USER MOD reduce.3.24.130724 H: found=0, std=0, add=1209, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1210 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 146 HIS : no HD1:sc= -0.398 K(o=0.09,f=-0.59) USER MOD Set 1.2: A 150 THR OG1 : rot 69:sc= 0.488 USER MOD Set 2.1: A 84 TYR OH : rot -67:sc= 2.36 USER MOD Set 2.2: A 127 CYS SG : rot 75:sc= 1.33 USER MOD Set 3.1: A 126 ASN : amide:sc=-0.00362 K(o=-0.54,f=-1.6) USER MOD Set 3.2: A 156 MET CE :methyl -139:sc= -0.533 (180deg=-4.04!) USER MOD Set 4.1: A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 4.2: A 83 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 25 SER OG : rot -115:sc= 1.13 USER MOD Set 5.2: A 38 THR OG1 : rot -130:sc= 1.48 USER MOD Set 6.1: A 34 THR OG1 : rot 180:sc=-0.00809 USER MOD Set 6.2: A 35 ASN : amide:sc= -3.36! C(o=-3.4!,f=-11!) USER MOD Set 7.1: A 20 THR OG1 : rot -72:sc= 1.1 USER MOD Set 7.2: A 136 ASN : amide:sc= -10.6! C(o=-9.5!,f=-11!) USER MOD Single : A 11 CYS SG : rot 180:sc= -0.672 USER MOD Single : A 13 SER OG : rot -105:sc= -3.47! USER MOD Single : A 19 GLN : amide:sc=-0.00128 K(o=-0.0013,f=-0.63) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 CYS SG : rot -170:sc= -1.54 USER MOD Single : A 28 GLN : amide:sc= -0.0782 K(o=-0.078,f=-1.8!) USER MOD Single : A 31 LYS NZ :NH3+ 162:sc= -0.0418 (180deg=-0.54) USER MOD Single : A 32 GLN : amide:sc= -0.528 X(o=-0.53,f=-0.068) USER MOD Single : A 39 MET CE :methyl -167:sc= -5.73! (180deg=-5.96!) USER MOD Single : A 41 GLN :FLIP amide:sc= -4! C(o=-6.1!,f=-4!) USER MOD Single : A 44 HIS : no HE2:sc= -1.4 K(o=-1.4,f=-2.1) USER MOD Single : A 45 GLN : amide:sc= -0.429 K(o=-0.43,f=-2.6!) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.0191 USER MOD Single : A 57 SER OG : rot -25:sc= 0.193 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.144 K(o=-0.14,f=-1.1) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.841 K(o=-0.84,f=-3.2!) USER MOD Single : A 75 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.121) USER MOD Single : A 76 LYS NZ :NH3+ 139:sc= 1.25 (180deg=-0.339) USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.486 USER MOD Single : A 85 TYR OH : rot 30:sc= -0.988 USER MOD Single : A 86 HIS :FLIP no HD1:sc= -3.38! C(o=-4.4!,f=-3.4!) USER MOD Single : A 91 GLN :FLIP amide:sc= -0.111 F(o=-0.63,f=-0.11) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 GLN : amide:sc= -0.261 X(o=-0.26,f=-0.00013) USER MOD Single : A 105 THR OG1 : rot 69:sc= -0.368 USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= -0.258 K(o=-0.26,f=-0.92) USER MOD Single : A 123 CYS SG : rot -102:sc= -1.87! USER MOD Single : A 129 LYS NZ :NH3+ -136:sc= -1.5 (180deg=-2.82!) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 GLN : amide:sc= -0.127 K(o=-0.13,f=-0.85) USER MOD Single : A 133 HIS : no HD1:sc= -0.372 X(o=-0.37,f=0.07) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl 138:sc= -1.18 (180deg=-3.66) USER MOD Single : A 139 THR OG1 : rot -43:sc= 0.308 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN :FLIP amide:sc= -2.56! F(o=-3.4,f=-2.6!) USER MOD Single : A 149 MET CE :methyl 134:sc= -0.324 (180deg=-2.24!) USER MOD Single : A 153 GLN : amide:sc= -0.123 X(o=-0.12,f=-0.54) USER MOD Single : A 157 SER OG : rot 86:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 8.435 13.221 -0.913 1.00 0.00 N ATOM 67 CA LEU A 8 7.498 13.626 -1.955 1.00 0.00 C ATOM 68 C LEU A 8 6.061 13.570 -1.447 1.00 0.00 C ATOM 69 O LEU A 8 5.773 13.015 -0.386 1.00 0.00 O ATOM 70 CB LEU A 8 7.652 12.728 -3.184 1.00 0.00 C ATOM 71 CG LEU A 8 6.527 11.720 -3.424 1.00 0.00 C ATOM 72 CD1 LEU A 8 6.549 11.228 -4.863 1.00 0.00 C ATOM 73 CD2 LEU A 8 6.642 10.552 -2.456 1.00 0.00 C ATOM 0 HA LEU A 8 7.725 14.655 -2.234 1.00 0.00 H new ATOM 0 HB2 LEU A 8 7.737 13.364 -4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.590 12.181 -3.094 1.00 0.00 H new ATOM 0 HG LEU A 8 5.574 12.219 -3.247 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.742 10.512 -5.015 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.416 12.073 -5.539 1.00 0.00 H new ATOM 0 HD13 LEU A 8 7.505 10.746 -5.068 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.833 9.845 -2.641 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.600 10.053 -2.600 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.575 10.920 -1.432 1.00 0.00 H new ATOM 85 N PRO A 9 5.136 14.156 -2.221 1.00 0.00 N ATOM 86 CA PRO A 9 3.713 14.183 -1.870 1.00 0.00 C ATOM 87 C PRO A 9 3.065 12.806 -1.969 1.00 0.00 C ATOM 88 O PRO A 9 2.401 12.353 -1.035 1.00 0.00 O ATOM 89 CB PRO A 9 3.110 15.133 -2.908 1.00 0.00 C ATOM 90 CG PRO A 9 4.036 15.058 -4.073 1.00 0.00 C ATOM 91 CD PRO A 9 5.408 14.836 -3.498 1.00 0.00 C ATOM 0 HA PRO A 9 3.554 14.499 -0.839 1.00 0.00 H new ATOM 0 HB2 PRO A 9 2.101 14.828 -3.184 1.00 0.00 H new ATOM 0 HB3 PRO A 9 3.041 16.150 -2.521 1.00 0.00 H new ATOM 0 HG2 PRO A 9 3.757 14.244 -4.742 1.00 0.00 H new ATOM 0 HG3 PRO A 9 4.002 15.977 -4.658 1.00 0.00 H new ATOM 0 HD2 PRO A 9 6.025 14.224 -4.156 1.00 0.00 H new ATOM 0 HD3 PRO A 9 5.938 15.777 -3.348 1.00 0.00 H new ATOM 99 N LEU A 10 3.261 12.145 -3.104 1.00 0.00 N ATOM 100 CA LEU A 10 2.695 10.819 -3.324 1.00 0.00 C ATOM 101 C LEU A 10 2.861 9.944 -2.086 1.00 0.00 C ATOM 102 O LEU A 10 2.048 9.054 -1.829 1.00 0.00 O ATOM 103 CB LEU A 10 3.364 10.151 -4.527 1.00 0.00 C ATOM 104 CG LEU A 10 2.975 8.696 -4.790 1.00 0.00 C ATOM 105 CD1 LEU A 10 1.466 8.562 -4.922 1.00 0.00 C ATOM 106 CD2 LEU A 10 3.670 8.175 -6.039 1.00 0.00 C ATOM 0 H LEU A 10 3.807 12.505 -3.886 1.00 0.00 H new ATOM 0 HA LEU A 10 1.630 10.934 -3.525 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.131 10.735 -5.417 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.444 10.198 -4.389 1.00 0.00 H new ATOM 0 HG LEU A 10 3.299 8.095 -3.941 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.208 7.520 -5.109 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.989 8.894 -4.000 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.117 9.176 -5.752 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.381 7.138 -6.210 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.377 8.780 -6.897 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.750 8.233 -5.905 1.00 0.00 H new ATOM 118 N CYS A 11 3.915 10.204 -1.321 1.00 0.00 N ATOM 119 CA CYS A 11 4.186 9.441 -0.108 1.00 0.00 C ATOM 120 C CYS A 11 3.853 10.259 1.135 1.00 0.00 C ATOM 121 O CYS A 11 3.368 9.724 2.132 1.00 0.00 O ATOM 122 CB CYS A 11 5.652 9.007 -0.070 1.00 0.00 C ATOM 123 SG CYS A 11 5.991 7.650 1.076 1.00 0.00 S ATOM 0 H CYS A 11 4.596 10.937 -1.519 1.00 0.00 H new ATOM 0 HA CYS A 11 3.552 8.554 -0.117 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.957 8.706 -1.072 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.266 9.864 0.207 1.00 0.00 H new ATOM 0 HG CYS A 11 7.256 7.353 1.035 1.00 0.00 H new ATOM 129 N ASP A 12 4.119 11.559 1.069 1.00 0.00 N ATOM 130 CA ASP A 12 3.848 12.453 2.189 1.00 0.00 C ATOM 131 C ASP A 12 2.350 12.552 2.455 1.00 0.00 C ATOM 132 O ASP A 12 1.925 13.087 3.480 1.00 0.00 O ATOM 133 CB ASP A 12 4.423 13.843 1.911 1.00 0.00 C ATOM 134 CG ASP A 12 4.147 14.819 3.038 1.00 0.00 C ATOM 135 OD1 ASP A 12 4.574 14.545 4.178 1.00 0.00 O ATOM 136 OD2 ASP A 12 3.503 15.858 2.779 1.00 0.00 O ATOM 0 H ASP A 12 4.522 12.017 0.252 1.00 0.00 H new ATOM 0 HA ASP A 12 4.329 12.041 3.076 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.499 13.764 1.758 1.00 0.00 H new ATOM 0 HB3 ASP A 12 3.997 14.231 0.986 1.00 0.00 H new ATOM 141 N SER A 13 1.553 12.035 1.525 1.00 0.00 N ATOM 142 CA SER A 13 0.101 12.070 1.657 1.00 0.00 C ATOM 143 C SER A 13 -0.458 10.668 1.879 1.00 0.00 C ATOM 144 O SER A 13 -1.259 10.443 2.787 1.00 0.00 O ATOM 145 CB SER A 13 -0.530 12.692 0.410 1.00 0.00 C ATOM 146 OG SER A 13 -1.852 12.218 0.217 1.00 0.00 O ATOM 0 H SER A 13 1.888 11.587 0.672 1.00 0.00 H new ATOM 0 HA SER A 13 -0.146 12.682 2.524 1.00 0.00 H new ATOM 0 HB2 SER A 13 -0.540 13.778 0.507 1.00 0.00 H new ATOM 0 HB3 SER A 13 0.076 12.455 -0.465 1.00 0.00 H new ATOM 0 HG SER A 13 -1.863 11.572 -0.519 1.00 0.00 H new ATOM 152 N LEU A 14 -0.031 9.729 1.043 1.00 0.00 N ATOM 153 CA LEU A 14 -0.488 8.347 1.147 1.00 0.00 C ATOM 154 C LEU A 14 -0.414 7.855 2.589 1.00 0.00 C ATOM 155 O LEU A 14 -1.373 7.287 3.111 1.00 0.00 O ATOM 156 CB LEU A 14 0.353 7.442 0.244 1.00 0.00 C ATOM 157 CG LEU A 14 -0.159 7.258 -1.185 1.00 0.00 C ATOM 158 CD1 LEU A 14 0.898 6.588 -2.049 1.00 0.00 C ATOM 159 CD2 LEU A 14 -1.447 6.447 -1.190 1.00 0.00 C ATOM 0 H LEU A 14 0.631 9.899 0.286 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.528 8.309 0.823 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.364 7.847 0.197 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.425 6.460 0.712 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.371 8.242 -1.604 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.516 6.465 -3.062 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.795 7.207 -2.072 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.142 5.611 -1.633 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -1.797 6.326 -2.215 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -1.261 5.466 -0.752 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -2.207 6.967 -0.606 1.00 0.00 H new ATOM 171 N ILE A 15 0.730 8.080 3.227 1.00 0.00 N ATOM 172 CA ILE A 15 0.927 7.663 4.609 1.00 0.00 C ATOM 173 C ILE A 15 -0.266 8.052 5.476 1.00 0.00 C ATOM 174 O ILE A 15 -0.775 7.240 6.249 1.00 0.00 O ATOM 175 CB ILE A 15 2.205 8.281 5.207 1.00 0.00 C ATOM 176 CG1 ILE A 15 3.445 7.564 4.668 1.00 0.00 C ATOM 177 CG2 ILE A 15 2.166 8.213 6.726 1.00 0.00 C ATOM 178 CD1 ILE A 15 4.719 8.365 4.819 1.00 0.00 C ATOM 0 H ILE A 15 1.534 8.549 2.809 1.00 0.00 H new ATOM 0 HA ILE A 15 1.028 6.578 4.600 1.00 0.00 H new ATOM 0 HB ILE A 15 2.257 9.329 4.911 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.560 6.613 5.188 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.292 7.334 3.613 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.076 8.654 7.133 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.300 8.764 7.093 1.00 0.00 H new ATOM 0 HG23 ILE A 15 2.094 7.172 7.042 1.00 0.00 H new ATOM 0 HD11 ILE A 15 5.557 7.796 4.416 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.624 9.305 4.276 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.896 8.572 5.874 1.00 0.00 H new ATOM 190 N ILE A 16 -0.707 9.298 5.341 1.00 0.00 N ATOM 191 CA ILE A 16 -1.842 9.793 6.110 1.00 0.00 C ATOM 192 C ILE A 16 -3.062 8.896 5.930 1.00 0.00 C ATOM 193 O ILE A 16 -3.877 8.751 6.840 1.00 0.00 O ATOM 194 CB ILE A 16 -2.212 11.232 5.704 1.00 0.00 C ATOM 195 CG1 ILE A 16 -1.072 12.192 6.049 1.00 0.00 C ATOM 196 CG2 ILE A 16 -3.500 11.661 6.390 1.00 0.00 C ATOM 197 CD1 ILE A 16 -1.226 13.562 5.426 1.00 0.00 C ATOM 0 H ILE A 16 -0.296 9.983 4.707 1.00 0.00 H new ATOM 0 HA ILE A 16 -1.541 9.786 7.157 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.371 11.260 4.626 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -1.013 12.299 7.132 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -0.129 11.756 5.720 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -3.748 12.680 6.093 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.308 10.991 6.098 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -3.367 11.620 7.471 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -0.382 14.189 5.713 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -1.254 13.467 4.341 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -2.153 14.018 5.775 1.00 0.00 H new ATOM 209 N TRP A 17 -3.178 8.295 4.751 1.00 0.00 N ATOM 210 CA TRP A 17 -4.298 7.410 4.452 1.00 0.00 C ATOM 211 C TRP A 17 -4.106 6.048 5.110 1.00 0.00 C ATOM 212 O TRP A 17 -5.069 5.419 5.551 1.00 0.00 O ATOM 213 CB TRP A 17 -4.452 7.242 2.940 1.00 0.00 C ATOM 214 CG TRP A 17 -5.472 6.213 2.557 1.00 0.00 C ATOM 215 CD1 TRP A 17 -6.830 6.356 2.584 1.00 0.00 C ATOM 216 CD2 TRP A 17 -5.215 4.883 2.093 1.00 0.00 C ATOM 217 NE1 TRP A 17 -7.433 5.194 2.164 1.00 0.00 N ATOM 218 CE2 TRP A 17 -6.464 4.276 1.857 1.00 0.00 C ATOM 219 CE3 TRP A 17 -4.052 4.147 1.853 1.00 0.00 C ATOM 220 CZ2 TRP A 17 -6.580 2.968 1.393 1.00 0.00 C ATOM 221 CZ3 TRP A 17 -4.169 2.849 1.393 1.00 0.00 C ATOM 222 CH2 TRP A 17 -5.425 2.271 1.166 1.00 0.00 C ATOM 0 H TRP A 17 -2.511 8.404 3.987 1.00 0.00 H new ATOM 0 HA TRP A 17 -5.204 7.863 4.854 1.00 0.00 H new ATOM 0 HB2 TRP A 17 -4.731 8.200 2.502 1.00 0.00 H new ATOM 0 HB3 TRP A 17 -3.488 6.965 2.513 1.00 0.00 H new ATOM 0 HD1 TRP A 17 -7.353 7.250 2.890 1.00 0.00 H new ATOM 0 HE1 TRP A 17 -8.439 5.040 2.093 1.00 0.00 H new ATOM 0 HE3 TRP A 17 -3.079 4.584 2.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 -7.547 2.520 1.