOM 1405 NE1 TRP A 90 -1.409 20.612 -5.203 1.00 0.00 N ATOM 1406 CE2 TRP A 90 -1.156 21.944 -5.388 1.00 0.00 C ATOM 1407 CE3 TRP A 90 -2.368 24.029 -5.298 1.00 0.00 C ATOM 1408 CZ2 TRP A 90 0.027 22.592 -5.732 1.00 0.00 C ATOM 1409 CZ3 TRP A 90 -1.193 24.673 -5.638 1.00 0.00 C ATOM 1410 CH2 TRP A 90 -0.010 23.954 -5.853 1.00 0.00 C ATOM 0 H TRP A 90 -4.682 19.059 -4.229 1.00 0.00 H new ATOM 0 HA TRP A 90 -4.853 20.765 -2.704 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -5.360 21.953 -5.472 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -4.889 22.919 -4.088 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -3.201 19.501 -4.673 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -0.725 19.861 -5.295 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.276 24.591 -5.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 0.940 22.040 -5.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -1.187 25.748 -5.740 1.00 0.00 H new ATOM 0 HH2 TRP A 90 0.891 24.486 -6.120 1.00 0.00 H new ATOM 1421 N ALA A 91 -7.170 21.242 -1.898 1.00 0.00 N ATOM 1422 CA ALA A 91 -8.450 21.716 -1.375 1.00 0.00 C ATOM 1423 C ALA A 91 -8.641 23.205 -1.656 1.00 0.00 C ATOM 1424 O ALA A 91 -7.718 24.000 -1.485 1.00 0.00 O ATOM 1425 CB ALA A 91 -8.550 21.449 0.119 1.00 0.00 C ATOM 0 H ALA A 91 -6.585 20.760 -1.215 1.00 0.00 H new ATOM 0 HA ALA A 91 -9.242 21.167 -1.884 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -9.510 21.809 0.490 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -8.468 20.378 0.303 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.743 21.969 0.636 1.00 0.00 H new ATOM 1431 N PRO A 92 -9.849 23.603 -2.095 1.00 0.00 N ATOM 1432 CA PRO A 92 -10.156 25.000 -2.402 1.00 0.00 C ATOM 1433 C PRO A 92 -10.487 25.809 -1.153 1.00 0.00 C ATOM 1434 O PRO A 92 -10.618 27.033 -1.210 1.00 0.00 O ATOM 1435 CB PRO A 92 -11.380 24.887 -3.306 1.00 0.00 C ATOM 1436 CG PRO A 92 -12.080 23.657 -2.835 1.00 0.00 C ATOM 1437 CD PRO A 92 -11.009 22.720 -2.332 1.00 0.00 C ATOM 0 HA PRO A 92 -9.313 25.519 -2.857 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.020 25.765 -3.220 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -11.093 24.804 -4.354 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.791 23.894 -2.043 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -12.647 23.199 -3.646 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -11.319 22.213 -1.418 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.779 21.946 -3.064 1.00 0.00 H new ATOM 1445 N GLY A 93 -10.622 25.119 -0.025 1.00 0.00 N ATOM 1446 CA GLY A 93 -10.938 25.789 1.223 1.00 0.00 C ATOM 1447 C GLY A 93 -9.703 26.309 1.932 1.00 0.00 C ATOM 1448 O GLY A 93 -9.732 26.564 3.137 1.00 0.00 O ATOM 0 H GLY A 93 -10.518 24.107 0.047 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -11.616 26.619 1.024 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -11.466 25.097 1.880 1.00 0.00 H new ATOM 1452 N GLU A 94 -8.616 26.467 1.185 1.00 0.00 N ATOM 1453 CA GLU A 94 -7.366 26.961 1.750 1.00 0.00 C ATOM 1454 C GLU A 94 -6.796 28.098 0.903 1.00 0.00 C ATOM 1455 O GLU A 94 -5.922 27.880 0.063 1.00 0.00 O ATOM 1456 CB GLU A 94 -6.345 25.825 1.852 1.00 0.00 C ATOM 1457 CG GLU A 94 -5.376 25.983 3.013 1.00 0.00 C ATOM 1458 CD GLU A 94 -4.486 24.769 3.199 1.00 0.00 C ATOM 1459 OE1 GLU A 94 -3.658 24.497 2.303 1.00 0.00 O ATOM 1460 OE2 GLU A 94 -4.617 24.090 4.239 1.00 0.00 O ATOM 0 H GLU A 94 -8.575 26.260 0.187 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.574 27.345 2.748 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -6.876 24.879 1.958 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -5.779 25.771 0.922 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.754 26.862 2.845 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -5.939 26.160 3.930 1.00 0.00 H new ATOM 1467 N PRO A 95 -7.289 29.332 1.112 1.00 0.00 N ATOM 1468 CA PRO A 95 -6.825 30.505 0.363 1.00 0.00 C ATOM 1469 C PRO A 95 -5.416 30.928 0.764 1.00 0.00 C ATOM 1470 O PRO A 95 -5.176 31.321 1.906 1.00 0.00 O ATOM 1471 CB PRO A 95 -7.836 31.588 0.740 1.00 0.00 C ATOM 1472 CG PRO A 95 -8.338 31.185 2.083 1.00 0.00 C ATOM 1473 CD PRO A 95 -8.333 29.681 2.094 1.00 0.00 C ATOM 0 HA PRO A 95 -6.769 30.309 -0.708 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -7.369 32.572 0.771 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -8.647 31.643 0.014 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -7.701 31.583 2.873 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -9.342 31.573 2.257 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -8.100 29.288 3.084 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -9.303 29.274 1.809 1.00 0.00 H new ATOM 1481 N THR A 96 -4.486 30.844 -0.184 1.00 0.00 N ATOM 1482 CA THR A 96 -3.100 31.219 0.070 1.00 0.00 C ATOM 1483 C THR A 96 -2.954 32.735 0.155 1.00 0.00 C ATOM 1484 O THR A 96 -3.418 33.464 -0.722 1.00 0.00 O ATOM 1485 CB THR A 96 -2.192 30.669 -1.031 1.00 0.00 C ATOM 1486 OG1 THR A 96 -2.851 30.693 -2.284 1.00 0.00 O ATOM 1487 CG2 THR A 96 -1.740 29.246 -0.778 1.00 0.00 C ATOM 0 H THR A 96 -4.668 30.520 -1.134 1.00 0.00 H new ATOM 0 HA THR A 96 -2.802 30.789 1.026 1.00 0.00 H new ATOM 0 HB THR A 96 -1.316 31.318 -1.033 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.253 30.339 -2.975 1.00 0.00 H new ATOM 0 HG21 THR A 96 -1.099 28.917 -1.596 1.00 0.00 H new ATOM 0 HG22 THR A 96 -1.184 29.202 0.159 1.00 0.00 H new ATOM 0 HG23 THR A 96 -2.611 28.594 -0.714 1.00 0.00 H new ATOM 1495 N SER A 97 -2.305 33.203 1.217 1.00 0.00 N ATOM 1496 CA SER A 97 -2.097 34.633 1.417 1.00 0.00 C ATOM 1497 C SER A 