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 -3.277 2.270 1.205 1.00 0.00 H new ATOM 0 HH2 TRP A 17 -5.482 1.255 0.805 1.00 0.00 H new ATOM 233 N LEU A 18 -2.858 5.598 5.174 1.00 0.00 N ATOM 234 CA LEU A 18 -2.540 4.309 5.780 1.00 0.00 C ATOM 235 C LEU A 18 -2.603 4.392 7.302 1.00 0.00 C ATOM 236 O LEU A 18 -2.672 3.371 7.985 1.00 0.00 O ATOM 237 CB LEU A 18 -1.150 3.846 5.340 1.00 0.00 C ATOM 238 CG LEU A 18 -0.955 2.335 5.213 1.00 0.00 C ATOM 239 CD1 LEU A 18 -1.427 1.848 3.851 1.00 0.00 C ATOM 240 CD2 LEU A 18 0.504 1.964 5.437 1.00 0.00 C ATOM 0 H LEU A 18 -2.050 6.106 4.814 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.281 3.584 5.444 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.925 4.303 4.377 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.419 4.228 6.053 1.00 0.00 H new ATOM 0 HG LEU A 18 -1.556 1.846 5.980 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.280 0.770 3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.485 2.079 3.729 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.854 2.345 3.068 1.00 0.00 H new ATOM 0 HD21 LEU A 18 0.624 0.885 5.343 1.00 0.00 H new ATOM 0 HD22 LEU A 18 1.125 2.464 4.694 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.810 2.277 6.435 1.00 0.00 H new ATOM 252 N GLN A 19 -2.581 5.614 7.824 1.00 0.00 N ATOM 253 CA GLN A 19 -2.637 5.829 9.265 1.00 0.00 C ATOM 254 C GLN A 19 -3.972 5.360 9.834 1.00 0.00 C ATOM 255 O GLN A 19 -4.071 5.016 11.012 1.00 0.00 O ATOM 256 CB GLN A 19 -2.422 7.309 9.589 1.00 0.00 C ATOM 257 CG GLN A 19 -0.985 7.769 9.408 1.00 0.00 C ATOM 258 CD GLN A 19 -0.644 8.971 10.266 1.00 0.00 C ATOM 259 OE1 GLN A 19 -1.528 9.713 10.694 1.00 0.00 O ATOM 260 NE2 GLN A 19 0.644 9.169 10.523 1.00 0.00 N ATOM 0 H GLN A 19 -2.525 6.469 7.271 1.00 0.00 H new ATOM 0 HA GLN A 19 -1.841 5.244 9.726 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -3.070 7.910 8.951 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -2.727 7.495 10.619 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -0.311 6.949 9.655 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -0.816 8.016 8.360 1.00 0.00 H new ATOM 0 HE21 GLN A 19 1.343 8.528 10.148 1.00 0.00 H new ATOM 0 HE22 GLN A 19 0.934 9.962 11.096 1.00 0.00 H new ATOM 269 N THR A 20 -4.999 5.350 8.989 1.00 0.00 N ATOM 270 CA THR A 20 -6.329 4.925 9.408 1.00 0.00 C ATOM 271 C THR A 20 -6.304 3.502 9.955 1.00 0.00 C ATOM 272 O THR A 20 -7.093 3.150 10.832 1.00 0.00 O ATOM 273 CB THR A 20 -7.334 4.998 8.243 1.00 0.00 C ATOM 274 OG1 THR A 20 -6.869 4.207 7.144 1.00 0.00 O ATOM 275 CG2 THR A 20 -7.534 6.436 7.790 1.00 0.00 C ATOM 0 H THR A 20 -4.935 5.631 8.011 1.00 0.00 H new ATOM 0 HA THR A 20 -6.647 5.608 10.196 1.00 0.00 H new ATOM 0 HB THR A 20 -8.290 4.607 8.592 1.00 0.00 H new ATOM 0 HG1 THR A 20 -6.111 4.656 6.715 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.248 6.462 6.967 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.916 7.029 8.621 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.581 6.849 7.458 1.00 0.00 H new ATOM 283 N PHE A 21 -5.394 2.687 9.431 1.00 0.00 N ATOM 284 CA PHE A 21 -5.267 1.302 9.868 1.00 0.00 C ATOM 285 C PHE A 21 -4.328 1.192 11.065 1.00 0.00 C ATOM 286 O PHE A 21 -3.107 1.245 10.918 1.00 0.00 O ATOM 287 CB PHE A 21 -4.754 0.429 8.721 1.00 0.00 C ATOM 288 CG PHE A 21 -5.515 0.614 7.439 1.00 0.00 C ATOM 289 CD1 PHE A 21 -5.223 1.670 6.591 1.00 0.00 C ATOM 290 CD2 PHE A 21 -6.523 -0.267 7.083 1.00 0.00 C ATOM 291 CE1 PHE A 21 -5.921 1.844 5.411 1.00 0.00 C ATOM 292 CE2 PHE A 21 -7.224 -0.099 5.904 1.00 0.00 C ATOM 293 CZ PHE A 21 -6.924 0.958 5.067 1.00 0.00 C ATOM 0 H PHE A 21 -4.734 2.962 8.703 1.00 0.00 H new ATOM 0 HA PHE A 21 -6.254 0.951 10.170 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.702 0.655 8.546 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.810 -0.618 9.019 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -4.440 2.366 6.855 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -6.764 -1.094 7.734 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -5.683 2.671 4.759 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -8.006 -0.794 5.637 1.00 0.00 H new ATOM 0 HZ PHE A 21 -7.472 1.092 4.146 1.00 0.00 H new ATOM 303 N LYS A 22 -4.906 1.039 12.251 1.00 0.00 N ATOM 304 CA LYS A 22 -4.123 0.921 13.476 1.00 0.00 C ATOM 305 C LYS A 22 -3.660 -0.516 13.689 1.00 0.00 C ATOM 306 O LYS A 22 -3.508 -0.969 14.824 1.00 0.00 O ATOM 307 CB LYS A 22 -4.946 1.387 14.679 1.00 0.00 C ATOM 308 CG LYS A 22 -6.032 0.407 15.089 1.00 0.00 C ATOM 309 CD LYS A 22 -6.222 0.385 16.597 1.00 0.00 C ATOM 310 CE LYS A 22 -7.517 -0.312 16.985 1.00 0.00 C ATOM 311 NZ LYS A 22 -8.657 0.643 17.071 1.00 0.00 N ATOM 0 H LYS A 22 -5.915 0.994 12.391 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.243 1.557 13.378 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -4.278 1.551 15.524 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.405 2.348 14.445 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -6.971 0.680 14.607 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -5.773 -0.592 14.739 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -5.379 -0.125 17.064 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -6.228 1.406 16.979 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -7.746 -1.086 16.253 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -7.387 -0.810 17.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -9.521 0.129 17.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -8.450 1.367 17.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -8.797 1.100 16.147 1.00 0.00 H new ATOM 325 N THR A 23 -3.435 -1.230 12.590 1.00 0.00 N ATOM 326 CA THR A 23 -2.989 -2.616 12.657 1.00 0.00 C ATOM 327 C THR A 23 -1.852 -2.780 13.659 1.00 0.00 C ATOM 328 O THR A 23 -1.178 -1.812 14.010 1.00 0.00 O ATOM 329 CB THR A 23 -2.521 -3.122 11.279 1.00 0.00 C ATOM 330 OG1 THR A 23 -1.402 -2.351 10.828 1.00 0.00 O ATOM 331 CG2 THR A 23 -3.647 -3.036 10.260 1.00 0.00 C ATOM 0 H THR A 23 -3.554 -0.871 11.643 1.00 0.00 H new ATOM 0 HA THR A 23 -3.844 -3.208 12.982 1.00 0.00 H new ATOM 0 HB THR A 23 -2.224 -4.166 11.381 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.110 -2.680 9.952 1.00 0.00 H new ATOM 0 HG21 THR A 23 -3.293 -3.399 9.295 1.00 0.00 H new ATOM 0 HG22 THR A 23 -4.486 -3.648 10.592 1.00 0.00 H new ATOM 0 HG23 THR A 23 -3.970 -2.000 10.162 1.00 0.00 H new ATOM 339 N ALA A 24 -1.644 -4.010 14.115 1.00 0.00 N ATOM 340 CA ALA A 24 -0.587 -4.301 15.075 1.00 0.00 C ATOM 341 C ALA A 24 0.688 -3.535 14.736 1.00 0.00 C ATOM 342 O ALA A 24 1.440 -3.139 15.626 1.00 0.00 O ATOM 343 CB ALA A 24 -0.310 -5.796 15.119 1.00 0.00 C ATOM 0 H ALA A 24 -2.194 -4.822 13.835 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.925 -3.976 16.059 1.00 0.00 H new ATOM 0 HB1 ALA A 24 0.482 -5.998 15.840 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -1.215 -6.325 15.416 1.00 0.00 H new ATOM 0 HB3 ALA A 24 0.002 -6.137 14.132 1.00 0.00 H new ATOM 349 N SER A 25 0.924 -3.330 13.445 1.00 0.00 N ATOM 350 CA SER A 25 2.110 -2.615 12.988 1.00 0.00 C ATOM 351 C SER A 25 1.847 -1.113 12.921 1.00 0.00 C ATOM 352 O SER A 25 0.826 -0.659 12.405 1.00 0.00 O ATOM 353 CB SER A 25 2.546 -3.130 11.615 1.00 0.00 C ATOM 354 OG SER A 25 3.792 -2.574 11.234 1.00 0.00 O ATOM 0 H SER A 25 0.309 -3.649 12.696 1.00 0.00 H new ATOM 0 HA SER A 25 2.911 -2.795 13.706 1.00 0.00 H new ATOM 0 HB2 SER A 25 2.621 -4.217 11.638 1.00 0.00 H new ATOM 0 HB3 SER A 25 1.789 -2.878 10.872 1.00 0.00 H new ATOM 0 HG SER A 25 3.670 -2.010 10.442 1.00 0.00 H new ATOM 360 N PRO A 26 2.791 -0.323 13.454 1.00 0.00 N ATOM 361 CA PRO A 26 2.685 1.139 13.467 1.00 0.00 C ATOM 362 C PRO A 26 2.828 1.742 12.074 1.00 0.00 C ATOM 363 O PRO A 26 2.981 1.021 11.088 1.00 0.00 O ATOM 364 CB PRO A 26 3.850 1.571 14.360 1.00 0.00 C ATOM 365 CG PRO A 26 4.839 0.462 14.255 1.00 0.00 C ATOM 366 CD PRO A 26 4.034 -0.797 14.086 1.00 0.00 C ATOM 0 HA PRO A 26 1.711 1.475 13.823 1.00 0.00 H new ATOM 0 HB2 PRO A 26 4.277 2.516 14.024 1.00 0.00 H new ATOM 0 HB3 PRO A 26 3.526 1.716 15.391 1.00 0.00 H new ATOM 0 HG2 PRO A 26 5.507 0.614 13.408 1.00 0.00 H new ATOM 0 HG3 PRO A 26 5.463 0.410 15.147 1.00 0.00 H new ATOM 0 HD2 PRO A 26 4.551 -1.524 13.460 1.00 0.00 H new ATOM 0 HD3 PRO A 26 3.839 -1.281 15.043 1.00 0.00 H new ATOM 374 N CYS A 27 2.779 3.068 12.001 1.00 0.00 N ATOM 375 CA CYS A 27 2.903 3.768 10.728 1.00 0.00 C ATOM 376 C CYS A 27 3.215 5.245 10.948 1.00 0.00 C ATOM 377 O CYS A 27 2.351 6.015 11.367 1.00 0.00 O ATOM 378 CB CYS A 27 1.617 3.622 9.914 1.00 0.00 C ATOM 379 SG CYS A 27 1.451 4.824 8.573 1.00 0.00 S ATOM 0 H CYS A 27 2.654 3.679 12.808 1.00 0.00 H new ATOM 0 HA CYS A 27 3.728 3.319 10.174 1.00 0.00 H new ATOM 0 HB2 CYS A 27 1.578 2.617 9.494 1.00 0.00 H new ATOM 0 HB3 CYS A 27 0.763 3.721 10.584 1.00 0.00 H new ATOM 0 HG CYS A 27 0.250 4.760 8.079 1.00 0.00 H new ATOM 385 N GLN A 28 4.455 5.632 10.665 1.00 0.00 N ATOM 386 CA GLN A 28 4.880 7.016 10.835 1.00 0.00 C ATOM 387 C GLN A 28 5.679 7.492 9.626 1.00 0.00 C ATOM 388 O GLN A 28 5.188 8.280 8.817 1.00 0.00 O ATOM 389 CB GLN A 28 5.720 7.161 12.105 1.00 0.00 C ATOM 390 CG GLN A 28 4.971 6.792 13.375 1.00 0.00 C ATOM 391 CD GLN A 28 4.142 7.939 13.918 1.00 0.00 C ATOM 392 OE1 GLN A 28 4.444 9.108 13.675 1.00 0.00 O ATOM 393 NE2 GLN A 28 3.088 7.611 14.657 1.00 0.00 N ATOM 0 H GLN A 28 5.182 5.007 10.317 1.00 0.00 H new ATOM 0 HA GLN A 28 3.988 7.636 10.925 1.00 0.00 H new ATOM 0 HB2 GLN A 28 6.605 6.531 12.019 1.00 0.00 H new ATOM 0 HB3 GLN A 28 6.068 8.191 12.185 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.320 5.941 13.174 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.686 6.474 14.134 1.00 0.00 H new ATOM 0 HE21 GLN A 28 2.874 6.629 14.833 1.00 0.00 H new ATOM 0 HE22 GLN A 28 2.492 8.341 15.048 1.00 0.00 H new ATOM 402 N ASP A 29 6.911 7.009 9.509 1.00 0.00 N ATOM 403 CA ASP A 29 7.777 7.385 8.398 1.00 0.00 C ATOM 404 C ASP A 29 7.750 6.322 7.304 1.00 0.00 C ATOM 405 O ASP A 29 7.013 5.340 7.396 1.00 0.00 O ATOM 406 CB ASP A 29 9.211 7.593 8.889 1.00 0.00 C ATOM 407 CG ASP A 29 9.988 8.558 8.016 1.00 0.00 C ATOM 408 OD1 ASP A 29 9.439 9.628 7.681 1.00 0.00 O ATOM 409 OD2 ASP A 29 11.145 8.242 7.666 1.00 0.00 O ATOM 0 H ASP A 29 7.332 6.356 10.170 1.00 0.00 H new ATOM 0 HA ASP A 29 7.405 8.320 7.980 1.00 0.00 H new ATOM 0 HB2 ASP A 29 9.191 7.969 9.912 1.00 0.00 H new ATOM 0 HB3 ASP A 29 9.727 6.633 8.912 1.00 0.00 H new ATOM 414 N VAL A 30 8.558 6.525 6.269 1.00 0.00 N ATOM 415 CA VAL A 30 8.627 5.585 5.156 1.00 0.00 C ATOM 416 C VAL A 30 9.507 4.389 5.502 1.00 0.00 C ATOM 417 O VAL A 30 9.187 3.250 5.163 1.00 0.00 O ATOM 418 CB VAL A 30 9.172 6.260 3.884 1.00 0.00 C ATOM 419 CG1 VAL A 30 8.591 7.657 3.729 1.00 0.00 C ATOM 420 CG2 VAL A 30 10.692 6.306 3.916 1.00 0.00 C ATOM 0 H VAL A 30 9.175 7.332 6.178 1.00 0.00 H new ATOM 0 HA VAL A 30 7.610 5.242 4.967 1.00 0.00 H new ATOM 0 HB VAL A 30 8.867 5.669 3.021 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.988 8.118 2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.505 7.594 3.657 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.863 8.262 4.594 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.061 6.786 3.010 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.021 6.874 4.787 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.086 5.291 3.975 1.00 0.00 H new ATOM 430 N LYS A 31 10.619 4.656 6.179 1.00 0.00 N ATOM 431 CA LYS A 31 11.547 3.603 6.573 1.00 0.00 C ATOM 432 C LYS A 31 10.917 2.685 7.616 1.00 0.00 C ATOM 433 O LYS A 31 11.428 1.599 7.888 1.00 0.00 O ATOM 434 CB LYS A 31 12.837 4.212 7.127 1.00 0.00 C ATOM 435 CG LYS A 31 13.412 5.315 6.255 1.00 0.00 C ATOM 436 CD LYS A 31 14.931 5.319 6.290 1.00 0.00 C ATOM 437 CE LYS A 31 15.461 6.228 7.388 1.00 0.00 C ATOM 438 NZ LYS A 31 15.156 5.695 8.745 1.00 0.00 N ATOM 0 H LYS A 31 10.899 5.594 6.466 1.00 0.00 H new ATOM 0 HA LYS A 31 11.783 3.011 5.688 1.00 0.00 H new ATOM 0 HB2 LYS A 31 12.642 4.611 8.122 1.00 0.00 H new ATOM 0 HB3 LYS A 31 13.582 3.424 7.240 1.00 0.00 H new ATOM 0 HG2 LYS A 31 13.071 5.183 5.228 1.00 0.00 H new ATOM 0 HG3 LYS A 31 13.037 6.281 6.594 1.00 0.00 H new ATOM 0 HD2 LYS A 31 15.295 4.304 6.449 1.00 0.00 H new ATOM 0 HD3 LYS A 31 15.317 5.648 5.325 1.00 0.00 H new ATOM 0 HE2 LYS A 31 16.539 6.342 7.276 1.00 0.00 H new ATOM 0 HE3 LYS A 31 15.023 7.220 7.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 15.774 6.153 9.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 14.162 5.891 8.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 15.319 4.668 8.759 1.00 0.00 H new ATOM 452 N GLN A 32 9.805 3.128 8.194 1.00 0.00 N ATOM 453 CA GLN A 32 9.106 2.345 9.206 1.00 0.00 C ATOM 454 C GLN A 32 8.072 1.426 8.564 1.00 0.00 C ATOM 455 O GLN A 32 7.742 0.371 9.108 1.00 0.00 O ATOM 456 CB GLN A 32 8.426 3.270 10.217 1.00 0.00 C ATOM 457 CG GLN A 32 9.361 3.776 11.303 1.00 0.00 C ATOM 458 CD GLN A 32 8.659 4.667 12.309 1.00 0.00 C ATOM 459 OE1 GLN A 32 9.148 5.746 12.646 1.00 0.00 O ATOM 460 NE2 GLN A 32 7.507 4.221 12.793 1.00 0.00 N ATOM 0 H GLN A 32 9.369 4.025 7.979 1.00 0.00 H new ATOM 0 HA GLN A 32 9.841 1.729 9.725 1.00 0.00 H new ATOM 0 HB2 GLN A 32 8.002 4.123 9.688 1.00 0.00 H new ATOM 0 HB3 GLN A 32 7.596 2.738 10.682 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.802 2.925 11.822 1.00 0.00 H new ATOM 0 HG3 GLN A 32 10.180 4.329 10.843 1.00 0.00 H new ATOM 0 HE21 GLN A 32 7.139 3.321 12.486 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.989 4.778 13.473 1.00 0.00 H new ATOM 469 N LEU A 33 7.564 1.832 7.406 1.00 0.00 N ATOM 470 CA LEU A 33 6.566 1.045 6.690 1.00 0.00 C ATOM 471 C LEU A 33 7.227 0.143 5.652 1.00 0.00 C ATOM 472 O LEU A 33 6.699 -0.914 5.306 1.00 0.00 O ATOM 473 CB LEU A 33 5.553 1.967 6.010 1.00 0.00 C ATOM 474 CG LEU A 33 4.671 2.798 6.942 1.00 0.00 C ATOM 475 CD1 LEU A 33 4.044 3.961 6.188 1.00 0.00 C ATOM 476 CD2 LEU A 33 3.594 1.929 7.574 1.00 0.00 C ATOM 0 H LEU A 33 7.827 2.702 6.943 1.00 0.00 H new ATOM 0 HA LEU A 33 6.047 0.416 7.413 1.00 0.00 H new ATOM 0 HB2 LEU A 33 6.095 2.647 5.353 1.00 0.00 H new ATOM 0 HB3 LEU A 33 4.907 1.359 5.377 1.00 0.00 H new ATOM 0 HG LEU A 33 5.297 3.202 7.737 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.420 4.541 6.868 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.830 4.599 5.784 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.432 3.578 5.371 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.976 2.538 8.234 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.971 1.495 6.792 1.00 0.00 H new ATOM 0 HD23 LEU A 33 4.062 1.130 8.150 1.00 0.00 H new ATOM 488 N THR A 34 8.387 0.566 5.161 1.00 0.00 N ATOM 489 CA THR A 34 9.121 -0.203 4.164 1.00 0.00 C ATOM 490 C THR A 34 9.056 -1.696 4.464 1.00 0.00 C ATOM 491 O THR A 34 9.088 -2.524 3.554 1.00 0.00 O