97 -0.795 34.894 2.168 1.00 0.00 C ATOM 1498 O SER A 97 0.008 35.735 1.764 1.00 0.00 O ATOM 1499 CB SER A 97 -3.273 35.237 2.185 1.00 0.00 C ATOM 1500 OG SER A 97 -3.489 36.587 1.807 1.00 0.00 O ATOM 0 H SER A 97 -1.914 32.613 1.952 1.00 0.00 H new ATOM 0 HA SER A 97 -2.030 35.106 0.437 1.00 0.00 H new ATOM 0 HB2 SER A 97 -4.174 34.654 1.994 1.00 0.00 H new ATOM 0 HB3 SER A 97 -3.079 35.182 3.256 1.00 0.00 H new ATOM 0 HG SER A 97 -4.247 36.950 2.311 1.00 0.00 H new ATOM 1506 N ARG A 98 -0.594 34.167 3.264 1.00 0.00 N ATOM 1507 CA ARG A 98 0.610 34.321 4.072 1.00 0.00 C ATOM 1508 C ARG A 98 1.284 32.973 4.308 1.00 0.00 C ATOM 1509 O ARG A 98 2.439 32.911 4.728 1.00 0.00 O ATOM 1510 CB ARG A 98 0.270 34.976 5.412 1.00 0.00 C ATOM 1511 CG ARG A 98 -0.824 34.253 6.182 1.00 0.00 C ATOM 1512 CD ARG A 98 -1.508 35.178 7.177 1.00 0.00 C ATOM 1513 NE ARG A 98 -1.014 34.979 8.537 1.00 0.00 N ATOM 1514 CZ ARG A 98 -1.406 33.982 9.326 1.00 0.00 C ATOM 1515 NH1 ARG A 98 -2.293 33.097 8.891 1.00 0.00 N ATOM 1516 NH2 ARG A 98 -0.910 33.869 10.549 1.00 0.00 N ATOM 0 H ARG A 98 -1.249 33.467 3.612 1.00 0.00 H new ATOM 0 HA ARG A 98 1.303 34.962 3.527 1.00 0.00 H new ATOM 0 HB2 ARG A 98 1.170 35.016 6.026 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -0.041 36.006 5.235 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -1.562 33.858 5.484 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -0.397 33.401 6.710 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -1.345 36.214 6.880 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -2.584 35.005 7.153 1.00 0.00 H new ATOM 0 HE ARG A 98 -0.330 35.642 8.902 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -2.676 33.180 7.949 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -2.592 32.334 9.498 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -0.227 34.547 10.887 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -1.211 33.104 11.153 1.00 0.00 H new ATOM 1530 N SER A 99 0.553 31.896 4.036 1.00 0.00 N ATOM 1531 CA SER A 99 1.080 30.548 4.219 1.00 0.00 C ATOM 1532 C SER A 99 1.269 29.851 2.876 1.00 0.00 C ATOM 1533 O SER A 99 0.315 29.342 2.289 1.00 0.00 O ATOM 1534 CB SER A 99 0.142 29.727 5.105 1.00 0.00 C ATOM 1535 OG SER A 99 0.540 28.368 5.150 1.00 0.00 O ATOM 0 H SER A 99 -0.405 31.931 3.688 1.00 0.00 H new ATOM 0 HA SER A 99 2.052 30.628 4.707 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.135 30.140 6.114 1.00 0.00 H new ATOM 0 HB3 SER A 99 -0.877 29.798 4.725 1.00 0.00 H new ATOM 0 HG SER A 99 -0.075 27.866 5.724 1.00 0.00 H new ATOM 1541 N GLN A 100 2.509 29.832 2.395 1.00 0.00 N ATOM 1542 CA GLN A 100 2.826 29.197 1.120 1.00 0.00 C ATOM 1543 C GLN A 100 3.768 28.015 1.320 1.00 0.00 C ATOM 1544 O GLN A 100 4.278 27.446 0.356 1.00 0.00 O ATOM 1545 CB GLN A 100 3.456 30.211 0.164 1.00 0.00 C ATOM 1546 CG GLN A 100 2.438 31.022 -0.619 1.00 0.00 C ATOM 1547 CD GLN A 100 2.958 32.394 -1.005 1.00 0.00 C ATOM 1548 OE1 GLN A 100 3.833 32.521 -1.859 1.00 0.00 O ATOM 1549 NE2 GLN A 100 2.417 33.430 -0.373 1.00 0.00 N ATOM 0 H GLN A 100 3.310 30.249 2.869 1.00 0.00 H new ATOM 0 HA GLN A 100 1.897 28.828 0.686 1.00 0.00 H new ATOM 0 HB2 GLN A 100 4.089 30.891 0.734 1.00 0.00 H new ATOM 0 HB3 GLN A 100 4.104 29.684 -0.536 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.160 30.476 -1.520 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.533 31.135 -0.023 1.00 0.00 H new ATOM 0 HE21 GLN A 100 1.693 33.278 0.329 1.00 0.00 H new ATOM 0 HE22 GLN A 100 2.726 34.378 -0.590 1.00 0.00 H new ATOM 1558 N GLY A 101 3.993 27.651 2.579 1.00 0.00 N ATOM 1559 CA GLY A 101 4.873 26.538 2.883 1.00 0.00 C ATOM 1560 C GLY A 101 4.204 25.194 2.667 1.00 0.00 C ATOM 1561 O GLY A 101 3.215 24.874 3.325 1.00 0.00 O ATOM 0 H GLY A 101 3.582 28.107 3.393 1.00 0.00 H new ATOM 0 HA2 GLY A 101 5.764 26.602 2.258 1.00 0.00 H new ATOM 0 HA3 GLY A 101 5.204 26.613 3.919 1.00 0.00 H new ATOM 1565 N GLU A 102 4.745 24.408 1.740 1.00 0.00 N ATOM 1566 CA GLU A 102 4.193 23.091 1.437 1.00 0.00 C ATOM 1567 C GLU A 102 5.289 22.129 0.989 1.00 0.00 C ATOM 1568 O GLU A 102 5.892 22.309 -0.070 1.00 0.00 O ATOM 1569 CB GLU A 102 3.118 23.195 0.351 1.00 0.00 C ATOM 1570 CG GLU A 102 3.031 24.566 -0.303 1.00 0.00 C ATOM 1571 CD GLU A 102 2.604 24.493 -1.756 1.00 0.00 C ATOM 1572 OE1 GLU A 102 3.242 23.744 -2.525 1.00 0.00 O ATOM 1573 OE2 GLU A 102 1.632 25.186 -2.124 1.00 0.00 O ATOM 0 H GLU A 102 5.564 24.660 1.186 1.00 0.00 H new ATOM 0 HA GLU A 102 3.740 22.702 2.349 1.00 0.00 H new ATOM 0 HB2 GLU A 102 3.319 22.449 -0.418 1.00 0.00 H new ATOM 0 HB3 GLU A 102 2.150 22.950 0.788 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.323 25.184 0.249 1.00 0.00 H new ATOM 0 HG3 GLU A 102 4.002 25.058 -0.238 1.00 0.00 H new ATOM 1580 N ASP A 103 5.540 21.105 1.800 1.00 0.00 N ATOM 1581 CA ASP A 103 6.562 20.111 1.487 1.00 0.00 C ATOM 1582 C ASP A 103 5.951 18.716 1.401 1.00 0.00 C ATOM 1583 O ASP A 103 6.645 17.740 1.116 1.00 0.00 O ATOM 1584 CB ASP A 103 7.667 20.133 2.543 1.00 0.00 C ATOM 1585 CG ASP A 103 8.926 19.428 2.079 1.00 0.00 C ATOM 1586 OD1 ASP A 103 9.764 20.081 1.423 1.00 0.00 O ATOM 1587 OD2 ASP A 103 9.074 18.223 2.372 1.00 0.00 O ATOM 0 H ASP A 103 5.049 20.942 2.679 1.00 0.00 H new ATOM 0 HA ASP A 103 6.993 20.361 0.518 1.00 0.00 H new ATOM 0 HB2 ASP A 103 7.905 21.167 2.794 1.00 0.00 H new ATOM 0 HB3 ASP A 103 7.304 19.659 3.455 1.00 0.00 H new ATOM 1592 N CYS A 104 4.649 18.633 1.649 1.00 0.00 N ATOM 1593 CA CYS A 104 3.935 17.364 1.600 1.00 0.00 C ATOM 1594 C CYS A 104 2.434 17.600 1.483 1.00 0.00 C ATOM 1595 O CYS A 104 1.930 18.657 1.867 1.00 0.00 O