ATOM 492 CB THR A 34 10.597 0.231 4.094 1.00 0.00 C ATOM 493 OG1 THR A 34 11.126 0.385 5.416 1.00 0.00 O ATOM 494 CG2 THR A 34 10.742 1.538 3.330 1.00 0.00 C ATOM 0 H THR A 34 8.839 1.438 5.438 1.00 0.00 H new ATOM 0 HA THR A 34 8.647 -0.007 3.202 1.00 0.00 H new ATOM 0 HB THR A 34 11.155 -0.543 3.567 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.065 0.660 5.363 1.00 0.00 H new ATOM 0 HG21 THR A 34 11.793 1.824 3.294 1.00 0.00 H new ATOM 0 HG22 THR A 34 10.366 1.410 2.315 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.171 2.319 3.833 1.00 0.00 H new ATOM 502 N ASN A 35 8.963 -2.034 5.746 1.00 0.00 N ATOM 503 CA ASN A 35 8.893 -3.428 6.166 1.00 0.00 C ATOM 504 C ASN A 35 7.824 -4.180 5.379 1.00 0.00 C ATOM 505 O ASN A 35 8.064 -5.278 4.878 1.00 0.00 O ATOM 506 CB ASN A 35 8.596 -3.517 7.665 1.00 0.00 C ATOM 507 CG ASN A 35 9.343 -2.468 8.465 1.00 0.00 C ATOM 508 OD1 ASN A 35 9.965 -1.567 7.901 1.00 0.00 O ATOM 509 ND2 ASN A 35 9.285 -2.580 9.787 1.00 0.00 N ATOM 0 H ASN A 35 8.934 -1.361 6.512 1.00 0.00 H new ATOM 0 HA ASN A 35 9.859 -3.891 5.966 1.00 0.00 H new ATOM 0 HB2 ASN A 35 7.525 -3.400 7.828 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.867 -4.508 8.028 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.768 -1.903 10.378 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.758 -3.343 10.212 1.00 0.00 H new ATOM 516 N GLY A 36 6.641 -3.581 5.275 1.00 0.00 N ATOM 517 CA GLY A 36 5.553 -4.207 4.548 1.00 0.00 C ATOM 518 C GLY A 36 4.459 -4.714 5.465 1.00 0.00 C ATOM 519 O GLY A 36 3.289 -4.758 5.084 1.00 0.00 O ATOM 0 H GLY A 36 6.417 -2.673 5.682 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.130 -3.490 3.845 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.944 -5.037 3.960 1.00 0.00 H new ATOM 523 N VAL A 37 4.838 -5.101 6.679 1.00 0.00 N ATOM 524 CA VAL A 37 3.880 -5.608 7.654 1.00 0.00 C ATOM 525 C VAL A 37 2.613 -4.761 7.672 1.00 0.00 C ATOM 526 O VAL A 37 1.511 -5.266 7.451 1.00 0.00 O ATOM 527 CB VAL A 37 4.483 -5.639 9.071 1.00 0.00 C ATOM 528 CG1 VAL A 37 3.523 -6.302 10.047 1.00 0.00 C ATOM 529 CG2 VAL A 37 5.826 -6.354 9.062 1.00 0.00 C ATOM 0 H VAL A 37 5.802 -5.073 7.011 1.00 0.00 H new ATOM 0 HA VAL A 37 3.630 -6.625 7.351 1.00 0.00 H new ATOM 0 HB VAL A 37 4.645 -4.613 9.400 1.00 0.00 H new ATOM 0 HG11 VAL A 37 3.967 -6.314 11.042 1.00 0.00 H new ATOM 0 HG12 VAL A 37 2.588 -5.743 10.074 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.325 -7.325 9.725 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.238 -6.367 10.071 1.00 0.00 H new ATOM 0 HG22 VAL A 37 5.691 -7.377 8.712 1.00 0.00 H new ATOM 0 HG23 VAL A 37 6.512 -5.831 8.396 1.00 0.00 H new ATOM 539 N THR A 38 2.775 -3.468 7.935 1.00 0.00 N ATOM 540 CA THR A 38 1.645 -2.549 7.982 1.00 0.00 C ATOM 541 C THR A 38 0.779 -2.679 6.734 1.00 0.00 C ATOM 542 O THR A 38 -0.401 -3.019 6.818 1.00 0.00 O ATOM 543 CB THR A 38 2.113 -1.088 8.118 1.00 0.00 C ATOM 544 OG1 THR A 38 3.246 -1.017 8.991 1.00 0.00 O ATOM 545 CG2 THR A 38 0.995 -0.209 8.658 1.00 0.00 C ATOM 0 H THR A 38 3.679 -3.033 8.119 1.00 0.00 H new ATOM 0 HA THR A 38 1.057 -2.817 8.860 1.00 0.00 H new ATOM 0 HB THR A 38 2.393 -0.725 7.129 1.00 0.00 H new ATOM 0 HG1 THR A 38 3.097 -0.321 9.664 1.00 0.00 H new ATOM 0 HG21 THR A 38 1.350 0.818 8.745 1.00 0.00 H new ATOM 0 HG22 THR A 38 0.145 -0.243 7.977 1.00 0.00 H new ATOM 0 HG23 THR A 38 0.689 -0.572 9.639 1.00 0.00 H new ATOM 553 N MET A 39 1.372 -2.406 5.577 1.00 0.00 N ATOM 554 CA MET A 39 0.654 -2.494 4.310 1.00 0.00 C ATOM 555 C MET A 39 -0.101 -3.815 4.204 1.00 0.00 C ATOM 556 O MET A 39 -1.238 -3.855 3.737 1.00 0.00 O ATOM 557 CB MET A 39 1.626 -2.353 3.137 1.00 0.00 C ATOM 558 CG MET A 39 2.210 -0.956 2.997 1.00 0.00 C ATOM 559 SD MET A 39 3.736 -0.744 3.933 1.00 0.00 S ATOM 560 CE MET A 39 4.957 -1.156 2.688 1.00 0.00 C ATOM 0 H MET A 39 2.348 -2.122 5.490 1.00 0.00 H new ATOM 0 HA MET A 39 -0.069 -1.679 4.273 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.440 -3.067 3.262 1.00 0.00 H new ATOM 0 HB3 MET A 39 1.110 -2.616 2.214 1.00 0.00 H new ATOM 0 HG2 MET A 39 2.403 -0.751 1.944 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.476 -0.224 3.335 1.00 0.00 H new ATOM 0 HE1 MET A 39 5.928 -1.297 3.163 1.00 0.00 H new ATOM 0 HE2 MET A 39 4.664 -2.075 2.181 1.00 0.00 H new ATOM 0 HE3 MET A 39 5.023 -0.346 1.961 1.00 0.00 H new ATOM 570 N ALA A 40 0.541 -4.894 4.641 1.00 0.00 N ATOM 571 CA ALA A 40 -0.071 -6.217 4.596 1.00 0.00 C ATOM 572 C ALA A 40 -1.340 -6.263 5.441 1.00 0.00 C ATOM 573 O ALA A 40 -2.426 -6.533 4.930 1.00 0.00 O ATOM 574 CB ALA A 40 0.918 -7.272 5.068 1.00 0.00 C ATOM 0 H ALA A 40 1.484 -4.878 5.030 1.00 0.00 H new ATOM 0 HA ALA A 40 -0.346 -6.429 3.563 1.00 0.00 H new ATOM 0 HB1 ALA A 40 0.448 -8.255 5.029 1.00 0.00 H new ATOM 0 HB2 ALA A 40 1.795 -7.264 4.421 1.00 0.00 H new ATOM 0 HB3 ALA A 40 1.221 -7.055 6.092 1.00 0.00 H new ATOM 580 N GLN A 41 -1.193 -5.999 6.736 1.00 0.00 N ATOM 581 CA GLN A 41 -2.328 -6.013 7.651 1.00 0.00 C ATOM 582 C GLN A 41 -3.448 -5.110 7.143 1.00 0.00 C ATOM 583 O GLN A 41 -4.623 -5.339 7.430 1.00 0.00 O ATOM 584 CB GLN A 41 -1.890 -5.567 9.047 1.00 0.00 C ATOM 585 CG GLN A 41 -0.928 -6.532 9.720 1.00 0.00 C ATOM 586 CD GLN A 41 -0.881 -6.355 11.225 1.00 0.00 C ATOM 587 OE1 GLN A 41 0.326 -6.292 11.776 1.00 0.00 O flip ATOM 588 NE2 GLN A 41 -1.917 -6.275 11.885 1.00 0.00 N flip ATOM 0 H GLN A 41 -0.300 -5.773 7.174 1.00 0.00 H new ATOM 0 HA GLN A 41 -2.706 -7.034 7.706 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.418 -4.587 8.975 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -2.773 -5.450 9.675 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -1.224 -7.555 9.487 1.00 0.00 H new ATOM 0 HG3 GLN A 41 0.071 -6.388 9.310 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -2.823 -6.328 11.420 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -1.869 -6.155 12.897 1.00 0.00 H new ATOM 597 N VAL A 42 -3.075 -4.081 6.388 1.00 0.00 N ATOM 598 CA VAL A 42 -4.048 -3.143 5.840 1.00 0.00 C ATOM 599 C VAL A 42 -4.783 -3.748 4.649 1.00 0.00 C ATOM 600 O VAL A 42 -5.989 -3.554 4.486 1.00 0.00 O ATOM 601 CB VAL A 42 -3.374 -1.830 5.400 1.00 0.00 C ATOM 602 CG1 VAL A 42 -4.278 -1.058 4.451 1.00 0.00 C ATOM 603 CG2 VAL A 42 -3.015 -0.984 6.613 1.00 0.00 C ATOM 0 H VAL A 42 -2.107 -3.876 6.142 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.763 -2.928 6.634 1.00 0.00 H new ATOM 0 HB VAL A 42 -2.454 -2.074 4.869 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.785 -0.133 4.151 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.481 -1.664 3.568 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.216 -0.823 4.953 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.540 -0.060 6.284 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.920 -0.747 7.172 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.328 -1.538 7.252 1.00 0.00 H new ATOM 613 N LEU A 43 -4.050 -4.482 3.819 1.00 0.00 N ATOM 614 CA LEU A 43 -4.633 -5.116 2.642 1.00 0.00 C ATOM 615 C LEU A 43 -5.727 -6.102 3.040 1.00 0.00 C ATOM 616 O LEU A 43 -6.723 -6.258 2.333 1.00 0.00 O ATOM 617 CB LEU A 43 -3.549 -5.837 1.838 1.00 0.00 C ATOM 618 CG LEU A 43 -2.712 -4.962 0.904 1.00 0.00 C ATOM 619 CD1 LEU A 43 -1.403 -5.653 0.556 1.00 0.00 C ATOM 620 CD2 LEU A 43 -3.494 -4.630 -0.358 1.00 0.00 C ATOM 0 H LEU A 43 -3.052 -4.653 3.939 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.079 -4.337 2.023 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.877 -6.334 2.537 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.024 -6.617 1.243 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.481 -4.030 1.420 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -0.821 -5.016 -0.109 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.836 -5.839 1.468 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.613 -6.600 0.059 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.883 -4.007 -1.011 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.756 -5.552 -0.877 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.404 -4.093 -0.091 1.00 0.00 H new ATOM 632 N HIS A 44 -5.536 -6.762 4.177 1.00 0.00 N ATOM 633 CA HIS A 44 -6.509 -7.731 4.671 1.00 0.00 C ATOM 634 C HIS A 44 -7.836 -7.052 4.994 1.00 0.00 C ATOM 635 O HIS A 44 -8.896 -7.670 4.911 1.00 0.00 O ATOM 636 CB HIS A 44 -5.969 -8.439 5.914 1.00 0.00 C ATOM 637 CG HIS A 44 -6.974 -9.325 6.583 1.00 0.00 C ATOM 638 ND1 HIS A 44 -6.994 -10.695 6.423 1.00 0.00 N ATOM 639 CD2 HIS A 44 -7.997 -9.030 7.418 1.00 0.00 C ATOM 640 CE1 HIS A 44 -7.987 -11.204 7.131 1.00 0.00 C ATOM 641 NE2 HIS A 44 -8.611 -10.214 7.744 1.00 0.00 N ATOM 0 H HIS A 44 -4.717 -6.644 4.774 1.00 0.00 H new ATOM 0 HA HIS A 44 -6.680 -8.469 3.887 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -5.101 -9.035 5.634 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -5.625 -7.690 6.628 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -6.344 -11.231 5.848 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -8.278 -8.046 7.764 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -8.244 -12.251 7.197 1.00 0.00 H new ATOM 650 N GLN A 45 -7.768 -5.777 5.365 1.00 0.00 N ATOM 651 CA GLN A 45 -8.965 -5.015 5.702 1.00 0.00 C ATOM 652 C GLN A 45 -9.727 -4.613 4.444 1.00 0.00 C ATOM 653 O GLN A 45 -10.944 -4.430 4.476 1.00 0.00 O ATOM 654 CB GLN A 45 -8.591 -3.769 6.506 1.00 0.00 C ATOM 655 CG GLN A 45 -7.712 -4.063 7.711 1.00 0.00 C ATOM 656 CD GLN A 45 -7.927 -3.079 8.844 1.00 0.00 C ATOM 657 OE1 GLN A 45 -8.791 -2.205 8.768 1.00 0.00 O ATOM 658 NE2 GLN A 45 -7.139 -3.215 9.904 1.00 0.00 N ATOM 0 H GLN A 45 -6.898 -5.251 5.440 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.611 -5.650 6.308 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -8.074 -3.067 5.852 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -9.503 -3.277 6.844 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -7.917 -5.072 8.068 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.665 -4.038 7.407 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.436 -3.954 9.925 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.237 -2.581 10.697 1.00 0.00 H new ATOM 667 N ILE A 46 -9.003 -4.477 3.338 1.00 0.00 N ATOM 668 CA ILE A 46 -9.612 -4.098 2.069 1.00 0.00 C ATOM 669 C ILE A 46 -10.524 -5.202 1.545 1.00 0.00 C ATOM 670 O ILE A 46 -11.659 -4.945 1.143 1.00 0.00 O ATOM 671 CB ILE A 46 -8.545 -3.781 1.005 1.00 0.00 C ATOM 672 CG1 ILE A 46 -7.635 -2.647 1.485 1.00 0.00 C ATOM 673 CG2 ILE A 46 -9.205 -3.414 -0.316 1.00 0.00 C ATOM 674 CD1 ILE A 46 -6.500 -2.340 0.534 1.00 0.00 C ATOM 0 H ILE A 46 -7.994 -4.624 3.295 1.00 0.00 H new ATOM 0 HA ILE A 46 -10.203 -3.202 2.258 1.00 0.00 H new ATOM 0 HB ILE A 46 -7.935 -4.671 0.849 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -8.233 -1.747 1.626 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.221 -2.911 2.458 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.437 -3.193 -1.057 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -9.814 -4.249 -0.663 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.837 -2.537 -0.176 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -5.897 -1.527 0.938 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -5.878 -3.227 0.411 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -6.906 -2.045 -0.434 1.00 0.00 H new ATOM 686 N ASP A 47 -10.021 -6.431 1.553 1.00 0.00 N ATOM 687 CA ASP A 47 -10.791 -7.576 1.081 1.00 0.00 C ATOM 688 C ASP A 47 -10.237 -8.877 1.654 1.00 0.00 C ATOM 689 O ASP A 47 -9.069 -9.208 1.452 1.00 0.00 O ATOM 690 CB ASP A 47 -10.778 -7.631 -0.447 1.00 0.00 C ATOM 691 CG ASP A 47 -11.974 -8.374 -1.010 1.00 0.00 C ATOM 692 OD1 ASP A 47 -13.085 -8.212 -0.462 1.00 0.00 O ATOM 693 OD2 ASP A 47 -11.799 -9.118 -1.997 1.00 0.00 O ATOM 0 H ASP A 47 -9.083 -6.660 1.881 1.00 0.00 H new ATOM 0 HA ASP A 47 -11.819 -7.458 1.424 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -10.765 -6.616 -0.844 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -9.862 -8.117 -0.782 1.00 0.00 H new ATOM 698 N VAL A 48 -11.083 -9.610 2.371 1.00 0.00 N ATOM 699 CA VAL A 48 -10.679 -10.874 2.973 1.00 0.00 C ATOM 700 C VAL A 48 -10.676 -11.998 1.943 1.00 0.00 C ATOM 701 O VAL A 48 -10.093 -13.058 2.167 1.00 0.00 O ATOM 702 CB VAL A 48 -11.608 -11.263 4.138 1.00 0.00 C ATOM 703 CG1 VAL A 48 -11.291 -10.435 5.374 1.00 0.00 C ATOM 704 CG2 VAL A 48 -13.066 -11.098 3.735 1.00 0.00 C ATOM 0 H VAL A 48 -12.053 -9.349 2.549 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.668 -10.733 3.355 1.00 0.00 H new ATOM 0 HB VAL A 48 -11.438 -12.312 4.380 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -11.958 -10.724 6.186 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -10.257 -10.609 5.673 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -11.430 -9.378 5.149 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -13.708 -11.377 4.570 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -13.253 -10.059 3.465 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -13.282 -11.740 2.881 1.00 0.00 H new ATOM 714 N ALA A 49 -11.331 -11.757 0.812 1.00 0.00 N ATOM 715 CA ALA A 49 -11.402 -12.748 -0.255 1.00 0.00 C ATOM 716 C ALA A 49 -10.059 -12.889 -0.964 1.00 0.00 C ATOM 717 O ALA A 49 -9.693 -13.976 -1.412 1.00 0.00 O ATOM 718 CB ALA A 49 -12.489 -12.374 -1.251 1.00 0.00 C ATOM 0 H ALA A 49 -11.820 -10.885 0.611 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.650 -13.710 0.193 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.531 -13.123 -2.042 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -13.451 -12.331 -0.741 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.265 -11.400 -1.685 1.00 0.00 H new ATOM 724 N TRP A 50 -9.329 -11.784 -1.063 1.00 0.00 N ATOM 725 CA TRP A 50 -8.026 -11.784 -1.718 1.00 0.00 C ATOM 726 C TRP A 50 -6.900 -11.727 -0.692 1.00 0.00 C ATOM 727 O TRP A 50 -5.776 -12.149 -0.965 1.00 0.00 O ATOM 728 CB TRP A 50 -7.916 -10.601 -2.681 1.00 0.00 C ATOM 729 CG TRP A 50 -7.058 -10.885 -3.877 1.00 0.00 C ATOM 730 CD1 TRP A 50 -5.818 -10.375 -4.136 1.00 0.00 C ATOM 731 CD2 TRP A 50 -7.378 -11.746 -4.975 1.00 0.00 C ATOM 732 NE1 TRP A 50 -5.348 -10.867 -5.330 1.00 0.00 N ATOM 733 CE2 TRP A 50 -6.286 -11.710 -5.864 1.00 0.00 C ATOM 734 CE3 TRP A 50 -8.480 -12.544 -5.294 1.00 0.00 C ATOM 735 CZ2 TRP A 50 -6.266 -12.441 -7.049 1.00 0.00 C ATOM 736 CZ3 TRP A 50 -8.459 -13.269 -6.470 1.00 0.00 C ATOM 737 CH2 TRP A 50 -7.358 -13.215 -7.336 1.00 0.00 C ATOM 0 H TRP A 50 -9.617 -10.876 -0.698 1.00 0.00 H new ATOM 0 HA TRP A 50 -7.931 -12.712 -2.282 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -8.914 -10.322 -3.017 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -7.508 -9.743 -2.146 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -5.285 -9.687 -3.497 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.447 -10.641 -5.750 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -9.333 -12.593 -4.633 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -5.419 -12.399 -7.718 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -9.306 -13.888 -6.727 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -7.372 -13.795 -8.247 1.00 0.00 H new ATOM 748 N PHE A 51 -7.209 -11.203 0.490 1.00 0.00 N ATOM 749 CA PHE A 51 -6.221 -11.091 1.558 1.00 0.00 C ATOM 750 C PHE A 51 -6.760 -11.676 2.860 1.00 0.00 C ATOM 751 O PHE A 51 -7.212 -10.945 3.741 1.00 0.00 O ATOM 752 CB PHE A 51 -5.830 -9.626 1.766 1.00 0.00 C ATOM 753 CG PHE A 51 -5.112 -9.024 0.592 1.00 0.00 C ATOM 754 CD1 PHE A 51 -5.819 -8.563 -0.506 1.00 0.00 C ATOM 755 CD2 PHE A 51 -3.731 -8.919 0.588 1.00 0.00 C ATOM 756 CE1 PHE A 51 -5.161 -8.010 -1.588 1.00 0.00 C ATOM 757 CE2 PHE A 51 -3.067 -8.366 -0.491 1.00 0.00 C ATOM 758 CZ PHE A 51 -3.784 -7.910 -1.580 1.00 0.00 C ATOM 0 H PHE A 51 -8.135 -10.850 0.733 1.00 0.00 H new ATOM 0 HA PHE A 51 -5.337 -11.658 1.265 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -6.729 -9.044 1.969 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -5.195 -9.550 2.648 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -6.896 -8.637 -0.517 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -3.166 -9.273 1.438 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -5.724 -7.656 -2.439 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -1.990 -8.291 -0.483 1.00 0.00 H new ATOM 0 HZ PHE A 51 -3.268 -7.476 -2.424 1.00 0.00 H new ATOM 768 N SER A 52 -6.708 -12.999 2.973 1.00 0.00 N ATOM 769 CA SER A 52 -7.194 -13.684 4.165 1.00 0.00 C ATOM 770 C SER A 52 -6.050 -13.966 5.134 1.00 0.00 C ATOM 771 O SER A 52 -4.884 -13.994 4.742 1.00 0.00 O ATOM 772 CB SER A 52 -7.887 -14.993 3.781 1.00 0.00 C ATOM 773 OG SER A 52 -8.823 -15.384 4.770 1.00 0.00 O ATOM 0 H SER A 52 -6.334 -13.618 2.254 1.00 0.00 H new ATOM 0 HA SER A 52 -7.914 -13.032 4.660 1.00 0.00 H new ATOM 0 HB2 SER A 52 -8.394 -14.872 2.824 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.142 -15.778 3.651 1.00 0.00 H new ATOM 0 HG SER A 52 -9.253 -16.222 4.500 1.00 0.00 H new ATOM 779 N GLU A 53 -6.393 -14.175 6.401 1.00 0.00 N ATOM 780 CA GLU A 53 -5.395 -14.455 7.427 1.00 0.00 C ATOM 781 C GLU A 53 -4.337 -15.424 6.906 1.00 0.00 C ATOM 782 O GLU A 53 -3.181 -15.383 7.328 1.00 0.00 O ATOM 783 CB GLU A 53 -6.062 -15.034 8.676 1.00 0.00 C ATOM 784 CG GLU A 53 -6.909 -14.027 9.436 1.00 0.00 C ATOM 785 CD GLU A 53 -7.511 -14.607 10.700 1.00 0.00 C ATOM 786 OE1 GLU A 53 -8.020 -15.747 10.647 1.00 0.00 O ATOM 787 OE2 GLU A 53 -7.474 -13.922 11.743 1.00 0.00 O ATOM 0 H GLU A 53 -7.354 -14.156 6.742 1.00 0.00 H new ATOM 0 HA GLU A 53 -4.907 -13.516 7.688 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -6.689 -15.877 8.385 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -5.292 -15.424 9.341 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -6.296 -13.163 9.693 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -7.709 -13.669 8.788 1.00 0.00 H new ATOM 794 N SER A 54 -4.742 -16.295 5.987 1.00 0.00 N ATOM 795 CA SER A 54 -3.831 -17.278 5.412 1.00 0.00 C ATOM 796 C SER A 54 -2.641 -16.592 4.748 1.00 0.00 C ATOM 797 O SER A 54 -1.498 -17.021 4.903 1.00 0.00 O ATOM 798 CB SER A 54 -4.566 -18.149 4.392 1.00 0.00 C ATOM 799 OG SER A 54 -5.052 -17.371 3.312 1.00 0.00 O ATOM 0 H SER A 54 -5.694 -16.340 5.625 1.00 0.00 H new ATOM 0 HA SER A 54 -3.460 -17.910 6.219 1.00 0.00 H new ATOM 0 HB2 SER A 54 -3.893 -18.919 4.015 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.397 -18.661 4.878 1.00 0.00 H new ATOM 0 HG SER A 54 -5.516 -17.952 2.673 1.00 0.00 H new ATOM 805 N TRP A 55 -2.919 -15.525 4.008 1.00 0.00 N ATOM 806 CA TRP A 55 -1.871 -14.779 3.320 1.00 0.00 C ATOM 807 C TRP A 55 -1.036 -13.974 4.309 1.00 0.00 C ATOM 808 O TRP A 55 0.187 -14.113 4.362 1.00 0.00 O ATOM 809 CB TRP A 55 -2.484 -13.846 2.274 1.00 0.00 C ATOM 810 CG TRP A 55 -1.488 -12.914 1.652 1.00 0.00 C ATOM 811 CD1 TRP A 55 -0.636 -13.194 0.623 1.00 0.00 C ATOM 812 CD2 TRP A 55 -1.241 -11.553 2.023 1.00 0.00 C ATOM 813 NE1 TRP A 55 0.127 -12.088 0.331 1.00 0.00 N ATOM 814 CE2 TRP A 55 -0.226 -11.069 1.175 1.00 0.00 C ATOM 815 CE3 TRP A 55 -1.780 -10.696 2.986 1.00 0.00 C ATOM 816 CZ2 TRP A 55 0.260 -9.767 1.264 1.00 0.00 C ATOM 817 CZ3 TRP A 55 -1.297 -9.405 3.074 1.00 0.00 C ATOM 818 CH2 TRP A 55 -0.286 -8.950 2.216 1.00 0.00 C ATOM 0 H TRP A 55 -3.860 -15.157 3.869 1.00 0.00 H new ATOM 0 HA TRP A 55 -1.218 -15.495 2.821 1.00 0.00 H new ATOM 0 HB2 TRP A 55 -2.948 -14.445 1.491 1.00 0.00 H new ATOM 0 HB3 TRP A 55 -3.277 -13.261 2.740 1.00 0.00 H new ATOM 0 HD1 TRP A 55 -0.571 -14.144 0.113 1.00 0.00 H new ATOM 0 HE1 TRP A 55 0.840 -12.035 -0.396 1.00 0.00 H new ATOM 0 HE3 TRP A 55 -2.561 -11.037 3.650 1.00 0.00 H new ATOM 0 HZ2 TRP A 55 1.040 -9.415 0.605 1.00 0.00 H new ATOM 0 HZ3 TRP A 55 -1.705 -8.735 3.816 1.00 0.00 H new ATOM 0 HH2 TRP A 55 0.069 -7.934 2.308 1.00 0.00 H new ATOM 829 N LEU A 56 -1.702 -13.132 5.092 1.00 0.00 N ATOM 830 CA LEU A 56 -1.020 -12.305 6.081 1.00 0.00 C ATOM 831 C LEU A 56 -0.211 -13.165 7.046 1.00 0.00 C ATOM 832 O LEU A 56 0.716 -12.682 7.696 1.00 0.00 O ATOM 833 CB LEU A 56 -2.035 -11.464 6.858 1.00 0.00 C ATOM 834 CG LEU A 56 -1.457 -10.520 7.913 1.00 0.00 C ATOM 835 CD1 LEU A 56 -0.767 -9.338 7.252 1.00 0.00 C ATOM 836 CD2 LEU A 56 -2.550 -10.042 8.858 1.00 0.00 C ATOM 0 H LEU A 56 -2.713 -13.004 5.061 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.335 -11.642 5.553 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.608 -10.872 6.145 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.736 -12.139 7.348 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.716 -11.068 8.495 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.362 -8.678 8.019 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.044 -9.698 6.618 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.487 -8.790 6.644 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.120 -9.371 9.602 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.315 -9.512 8.291 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.999 -10.900 9.359 1.00 0.00 H new ATOM 848 N SER A 57 -0.566 -14.443 7.132 1.00 0.00 N ATOM 849 CA SER A 57 0.127 -15.371 8.018 1.00 0.00 C ATOM 850 C SER A 57 1.555 -15.616 7.540 1.00 0.00 C ATOM 851 O SER A 57 2.366 -16.211 8.250 1.00 0.00 O ATOM 852 CB SER A 57 -0.631 -16.697 8.095 1.00 0.00 C ATOM 853 OG SER A 57 0.018 -17.606 8.968 1.00 0.00 O ATOM 0 H SER A 57 -1.329 -14.859 6.599 1.00 0.00 H new ATOM 0 HA SER A 57 0.167 -14.924 9.012 1.00 0.00 H new ATOM 0 HB2 SER A 57 -1.649 -16.518 8.442 1.00 0.00 H new ATOM 0 HB3 SER A 57 -0.706 -17.135 7.100 1.00 0.00 H new ATOM 0 HG SER A 57 0.971 -17.384 9.022 1.00 0.00 H new ATOM 859 N ARG A 58 1.855 -15.152 6.331 1.00 0.00 N ATOM 860 CA ARG A 58 3.184 -15.321 5.756 1.00 0.00 C ATOM 861 C ARG A 58 4.061 -14.108 6.049 1.00 0.00 C ATOM 862 O ARG A 58 5.272 -14.136 5.823 1.00 0.00 O ATOM 863 CB ARG A 58 3.085 -15.540 4.245 1.00 0.00 C ATOM 864 CG ARG A 58 2.062 -16.591 3.847 1.00 0.00 C ATOM 865 CD ARG A 58 2.446 -17.968 4.367 1.00 0.00 C ATOM 866 NE ARG A 58 3.490 -18.588 3.555 1.00 0.00 N ATOM 867 CZ ARG A 58 4.149 -19.682 3.916 1.00 0.00 C ATOM 868 NH1 ARG A 58 3.874 -20.275 5.070 1.00 0.00 N ATOM 869 NH2 ARG A 58 5.086 -20.187 3.123 1.00 0.00 N ATOM 0 H ARG A 58 1.196 -14.656 5.731 1.00 0.00 H new ATOM 0 HA ARG A 58 3.642 -16.198 6.214 1.00 0.00 H new ATOM 0 HB2 ARG A 58 2.828 -14.595 3.766 1.00 0.00 H new ATOM 0 HB3 ARG A 58 4.063 -15.835 3.864 1.00 0.00 H new ATOM 0 HG2 ARG A 58 1.083 -16.313 4.238 1.00 0.00 H new ATOM 0 HG3 ARG A 58 1.975 -16.622 2.761 1.00 0.00 H new ATOM 0 HD2 ARG A 58 2.791 -17.883 5.398 1.00 0.00 H new ATOM 0 HD3 ARG A 58 1.565 -18.610 4.377 1.00 0.00 H new ATOM 0 HE ARG A 58 3.726 -18.156 2.661 1.00 0.00 H new ATOM 0 HH11 ARG A 58 3.155 -19.890 5.682 1.00 0.00 H new ATOM 0 HH12 ARG A 58 4.382 -21.116 5.345 1.00 0.00 H new ATOM 0 HH21 ARG A 58 5.301 -19.734 2.235 1.00 0.00 H new ATOM 0 HH22 ARG A 58 5.591 -21.028 3.402 1.00 0.00 H new ATOM 883 N ILE A 59 3.443 -13.044 6.551 1.00 0.00 N ATOM 884 CA ILE A 59 4.167 -11.822 6.874 1.00 0.00 C ATOM 885 C ILE A 59 4.712 -11.866 8.298 1.00 0.00 C ATOM 886 O ILE A 59 4.062 -12.382 9.208 1.00 0.00 O ATOM 887 CB ILE A 59 3.272 -10.578 6.718 1.00 0.00 C ATOM 888 CG1 ILE A 59 2.386 -10.714 5.478 1.00 0.00 C ATOM 889 CG2 ILE A 59 4.123 -9.320 6.632 1.00 0.00 C ATOM 890 CD1 ILE A 59 3.097 -10.375 4.187 1.00 0.00 C ATOM 0 H ILE A 59 2.442 -13.004 6.743 1.00 0.00 H new ATOM 0 HA ILE A 59 4.997 -11.753 6.171 1.00 0.00 H new ATOM 0 HB ILE A 59 2.629 -10.498 7.595 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.011 -11.736 5.419 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.519 -10.063 5.588 1.00 0.00 H new ATOM 0 HG21 ILE A 59 3.476 -8.450 6.522 1.00 0.00 H new ATOM 0 HG22 ILE A 59 4.716 -9.219 7.541 1.00 0.00 H new ATOM 0 HG23 ILE A 59 4.788 -9.389 5.771 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.408 -10.494 3.350 1.00 0.00 H new ATOM 0 HD12 ILE A 59 3.448 -9.344 4.225 1.00 0.00 H new ATOM 0 HD13 ILE A 59 3.948 -11.043 4.054 1.00 0.00 H new ATOM 902 N LYS A 60 5.909 -11.320 8.485 1.00 0.00 N ATOM 903 CA LYS A 60 6.542 -11.294 9.798 1.00 0.00 C ATOM 904 C LYS A 60 6.828 -9.861 10.235 1.00 0.00 C ATOM 905 O LYS A 60 7.121 -8.996 9.409 1.00 0.00 O ATOM 906 CB LYS A 60 7.842 -12.101 9.777 1.00 0.00 C ATOM 907 CG LYS A 60 7.654 -13.565 10.132 1.00 0.00 C ATOM 908 CD LYS A 60 8.884 -14.135 10.819 1.00 0.00 C ATOM 909 CE LYS A 60 9.041 -15.621 10.540 1.00 0.00 C ATOM 910 NZ LYS A 60 9.697 -16.332 11.672 1.00 0.00 N ATOM 0 H LYS A 60 6.460 -10.889 7.743 1.00 0.00 H new ATOM 0 HA LYS A 60 5.854 -11.744 10.514 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.288 -12.031 8.785 1.00 0.00 H new ATOM 0 HB3 LYS A 60 8.549 -11.654 10.476 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.788 -13.674 10.785 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.444 -14.136 9.227 1.00 0.00 H new ATOM 0 HD2 LYS A 60 9.772 -13.604 10.476 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.810 -13.972 11.894 1.00 0.00 H new ATOM 0 HE2 LYS A 60 8.061 -16.061 10.354 1.00 0.00 H new ATOM 0 HE3 LYS A 60 9.630 -15.760 9.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 9.786 -17.343 11.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 10.642 -15.930 11.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 9.122 -16.221 12.531 1.00 0.00 H new ATOM 924 N ASP A 61 6.742 -9.616 11.538 1.00 0.00 N ATOM 925 CA ASP A 61 6.994 -8.288 12.085 1.00 0.00 C ATOM 926 C ASP A 61 8.358 -8.231 12.767 1.00 0.00 C ATOM 927 O ASP A 61 8.816 -7.163 13.172 1.00 0.00 O ATOM 928 CB ASP A 61 5.897 -7.906 13.080 1.00 0.00 C ATOM 929 CG ASP A 61 5.974 -6.451 13.496 1.00 0.00 C ATOM 930 OD1 ASP A 61 5.727 -5.576 12.641 1.00 0.00 O ATOM 931 OD2 ASP A 61 6.282 -6.187 14.678 1.00 0.00 O ATOM 0 H ASP A 61 6.500 -10.320 12.235 1.00 0.00 H new ATOM 0 HA ASP A 61 6.990 -7.576 11.260 1.00 0.00 H new ATOM 0 HB2 ASP A 61 4.922 -8.102 12.634 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.976 -8.538 13.964 1.00 0.00 H new ATOM 936 N ASP A 62 9.000 -9.387 12.891 1.00 0.00 N ATOM 937 CA ASP A 62 10.311 -9.469 13.523 1.00 0.00 C ATOM 938 C ASP A 62 11.319 -8.579 12.802 1.00 0.00 C ATOM 939 O ASP A 62 12.388 -8.278 13.333 1.00 0.00 O ATOM 940 CB ASP A 62 10.807 -10.916 13.534 1.00 0.00 C ATOM 941 CG ASP A 62 11.645 -11.233 14.757 1.00 0.00 C ATOM 942 OD1 ASP A 62 11.162 -10.998 15.884 1.00 0.00 O ATOM 943 OD2 ASP A 62 12.784 -11.715 14.586 1.00 0.00 O ATOM 0 H ASP A 62 8.634 -10.280 12.562 1.00 0.00 H new ATOM 0 HA ASP A 62 10.213 -9.119 14.551 1.00 0.00 H new ATOM 0 HB2 ASP A 62 9.951 -11.590 13.499 1.00 0.00 H new ATOM 0 HB3 ASP A 62 11.396 -11.102 12.636 1.00 0.00 H new ATOM 948 N VAL A 63 10.970 -8.161 11.590 1.00 0.00 N ATOM 949 CA VAL A 63 11.844 -7.305 10.796 1.00 0.00 C ATOM 950 C VAL A 63 12.551 -6.278 11.672 1.00 0.00 C ATOM 951 O VAL A 63 13.636 -5.803 11.338 1.00 0.00 O ATOM 952 CB VAL A 63 11.058 -6.570 9.694 1.00 0.00 C ATOM 953 CG1 VAL A 63 10.255 -7.557 8.861 1.00 0.00 C ATOM 954 CG2 VAL A 63 10.151 -5.511 10.303 1.00 0.00 C ATOM 0 H VAL A 63 10.089 -8.401 11.136 1.00 0.00 H new ATOM 0 HA VAL A 63 12.586 -7.954 10.332 1.00 0.00 H new ATOM 0 HB VAL A 63 11.769 -6.071 9.036 1.00 0.00 H new ATOM 0 HG11 VAL A 63 9.707 -7.019 8.088 1.00 0.00 H new ATOM 0 HG12 VAL A 63 10.931 -8.274 8.394 1.00 0.00 H new ATOM 0 HG13 VAL A 63 9.551 -8.087 9.503 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.603 -5.002 9.510 1.00 0.00 H new ATOM 0 HG22 VAL A 63 9.445 -5.985 10.985 1.00 0.00 H new ATOM 0 HG23 VAL A 63 10.754 -4.787 10.851 1.00 0.00 H new ATOM 964 N GLY