ATOM 1596 CB CYS A 104 4.236 16.530 2.848 1.00 0.00 C ATOM 1597 SG CYS A 104 4.794 17.506 4.282 1.00 0.00 S ATOM 0 H CYS A 104 4.064 19.434 1.887 1.00 0.00 H new ATOM 0 HA CYS A 104 4.275 16.816 0.721 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.339 15.976 3.126 1.00 0.00 H new ATOM 0 HB3 CYS A 104 5.002 15.794 2.603 1.00 0.00 H new ATOM 1602 N VAL A 105 1.724 16.618 0.948 1.00 0.00 N ATOM 1603 CA VAL A 105 0.285 16.732 0.784 1.00 0.00 C ATOM 1604 C VAL A 105 -0.453 15.723 1.651 1.00 0.00 C ATOM 1605 O VAL A 105 -0.142 14.532 1.646 1.00 0.00 O ATOM 1606 CB VAL A 105 -0.132 16.543 -0.684 1.00 0.00 C ATOM 1607 CG1 VAL A 105 -1.645 16.490 -0.808 1.00 0.00 C ATOM 1608 CG2 VAL A 105 0.424 17.669 -1.537 1.00 0.00 C ATOM 0 H VAL A 105 2.120 15.737 0.621 1.00 0.00 H new ATOM 0 HA VAL A 105 0.012 17.739 1.101 1.00 0.00 H new ATOM 0 HB VAL A 105 0.277 15.597 -1.039 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.920 16.356 -1.854 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -2.029 15.655 -0.222 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.073 17.421 -0.437 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.122 17.523 -2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 105 0.038 18.623 -1.177 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.512 17.671 -1.473 1.00 0.00 H new ATOM 1618 N MET A 106 -1.437 16.217 2.388 1.00 0.00 N ATOM 1619 CA MET A 106 -2.239 15.380 3.262 1.00 0.00 C ATOM 1620 C MET A 106 -3.697 15.418 2.828 1.00 0.00 C ATOM 1621 O MET A 106 -4.089 16.253 2.021 1.00 0.00 O ATOM 1622 CB MET A 106 -2.111 15.849 4.712 1.00 0.00 C ATOM 1623 CG MET A 106 -2.328 17.343 4.890 1.00 0.00 C ATOM 1624 SD MET A 106 -1.377 18.024 6.262 1.00 0.00 S ATOM 1625 CE MET A 106 -2.053 19.680 6.351 1.00 0.00 C ATOM 0 H MET A 106 -1.699 17.203 2.396 1.00 0.00 H new ATOM 0 HA MET A 106 -1.875 14.355 3.193 1.00 0.00 H new ATOM 0 HB2 MET A 106 -2.834 15.310 5.325 1.00 0.00 H new ATOM 0 HB3 MET A 106 -1.120 15.587 5.084 1.00 0.00 H new ATOM 0 HG2 MET A 106 -2.052 17.858 3.970 1.00 0.00 H new ATOM 0 HG3 MET A 106 -3.388 17.535 5.057 1.00 0.00 H new ATOM 0 HE1 MET A 106 -1.564 20.230 7.155 1.00 0.00 H new ATOM 0 HE2 MET A 106 -1.883 20.194 5.405 1.00 0.00 H new ATOM 0 HE3 MET A 106 -3.124 19.626 6.547 1.00 0.00 H new ATOM 1635 N MET A 107 -4.494 14.512 3.363 1.00 0.00 N ATOM 1636 CA MET A 107 -5.908 14.452 3.024 1.00 0.00 C ATOM 1637 C MET A 107 -6.745 14.551 4.293 1.00 0.00 C ATOM 1638 O MET A 107 -6.500 13.830 5.259 1.00 0.00 O ATOM 1639 CB MET A 107 -6.214 13.143 2.289 1.00 0.00 C ATOM 1640 CG MET A 107 -7.661 12.697 2.397 1.00 0.00 C ATOM 1641 SD MET A 107 -7.973 11.671 3.846 1.00 0.00 S ATOM 1642 CE MET A 107 -9.494 12.396 4.453 1.00 0.00 C ATOM 0 H MET A 107 -4.189 13.807 4.034 1.00 0.00 H new ATOM 0 HA MET A 107 -6.156 15.287 2.369 1.00 0.00 H new ATOM 0 HB2 MET A 107 -5.959 13.262 1.236 1.00 0.00 H new ATOM 0 HB3 MET A 107 -5.572 12.357 2.686 1.00 0.00 H new ATOM 0 HG2 MET A 107 -8.305 13.576 2.435 1.00 0.00 H new ATOM 0 HG3 MET A 107 -7.933 12.141 1.499 1.00 0.00 H new ATOM 0 HE1 MET A 107 -9.503 12.364 5.543 1.00 0.00 H new ATOM 0 HE2 MET A 107 -9.562 13.431 4.119 1.00 0.00 H new ATOM 0 HE3 MET A 107 -10.344 11.834 4.067 1.00 0.00 H new ATOM 1652 N ARG A 108 -7.727 15.449 4.291 1.00 0.00 N ATOM 1653 CA ARG A 108 -8.589 15.634 5.458 1.00 0.00 C ATOM 1654 C ARG A 108 -9.637 16.715 5.220 1.00 0.00 C ATOM 1655 O ARG A 108 -10.837 16.437 5.237 1.00 0.00 O ATOM 1656 CB ARG A 108 -7.751 15.997 6.688 1.00 0.00 C ATOM 1657 CG ARG A 108 -8.368 15.541 8.000 1.00 0.00 C ATOM 1658 CD ARG A 108 -8.130 16.553 9.108 1.00 0.00 C ATOM 1659 NE ARG A 108 -9.006 16.327 10.254 1.00 0.00 N ATOM 1660 CZ ARG A 108 -10.229 16.839 10.359 1.00 0.00 C ATOM 1661 NH1 ARG A 108 -10.718 17.605 9.392 1.00 0.00 N ATOM 1662 NH2 ARG A 108 -10.964 16.587 11.433 1.00 0.00 N ATOM 0 H ARG A 108 -7.946 16.056 3.501 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.106 14.690 5.632 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -6.761 15.552 6.587 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -7.613 17.078 6.717 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -9.439 15.391 7.867 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -7.945 14.579 8.287 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -7.090 16.499 9.431 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -8.292 17.559 8.721 1.00 0.00 H new ATOM 0 HE ARG A 108 -8.661 15.744 11.016 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -10.155 17.803 8.564 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -11.656 17.996 9.476 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -10.592 16.000 12.180 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -11.902 16.980 11.513 1.00 0.00 H new ATOM 1676 N GLY A 109 -9.173 17.948 5.015 1.00 0.00 N ATOM 1677 CA GLY A 109 -10.074 19.068 4.789 1.00 0.00 C ATOM 1678 C GLY A 109 -11.298 18.689 3.981 1.00 0.00 C ATOM 1679 O GLY A 109 -11.216 18.521 2.765 1.00 0.00 O ATOM 0 H GLY A 109 -8.183 18.191 5.002 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -10.391 19.472 5.750 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -9.535 19.862 4.272 1.00 0.00 H new ATOM 1683 N SER A 110 -12.435 18.551 4.667 1.00 0.00 N ATOM 1684 CA SER A 110 -13.695 18.185 4.022 1.00 0.00 C ATOM 1685 C SER A 110 -13.643 16.752 3.506 1.00 0.00 C ATOM 1686 O SER A 110 -14.243 15.846 4.085 1.00 0.00 O ATOM 1687 CB SER A 110 -14.009 19.143 2.869 1.00 0.00 C ATOM 1688 OG SER A 110 -14.211 20.463 3.344 1.00 0.00 O ATOM 0 H SER A 110 -12.507 18.689 5.675 1.00 0.00 H new ATOM 0 HA SER A 110 -14.487 18.259 