A 64 11.929 -5.939 12.797 1.00 0.00 N ATOM 965 CA GLY A 64 12.514 -4.970 13.706 1.00 0.00 C ATOM 966 C GLY A 64 14.029 -4.997 13.685 1.00 0.00 C ATOM 967 O GLY A 64 14.673 -3.972 13.462 1.00 0.00 O ATOM 0 H GLY A 64 11.030 -6.318 13.095 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.168 -3.971 13.440 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.164 -5.169 14.719 1.00 0.00 H new ATOM 971 N ASP A 65 14.601 -6.173 13.921 1.00 0.00 N ATOM 972 CA ASP A 65 16.051 -6.330 13.929 1.00 0.00 C ATOM 973 C ASP A 65 16.527 -7.047 12.670 1.00 0.00 C ATOM 974 O ASP A 65 17.728 -7.163 12.427 1.00 0.00 O ATOM 975 CB ASP A 65 16.494 -7.106 15.171 1.00 0.00 C ATOM 976 CG ASP A 65 17.955 -6.877 15.506 1.00 0.00 C ATOM 977 OD1 ASP A 65 18.365 -5.701 15.600 1.00 0.00 O ATOM 978 OD2 ASP A 65 18.688 -7.873 15.674 1.00 0.00 O ATOM 0 H ASP A 65 14.083 -7.031 14.109 1.00 0.00 H new ATOM 0 HA ASP A 65 16.499 -5.337 13.951 1.00 0.00 H new ATOM 0 HB2 ASP A 65 15.879 -6.809 16.020 1.00 0.00 H new ATOM 0 HB3 ASP A 65 16.323 -8.171 15.011 1.00 0.00 H new ATOM 983 N ASN A 66 15.578 -7.525 11.872 1.00 0.00 N ATOM 984 CA ASN A 66 15.901 -8.232 10.638 1.00 0.00 C ATOM 985 C ASN A 66 15.468 -7.424 9.419 1.00 0.00 C ATOM 986 O ASN A 66 14.315 -7.004 9.318 1.00 0.00 O ATOM 987 CB ASN A 66 15.225 -9.605 10.620 1.00 0.00 C ATOM 988 CG ASN A 66 16.111 -10.693 11.196 1.00 0.00 C ATOM 989 OD1 ASN A 66 17.325 -10.694 10.990 1.00 0.00 O ATOM 990 ND2 ASN A 66 15.506 -11.626 11.921 1.00 0.00 N ATOM 0 H ASN A 66 14.579 -7.436 12.058 1.00 0.00 H new ATOM 0 HA ASN A 66 16.982 -8.366 10.598 1.00 0.00 H new ATOM 0 HB2 ASN A 66 14.296 -9.557 11.189 1.00 0.00 H new ATOM 0 HB3 ASN A 66 14.958 -9.862 9.595 1.00 0.00 H new ATOM 0 HD21 ASN A 66 16.050 -12.384 12.334 1.00 0.00 H new ATOM 0 HD22 ASN A 66 14.497 -11.585 12.066 1.00 0.00 H new ATOM 997 N TRP A 67 16.398 -7.211 8.496 1.00 0.00 N ATOM 998 CA TRP A 67 16.113 -6.454 7.283 1.00 0.00 C ATOM 999 C TRP A 67 15.716 -7.383 6.142 1.00 0.00 C ATOM 1000 O TRP A 67 14.967 -6.995 5.244 1.00 0.00 O ATOM 1001 CB TRP A 67 17.330 -5.621 6.878 1.00 0.00 C ATOM 1002 CG TRP A 67 18.501 -6.451 6.448 1.00 0.00 C ATOM 1003 CD1 TRP A 67 19.566 -6.828 7.215 1.00 0.00 C ATOM 1004 CD2 TRP A 67 18.726 -7.006 5.147 1.00 0.00 C ATOM 1005 NE1 TRP A 67 20.439 -7.583 6.471 1.00 0.00 N ATOM 1006 CE2 TRP A 67 19.947 -7.707 5.198 1.00 0.00 C ATOM 1007 CE3 TRP A 67 18.015 -6.980 3.944 1.00 0.00 C ATOM 1008 CZ2 TRP A 67 20.469 -8.374 4.093 1.00 0.00 C ATOM 1009 CZ3 TRP A 67 18.535 -7.641 2.848 1.00 0.00 C ATOM 1010 CH2 TRP A 67 19.751 -8.332 2.929 1.00 0.00 C ATOM 0 H TRP A 67 17.357 -7.552 8.564 1.00 0.00 H new ATOM 0 HA TRP A 67 15.277 -5.786 7.491 1.00 0.00 H new ATOM 0 HB2 TRP A 67 17.049 -4.952 6.064 1.00 0.00 H new ATOM 0 HB3 TRP A 67 17.628 -4.993 7.718 1.00 0.00 H new ATOM 0 HD1 TRP A 67 19.702 -6.570 8.255 1.00 0.00 H new ATOM 0 HE1 TRP A 67 21.312 -7.986 6.811 1.00 0.00 H new ATOM 0 HE3 TRP A 67 17.075 -6.452 3.872 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 21.407 -8.906 4.152 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 17.995 -7.625 1.913 1.00 0.00 H new ATOM 0 HH2 TRP A 67 20.129 -8.842 2.055 1.00 0.00 H new ATOM 1021 N ARG A 68 16.221 -8.612 6.182 1.00 0.00 N ATOM 1022 CA ARG A 68 15.918 -9.596 5.149 1.00 0.00 C ATOM 1023 C ARG A 68 14.444 -9.988 5.187 1.00 0.00 C ATOM 1024 O ARG A 68 13.833 -10.242 4.149 1.00 0.00 O ATOM 1025 CB ARG A 68 16.792 -10.839 5.328 1.00 0.00 C ATOM 1026 CG ARG A 68 18.240 -10.630 4.916 1.00 0.00 C ATOM 1027 CD ARG A 68 18.451 -10.943 3.443 1.00 0.00 C ATOM 1028 NE ARG A 68 19.836 -11.302 3.152 1.00 0.00 N ATOM 1029 CZ ARG A 68 20.393 -12.448 3.528 1.00 0.00 C ATOM 1030 NH1 ARG A 68 19.685 -13.342 4.205 1.00 0.00 N ATOM 1031 NH2 ARG A 68 21.659 -12.703 3.226 1.00 0.00 N ATOM 0 H ARG A 68 16.841 -8.950 6.918 1.00 0.00 H new ATOM 0 HA ARG A 68 16.131 -9.146 4.179 1.00 0.00 H new ATOM 0 HB2 ARG A 68 16.761 -11.147 6.373 1.00 0.00 H new ATOM 0 HB3 ARG A 68 16.371 -11.656 4.742 1.00 0.00 H new ATOM 0 HG2 ARG A 68 18.531 -9.599 5.115 1.00 0.00 H new ATOM 0 HG3 ARG A 68 18.887 -11.266 5.520 1.00 0.00 H new ATOM 0 HD2 ARG A 68 17.795 -11.762 3.149 1.00 0.00 H new ATOM 0 HD3 ARG A 68 18.168 -10.077 2.844 1.00 0.00 H new ATOM 0 HE ARG A 68 20.407 -10.636 2.631 1.00 0.00 H new ATOM 0 HH11 ARG A 68 18.711 -13.150 4.438 1.00 0.00 H new ATOM 0 HH12 ARG A 68 20.115 -14.221 4.493 1.00 0.00 H new ATOM 0 HH21 ARG A 68 22.207 -12.019 2.704 1.00 0.00 H new ATOM 0 HH22 ARG A 68 22.085 -13.583 3.516 1.00 0.00 H new ATOM 1045 N ILE A 69 13.880 -10.035 6.389 1.00 0.00 N ATOM 1046 CA ILE A 69 12.478 -10.396 6.561 1.00 0.00 C ATOM 1047 C ILE A 69 11.562 -9.360 5.919 1.00 0.00 C ATOM 1048 O ILE A 69 10.467 -9.684 5.458 1.00 0.00 O ATOM 1049 CB ILE A 69 12.112 -10.536 8.050 1.00 0.00 C ATOM 1050 CG1 ILE A 69 12.877 -11.703 8.678 1.00 0.00 C ATOM 1051 CG2 ILE A 69 10.612 -10.732 8.210 1.00 0.00 C ATOM 1052 CD1 ILE A 69 12.609 -11.875 10.157 1.00 0.00 C ATOM 0 H ILE A 69 14.372 -9.828 7.258 1.00 0.00 H new ATOM 0 HA ILE A 69 12.336 -11.358 6.069 1.00 0.00 H new ATOM 0 HB ILE A 69 12.396 -9.619 8.567 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.610 -12.623 8.159 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.945 -11.550 8.526 1.00 0.00 H new ATOM 0 HG21 ILE A 69 10.369 -10.829 9.268 1.00 0.00 H new ATOM 0 HG22 ILE A 69 10.086 -9.872 7.794 1.00 0.00 H new ATOM 0 HG23 ILE A 69 10.305 -11.635 7.682 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.184 -12.720 10.535 1.00 0.00 H new ATOM 0 HD12 ILE A 69 12.903 -10.970 10.688 1.00 0.00 H new ATOM 0 HD13 ILE A 69 11.546 -12.059 10.315 1.00 0.00 H new ATOM 1064 N LYS A 70 12.017 -8.112 5.891 1.00 0.00 N ATOM 1065 CA LYS A 70 11.240 -7.027 5.303 1.00 0.00 C ATOM 1066 C LYS A 70 10.885 -7.336 3.852 1.00 0.00 C ATOM 1067 O LYS A 70 9.710 -7.400 3.491 1.00 0.00 O ATOM 1068 CB LYS A 70 12.022 -5.713 5.379 1.00 0.00 C ATOM 1069 CG LYS A 70 11.890 -5.003 6.715 1.00 0.00 C ATOM 1070 CD LYS A 70 12.135 -3.509 6.579 1.00 0.00 C ATOM 1071 CE LYS A 70 13.599 -3.162 6.804 1.00 0.00 C ATOM 1072 NZ LYS A 70 13.885 -2.865 8.234 1.00 0.00 N ATOM 0 H LYS A 70 12.920 -7.827 6.269 1.00 0.00 H new ATOM 0 HA LYS A 70 10.315 -6.926 5.871 1.00 0.00 H new ATOM 0 HB2 LYS A 70 13.076 -5.915 5.187 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.676 -5.048 4.588 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.893 -5.174 7.122 1.00 0.00 H new ATOM 0 HG3 LYS A 70 12.601 -5.426 7.425 1.00 0.00 H new ATOM 0 HD2 LYS A 70 11.830 -3.178 5.586 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.518 -2.971 7.298 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.224 -3.992 6.473 1.00 0.00 H new ATOM 0 HE3 LYS A 70 13.866 -2.299 6.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.893 -2.633 8.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 13.308 -2.057 8.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.655 -3.697 8.814 1.00 0.00 H new ATOM 1086 N ALA A 71 11.907 -7.529 3.026 1.00 0.00 N ATOM 1087 CA ALA A 71 11.702 -7.836 1.616 1.00 0.00 C ATOM 1088 C ALA A 71 10.688 -8.961 1.440 1.00 0.00 C ATOM 1089 O ALA A 71 9.703 -8.814 0.717 1.00 0.00 O ATOM 1090 CB ALA A 71 13.023 -8.207 0.959 1.00 0.00 C ATOM 0 H ALA A 71 12.886 -7.478 3.309 1.00 0.00 H new ATOM 0 HA ALA A 71 11.304 -6.945 1.130 1.00 0.00 H new ATOM 0 HB1 ALA A 71 12.855 -8.434 -0.094 1.00 0.00 H new ATOM 0 HB2 ALA A 71 13.719 -7.372 1.044 1.00 0.00 H new ATOM 0 HB3 ALA A 71 13.444 -9.081 1.456 1.00 0.00 H new ATOM 1096 N SER A 72 10.936 -10.084 2.106 1.00 0.00 N ATOM 1097 CA SER A 72 10.046 -11.236 2.020 1.00 0.00 C ATOM 1098 C SER A 72 8.585 -10.797 2.049 1.00 0.00 C ATOM 1099 O SER A 72 7.755 -11.313 1.301 1.00 0.00 O ATOM 1100 CB SER A 72 10.321 -12.207 3.170 1.00 0.00 C ATOM 1101 OG SER A 72 11.325 -13.143 2.817 1.00 0.00 O ATOM 0 H SER A 72 11.746 -10.221 2.711 1.00 0.00 H new ATOM 0 HA SER A 72 10.237 -11.742 1.073 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.633 -11.650 4.054 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.404 -12.734 3.432 1.00 0.00 H new ATOM 0 HG SER A 72 11.484 -13.751 3.569 1.00 0.00 H new ATOM 1107 N ASN A 73 8.278 -9.840 2.919 1.00 0.00 N ATOM 1108 CA ASN A 73 6.917 -9.331 3.047 1.00 0.00 C ATOM 1109 C ASN A 73 6.559 -8.434 1.866 1.00 0.00 C ATOM 1110 O ASN A 73 5.611 -8.708 1.129 1.00 0.00 O ATOM 1111 CB ASN A 73 6.762 -8.556 4.357 1.00 0.00 C ATOM 1112 CG ASN A 73 7.304 -9.321 5.549 1.00 0.00 C ATOM 1113 OD1 ASN A 73 7.640 -10.500 5.443 1.00 0.00 O ATOM 1114 ND2 ASN A 73 7.390 -8.650 6.692 1.00 0.00 N ATOM 0 H ASN A 73 8.953 -9.402 3.546 1.00 0.00 H new ATOM 0 HA ASN A 73 6.236 -10.182 3.053 1.00 0.00 H new ATOM 0 HB2 ASN A 73 7.281 -7.601 4.275 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.708 -8.332 4.521 1.00 0.00 H new ATOM 0 HD21 ASN A 73 7.746 -9.112 7.529 1.00 0.00 H new ATOM 0 HD22 ASN A 73 7.100 -7.673 6.733 1.00 0.00 H new ATOM 1121 N LEU A 74 7.322 -7.361 1.693 1.00 0.00 N ATOM 1122 CA LEU A 74 7.087 -6.422 0.601 1.00 0.00 C ATOM 1123 C LEU A 74 6.660 -7.157 -0.666 1.00 0.00 C ATOM 1124 O LEU A 74 5.738 -6.731 -1.362 1.00 0.00 O ATOM 1125 CB LEU A 74 8.348 -5.600 0.327 1.00 0.00 C ATOM 1126 CG LEU A 74 8.705 -4.550 1.379 1.00 0.00 C ATOM 1127 CD1 LEU A 74 9.955 -3.787 0.968 1.00 0.00 C ATOM 1128 CD2 LEU A 74 7.541 -3.594 1.596 1.00 0.00 C ATOM 0 H LEU A 74 8.109 -7.119 2.295 1.00 0.00 H new ATOM 0 HA LEU A 74 6.282 -5.751 0.899 1.00 0.00 H new ATOM 0 HB2 LEU A 74 9.190 -6.285 0.226 1.00 0.00 H new ATOM 0 HB3 LEU A 74 8.229 -5.098 -0.633 1.00 0.00 H new ATOM 0 HG LEU A 74 8.909 -5.061 2.320 1.00 0.00 H new ATOM 0 HD11 LEU A 74 10.194 -3.044 1.729 1.00 0.00 H new ATOM 0 HD12 LEU A 74 10.788 -4.482 0.865 1.00 0.00 H new ATOM 0 HD13 LEU A 74 9.780 -3.288 0.015 1.00 0.00 H new ATOM 0 HD21 LEU A 74 7.814 -2.854 2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 74 7.305 -3.089 0.659 1.00 0.00 H new ATOM 0 HD23 LEU A 74 6.670 -4.153 1.936 1.00 0.00 H new ATOM 1140 N LYS A 75 7.334 -8.263 -0.958 1.00 0.00 N ATOM 1141 CA LYS A 75 7.024 -9.061 -2.138 1.00 0.00 C ATOM 1142 C LYS A 75 5.558 -9.481 -2.141 1.00 0.00 C ATOM 1143 O LYS A 75 4.809 -9.155 -3.062 1.00 0.00 O ATOM 1144 CB LYS A 75 7.921 -10.299 -2.193 1.00 0.00 C ATOM 1145 CG LYS A 75 9.288 -10.034 -2.799 1.00 0.00 C ATOM 1146 CD LYS A 75 10.299 -9.630 -1.738 1.00 0.00 C ATOM 1147 CE LYS A 75 11.725 -9.757 -2.250 1.00 0.00 C ATOM 1148 NZ LYS A 75 11.918 -9.035 -3.539 1.00 0.00 N ATOM 0 H LYS A 75 8.100 -8.628 -0.393 1.00 0.00 H new ATOM 0 HA LYS A 75 7.209 -8.447 -3.019 1.00 0.00 H new ATOM 0 HB2 LYS A 75 8.050 -10.689 -1.183 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.420 -11.075 -2.773 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.638 -10.928 -3.315 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.209 -9.245 -3.547 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.112 -8.601 -1.429 1.00 0.00 H new ATOM 0 HD3 LYS A 75 10.171 -10.256 -0.855 1.00 0.00 H new ATOM 0 HE2 LYS A 75 12.415 -9.361 -1.505 1.00 0.00 H new ATOM 0 HE3 LYS A 75 11.970 -10.811 -2.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 12.934 -8.971 -3.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.436 -9.552 -4.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 11.519 -8.078 -3.464 1.00 0.00 H new ATOM 1162 N LYS A 76 5.153 -10.205 -1.103 1.00 0.00 N ATOM 1163 CA LYS A 76 3.776 -10.668 -0.983 1.00 0.00 C ATOM 1164 C LYS A 76 2.799 -9.500 -1.073 1.00 0.00 C ATOM 1165 O LYS A 76 1.756 -9.598 -1.719 1.00 0.00 O ATOM 1166 CB LYS A 76 3.579 -11.410 0.341 1.00 0.00 C ATOM 1167 CG LYS A 76 4.331 -12.728 0.417 1.00 0.00 C ATOM 1168 CD LYS A 76 4.658 -13.100 1.854 1.00 0.00 C ATOM 1169 CE LYS A 76 5.614 -14.282 1.919 1.00 0.00 C ATOM 1170 NZ LYS A 76 7.004 -13.891 1.554 1.00 0.00 N ATOM 0 H LYS A 76 5.760 -10.484 -0.332 1.00 0.00 H new ATOM 0 HA LYS A 76 3.576 -11.351 -1.809 1.00 0.00 H new ATOM 0 HB2 LYS A 76 3.904 -10.768 1.160 1.00 0.00 H new ATOM 0 HB3 LYS A 76 2.516 -11.599 0.487 1.00 0.00 H new ATOM 0 HG2 LYS A 76 3.731 -13.517 -0.037 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.253 -12.656 -0.160 1.00 0.00 H new ATOM 0 HD2 LYS A 76 5.102 -12.243 2.361 1.00 0.00 H new ATOM 0 HD3 LYS A 76 3.739 -13.344 2.386 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.607 -14.700 2.926 1.00 0.00 H new ATOM 0 HE3 LYS A 76 5.268 -15.066 1.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.676 -14.363 2.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.199 -14.177 0.