4.767 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.190 19.133 2.150 1.00 0.00 H new ATOM 0 HB3 SER A 110 -14.900 18.803 2.341 1.00 0.00 H new ATOM 0 HG SER A 110 -14.408 21.056 2.589 1.00 0.00 H new ATOM 1694 N GLY A 111 -12.918 16.560 2.414 1.00 0.00 N ATOM 1695 CA GLY A 111 -12.781 15.253 1.820 1.00 0.00 C ATOM 1696 C GLY A 111 -11.895 15.292 0.595 1.00 0.00 C ATOM 1697 O GLY A 111 -12.225 14.712 -0.440 1.00 0.00 O ATOM 0 H GLY A 111 -12.416 17.301 1.925 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -12.362 14.562 2.551 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -13.765 14.871 1.547 1.00 0.00 H new ATOM 1701 N ARG A 112 -10.771 15.990 0.712 1.00 0.00 N ATOM 1702 CA ARG A 112 -9.836 16.116 -0.397 1.00 0.00 C ATOM 1703 C ARG A 112 -8.389 16.161 0.096 1.00 0.00 C ATOM 1704 O ARG A 112 -8.034 15.517 1.083 1.00 0.00 O ATOM 1705 CB ARG A 112 -10.157 17.372 -1.212 1.00 0.00 C ATOM 1706 CG ARG A 112 -10.580 18.560 -0.363 1.00 0.00 C ATOM 1707 CD ARG A 112 -12.093 18.659 -0.257 1.00 0.00 C ATOM 1708 NE ARG A 112 -12.595 19.934 -0.758 1.00 0.00 N ATOM 1709 CZ ARG A 112 -13.878 20.170 -1.019 1.00 0.00 C ATOM 1710 NH1 ARG A 112 -14.783 19.221 -0.825 1.00 0.00 N ATOM 1711 NH2 ARG A 112 -14.256 21.357 -1.473 1.00 0.00 N ATOM 0 H ARG A 112 -10.487 16.476 1.562 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.945 15.237 -1.032 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -9.280 17.649 -1.797 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.953 17.141 -1.920 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -10.150 18.467 0.634 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -10.184 19.478 -0.797 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -12.550 17.844 -0.819 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -12.392 18.536 0.784 1.00 0.00 H new ATOM 0 HE ARG A 112 -11.925 20.686 -0.917 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -14.496 18.307 -0.475 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -15.766 19.405 -1.026 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -13.563 22.090 -1.622 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -15.240 21.537 -1.673 1.00 0.00 H new ATOM 1725 N TRP A 113 -7.562 16.919 -0.614 1.00 0.00 N ATOM 1726 CA TRP A 113 -6.149 17.062 -0.294 1.00 0.00 C ATOM 1727 C TRP A 113 -5.827 18.427 0.268 1.00 0.00 C ATOM 1728 O TRP A 113 -6.550 19.396 0.058 1.00 0.00 O ATOM 1729 CB TRP A 113 -5.281 16.929 -1.540 1.00 0.00 C ATOM 1730 CG TRP A 113 -5.208 15.575 -2.144 1.00 0.00 C ATOM 1731 CD1 TRP A 113 -6.027 14.512 -1.924 1.00 0.00 C ATOM 1732 CD2 TRP A 113 -4.247 15.161 -3.110 1.00 0.00 C ATOM 1733 NE1 TRP A 113 -5.631 13.454 -2.703 1.00 0.00 N ATOM 1734 CE2 TRP A 113 -4.533 13.828 -3.439 1.00 0.00 C ATOM 1735 CE3 TRP A 113 -3.169 15.800 -3.726 1.00 0.00 C ATOM 1736 CZ2 TRP A 113 -3.776 13.113 -4.365 1.00 0.00 C ATOM 1737 CZ3 TRP A 113 -2.416 15.093 -4.645 1.00 0.00 C ATOM 1738 CH2 TRP A 113 -2.722 13.760 -4.958 1.00 0.00 C ATOM 0 H TRP A 113 -7.855 17.454 -1.432 1.00 0.00 H new ATOM 0 HA TRP A 113 -5.943 16.277 0.434 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -5.655 17.621 -2.294 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -4.269 17.248 -1.289 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -6.863 14.502 -1.240 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -6.079 12.538 -2.731 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -2.928 16.826 -3.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -4.011 12.087 -4.607 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -1.579 15.574 -5.129 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -2.116 13.233 -5.680 1.00 0.00 H new ATOM 1749 N ASN A 114 -4.677 18.495 0.907 1.00 0.00 N ATOM 1750 CA ASN A 114 -4.158 19.732 1.424 1.00 0.00 C ATOM 1751 C ASN A 114 -2.668 19.775 1.120 1.00 0.00 C ATOM 1752 O ASN A 114 -1.914 18.897 1.536 1.00 0.00 O ATOM 1753 CB ASN A 114 -4.403 19.841 2.932 1.00 0.00 C ATOM 1754 CG ASN A 114 -5.876 19.970 3.269 1.00 0.00 C ATOM 1755 OD1 ASN A 114 -6.393 21.075 3.432 1.00 0.00 O ATOM 1756 ND2 ASN A 114 -6.559 18.836 3.377 1.00 0.00 N ATOM 0 H ASN A 114 -4.078 17.687 1.080 1.00 0.00 H new ATOM 0 HA ASN A 114 -4.665 20.574 0.954 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -3.995 18.961 3.428 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -3.866 20.705 3.323 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -7.553 18.859 3.603 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -6.089 17.942 3.233 1.00 0.00 H new ATOM 1763 N ASP A 115 -2.251 20.790 0.381 1.00 0.00 N ATOM 1764 CA ASP A 115 -0.854 20.935 0.006 1.00 0.00 C ATOM 1765 C ASP A 115 -0.153 21.923 0.933 1.00 0.00 C ATOM 1766 O ASP A 115 -0.163 23.131 0.694 1.00 0.00 O ATOM 1767 CB ASP A 115 -0.752 21.390 -1.454 1.00 0.00 C ATOM 1768 CG ASP A 115 0.558 20.978 -2.097 1.00 0.00 C ATOM 1769 OD1 ASP A 115 1.622 21.248 -1.501 1.00 0.00 O ATOM 1770 OD2 ASP A 115 0.519 20.387 -3.196 1.00 0.00 O ATOM 0 H ASP A 115 -2.861 21.527 0.028 1.00 0.00 H new ATOM 0 HA ASP A 115 -0.357 19.970 0.105 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.581 20.968 -2.022 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -0.852 22.474 -1.502 1.00 0.00 H new ATOM 1775 N ALA A 116 0.443 21.399 2.005 1.00 0.00 N ATOM 1776 CA ALA A 116 1.132 22.229 2.977 1.00 0.00 C ATOM 1777 C ALA A 116 2.171 21.430 3.754 1.00 0.00 C ATOM 1778 O ALA A 116 2.122 20.201 3.793 1.00 0.00 O ATOM 1779 CB ALA A 116 0.131 22.855 3.932 1.00 0.00 C ATOM 0 H ALA A 116 0.459 20.401 2.217 1.00 0.00 H new ATOM 0 HA ALA A 116 1.653 23.018 2.435 1.00 0.00 H new ATOM 0 HB1 ALA A 116 0.658 23.475 4.657 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -0.572 23.471 3.370 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -0.413 22.069 4.455 1.00 0.00 H new ATOM 1785 N PHE A 117 3.106 22.139 4.377 1.00 0.00 N ATOM 1786 CA PHE A 117 4.160 21.506 5.164 1.00 0.00 C ATOM 1787 C PHE A 117 3.582 20.461 6.114 1.00 0.00 C ATOM 1788 O PHE A 117 2.409 20.525 6.485 1.00 0.00 O ATOM 1789 CB PHE A 117 4.930 22.559 5.963 1.00 0.00 C ATOM 1790 CG PHE A 117 6.331 22.781 5.468 1.00 0.00 C ATOM 1791 CD1 PHE A 117 6.561 23.332 4.218 1.00 0.00 C ATOM 1792 CD2 PHE A 117 7.419 22.439 6.257 1.00 0.00 C ATOM 1793 CE1 PHE A 117 7.849 23.537 3.762 1.00 0.00 C ATOM 1794 CE2 PHE A 117 8.709 22.642 5.806 1.00 0.00 C ATOM 1795 CZ PHE A 117 8.925 23.191 4.557 1.00 0.00 C ATOM 0 H PHE A 117 3.156 23.157 4.352 1.00 0.00 H new ATOM 0 HA PHE A 117 4.841 21.008 4.474 1.00 0.00 H new ATOM 0 HB2 PHE A 117 4.386 23.503 5.924 1.00 0.00 H new ATOM 0 HB3 PHE A 117 4.967 22.255 7.009 1.00 0.00 H new ATOM 0 HD1 PHE A 117 5.724 23.605 3.593 1.00 0.00 H new ATOM 0 HD2 PHE A 117 7.256 22.009 7.234 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.015 23.967 2.785 1.00 0.00 H new ATOM 0 HE2 PHE A 117 9.548 22.372 6.430 1.00 0.00 H new ATOM 0 HZ PHE A 117 9.933 23.349 4.203 1.00 0.00 H new ATOM 1805 N CYS A 118 4.412 19.500 6.503 1.00 0.00 N ATOM 1806 CA CYS A 118 3.984 18.439 7.407 1.00 0.00 C ATOM 1807 C CYS A 118 3.925 18.940 8.847 1.00 0.00 C ATOM 1808 O CYS A 118 4.829 18.684 9.643 1.00 0.00 O ATOM 1809 CB CYS A 118 4.934 17.244 7.305 1.00 0.00 C ATOM 1810 SG CYS A 118 4.664 16.204 5.835 1.00 0.00 S ATOM 0 H CYS A 118 5.386 19.434 6.206 1.00 0.00 H new ATOM 0 HA CYS A 118 2.983 18.125 7.113 1.00 0.00 H new ATOM 0 HB2 CYS A 118 5.961 17.610 7.295 1.00 0.00 H new ATOM 0 HB3 CYS A 118 4.824 16.628 8.198 1.00 0.00 H new ATOM 1815 N ASP A 119 2.853 19.655 9.175 1.00 0.00 N ATOM 1816 CA ASP A 119 2.672 20.195 10.518 1.00 0.00 C ATOM 1817 C ASP A 119 1.864 19.239 11.391 1.00 0.00 C ATOM 1818 O ASP A 119 1.269 19.651 12.388 1.00 0.00 O ATOM 1819 CB ASP A 119 1.976 21.556 10.453 1.00 0.00 C ATOM 1820 CG ASP A 119 0.842 21.577 9.448 1.00 0.00 C ATOM 1821 OD1 ASP A 119 -0.071 20.734 9.564 1.00 0.00 O ATOM 1822 OD2 ASP A 119 0.866 22.439 8.544 1.00 0.00 O ATOM 0 H ASP A 119 2.096 19.874 8.528 1.00 0.00 H new ATOM 0 HA ASP A 119 3.658 20.318 10.966 1.00 0.00 H new ATOM 0 HB2 ASP A 119 1.588 21.810 11.439 1.00 0.00 H new ATOM 0 HB3 ASP A 119 2.705 22.322 10.190 1.00 0.00 H new ATOM 1827 N ARG A 120 1.853 17.962 11.013 1.00 0.00 N ATOM 1828 CA ARG A 120 1.125 16.939 11.761 1.00 0.00 C ATOM 1829 C ARG A 120 -0.369 17.254 11.824 1.00 0.00 C ATOM 1830 O ARG A 120 -0.795 18.148 12.554 1.00 0.00 O ATOM 1831 CB ARG A 120 1.690 16.816 13.176 1.00 0.00 C ATOM 1832 CG ARG A 120 1.740 15.388 13.687 1.00 0.00 C ATOM 1833 CD ARG A 120 3.096 14.752 13.427 1.00 0.00 C ATOM 1834 NE ARG A 120 4.033 14.998 14.519 1.00 0.00 N ATOM 1835 CZ ARG A 120 4.053 14.293 15.647 1.00 0.00 C ATOM 1836 NH1 ARG A 120 3.188 13.304 15.830 1.00 0.00 N ATOM 1837 NH2 ARG A 120 4.938 14.578 16.593 1.00 0.00 N ATOM 0 H ARG A 120 2.342 17.610 10.190 1.00 0.00 H new ATOM 0 HA ARG A 120 1.251 15.991 11.238 1.00 0.00 H new ATOM 0 HB2 ARG A 120 2.696 17.235 13.194 1.00 0.00 H new ATOM 0 HB3 ARG A 120 1.082 17.415 13.854 1.00 0.00 H new ATOM 0 HG2 ARG A 120 1.530 15.375 14.756 1.00 0.00 H new ATOM 0 HG3 ARG A 120 0.961 14.799 13.202 1.00 0.00 H new ATOM 0 HD2 ARG A 120 2.972 13.678 13.290 1.00 0.00 H new ATOM 0 HD3 ARG A 120 3.509 15.146 12.499 1.00 0.00 H new ATOM 0 HE ARG A 120 4.710 15.753 14.411 1.00 0.00 H new ATOM 0 HH11 ARG A 120 2.506 13.083 15.105 1.00 0.00 H new ATOM 0 HH12 ARG A 120 3.205 12.765 16.696 1.00 0.00 H new ATOM 0 HH21 ARG A 120 5.604 15.338 16.456 1.00 0.00 H new ATOM 0 HH22 ARG A 120 4.953 14.037 17.458 1.00 0.00 H new ATOM 1851 N LYS A 121 -1.160 16.510 11.056 1.00 0.00 N ATOM 1852 CA LYS A 121 -2.605 16.712 11.031 1.00 0.00 C ATOM 1853 C LYS A 121 -3.340 15.433 10.633 1.00 0.00 C ATOM 1854 O LYS A 121 -4.530 15.467 10.321 1.00 0.00 O ATOM 1855 CB LYS A 121 -2.964 17.840 10.061 1.00 0.00 C ATOM 1856 CG LYS A 121 -3.522 19.076 10.747 1.00 0.00 C ATOM 1857 CD LYS A 121 -5.037 19.018 10.854 1.00 0.00 C ATOM 1858 CE LYS A 121 -5.488 18.885 12.300 1.00 0.00 C ATOM 1859 NZ LYS A 121 -5.945 17.502 12.614 1.00 0.00 N ATOM 0 H LYS A 121 -0.826 15.765 10.445 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.920 16.986 12.038 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -2.075 18.119 9.495 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.696 17.471 9.343 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -3.089 19.167 11.743 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -3.229 19.966 10.190 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -5.468 19.919 10.418 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -5.412 18.174 10.276 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -4.666 19.155 12.963 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -6.298 19.588 12.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -5.686 17.264 13.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -6.978 17.445 12.