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.109 -12.860 1.641 1.00 0.00 H new ATOM 1184 N VAL A 77 3.145 -8.394 -0.421 1.00 0.00 N ATOM 1185 CA VAL A 77 2.300 -7.206 -0.430 1.00 0.00 C ATOM 1186 C VAL A 77 2.113 -6.674 -1.846 1.00 0.00 C ATOM 1187 O VAL A 77 1.011 -6.286 -2.236 1.00 0.00 O ATOM 1188 CB VAL A 77 2.891 -6.090 0.452 1.00 0.00 C ATOM 1189 CG1 VAL A 77 2.054 -4.824 0.345 1.00 0.00 C ATOM 1190 CG2 VAL A 77 2.992 -6.551 1.898 1.00 0.00 C ATOM 0 H VAL A 77 4.004 -8.296 0.120 1.00 0.00 H new ATOM 0 HA VAL A 77 1.332 -7.504 -0.027 1.00 0.00 H new ATOM 0 HB VAL A 77 3.896 -5.864 0.096 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.487 -4.047 0.975 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.038 -4.485 -0.691 1.00 0.00 H new ATOM 0 HG13 VAL A 77 1.036 -5.032 0.674 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.412 -5.750 2.507 1.00 0.00 H new ATOM 0 HG22 VAL A 77 1.999 -6.807 2.269 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.638 -7.427 1.956 1.00 0.00 H new ATOM 1200 N LEU A 78 3.198 -6.660 -2.614 1.00 0.00 N ATOM 1201 CA LEU A 78 3.155 -6.176 -3.990 1.00 0.00 C ATOM 1202 C LEU A 78 2.350 -7.123 -4.875 1.00 0.00 C ATOM 1203 O LEU A 78 1.328 -6.739 -5.444 1.00 0.00 O ATOM 1204 CB LEU A 78 4.573 -6.024 -4.542 1.00 0.00 C ATOM 1205 CG LEU A 78 4.722 -5.127 -5.772 1.00 0.00 C ATOM 1206 CD1 LEU A 78 6.188 -4.979 -6.149 1.00 0.00 C ATOM 1207 CD2 LEU A 78 3.922 -5.686 -6.939 1.00 0.00 C ATOM 0 H LEU A 78 4.117 -6.978 -2.307 1.00 0.00 H new ATOM 0 HA LEU A 78 2.665 -5.202 -3.992 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.209 -5.629 -3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.952 -7.015 -4.792 1.00 0.00 H new ATOM 0 HG LEU A 78 4.329 -4.140 -5.529 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.275 -4.338 -7.026 1.00 0.00 H new ATOM 0 HD12 LEU A 78 6.734 -4.533 -5.318 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.607 -5.960 -6.374 1.00 0.00 H new ATOM 0 HD21 LEU A 78 4.039 -5.035 -7.806 1.00 0.00 H new ATOM 0 HD22 LEU A 78 4.284 -6.685 -7.183 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.868 -5.739 -6.665 1.00 0.00 H new ATOM 1219 N HIS A 79 2.817 -8.362 -4.984 1.00 0.00 N ATOM 1220 CA HIS A 79 2.140 -9.365 -5.798 1.00 0.00 C ATOM 1221 C HIS A 79 0.683 -9.519 -5.370 1.00 0.00 C ATOM 1222 O HIS A 79 -0.200 -9.723 -6.201 1.00 0.00 O ATOM 1223 CB HIS A 79 2.859 -10.710 -5.692 1.00 0.00 C ATOM 1224 CG HIS A 79 2.555 -11.644 -6.822 1.00 0.00 C ATOM 1225 ND1 HIS A 79 1.585 -12.622 -6.751 1.00 0.00 N ATOM 1226 CD2 HIS A 79 3.097 -11.743 -8.059 1.00 0.00 C ATOM 1227 CE1 HIS A 79 1.546 -13.284 -7.893 1.00 0.00 C ATOM 1228 NE2 HIS A 79 2.453 -12.770 -8.704 1.00 0.00 N ATOM 0 H HIS A 79 3.661 -8.696 -4.519 1.00 0.00 H new ATOM 0 HA HIS A 79 2.163 -9.030 -6.835 1.00 0.00 H new ATOM 0 HB2 HIS A 79 3.934 -10.536 -5.655 1.00 0.00 H new ATOM 0 HB3 HIS A 79 2.581 -11.188 -4.752 1.00 0.00 H new ATOM 0 HD2 HIS A 79 3.888 -11.129 -8.463 1.00 0.00 H new ATOM 0 HE1 HIS A 79 0.885 -14.106 -8.124 1.00 0.00 H new ATOM 0 HE2 HIS A 79 2.644 -13.085 -9.655 1.00 0.00 H new ATOM 1237 N GLY A 80 0.441 -9.419 -4.066 1.00 0.00 N ATOM 1238 CA GLY A 80 -0.909 -9.551 -3.550 1.00 0.00 C ATOM 1239 C GLY A 80 -1.860 -8.533 -4.149 1.00 0.00 C ATOM 1240 O GLY A 80 -3.068 -8.762 -4.206 1.00 0.00 O ATOM 0 H GLY A 80 1.156 -9.249 -3.358 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.278 -10.555 -3.759 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -0.894 -9.436 -2.466 1.00 0.00 H new ATOM 1244 N ILE A 81 -1.314 -7.407 -4.594 1.00 0.00 N ATOM 1245 CA ILE A 81 -2.123 -6.351 -5.191 1.00 0.00 C ATOM 1246 C ILE A 81 -2.200 -6.506 -6.706 1.00 0.00 C ATOM 1247 O ILE A 81 -3.275 -6.407 -7.298 1.00 0.00 O ATOM 1248 CB ILE A 81 -1.562 -4.956 -4.857 1.00 0.00 C ATOM 1249 CG1 ILE A 81 -1.812 -4.620 -3.385 1.00 0.00 C ATOM 1250 CG2 ILE A 81 -2.188 -3.903 -5.760 1.00 0.00 C ATOM 1251 CD1 ILE A 81 -0.745 -3.737 -2.777 1.00 0.00 C ATOM 0 H ILE A 81 -0.316 -7.202 -4.553 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.123 -6.443 -4.768 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.486 -4.963 -5.031 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.778 -4.124 -3.293 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -1.874 -5.547 -2.815 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -1.781 -2.923 -5.512 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -1.963 -4.136 -6.801 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -3.268 -3.895 -5.615 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -0.987 -3.540 -1.733 1.00 0.00 H new ATOM 0 HD12 ILE A 81 0.221 -4.239 -2.837 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -0.698 -2.795 -3.323 1.00 0.00 H new ATOM 1263 N THR A 82 -1.052 -6.753 -7.329 1.00 0.00 N ATOM 1264 CA THR A 82 -0.988 -6.923 -8.775 1.00 0.00 C ATOM 1265 C THR A 82 -1.976 -7.984 -9.247 1.00 0.00 C ATOM 1266 O THR A 82 -2.762 -7.749 -10.165 1.00 0.00 O ATOM 1267 CB THR A 82 0.429 -7.316 -9.233 1.00 0.00 C ATOM 1268 OG1 THR A 82 0.751 -8.628 -8.756 1.00 0.00 O ATOM 1269 CG2 THR A 82 1.458 -6.319 -8.724 1.00 0.00 C ATOM 0 H THR A 82 -0.153 -6.840 -6.854 1.00 0.00 H new ATOM 0 HA THR A 82 -1.251 -5.963 -9.218 1.00 0.00 H new ATOM 0 HB THR A 82 0.450 -7.310 -10.323 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.653 -8.872 -9.052 1.00 0.00 H new ATOM 0 HG21 THR A 82 2.451 -6.617 -9.060 1.00 0.00 H new ATOM 0 HG22 THR A 82 1.226 -5.327 -9.112 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.435 -6.297 -7.634 1.00 0.00 H new ATOM 1277 N SER A 83 -1.930 -9.152 -8.615 1.00 0.00 N ATOM 1278 CA SER A 83 -2.819 -10.251 -8.973 1.00 0.00 C ATOM 1279 C SER A 83 -4.278 -9.811 -8.911 1.00 0.00 C ATOM 1280 O SER A 83 -5.120 -10.308 -9.660 1.00 0.00 O ATOM 1281 CB SER A 83 -2.594 -11.442 -8.040 1.00 0.00 C ATOM 1282 OG SER A 83 -1.490 -12.223 -8.466 1.00 0.00 O ATOM 0 H SER A 83 -1.286 -9.362 -7.852 1.00 0.00 H new ATOM 0 HA SER A 83 -2.591 -10.552 -9.996 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.421 -11.085 -7.025 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.491 -12.060 -8.012 1.00 0.00 H new ATOM 0 HG SER A 83 -1.366 -12.977 -7.852 1.00 0.00 H new ATOM 1288 N TYR A 84 -4.570 -8.876 -8.014 1.00 0.00 N ATOM 1289 CA TYR A 84 -5.928 -8.370 -7.851 1.00 0.00 C ATOM 1290 C TYR A 84 -6.321 -7.478 -9.025 1.00 0.00 C ATOM 1291 O TYR A 84 -7.498 -7.174 -9.222 1.00 0.00 O ATOM 1292 CB TYR A 84 -6.051 -7.591 -6.541 1.00 0.00 C ATOM 1293 CG TYR A 84 -7.467 -7.171 -6.216 1.00 0.00 C ATOM 1294 CD1 TYR A 84 -8.325 -8.022 -5.530 1.00 0.00 C ATOM 1295 CD2 TYR A 84 -7.947 -5.924 -6.596 1.00 0.00 C ATOM 1296 CE1 TYR A 84 -9.619 -7.643 -5.232 1.00 0.00 C ATOM 1297 CE2 TYR A 84 -9.239 -5.535 -6.301 1.00 0.00 C ATOM 1298 CZ TYR A 84 -10.072 -6.399 -5.619 1.00 0.00 C ATOM 1299 OH TYR A 84 -11.360 -6.017 -5.323 1.00 0.00 O ATOM 0 H TYR A 84 -3.884 -8.453 -7.388 1.00 0.00 H new ATOM 0 HA TYR A 84 -6.606 -9.223 -7.823 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -5.667 -8.204 -5.726 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.421 -6.703 -6.596 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -7.974 -8.997 -5.225 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -7.298 -5.247 -7.132 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -10.273 -8.317 -4.699 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -9.595 -4.561 -6.602 1.00 0.00 H new ATOM 0 HH TYR A 84 -11.990 -6.569 -5.832 1.00 0.00 H new ATOM 1309 N TYR A 85 -5.327 -7.062 -9.802 1.00 0.00 N ATOM 1310 CA TYR A 85 -5.566 -6.203 -10.955 1.00 0.00 C ATOM 1311 C TYR A 85 -5.680 -7.027 -12.234 1.00 0.00 C ATOM 1312 O TYR A 85 -6.392 -6.653 -13.167 1.00 0.00 O ATOM 1313 CB TYR A 85 -4.441 -5.176 -11.095 1.00 0.00 C ATOM 1314 CG TYR A 85 -4.744 -3.851 -10.433 1.00 0.00 C ATOM 1315 CD1 TYR A 85 -5.814 -3.071 -10.853 1.00 0.00 C ATOM 1316 CD2 TYR A 85 -3.961 -3.380 -9.387 1.00 0.00 C ATOM 1317 CE1 TYR A 85 -6.094 -1.859 -10.252 1.00 0.00 C ATOM 1318 CE2 TYR A 85 -4.234 -2.170 -8.778 1.00 0.00 C ATOM 1319 CZ TYR A 85 -5.301 -1.413 -9.215 1.00 0.00 C ATOM 1320 OH TYR A 85 -5.578 -0.208 -8.612 1.00 0.00 O ATOM 0 H TYR A 85 -4.348 -7.306 -9.654 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.509 -5.679 -10.796 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -3.529 -5.588 -10.663 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -4.245 -5.007 -12.154 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -6.438 -3.418 -11.663 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -3.124 -3.970 -9.044 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -6.929 -1.264 -10.592 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -3.616 -1.819 -7.965 1.00 0.00 H new ATOM 0 HH TYR A 85 -6.541 -0.032 -8.659 1.00 0.00 H new ATOM 1330 N HIS A 86 -4.974 -8.153 -12.269 1.00 0.00 N ATOM 1331 CA HIS A 86 -4.996 -9.032 -13.433 1.00 0.00 C ATOM 1332 C HIS A 86 -6.049 -10.124 -13.268 1.00 0.00 C ATOM 1333 O HIS A 86 -6.597 -10.623 -14.251 1.00 0.00 O ATOM 1334 CB HIS A 86 -3.620 -9.663 -13.647 1.00 0.00 C ATOM 1335 CG HIS A 86 -2.500 -8.669 -13.660 1.00 0.00 C ATOM 1336 ND1 HIS A 86 -2.329 -7.520 -12.964 1.00 0.00 N flip ATOM 1337 CD2 HIS A 86 -1.386 -8.800 -14.461 1.00 0.00 C flip ATOM 1338 CE1 HIS A 86 -1.125 -6.985 -13.353 1.00 0.00 C flip ATOM 1339 NE2 HIS A 86 -0.576 -7.776 -14.256 1.00 0.00 N flip ATOM 0 H HIS A 86 -4.380 -8.478 -11.506 1.00 0.00 H new ATOM 0 HA HIS A 86 -5.253 -8.433 -14.306 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -3.438 -10.393 -12.858 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -3.622 -10.208 -14.591 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.204 -9.612 -15.149 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -0.697 -6.066 -12.980 1.00 0.00 H new ATOM 0 HE2 HIS A 86 0.321 -7.623 -14.717 1.00 0.00 H new ATOM 1348 N GLU A 87 -6.325 -10.491 -12.021 1.00 0.00 N ATOM 1349 CA GLU A 87 -7.311 -11.524 -11.729 1.00 0.00 C ATOM 1350 C GLU A 87 -8.676 -10.908 -11.437 1.00 0.00 C ATOM 1351 O GLU A 87 -9.611 -11.037 -12.228 1.00 0.00 O ATOM 1352 CB GLU A 87 -6.858 -12.373 -10.540 1.00 0.00 C ATOM 1353 CG GLU A 87 -5.490 -13.007 -10.731 1.00 0.00 C ATOM 1354 CD GLU A 87 -5.258 -14.184 -9.803 1.00 0.00 C ATOM 1355 OE1 GLU A 87 -6.134 -15.071 -9.738 1.00 0.00 O ATOM 1356 OE2 GLU A 87 -4.198 -14.217 -9.143 1.00 0.00 O ATOM 0 H GLU A 87 -5.879 -10.088 -11.197 1.00 0.00 H new ATOM 0 HA GLU A 87 -7.400 -12.162 -12.608 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -6.839 -11.750 -9.646 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -7.592 -13.159 -10.365 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.388 -13.338 -11.764 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.719 -12.256 -10.560 1.00 0.00 H new ATOM 1363 N PHE A 88 -8.783 -10.237 -10.294 1.00 0.00 N ATOM 1364 CA PHE A 88 -10.033 -9.601 -9.895 1.00 0.00 C ATOM 1365 C PHE A 88 -10.555 -8.687 -11.000 1.00 0.00 C ATOM 1366 O PHE A 88 -11.570 -8.979 -11.635 1.00 0.00 O ATOM 1367 CB PHE A 88 -9.834 -8.800 -8.607 1.00 0.00 C ATOM 1368 CG PHE A 88 -11.055 -8.757 -7.733 1.00 0.00 C ATOM 1369 CD1 PHE A 88 -11.294 -9.758 -6.805 1.00 0.00 C ATOM 1370 CD2 PHE A 88 -11.963 -7.716 -7.840 1.00 0.00 C ATOM 1371 CE1 PHE A 88 -12.417 -9.721 -5.999 1.00 0.00 C ATOM 1372 CE2 PHE A 88 -13.087 -7.674 -7.036 1.00 0.00 C ATOM 1373 CZ PHE A 88 -13.315 -8.678 -6.116 1.00 0.00 C ATOM 0 H PHE A 88 -8.019 -10.120 -9.628 1.00 0.00 H new ATOM 0 HA PHE A 88 -10.770 -10.385 -9.717 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -9.008 -9.234 -8.043 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.544 -7.781 -8.863 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -10.595 -10.576 -6.710 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -11.791 -6.929 -8.559 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -12.592 -10.507 -5.279 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -13.786 -6.856 -7.128 1.00 0.00 H new ATOM 0 HZ PHE A 88 -14.194 -8.648 -5.489 1.00 0.00 H new ATOM 1383 N LEU A 89 -9.856 -7.580 -11.224 1.00 0.00 N ATOM 1384 CA LEU A 89 -10.248 -6.622 -12.251 1.00 0.00 C ATOM 1385 C LEU A 89 -9.993 -7.184 -13.646 1.00 0.00 C ATOM 1386 O LEU A 89 -10.915 -7.325 -14.448 1.00 0.00 O ATOM 1387 CB LEU A 89 -9.484 -5.309 -12.070 1.00 0.00 C ATOM 1388 CG LEU A 89 -9.783 -4.530 -10.789 1.00 0.00 C ATOM 1389 CD1 LEU A 89 -8.997 -3.228 -10.760 1.00 0.00 C ATOM 1390 CD2 LEU A 89 -11.275 -4.257 -10.666 1.00 0.00 C ATOM 0 H LEU A 89 -9.014 -7.324 -10.708 1.00 0.00 H new ATOM 0 HA LEU A 89 -11.316 -6.431 -12.146 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -8.416 -5.526 -12.099 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.701 -4.665 -12.922 1.00 0.00 H new ATOM 0 HG LEU A 89 -9.474 -5.136 -9.938 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.223 -2.687 -9.841 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.930 -3.446 -10.800 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.275 -2.616 -11.618 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -11.469 -3.702 -9.748 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -11.609 -3.671 -11.522 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.817 -5.202 -10.639 1.00 0.00 H new ATOM 1402 N GLY A 90 -8.734 -7.506 -13.927 1.00 0.00 N ATOM 1403 CA GLY A 90 -8.380 -8.051 -15.225 1.00 0.00 C ATOM 1404 C GLY A 90 -7.347 -7.208 -15.946 1.00 0.00 C ATOM 1405 O GLY A 90 -6.809 -7.620 -16.973 1.00 0.00 O ATOM 0 H GLY A 90 -7.953 -7.399 -13.279 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -7.994 -9.063 -15.098 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -9.276 -8.127 -15.841 1.00 0.00 H new ATOM 1409 N GLN A 91 -7.071 -6.025 -15.408 1.00 0.00 N ATOM 1410 CA GLN A 91 -6.098 -5.121 -16.009 1.00 0.00 C ATOM 1411 C GLN A 91 -4.690 -5.424 -15.505 1.00 0.00 C ATOM 1412 O GLN A 91 -4.509 -6.223 -14.587 1.00 0.00 O ATOM 1413 CB GLN A 91 -6.461 -3.667 -15.700 1.00 0.00 C ATOM 1414 CG GLN A 91 -6.491 -3.351 -14.214 1.00 0.00 C ATOM 1415 CD GLN A 91 -7.026 -1.962 -13.924 1.00 0.00 C ATOM 1416 OE1 GLN A 91 -8.340 -1.856 -13.760 1.00 0.00 O flip ATOM 1417 NE2 GLN A 91 -6.268 -0.995 -13.847 1.00 0.00 N flip ATOM 0 H GLN A 91 -7.507 -5.670 -14.557 1.00 0.00 H new ATOM 0 HA GLN A 91 -6.119 -5.271 -17.088 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -5.741 -3.010 -16.188 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -7.438 -3.446 -16.130 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.109 -4.089 -13.702 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -5.484 -3.441 -13.807 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -5.265 -1.122 -13.980 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -6.643 -0.067 -13.650 1.00 0.00 H new ATOM 1426 N GLN A 92 -3.698 -4.781 -16.113 1.00 0.00 N ATOM 1427 CA GLN A 92 -2.307 -4.983 -15.726 1.00 0.00 C ATOM 1428 C GLN A 92 -1.750 -3.746 -15.029 1.00 0.00 C ATOM 1429 O GLN A 92 -2.482 -2.794 -14.755 1.00 0.00 O ATOM 1430 CB GLN A 92 -1.458 -5.317 -16.954 1.00 0.00 C ATOM 1431 CG GLN A 92 -1.450 -4.219 -18.005 1.00 0.00 C ATOM 1432 CD GLN A 92 -1.049 -4.727 -19.376 1.00 0.00 C ATOM 1433 OE1 GLN A 92 -1.809 -4.617 -20.339 1.00 0.00 O ATOM 1434 NE2 GLN A 92 0.151 -5.287 -19.473 1.00 0.00 N ATOM 0 H GLN A 92 -3.832 -4.116 -16.875 1.00 0.00 H new ATOM 0 HA GLN A 92 -2.268 -5.819 -15.027 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -0.434 -5.511 -16.635 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -1.831 -6.237 -17.404 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -2.442 -3.770 -18.064 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -0.761 -3.432 -17.698 1.00 0.00 H new ATOM 0 HE21 GLN A 92 0.749 -5.358 -18.650 1.00 0.00 H new ATOM 0 HE22 GLN A 92 0.475 -5.646 -20.371 1.00 0.00 H new ATOM 1443 N ILE A 93 -0.453 -3.766 -14.746 1.00 0.00 N ATOM 1444 CA ILE A 93 0.201 -2.645 -14.081 1.00 0.00 C ATOM 1445 C ILE A 93 1.435 -2.192 -14.855 1.00 0.00 C ATOM 1446 O ILE A 93 2.216 -3.014 -15.335 1.00 0.00 O ATOM 1447 CB ILE A 93 0.615 -3.008 -12.643 1.00 0.00 C ATOM 1448 CG1 ILE A 93 -0.624 -3.236 -11.775 1.00 0.00 C ATOM 1449 CG2 ILE A 93 1.489 -1.911 -12.051 1.00 0.00 C ATOM 1450 CD1 ILE A 93 -0.305 -3.443 -10.310 1.00 0.00 C ATOM 0 H ILE A 93 0.167 -4.546 -14.966 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.523 -1.831 -14.047 1.00 0.00 H new ATOM 0 HB ILE A 93 1.193 -3.932 -12.669 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -1.291 -2.380 -11.876 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.164 -4.107 -12.148 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.774 -2.182 -11.034 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.385 -1.792 -12.659 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.934 -0.973 -12.035 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -1.230 -3.599 -9.755 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.337 -4.316 -10.197 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.208 -2.563 -9.921 1.00 0.00 H new ATOM 1462 N SER A 94 1.605 -0.879 -14.970 1.00 0.00 N ATOM 1463 CA SER A 94 2.743 -0.316 -15.686 1.00 0.00 C ATOM 1464 C SER A 94 3.963 -0.215 -14.775 1.00 0.00 C ATOM 1465 O SER A 94 3.834 0.001 -13.571 1.00 0.00 O ATOM 1466 CB SER A 94 2.391 1.066 -16.240 1.00 0.00 C ATOM 1467 OG SER A 94 1.867 0.971 -17.554 1.00 0.00 O ATOM 0 H SER A 94 0.969 -0.185 -14.576 1.00 0.00 H new ATOM 0 HA SER A 94 2.984 -0.982 -16.515 1.00 0.00 H new ATOM 0 HB2 SER A 94 1.662 1.547 -15.588 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.280 1.697 -16.244 1.00 0.00 H new ATOM 0 HG SER A 94 1.648 1.867 -17.885 1.00 0.00 H new ATOM 1473 N GLU A 95 5.146 -0.373 -15.361 1.00 0.00 N ATOM 1474 CA GLU A 95 6.389 -0.300 -14.602 1.00 0.00 C ATOM 1475 C GLU A 95 6.456 0.989 -13.789 1.00 0.00 C ATOM 1476 O GLU A 95 7.266 1.115 -12.872 1.00 0.00 O ATOM 1477 CB GLU A 95 7.593 -0.386 -15.543 1.00 0.00 C ATOM 1478 CG GLU A 95 8.049 -1.809 -15.818 1.00 0.00 C ATOM 1479 CD GLU A 95 8.673 -1.966 -17.192 1.00 0.00 C ATOM 1480 OE1 GLU A 95 7.967 -1.728 -18.194 1.00 0.00 O ATOM 1481 OE2 GLU A 95 9.866 -2.327 -17.264 1.00 0.00 O ATOM 0 H GLU A 95 5.270 -0.552 -16.358 1.00 0.00 H new ATOM 0 HA GLU A 95 6.414 -1.145 -13.913 1.00 0.00 H new ATOM 0 HB2 GLU A 95 7.340 0.095 -16.488 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.422 0.175 -15.112 1.00 0.00 H new ATOM 0 HG2 GLU A 95 8.771 -2.108 -15.059 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.197 -2.483 -15.731 1.00 0.00 H new ATOM 1488 N GLU A 96 5.598 1.945 -14.134 1.00 0.00 N ATOM 1489 CA GLU A 96 5.562 3.225 -13.438 1.00 0.00 C ATOM 1490 C GLU A 96 5.004 3.061 -12.027 1.00 0.00 C ATOM 1491 O GLU A 96 5.350 3.818 -11.118 1.00 0.00 O ATOM 1492 CB GLU A 96 4.714 4.232 -14.219 1.00 0.00 C ATOM 1493 CG GLU A 96 5.225 4.496 -15.625 1.00 0.00 C ATOM 1494 CD GLU A 96 6.406 5.447 -15.647 1.00 0.00 C ATOM 1495 OE1 GLU A 96 7.074 5.590 -14.601 1.00 0.00 O ATOM 1496 OE2 GLU A 96 6.663 6.049 -16.711 1.00 0.00 O ATOM 0 H GLU A 96 4.920 1.857 -14.891 1.00 0.00 H new ATOM 0 HA GLU A 96 6.583 3.599 -13.366 1.00 0.00 H new ATOM 0 HB2 GLU A 96 3.690 3.864 -14.277 1.00 0.00 H new ATOM 0 HB3 GLU A 96 4.684 5.173 -13.670 1.00 0.00 H new ATOM 0 HG2 GLU A 96 5.515 3.552 -16.086 1.00 0.00 H new ATOM 0 HG3 GLU A 96 4.418 4.911 -16.229 1.00 0.00 H new ATOM 1503 N LEU A 97 4.139 2.068 -11.851 1.00 0.00 N ATOM 1504 CA LEU A 97 3.533 1.804 -10.551 1.00 0.00 C ATOM 1505 C LEU A 97 4.333 0.760 -9.778 1.00 0.00 C ATOM 1506 O LEU A 97 4.392 0.794 -8.549 1.00 0.00 O ATOM 1507 CB LEU A 97 2.089 1.329 -10.727 1.00 0.00 C ATOM 1508 CG LEU A 97 1.245 2.106 -11.738 1.00 0.00 C ATOM 1509 CD1 LEU A 97 -0.156 1.522 -11.824 1.00 0.00 C ATOM 1510 CD2 LEU A 97 1.188 3.580 -11.364 1.00 0.00 C ATOM 0 H LEU A 97 3.842 1.433 -12.592 1.00 0.00 H new ATOM 0 HA LEU A 97 3.537 2.733 -9.981 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.106 0.281 -11.027 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.592 1.374 -9.758 1.00 0.00 H new ATOM 0 HG LEU A 97 1.714 2.018 -12.718 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.742 2.088 -12.548 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.097 0.480 -12.139 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -0.635 1.579 -10.846 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.583 4.118 -12.094 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.743 3.687 -10.375 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.197 3.992 -11.355 1.00 0.00 H new ATOM 1522 N ILE A 98 4.948 -0.164 -10.508 1.00 0.00 N ATOM 1523 CA ILE A 98 5.748 -1.216 -9.891 1.00 0.00 C ATOM 1524 C ILE A 98 6.661 -0.649 -8.809 1.00 0.00 C ATOM 1525 O ILE A 98 7.688 -0.031 -9.089 1.00 0.00 O ATOM 1526 CB ILE A 98 6.605 -1.956 -10.934 1.00 0.00 C ATOM 1527 CG1 ILE A 98 5.716 -2.549 -12.029 1.00 0.00 C ATOM 1528 CG2 ILE A 98 7.430 -3.046 -10.265 1.00 0.00 C ATOM 1529 CD1 ILE A 98 4.804 -3.651 -11.536 1.00 0.00 C ATOM 0 H ILE A 98 4.908 -0.206 -11.526 1.00 0.00 H new ATOM 0 HA ILE A 98 5.049 -1.921 -9.441 1.00 0.00 H new ATOM 0 HB ILE A 98 7.288 -1.242 -11.394 1.00 0.00 H new ATOM 0 HG12 ILE A 98 5.110 -1.754 -12.464 1.00 0.00 H new ATOM 0 HG13 ILE A 98 6.348 -2.941 -12.826 1.00 0.00 H new ATOM 0 HG21 ILE A 98 8.030 -3.560 -11.015 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.087 -2.599 -9.519 1.00 0.00 H new ATOM 0 HG23 ILE A 98 6.764 -3.761 -9.781 1.00 0.00 H new ATOM 0 HD11 ILE A 98 4.203 -4.024 -12.365 1.00 0.00 H new ATOM 0 HD12 ILE A 98 5.404 -4.464 -11.127 1.00 0.00 H new ATOM 0 HD13 ILE A 98 4.147 -3.259 -10.760 1.00 0.00 H new ATOM 1541 N PRO A 99 6.280 -0.864 -7.541 1.00 0.00 N ATOM 1542 CA PRO A 99 7.052 -0.385 -6.390 1.00 0.00 C ATOM 1543 C PRO A 99 8.370 -1.133 -6.225 1.00 0.00 C ATOM 1544 O PRO A 99 8.383 -2.328 -5.930 1.00 0.00 O ATOM 1545 CB PRO A 99 6.126 -0.662 -5.203 1.00 0.00 C ATOM 1546 CG PRO A 99 5.257 -1.784 -5.654 1.00 0.00 C ATOM 1547 CD PRO A 99 5.067 -1.592 -7.133 1.00 0.00 C ATOM 0 HA PRO A 99 7.332 0.663 -6.494 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.694 -0.934 -4.313 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.536 0.218 -4.948 1.00 0.00 H new ATOM 0 HG2 PRO A 99 5.722 -2.747 -5.442 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.300 -1.770 -5.133 1.00 0.00 H new ATOM 0 HD2 PRO A 99 4.976 -2.545 -7.654 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.164 -1.022 -7.352 1.00 0.00 H new ATOM 1555 N ASP A 100 9.476 -0.422 -6.415 1.00 0.00 N ATOM 1556 CA ASP A 100 10.800 -1.019 -6.285 1.00 0.00 C ATOM 1557 C ASP A 100 11.085 -1.399 -4.835 1.00 0.00 C ATOM 1558 O ASP A 100 11.595 -0.590 -4.059 1.00 0.00 O ATOM 1559 CB ASP A 100 11.871 -0.052 -6.791 1.00 0.00 C ATOM 1560 CG ASP A 100 11.812 0.142 -8.294 1.00 0.00 C ATOM 1561 OD1 ASP A 100 10.794 0.674 -8.784 1.00 0.00 O ATOM 1562 OD2 ASP A 100 12.784 -0.238 -8.980 1.00 0.00 O ATOM 0 H ASP A 100 9.482 0.568 -6.660 1.00 0.00 H new ATOM 0 HA ASP A 100 10.824 -1.925 -6.891 1.00 0.00 H new ATOM 0 HB2 ASP A 100 11.748 0.912 -6.298 1.00 0.00 H new ATOM 0 HB3 ASP A 100 12.856 -0.428 -6.514 1.00 0.00 H new ATOM 1567 N LEU A 101 10.751 -2.634 -4.476 1.00 0.00 N ATOM 1568 CA LEU A 101 10.969 -3.121 -3.119 1.00 0.00 C ATOM 1569 C LEU A 101 12.456 -3.137 -2.779 1.00 0.00 C ATOM 1570 O LEU A 101 12.860 -2.707 -1.699 1.00 0.00 O ATOM 1571 CB LEU A 101 10.383 -4.525 -2.960 1.00 0.00 C ATOM 1572 CG LEU A 101 9.007 -4.753 -3.585 1.00 0.00 C ATOM 1573 CD1 LEU A 101 8.515 -6.162 -3.294 1.00 0.00 C ATOM 1574 CD2 LEU A 101 8.011 -3.722 -3.074 1.00 0.00 C ATOM 0 H LEU A 101 10.328 -3.316 -5.106 1.00 0.00 H new ATOM 0 HA LEU A 101 10.465 -2.443 -2.430 1.00 0.00 H new ATOM 0 HB2 LEU A 101 11.081 -5.240 -3.396 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.318 -4.752 -1.896 1.00 0.00 H new ATOM 0 HG LEU A 101 9.097 -4.638 -4.665 1.00 0.00 H new ATOM 0 HD11 LEU A 101 7.534 -6.306 -3.747 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.216 -6.885 -3.710 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.442 -6.306 -2.216 1.00 0.00 H new ATOM 0 HD21 LEU A 101 7.037 -3.900 -3.530 1.00 0.00 H new ATOM 0 HD22 LEU A 101 7.925 -3.805 -1.991 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.356 -2.722 -3.335 1.00 0.00 H new ATOM 1586 N ASN A 102 13.265 -3.633 -3.709 1.00 0.00 N ATOM 1587 CA ASN A 102 14.708 -3.703 -3.508 1.00 0.00 C ATOM 1588 C ASN A 102 15.260 -2.355 -3.055 1.00 0.00 C ATOM 1589 O ASN A 102 16.162 -2.292 -2.219 1.00 0.00 O ATOM 1590 CB ASN A 102 15.403 -4.144 -4.798 1.00 0.00 C ATOM 1591 CG ASN A 102 15.557 -5.650 -4.887 1.00 0.00 C ATOM 1592 OD1 ASN A 102 16.671 -6.173 -4.861 1.00 0.00 O ATOM 1593 ND2 ASN A 102 14.436 -6.354 -4.992 1.00 0.00 N ATOM 0 H ASN A 102 12.946 -3.992 -4.609 1.00 0.00 H new ATOM 0 HA ASN A 102 14.906 -4.438 -2.727 1.00 0.00 H new ATOM 0 HB2 ASN A 102 14.831 -3.789 -5.655 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.386 -3.677 -4.855 1.00 0.00 H new ATOM 0 HD21 ASN A 102 14.477 -7.371 -5.055 1.00 0.00 H new ATOM 0 HD22 ASN A 102 13.534 -5.878 -5.010 1.00 0.00 H new ATOM 1600 N GLN A 103 14.712 -1.280 -3.611 1.00 0.00 N ATOM 1601 CA GLN A 103 15.150 0.067 -3.263 1.00 0.00 C ATOM 1602 C GLN A 103 14.429 0.569 -2.016 1.00 0.00 C ATOM 1603 O GLN A 103 14.793 1.600 -1.450 1.00 0.00 O ATOM 1604 CB GLN A 103 14.901 1.024 -4.431 1.00 0.00 C ATOM 1605 CG GLN A 103 16.093 1.170 -5.362 1.00 0.00 C ATOM 1606 CD GLN A 103 16.179 0.050 -6.381 1.00 0.00 C ATOM 1607 OE1 GLN A 103 17.079 -0.788 -6.325 1.00 0.00 O ATOM 1608 NE2 GLN A 103 15.239 0.030 -7.319 1.00 0.00 N ATOM 0 H GLN A 103 13.964 -1.315 -4.304 1.00 0.00 H new ATOM 0 HA GLN A 103 16.219 0.032 -3.052 1.00 0.00 H new ATOM 0 HB2 GLN A 103 14.044 0.670 -5.004 1.00 0.00 H new ATOM 0 HB3 GLN A 103 14.637 2.005 -4.036 1.00 0.00 H new ATOM 0 HG2 GLN A 103 16.028 2.125 -5.883 1.00 0.00 H new ATOM 0 HG3 GLN A 103 17.009 1.191 -4.772 1.00 0.00 H new ATOM 0 HE21 GLN A 103 14.512 0.745 -7.327 1.00 0.00 H new ATOM 0 HE22 GLN A 103 15.245 -0.700 -8.031 1.00 0.00 H new ATOM 1617 N ILE A 104 13.406 -0.166 -1.594 1.00 0.00 N ATOM 1618 CA ILE A 104 12.635 0.205 -0.414 1.00 0.00 C ATOM 1619 C ILE A 104 13.120 -0.551 0.819 1.00 0.00 C ATOM 1620 O ILE A 104 12.948 -0.093 1.949 1.00 0.00 O ATOM 1621 CB ILE A 104 11.133 -0.070 -0.613 1.00 0.00 C ATOM 1622 CG1 ILE A 104 10.557 0.868 -1.676 1.00 0.00 C ATOM 1623 CG2 ILE A 104 10.386 0.089 0.703 1.00 0.00 C ATOM 1624 CD1 ILE A 104 9.214 0.423 -2.211 1.00 0.00 C ATOM 0 H ILE A 104 13.092 -1.022 -2.052 1.00 0.00 H new ATOM 0 HA ILE A 104 12.783 1.274 -0.264 1.00 0.00 H new ATOM 0 HB ILE A 104 11.009 -1.097 -0.956 1.00 0.00 H new ATOM 0 HG12 ILE A 104 10.457 1.867 -1.252 1.00 0.00 H new ATOM 0 HG13 ILE A 104 11.262 0.942 -2.504 1.00 0.00 H new ATOM 0 HG21 ILE A 104 9.326 -0.109 0.546 1.00 0.00 H new ATOM 0 HG22 ILE A 104 10.782 -0.616 1.434 1.00 0.00 H new ATOM 0 HG23 ILE A 104 10.514 1.106 1.074 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.867 1.135 -2.960 1.00 0.00 H new ATOM 0 HD12 ILE A 104 9.312 -0.563 -2.665 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.494 0.376 -1.394 1.00 0.00 H new ATOM 1636 N THR A 105 13.729 -1.711 0.594 1.00 0.00 N ATOM 1637 CA THR A 105 14.240 -2.530 1.685 1.00 0.00 C ATOM 1638 C THR A 105 15.722 -2.267 1.923 1.00 0.00 C ATOM 1639 O THR A 105 16.201 -2.337 3.054 1.00 0.00 O ATOM 1640 CB THR A 105 14.035 -4.031 1.405 1.00 0.00 C ATOM 1641 OG1 THR A 105 12.910 -4.218 0.538 1.00 0.00 O ATOM 1642 CG2 THR A 105 13.816 -4.798 2.700 1.00 0.00 C ATOM 0 H THR A 105 13.880 -2.104 -0.335 1.00 0.00 H new ATOM 0 HA THR A 105 13.677 -2.254 2.577 1.00 0.00 H new ATOM 0 HB THR A 105 14.934 -4.414 0.922 1.00 0.00 H new ATOM 0 HG1 THR A 105 13.123 -3.872 -0.354 1.00 0.00 H new ATOM 0 HG21 THR A 105 13.674 -5.855 2.477 1.00 0.00 H new ATOM 0 HG22 THR A 105 14.686 -4.677 3.346 1.00 0.00 H new ATOM 0 HG23 THR A 105 12.931 -4.412 3.207 1.00 0.00 H new ATOM 1650 N GLU A 106 16.444 -1.964 0.849 1.00 0.00 N ATOM 1651 CA GLU A 106 17.874 -1.690 0.942 1.00 0.00 C ATOM 1652 C GLU A 106 18.136 -0.190 1.039 1.00 0.00 C ATOM 1653 O GLU A 106 19.063 0.246 1.722 1.00 0.00 O ATOM 1654 CB GLU A 106 18.607 -2.270 -0.270 1.00 0.00 C ATOM 1655 CG GLU A 106 18.483 -3.779 -0.391 1.00 0.00 C ATOM 1656 CD GLU A 106 19.627 -4.397 -1.171 1.00 0.00 C ATOM 1657 OE1 GLU A 106 20.132 -3.738 -2.104 1.00 0.00 O ATOM 1658 OE2 GLU A 106 20.017 -5.539 -0.850 1.00 0.00 O ATOM 0 H GLU A 106 16.063 -1.902 -0.095 1.00 0.00 H new ATOM 0 HA GLU A 106 18.251 -2.166 1.847 1.00 0.00 H new ATOM 0 HB2 GLU A 106 18.215 -1.808 -1.176 1.00 0.00 H new ATOM 0 HB3 GLU A 106 19.662 -2.004 -0.207 1.00 0.00 H new ATOM 0 HG2 GLU A 106 18.449 -4.218 0.606 1.00 0.00 H new ATOM 0 HG3 GLU A 106 17.540 -4.024 -0.880 1.00 0.00 H new ATOM 1665 N CYS A 107 17.313 0.594 0.351 1.00 0.00 N ATOM 1666 CA CYS A 107 17.455 2.045 0.358 1.00 0.00 C ATOM 1667 C CYS A 107 16.345 2.697 1.176 1.00 0.00 C ATOM 1668 O CYS A 107 16.593 3.616 1.956 