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -5.491 16.830 11.963 1.00 0.00 H new ATOM 1872 N LEU A 122 -2.629 14.309 10.644 1.00 0.00 N ATOM 1873 CA LEU A 122 -3.225 13.027 10.280 1.00 0.00 C ATOM 1874 C LEU A 122 -2.929 11.963 11.332 1.00 0.00 C ATOM 1875 O LEU A 122 -2.239 12.226 12.317 1.00 0.00 O ATOM 1876 CB LEU A 122 -2.707 12.573 8.915 1.00 0.00 C ATOM 1877 CG LEU A 122 -2.706 13.655 7.836 1.00 0.00 C ATOM 1878 CD1 LEU A 122 -1.329 14.285 7.712 1.00 0.00 C ATOM 1879 CD2 LEU A 122 -3.151 13.074 6.504 1.00 0.00 C ATOM 0 H LEU A 122 -1.643 14.260 10.900 1.00 0.00 H new ATOM 0 HA LEU A 122 -4.305 13.161 10.227 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -1.690 12.198 9.034 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.316 11.737 8.571 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.412 14.433 8.126 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.349 15.053 6.939 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.048 14.736 8.664 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.601 13.519 7.444 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.145 13.857 5.745 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.469 12.277 6.208 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.159 12.671 6.601 1.00 0.00 H new ATOM 1891 N GLY A 123 -3.458 10.761 11.118 1.00 0.00 N ATOM 1892 CA GLY A 123 -3.240 9.677 12.060 1.00 0.00 C ATOM 1893 C GLY A 123 -3.366 8.305 11.422 1.00 0.00 C ATOM 1894 O GLY A 123 -3.273 7.287 12.108 1.00 0.00 O ATOM 0 H GLY A 123 -4.033 10.519 10.311 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -2.247 9.778 12.499 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -3.959 9.761 12.875 1.00 0.00 H new ATOM 1898 N ALA A 124 -3.573 8.275 10.107 1.00 0.00 N ATOM 1899 CA ALA A 124 -3.705 7.014 9.386 1.00 0.00 C ATOM 1900 C ALA A 124 -2.708 6.940 8.236 1.00 0.00 C ATOM 1901 O ALA A 124 -2.613 7.864 7.429 1.00 0.00 O ATOM 1902 CB ALA A 124 -5.126 6.847 8.869 1.00 0.00 C ATOM 0 H ALA A 124 -3.652 9.107 9.522 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.487 6.200 10.078 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.209 5.902 8.333 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.821 6.851 9.708 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -5.367 7.669 8.195 1.00 0.00 H new ATOM 1908 N TRP A 125 -1.970 5.835 8.161 1.00 0.00 N ATOM 1909 CA TRP A 125 -0.983 5.650 7.107 1.00 0.00 C ATOM 1910 C TRP A 125 -1.564 4.830 5.969 1.00 0.00 C ATOM 1911 O TRP A 125 -2.189 3.786 6.189 1.00 0.00 O ATOM 1912 CB TRP A 125 0.268 4.965 7.656 1.00 0.00 C ATOM 1913 CG TRP A 125 -0.020 3.664 8.340 1.00 0.00 C ATOM 1914 CD1 TRP A 125 -0.439 3.494 9.626 1.00 0.00 C ATOM 1915 CD2 TRP A 125 0.088 2.352 7.774 1.00 0.00 C ATOM 1916 NE1 TRP A 125 -0.602 2.158 9.896 1.00 0.00 N ATOM 1917 CE2 TRP A 125 -0.283 1.436 8.776 1.00 0.00 C ATOM 1918 CE3 TRP A 125 0.460 1.864 6.519 1.00 0.00 C ATOM 1919 CZ2 TRP A 125 -0.292 0.060 8.560 1.00 0.00 C ATOM 1920 CZ3 TRP A 125 0.450 0.498 6.306 1.00 0.00 C ATOM 1921 CH2 TRP A 125 0.077 -0.390 7.322 1.00 0.00 C ATOM 0 H TRP A 125 -2.038 5.057 8.817 1.00 0.00 H new ATOM 0 HA TRP A 125 -0.707 6.633 6.726 1.00 0.00 H new ATOM 0 HB2 TRP A 125 0.967 4.790 6.838 1.00 0.00 H new ATOM 0 HB3 TRP A 125 0.762 5.636 8.359 1.00 0.00 H new ATOM 0 HD1 TRP A 125 -0.617 4.294 10.330 1.00 0.00 H new ATOM 0 HE1 TRP A 125 -0.910 1.766 10.786 1.00 0.00 H new ATOM 0 HE3 TRP A 125 0.750 2.541 5.730 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 -0.580 -0.627 9.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 0.735 0.109 5.339 1.00 0.00 H new ATOM 0 HH2 TRP A 125 0.081 -1.452 7.124 1.00 0.00 H new ATOM 1932 N VAL A 126 -1.363 5.308 4.750 1.00 0.00 N ATOM 1933 CA VAL A 126 -1.872 4.617 3.586 1.00 0.00 C ATOM 1934 C VAL A 126 -0.794 4.431 2.515 1.00 0.00 C ATOM 1935 O VAL A 126 -0.124 5.380 2.107 1.00 0.00 O ATOM 1936 CB VAL A 126 -3.100 5.349 3.002 1.00 0.00 C ATOM 1937 CG1 VAL A 126 -3.097 6.812 3.390 1.00 0.00 C ATOM 1938 CG2 VAL A 126 -3.178 5.186 1.494 1.00 0.00 C ATOM 0 H VAL A 126 -0.853 6.168 4.547 1.00 0.00 H new ATOM 0 HA VAL A 126 -2.184 3.625 3.912 1.00 0.00 H new ATOM 0 HB VAL A 126 -3.991 4.889 3.430 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -3.973 7.303 2.965 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.122 6.900 4.476 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -2.194 7.288 3.008 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -4.054 5.713 1.116 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -2.279 5.600 1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -3.257 4.128 1.246 1.00 0.00 H new ATOM 1948 N CYS A 127 -0.653 3.186 2.071 1.00 0.00 N ATOM 1949 CA CYS A 127 0.319 2.804 1.039 1.00 0.00 C ATOM 1950 C CYS A 127 -0.298 1.759 0.123 1.00 0.00 C ATOM 1951 O CYS A 127 -1.290 1.149 0.482 1.00 0.00 O ATOM 1952 CB CYS A 127 1.597 2.246 1.662 1.00 0.00 C ATOM 1953 SG CYS A 127 2.382 3.351 2.875 1.00 0.00 S ATOM 0 H CYS A 127 -1.211 2.405 2.416 1.00 0.00 H new ATOM 0 HA CYS A 127 0.579 3.695 0.467 1.00 0.00 H new ATOM 0 HB2 CYS A 127 1.367 1.298 2.147 1.00 0.00 H new ATOM 0 HB3 CYS A 127 2.311 2.032 0.867 1.00 0.00 H new ATOM 1958 N ASP A 128 0.273 1.525 -1.048 1.00 0.00 N ATOM 1959 CA ASP A 128 -0.296 0.522 -1.930 1.00 0.00 C ATOM 1960 C ASP A 128 0.737 -0.516 -2.334 1.00 0.00 C ATOM 1961 O ASP A 128 1.900 -0.205 -2.577 1.00 0.00 O ATOM 1962 CB ASP A 128 -0.888 1.182 -3.177 1.00 0.00 C ATOM 1963 CG ASP A 128 0.001 2.278 -3.735 1.00 0.00 C ATOM 1964 OD1 ASP A 128 1.234 2.192 -3.556 1.00 0.00 O ATOM 1965 OD2 ASP A 128 -0.538 3.222 -4.349 1.00 0.00 O ATOM 0 H ASP A 128 1.104 2.000 -1.401 1.00 0.00 H new ATOM 0 HA ASP A 128 -1.089 0.014 -1.382 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -1.048 0.424 -3.944 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -1.865 1.600 -2.933 1.00 0.00 H new ATOM 1970 N ARG A 129 0.275 -1.754 -2.410 1.00 0.00 N ATOM 1971 CA ARG A 129 1.109 -2.886 -2.787 1.00 0.00 C ATOM 1972 C ARG A 129 0.238 -4.006 -3.333 1.00 0.00 C ATOM 1973 O ARG A 129 -0.985 -3.946 -3.239 1.00 0.00 O ATOM 1974 CB ARG A 129 1.922 -3.381 -1.585 1.00 0.00 C ATOM 1975 CG ARG A 129 1.248 -4.487 -0.788 1.00 0.00 C ATOM 1976 CD ARG A 129 2.125 -5.726 -0.708 1.00 0.00 C ATOM 1977 NE ARG A 129 1.838 -6.525 0.482 1.00 0.00 N ATOM 1978 CZ ARG A 129 2.615 -7.514 0.910 1.00 0.00 C ATOM 1979 NH1 ARG A 129 3.723 -7.826 0.251 1.00 0.00 N ATOM 1980 NH2 ARG A 129 2.285 -8.192 2.001 1.00 0.00 N ATOM 0 H ARG A 129 -0.694 -2.004 -2.211 1.00 0.00 H new ATOM 0 HA ARG A 129 1.806 -2.567 -3.562 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.889 -3.740 -1.938 1.00 0.00 H new ATOM 0 HB3 ARG A 129 2.118 -2.539 -0.922 1.00 0.00 H new ATOM 0 HG2 ARG A 129 1.027 -4.130 0.218 1.00 0.00 H new ATOM 0 HG3 ARG A 129 0.295 -4.743 -1.252 1.00 0.00 H new ATOM 0 HD2 ARG A 129 1.973 -6.335 -1.599 1.00 0.00 H new ATOM 0 HD3 ARG A 129 3.173 -5.428 -0.700 1.00 0.00 H new ATOM 0 HE ARG A 129 0.994 -6.311 1.013 1.00 0.00 H new ATOM 0 HH11 ARG A 129 3.981 -7.306 -0.588 1.00 0.00 H new ATOM 0 HH12 ARG A 129 4.317 -8.586 0.583 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.435 -7.954 2.512 1.00 0.00 H new ATOM 0 HH22 ARG A 129 2.882 -8.951 2.330 1.00 0.00 H new ATOM 1994 N LEU A 130 0.864 -5.031 -3.888 1.00 0.00 N ATOM 1995 CA LEU A 130 0.119 -6.161 -4.430 1.00 0.00 C ATOM 1996 C LEU A 130 -0.560 -6.939 -3.308 1.00 0.00 C ATOM 1997 O LEU A 130 0.055 -7.240 -2.286 1.00 0.00 O ATOM 1998 CB LEU A 130 1.046 -7.073 -5.237 1.00 0.00 C ATOM 1999 CG LEU A 130 1.261 -6.664 -6.701 1.00 0.00 C ATOM 2000 CD1 LEU A 130 0.480 -7.581 -7.629 1.00 0.00 C ATOM 2001 CD2 LEU A 130 0.863 -5.208 -6.932 1.00 0.00 C ATOM 0 H LEU A 130 1.877 -5.106 -3.976 1.00 0.00 H new ATOM 0 HA LEU A 130 -0.654 -5.780 -5.098 1.00 0.00 H new ATOM 0 HB2 LEU A 130 2.016 -7.107 -4.741 1.00 0.00 H new ATOM 0 HB3 LEU A 130 0.641 -8.085 -5.216 1.00 0.00 H new ATOM 0 HG LEU A 130 2.323 -6.762 -6.924 1.00 0.00 H new ATOM 0 HD11 LEU A 130 0.643 -7.277 -8.663 1.00 0.00 H new ATOM 0 HD12 LEU A 130 0.818 -8.608 -7.495 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -0.583 -7.516 -7.395 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.026 -4.948 -7.978 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -0.190 -5.075 -6.685 1.00 0.00 H new ATOM 0 HD23 LEU A 130 1.468 -4.560 -6.298 1.00 0.00 H new ATOM 2013 N ALA A 131 -1.839 -7.249 -3.502 1.00 0.00 N ATOM 2014 CA ALA A 131 -2.616 -7.977 -2.502 1.00 0.00 C ATOM 2015 C ALA A 131 -2.084 -9.390 -2.287 1.00 0.00 C ATOM 2016 O ALA A 131 -2.600 -10.133 -1.451 1.00 0.00 O ATOM 2017 CB ALA A 131 -4.081 -8.023 -2.906 1.00 0.00 C ATOM 0 H ALA A 131 -2.361 -7.007 -4.344 1.00 0.00 H new ATOM 0 HA ALA A 131 -2.519 -7.442 -1.557 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -4.649 -8.568 -2.152 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.468 -7.007 -2.988 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.178 -8.526 -3.868 1.00 0.00 H new ATOM 2023 N THR A 132 -1.056 -9.761 -3.041 1.00 0.00 N ATOM 2024 CA THR A 132 -0.468 -11.087 -2.922 1.00 0.00 C ATOM 2025 C THR A 132 0.728 -11.073 -1.975 1.00 0.00 C ATOM 2026 O THR A 132 1.573 -10.180 -2.039 1.00 0.00 O ATOM 2027 CB THR A 132 -0.043 -11.608 -4.295 1.00 0.00 C ATOM 2028 OG1 THR A 132 1.115 -10.931 -4.751 1.00 0.00 O ATOM 2029 CG2 THR A 132 -1.113 -11.450 -5.353 1.00 0.00 C ATOM 0 H THR A 132 -0.614 -9.163 -3.739 1.00 0.00 H new ATOM 0 HA THR A 132 -1.225 -11.754 -2.509 1.00 0.00 H new ATOM 0 HB THR A 132 0.150 -12.671 -4.153 1.00 0.00 H new ATOM 0 HG1 THR A 132 1.373 -11.279 -5.630 1.00 0.00 H new ATOM 0 HG21 THR A 132 -0.746 -11.840 -6.303 1.00 0.00 H new ATOM 0 HG22 THR A 132 -2.004 -12.002 -5.054 1.00 0.00 H new ATOM 0 HG23 THR A 132 -1.361 -10.394 -5.465 1.00 0.00 H new ATOM 2037 N CYS A 133 0.789 -12.068 -1.096 1.00 0.00 N ATOM 2038 CA CYS A 133 1.879 -12.175 -0.132 1.00 0.00 C ATOM 2039 C CYS A 133 2.887 -13.235 -0.567 1.00 0.00 C ATOM 2040 O CYS A 133 2.872 -13.687 -1.712 1.00 0.00 O ATOM 2041 CB CYS A 133 1.329 -12.516 1.254 1.00 0.00 C ATOM 2042 SG CYS A 133 -0.325 -11.827 1.589 1.00 0.00 S ATOM 0 H CYS A 133 0.095 -12.813 -1.031 1.00 0.00 H new ATOM 0 HA CYS A 133 2.388 -11.212 -0.087 1.00 0.00 H new ATOM 0 HB2 CYS A 133 1.287 -13.600 1.360 1.00 0.00 H new ATOM 0 HB3 CYS A 133 2.024 -12.148 2.009 1.00 0.00 H new ATOM 2047 N THR A 134 3.761 -13.626 0.354 1.00 0.00 N ATOM 2048 CA THR A 134 4.776 -14.633 0.067 1.00 0.00 C ATOM 2049 C THR A 134 4.837 -15.678 1.180 1.00 0.00 C ATOM 2050 O THR A 134 5.058 -15.343 2.344 1.00 0.00 O ATOM 2051 CB THR A 134 6.146 -13.971 -0.103 1.00 0.00 C ATOM 2052 OG1 THR A 134 6.100 -12.614 0.300 1.00 0.00 O ATOM 2053 CG2 THR A 134 6.656 -14.010 -1.527 1.00 0.00 C ATOM 0 H THR A 134 3.787 -13.261 1.306 1.00 0.00 H new ATOM 0 HA THR A 134 4.504 -15.134 -0.862 1.00 0.00 H new ATOM 0 HB THR A 134 6.826 -14.547 0.525 1.00 0.00 H new ATOM 0 HG1 THR A 134 6.985 -12.209 0.186 1.00 0.00 H new ATOM 0 HG21 THR A 134 7.631 -13.524 -1.578 1.00 0.00 H new ATOM 0 HG22 THR A 134 6.750 -15.046 -1.852 1.00 0.00 H new ATOM 0 HG23 THR A 134 5.956 -13.487 -2.179 1.00 0.00 H new ATOM 2061 N PRO A 135 4.641 -16.964 0.836 1.00 0.00 N ATOM 2062 CA PRO A 135 4.675 -18.056 1.815 1.00 0.00 C ATOM 2063 C PRO A 135 6.085 -18.327 2.334 1.00 0.00 C ATOM 2064 O PRO A 135 7.011 -18.538 1.550 1.00 0.00 O ATOM 2065 CB PRO A 135 4.155 -19.258 1.024 1.00 0.00 C ATOM 2066 CG PRO A 135 4.487 -18.948 -0.393 1.00 0.00 C ATOM 2067 CD PRO A 135 4.371 -17.454 -0.529 1.00 0.00 C ATOM 0 HA PRO A 135 4.086 -17.826 2.703 1.00 0.00 H new ATOM 0 HB2 PRO A 135 4.632 -20.183 1.349 1.00 0.00 H new ATOM 0 HB3 PRO A 135 3.081 -19.388 1.160 1.00 0.00 H new ATOM 0 HG2 PRO A 135 5.493 -19.285 -0.641 1.00 0.00 H new ATOM 0 HG3 PRO A 135 3.804 -19.456 -1.074 1.00 0.00 H new ATOM 0 HD2 PRO A 135 5.090 -17.059 -1.247 1.00 0.00 H new ATOM 0 HD3 PRO A 135 3.380 -17.158 -0.874 1.00 0.00 H new ATOM 2075 N PRO A 136 6.269 -18.327 3.667 1.00 0.00 N ATOM 2076 CA PRO A 136 7.576 -18.575 4.283 1.00 0.00 C ATOM 2077 C PRO A 136 8.008 -20.033 4.156 1.00 0.00 C ATOM 2078 O PRO A 136 7.791 -20.835 5.066 1.00 0.00 O ATOM 2079 CB PRO A 136 7.352 -18.208 5.751 1.00 0.00 C ATOM 2080 CG PRO A 136 5.897 -18.426 5.975 1.00 0.00 C ATOM 2081 CD PRO A 136 5.219 -18.084 4.677 1.00 0.00 C ATOM 0 HA PRO A 136 8.369 -18.001 3.804 1.00 0.00 H new ATOM 0 HB2 PRO A 136 7.953 -18.833 6.412 1.00 0.00 H new ATOM 0 HB3 PRO A 136 7.633 -17.173 5.948 1.00 0.00 H new ATOM 0 HG2 PRO A 136 5.697 -19.459 6.259 1.00 0.00 H new ATOM 0 HG3 PRO A 136 5.529 -17.796 6.785 1.00 0.00 H new ATOM 0 HD2 PRO A 136 4.343 -18.709 4.504 1.00 0.00 H new ATOM 0 HD3 PRO A 136 4.879 -17.048 4.662 1.00 0.00 H new ATOM 2089 N ALA A 137 8.619 -20.367 3.023 1.00 0.00 N ATOM 2090 CA ALA A 137 9.083 -21.728 2.772 1.00 0.00 C ATOM 2091 C ALA A 137 7.945 -22.733 2.915 1.00 0.00 C ATOM 2092 O ALA A 137 8.158 -23.872 3.332 1.00 0.00 O ATOM 2093 CB ALA A 137 10.224 -22.077 3.717 1.00 0.00 C ATOM 0 H ALA A 137 8.805 -19.713 2.263 1.00 0.00 H new ATOM 0 HA ALA A 137 9.447 -21.779 1.746 1.00 0.00 H new ATOM 0 HB1 ALA A 137 10.561 -23.095 3.520 1.00 0.00 H new ATOM 0 HB2 ALA A 137 11.051 -21.384 3.561 1.00 0.00 H new ATOM 0 HB3 ALA A 137 9.878 -22.003 4.748 1.00 0.00 H new ATOM 2099 N SER A 138 6.736 -22.306 2.565 1.00 0.00 N ATOM 2100 CA SER A 138 5.564 -23.168 2.652 1.00 0.00 C ATOM 2101 C SER A 138 5.023 -23.495 1.264 1.00 0.00 C ATOM 2102 O SER A 138 4.379 -24.525 1.065 1.00 0.00 O ATOM 2103 CB SER A 138 4.475 -22.500 3.494 1.00 0.00 C ATOM 2104 OG SER A 138 4.197 -23.254 4.660 1.00 0.00 O ATOM 0 H SER A 138 6.543 -21.367 2.218 1.00 0.00 H new ATOM 0 HA SER A 138 5.864 -24.099 3.132 1.00 0.00 H new ATOM 0 HB2 SER A 138 4.792 -21.496 3.774 1.00 0.00 H new ATOM 0 HB3 SER A 138 3.567 -22.394 2.901 1.00 0.00 H new ATOM 0 HG SER A 138 3.499 -22.805 5.181 1.00 0.00 H new ATOM 2110 N GLU A 139 5.289 -22.608 0.308 1.00 0.00 N ATOM 2111 CA GLU A 139 4.831 -22.796 -1.065 1.00 0.00 C ATOM 2112 C GLU A 139 3.314 -22.953 -1.119 1.00 0.00 C ATOM 2113 O GLU A 139 2.781 -23.640 -1.991 1.00 0.00 O ATOM 2114 CB GLU A 139 5.506 -24.020 -1.689 1.00 0.00 C ATOM 2115 CG GLU A 139 6.927 -23.758 -2.157 1.00 0.00 C ATOM 2116 CD GLU A 139 7.138 -24.125 -3.613 1.00 0.00 C ATOM 2117 OE1 GLU A 139 6.505 -23.489 -4.483 1.00 0.00 O ATOM 2118 OE2 GLU A 139 7.936 -25.046 -3.885 1.00 0.00 O ATOM 0 H GLU A 139 5.820 -21.751 0.460 1.00 0.00 H new ATOM 0 HA GLU A 139 5.105 -21.909 -1.636 1.00 0.00 H new ATOM 0 HB2 GLU A 139 5.516 -24.830 -0.960 1.00 0.00 H new ATOM 0 HB3 GLU A 139 4.910 -24.361 -2.536 1.00 0.00 H new ATOM 0 HG2 GLU A 139 7.164 -22.704 -2.014 1.00 0.00 H new ATOM 0 HG3 GLU A 139 7.620 -24.328 -1.538 1.00 0.00 H new ATOM 2125 N GLY A 140 2.624 -22.311 -0.181 1.00 0.00 N ATOM 2126 CA GLY A 140 1.177 -22.391 -0.138 1.00 0.00 C ATOM 2127 C GLY A 140 0.685 -23.603 0.629 1.00 0.00 C ATOM 2128 O GLY A 140 0.008 -23.468 1.648 1.00 0.00 O ATOM 0 H GLY A 140 3.043 -21.736 0.550 1.00 0.00 H new ATOM 0 HA2 GLY A 140 0.780 -21.487 0.324 1.00 0.00 H new ATOM 0 HA3 GLY A 140 0.788 -22.426 -1.156 1.00 0.00 H new ATOM 2132 N SER A 141 1.026 -24.790 0.137 1.00 0.00 N ATOM 2133 CA SER A 141 0.616 -26.032 0.782 1.00 0.00 C ATOM 2134 C SER A 141 1.225 -26.149 2.175 1.00 0.00 C ATOM 2135 O SER A 141 2.302 -25.615 2.438 1.00 0.00 O ATOM 2136 CB SER A 141 1.028 -27.234 -0.070 1.00 0.00 C ATOM 2137 OG SER A 141 2.437 -27.381 -0.095 1.00 0.00 O ATOM 0 H SER A 141 1.585 -24.918 -0.706 1.00 0.00 H new ATOM 0 HA SER A 141 -0.470 -26.020 0.880 1.00 0.00 H new ATOM 0 HB2 SER A 141 0.572 -28.140 0.329 1.00 0.00 H new ATOM 0 HB3 SER A 141 0.654 -27.109 -1.086 1.00 0.00 H new ATOM 0 HG SER A 141 2.675 -28.157 -0.644 1.00 0.00 H new ATOM 2143 N ALA A 142 0.528 -26.850 3.064 1.00 0.00 N ATOM 2144 CA ALA A 142 0.999 -27.036 4.431 1.00 0.00 C ATOM 2145 C ALA A 142 1.229 -28.512 4.735 1.00 0.00 C ATOM 2146 O ALA A 142 2.360 -28.938 4.969 1.00 0.00 O ATOM 2147 CB ALA A 142 0.006 -26.440 5.417 1.00 0.00 C ATOM 0 H ALA A 142 -0.365 -27.299 2.861 1.00 0.00 H new ATOM 0 HA ALA A 142 1.952 -26.518 4.535 1.00 0.00 H new ATOM 0 HB1 ALA A 142 0.371 -26.586 6.434 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -0.106 -25.374 5.221 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -0.960 -26.933 5.304 1.00 0.00 H new ATOM 2153 N GLU A 143 0.150 -29.287 4.730 1.00 0.00 N ATOM 2154 CA GLU A 143 0.233 -30.717 5.006 1.00 0.00 C ATOM 2155 C GLU A 143 -0.999 -31.446 4.480 1.00 0.00 C ATOM 2156 O GLU A 143 -2.034 -30.780 4.271 1.00 0.00 O ATOM 2157 CB GLU A 143 0.381 -30.960 6.509 1.00 0.00 C ATOM 2158 CG GLU A 143 -0.693 -30.285 7.344 1.00 0.00 C ATOM 2159 CD GLU A 143 -1.370 -31.240 8.308 1.00 0.00 C ATOM 2160 OE1 GLU A 143 -0.656 -31.873 9.115 1.00 0.00 O ATOM 2161 OE2 GLU A 143 -2.612 -31.356 8.256 1.00 0.00 O ATOM 2162 OXT GLU A 143 -0.920 -32.677 4.285 1.00 0.00 O ATOM 0 H GLU A 143 -0.793 -28.949 4.538 1.00 0.00 H new ATOM 0 HA GLU A 143 1.111 -31.110 4.493 1.00 0.00 H new ATOM 0 HB2 GLU A 143 0.356 -32.033 6.699 1.00 0.00 H new ATOM 0 HB3 GLU A 143 1.359 -30.602 6.832 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -0.248 -29.463 7.905 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -1.443 -29.851 6.682 1.00 0.00 H new TER 2169 GLU A 143