1.00 0.00 O ATOM 1669 CB CYS A 107 17.437 2.587 -1.072 1.00 0.00 C ATOM 1670 SG CYS A 107 19.078 2.879 -1.772 1.00 0.00 S ATOM 0 H CYS A 107 16.541 0.249 -0.219 1.00 0.00 H new ATOM 0 HA CYS A 107 18.412 2.289 0.819 1.00 0.00 H new ATOM 0 HB2 CYS A 107 16.902 1.883 -1.709 1.00 0.00 H new ATOM 0 HB3 CYS A 107 16.876 3.521 -1.088 1.00 0.00 H new ATOM 0 HG CYS A 107 18.958 3.334 -2.984 1.00 0.00 H new ATOM 1676 N ALA A 108 15.121 2.215 0.992 1.00 0.00 N ATOM 1677 CA ALA A 108 13.973 2.750 1.713 1.00 0.00 C ATOM 1678 C ALA A 108 13.563 4.111 1.161 1.00 0.00 C ATOM 1679 O ALA A 108 12.960 4.921 1.865 1.00 0.00 O ATOM 1680 CB ALA A 108 14.284 2.853 3.199 1.00 0.00 C ATOM 0 H ALA A 108 14.899 1.455 0.350 1.00 0.00 H new ATOM 0 HA ALA A 108 13.137 2.064 1.574 1.00 0.00 H new ATOM 0 HB1 ALA A 108 13.418 3.254 3.725 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.520 1.864 3.591 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.137 3.515 3.347 1.00 0.00 H new ATOM 1686 N ASP A 109 13.895 4.356 -0.102 1.00 0.00 N ATOM 1687 CA ASP A 109 13.561 5.620 -0.749 1.00 0.00 C ATOM 1688 C ASP A 109 12.065 5.901 -0.652 1.00 0.00 C ATOM 1689 O ASP A 109 11.232 5.000 -0.743 1.00 0.00 O ATOM 1690 CB ASP A 109 13.995 5.597 -2.215 1.00 0.00 C ATOM 1691 CG ASP A 109 14.403 6.967 -2.720 1.00 0.00 C ATOM 1692 OD1 ASP A 109 15.586 7.332 -2.553 1.00 0.00 O ATOM 1693 OD2 ASP A 109 13.540 7.674 -3.281 1.00 0.00 O ATOM 0 H ASP A 109 14.395 3.696 -0.698 1.00 0.00 H new ATOM 0 HA ASP A 109 14.096 6.417 -0.233 1.00 0.00 H new ATOM 0 HB2 ASP A 109 14.830 4.906 -2.333 1.00 0.00 H new ATOM 0 HB3 ASP A 109 13.177 5.216 -2.827 1.00 0.00 H new ATOM 1698 N PRO A 110 11.715 7.182 -0.462 1.00 0.00 N ATOM 1699 CA PRO A 110 10.318 7.612 -0.349 1.00 0.00 C ATOM 1700 C PRO A 110 9.568 7.500 -1.671 1.00 0.00 C ATOM 1701 O PRO A 110 8.466 6.954 -1.727 1.00 0.00 O ATOM 1702 CB PRO A 110 10.432 9.077 0.080 1.00 0.00 C ATOM 1703 CG PRO A 110 11.763 9.517 -0.424 1.00 0.00 C ATOM 1704 CD PRO A 110 12.655 8.309 -0.345 1.00 0.00 C ATOM 0 HA PRO A 110 9.756 6.992 0.349 1.00 0.00 H new ATOM 0 HB2 PRO A 110 9.629 9.678 -0.346 1.00 0.00 H new ATOM 0 HB3 PRO A 110 10.366 9.179 1.163 1.00 0.00 H new ATOM 0 HG2 PRO A 110 11.691 9.883 -1.448 1.00 0.00 H new ATOM 0 HG3 PRO A 110 12.158 10.334 0.179 1.00 0.00 H new ATOM 0 HD2 PRO A 110 13.393 8.301 -1.147 1.00 0.00 H new ATOM 0 HD3 PRO A 110 13.206 8.277 0.595 1.00 0.00 H new ATOM 1712 N VAL A 111 10.171 8.021 -2.735 1.00 0.00 N ATOM 1713 CA VAL A 111 9.560 7.978 -4.058 1.00 0.00 C ATOM 1714 C VAL A 111 9.056 6.577 -4.386 1.00 0.00 C ATOM 1715 O VAL A 111 7.956 6.410 -4.911 1.00 0.00 O ATOM 1716 CB VAL A 111 10.552 8.423 -5.149 1.00 0.00 C ATOM 1717 CG1 VAL A 111 11.516 7.296 -5.486 1.00 0.00 C ATOM 1718 CG2 VAL A 111 9.806 8.886 -6.391 1.00 0.00 C ATOM 0 H VAL A 111 11.082 8.478 -2.706 1.00 0.00 H new ATOM 0 HA VAL A 111 8.717 8.669 -4.040 1.00 0.00 H new ATOM 0 HB VAL A 111 11.132 9.263 -4.767 1.00 0.00 H new ATOM 0 HG11 VAL A 111 12.209 7.629 -6.259 1.00 0.00 H new ATOM 0 HG12 VAL A 111 12.075 7.016 -4.593 1.00 0.00 H new ATOM 0 HG13 VAL A 111 10.956 6.434 -5.848 1.00 0.00 H new ATOM 0 HG21 VAL A 111 10.523 9.197 -7.151 1.00 0.00 H new ATOM 0 HG22 VAL A 111 9.199 8.067 -6.777 1.00 0.00 H new ATOM 0 HG23 VAL A 111 9.161 9.727 -6.136 1.00 0.00 H new ATOM 1728 N GLU A 112 9.869 5.573 -4.071 1.00 0.00 N ATOM 1729 CA GLU A 112 9.505 4.185 -4.332 1.00 0.00 C ATOM 1730 C GLU A 112 8.498 3.684 -3.302 1.00 0.00 C ATOM 1731 O GLU A 112 7.457 3.128 -3.653 1.00 0.00 O ATOM 1732 CB GLU A 112 10.751 3.297 -4.319 1.00 0.00 C ATOM 1733 CG GLU A 112 11.596 3.415 -5.576 1.00 0.00 C ATOM 1734 CD GLU A 112 10.780 3.255 -6.845 1.00 0.00 C ATOM 1735 OE1 GLU A 112 9.825 2.450 -6.838 1.00 0.00 O ATOM 1736 OE2 GLU A 112 11.095 3.935 -7.843 1.00 0.00 O ATOM 0 H GLU A 112 10.783 5.695 -3.635 1.00 0.00 H new ATOM 0 HA GLU A 112 9.044 4.136 -5.318 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.362 3.556 -3.455 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.445 2.258 -4.193 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.091 4.386 -5.587 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.380 2.658 -5.555 1.00 0.00 H new ATOM 1743 N LEU A 113 8.816 3.883 -2.027 1.00 0.00 N ATOM 1744 CA LEU A 113 7.940 3.451 -0.944 1.00 0.00 C ATOM 1745 C LEU A 113 6.484 3.779 -1.257 1.00 0.00 C ATOM 1746 O LEU A 113 5.591 2.963 -1.030 1.00 0.00 O ATOM 1747 CB LEU A 113 8.353 4.118 0.370 1.00 0.00 C ATOM 1748 CG LEU A 113 7.768 3.509 1.645 1.00 0.00 C ATOM 1749 CD1 LEU A 113 6.442 4.169 1.990 1.00 0.00 C ATOM 1750 CD2 LEU A 113 7.593 2.006 1.487 1.00 0.00 C ATOM 0 H LEU A 113 9.674 4.341 -1.718 1.00 0.00 H new ATOM 0 HA LEU A 113 8.036 2.370 -0.842 1.00 0.00 H new ATOM 0 HB2 LEU A 113 9.440 4.089 0.443 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.065 5.168 0.327 1.00 0.00 H new ATOM 0 HG LEU A 113 8.464 3.688 2.464 1.00 0.00 H new ATOM 0 HD11 LEU A 113 6.040 3.724 2.900 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.597 5.237 2.146 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.738 4.020 1.171 1.00 0.00 H new ATOM 0 HD21 LEU A 113 7.176 1.590 2.404 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.917 1.804 0.656 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.561 1.546 1.287 1.00 0.00 H new ATOM 1762 N GLY A 114 6.252 4.978 -1.782 1.00 0.00 N ATOM 1763 CA GLY A 114 4.903 5.392 -2.120 1.00 0.00 C ATOM 1764 C GLY A 114 4.289 4.533 -3.208 1.00 0.00 C ATOM 1765 O GLY A 114 3.088 4.262 -3.190 1.00 0.00 O ATOM 0 H GLY A 114 6.975 5.670 -1.979 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.278 5.346 -1.228 1.00 0.00 H new ATOM 0 HA3 GLY A 114 4.916 6.432 -2.446 1.00 0.00 H new ATOM 1769 N ARG A 115 5.113 4.106 -4.159 1.00 0.00 N ATOM 1770 CA ARG A 115 4.643 3.276 -5.261 1.00 0.00 C ATOM 1771 C ARG A 115 3.757 2.144 -4.750 1.00 0.00 C ATOM 1772 O ARG A 115 2.691 1.876 -5.306 1.00 0.00 O ATOM 1773 CB ARG A 115 5.830 2.699 -6.035 1.00 0.00 C ATOM 1774 CG ARG A 115 6.680 3.755 -6.723 1.00 0.00 C ATOM 1775 CD ARG A 115 6.268 3.943 -8.175 1.00 0.00 C ATOM 1776 NE ARG A 115 6.489 5.312 -8.633 1.00 0.00 N ATOM 1777 CZ ARG A 115 5.588 6.281 -8.515 1.00 0.00 C ATOM 1778 NH1 ARG A 115 4.412 6.033 -7.955 1.00 0.00 N ATOM 1779 NH2 ARG A 115 5.863 7.502 -8.957 1.00 0.00 N ATOM 0 H ARG A 115 6.110 4.321 -4.188 1.00 0.00 H new ATOM 0 HA ARG A 115 4.052 3.903 -5.929 1.00 0.00 H new ATOM 0 HB2 ARG A 115 6.458 2.130 -5.349 1.00 0.00 H new ATOM 0 HB3 ARG A 115 5.459 1.999 -6.784 1.00 0.00 H new ATOM 0 HG2 ARG A 115 6.586 4.702 -6.192 1.00 0.00 H new ATOM 0 HG3 ARG A 115 7.730 3.466 -6.676 1.00 0.00 H new ATOM 0 HD2 ARG A 115 6.832 3.255 -8.804 1.00 0.00 H new ATOM 0 HD3 ARG A 115 5.214 3.688 -8.289 1.00 0.00 H new ATOM 0 HE ARG A 115 7.384 5.536 -9.067 1.00 0.00 H new ATOM 0 HH11 ARG A 115 4.197 5.096 -7.613 1.00 0.00 H new ATOM 0 HH12 ARG A 115 3.722 6.779 -7.866 1.00 0.00 H new ATOM 0 HH21 ARG A 115 6.767 7.697 -9.388 1.00 0.00 H new ATOM 0 HH22 ARG A 115 5.170 8.245 -8.866 1.00 0.00 H new ATOM 1793 N LEU A 116 4.205 1.482 -3.689 1.00 0.00 N ATOM 1794 CA LEU A 116 3.454 0.378 -3.103 1.00 0.00 C ATOM 1795 C LEU A 116 2.154 0.875 -2.478 1.00 0.00 C ATOM 1796 O LEU A 116 1.083 0.318 -2.721 1.00 0.00 O ATOM 1797 CB LEU A 116 4.299 -0.337 -2.047 1.00 0.00 C ATOM 1798 CG LEU A 116 3.764 -1.683 -1.558 1.00 0.00 C ATOM 1799 CD1 LEU A 116 4.076 -2.780 -2.564 1.00 0.00 C ATOM 1800 CD2 LEU A 116 4.349 -2.026 -0.195 1.00 0.00 C ATOM 0 H LEU A 116 5.085 1.691 -3.217 1.00 0.00 H new ATOM 0 HA LEU A 116 3.208 -0.324 -3.900 1.00 0.00 H new ATOM 0 HB2 LEU A 116 5.298 -0.492 -2.454 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.404 0.324 -1.187 1.00 0.00 H new ATOM 0 HG LEU A 116 2.681 -1.607 -1.459 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.687 -3.730 -2.198 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.609 -2.541 -3.520 1.00 0.00 H new ATOM 0 HD13 LEU A 116 5.155 -2.856 -2.696 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.957 -2.987 0.138 1.00 0.00 H new ATOM 0 HD22 LEU A 116 5.435 -2.083 -0.269 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.074 -1.254 0.524 1.00 0.00 H new ATOM 1812 N LEU A 117 2.255 1.927 -1.674 1.00 0.00 N ATOM 1813 CA LEU A 117 1.087 2.502 -1.015 1.00 0.00 C ATOM 1814 C LEU A 117 0.013 2.869 -2.034 1.00 0.00 C ATOM 1815 O LEU A 117 -1.173 2.917 -1.710 1.00 0.00 O ATOM 1816 CB LEU A 117 1.488 3.740 -0.211 1.00 0.00 C ATOM 1817 CG LEU A 117 2.454 3.502 0.950 1.00 0.00 C ATOM 1818 CD1 LEU A 117 3.007 4.823 1.462 1.00 0.00 C ATOM 1819 CD2 LEU A 117 1.763 2.740 2.071 1.00 0.00 C ATOM 0 H LEU A 117 3.134 2.400 -1.462 1.00 0.00 H new ATOM 0 HA LEU A 117 0.678 1.753 -0.337 1.00 0.00 H new ATOM 0 HB2 LEU A 117 1.941 4.460 -0.892 1.00 0.00 H new ATOM 0 HB3 LEU A 117 0.583 4.201 0.184 1.00 0.00 H new ATOM 0 HG LEU A 117 3.287 2.899 0.588 1.00 0.00 H new ATOM 0 HD11 LEU A 117 3.693 4.635 2.288 1.00 0.00 H new ATOM 0 HD12 LEU A 117 3.539 5.331 0.658 1.00 0.00 H new ATOM 0 HD13 LEU A 117 2.186 5.451 1.808 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.466 2.580 2.889 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.911 3.317 2.432 1.00 0.00 H new ATOM 0 HD23 LEU A 117 1.416 1.777 1.696 1.00 0.00 H new ATOM 1831 N GLN A 118 0.438 3.126 -3.267 1.00 0.00 N ATOM 1832 CA GLN A 118 -0.488 3.487 -4.334 1.00 0.00 C ATOM 1833 C GLN A 118 -1.266 2.266 -4.817 1.00 0.00 C ATOM 1834 O GLN A 118 -2.480 2.329 -5.016 1.00 0.00 O ATOM 1835 CB GLN A 118 0.269 4.119 -5.503 1.00 0.00 C ATOM 1836 CG GLN A 118 -0.612 4.954 -6.418 1.00 0.00 C ATOM 1837 CD GLN A 118 0.174 5.641 -7.518 1.00 0.00 C ATOM 1838 OE1 GLN A 118 1.404 5.609 -7.530 1.00 0.00 O ATOM 1839 NE2 GLN A 118 -0.535 6.268 -8.449 1.00 0.00 N ATOM 0 H GLN A 118 1.417 3.091 -3.552 1.00 0.00 H new ATOM 0 HA GLN A 118 -1.197 4.212 -3.935 1.00 0.00 H new ATOM 0 HB2 GLN A 118 1.069 4.747 -5.110 1.00 0.00 H new ATOM 0 HB3 GLN A 118 0.741 3.330 -6.088 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.373 4.315 -6.865 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.134 5.706 -5.826 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -1.554 6.269 -8.400 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -0.061 6.749 -9.214 1.00 0.00 H new ATOM 1848 N LEU A 119 -0.559 1.157 -5.003 1.00 0.00 N ATOM 1849 CA LEU A 119 -1.183 -0.079 -5.462 1.00 0.00 C ATOM 1850 C LEU A 119 -2.221 -0.571 -4.460 1.00 0.00 C ATOM 1851 O LEU A 119 -3.294 -1.040 -4.842 1.00 0.00 O ATOM 1852 CB LEU A 119 -0.121 -1.157 -5.684 1.00 0.00 C ATOM 1853 CG LEU A 119 0.510 -1.202 -7.076 1.00 0.00 C ATOM 1854 CD1 LEU A 119 -0.555 -1.046 -8.150 1.00 0.00 C ATOM 1855 CD2 LEU A 119 1.573 -0.121 -7.215 1.00 0.00 C ATOM 0 H LEU A 119 0.446 1.088 -4.843 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.687 0.127 -6.406 1.00 0.00 H new ATOM 0 HB2 LEU A 119 0.673 -1.012 -4.952 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -0.570 -2.129 -5.479 1.00 0.00 H new ATOM 0 HG LEU A 119 0.988 -2.173 -7.206 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -0.087 -1.080 -9.134 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.280 -1.856 -8.064 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -1.063 -0.090 -8.023 1.00 0.00 H new ATOM 0 HD21 LEU A 119 2.011 -0.168 -8.212 1.00 0.00 H new ATOM 0 HD22 LEU A 119 1.118 0.858 -7.064 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.352 -0.278 -6.468 1.00 0.00 H new ATOM 1867 N ILE A 120 -1.897 -0.458 -3.176 1.00 0.00 N ATOM 1868 CA ILE A 120 -2.803 -0.888 -2.119 1.00 0.00 C ATOM 1869 C ILE A 120 -4.112 -0.107 -2.165 1.00 0.00 C ATOM 1870 O ILE A 120 -5.196 -0.686 -2.094 1.00 0.00 O ATOM 1871 CB ILE A 120 -2.165 -0.719 -0.727 1.00 0.00 C ATOM 1872 CG1 ILE A 120 -0.877 -1.538 -0.629 1.00 0.00 C ATOM 1873 CG2 ILE A 120 -3.147 -1.132 0.359 1.00 0.00 C ATOM 1874 CD1 ILE A 120 -0.025 -1.183 0.569 1.00 0.00 C ATOM 0 H ILE A 120 -1.013 -0.072 -2.843 1.00 0.00 H new ATOM 0 HA ILE A 120 -3.008 -1.945 -2.290 1.00 0.00 H new ATOM 0 HB ILE A 120 -1.916 0.332 -0.583 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -1.132 -2.597 -0.582 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -0.292 -1.391 -1.537 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.682 -1.007 1.337 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -4.039 -0.508 0.299 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -3.425 -2.177 0.220 1.00 0.00 H new ATOM 0 HD11 ILE A 120 0.872 -1.803 0.574 1.00 0.00 H new ATOM 0 HD12 ILE A 120 0.260 -0.132 0.514 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -0.592 -1.357 1.483 1.00 0.00 H new ATOM 1886 N LEU A 121 -4.003 1.212 -2.285 1.00 0.00 N ATOM 1887 CA LEU A 121 -5.178 2.074 -2.343 1.00 0.00 C ATOM 1888 C LEU A 121 -5.971 1.829 -3.622 1.00 0.00 C ATOM 1889 O LEU A 121 -7.186 2.021 -3.658 1.00 0.00 O ATOM 1890 CB LEU A 121 -4.760 3.544 -2.263 1.00 0.00 C ATOM 1891 CG LEU A 121 -5.669 4.540 -2.984 1.00 0.00 C ATOM 1892 CD1 LEU A 121 -6.989 4.690 -2.244 1.00 0.00 C ATOM 1893 CD2 LEU A 121 -4.978 5.888 -3.123 1.00 0.00 C ATOM 0 H LEU A 121 -3.113 1.707 -2.344 1.00 0.00 H new ATOM 0 HA LEU A 121 -5.815 1.836 -1.491 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.704 3.828 -1.212 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -3.754 3.638 -2.673 1.00 0.00 H new ATOM 0 HG LEU A 121 -5.877 4.156 -3.983 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -7.623 5.403 -2.772 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -7.491 3.724 -2.196 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -6.800 5.051 -1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.639 6.584 -3.638 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.740 6.278 -2.134 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -4.059 5.768 -3.697 1.00 0.00 H new ATOM 1905 N GLY A 122 -5.276 1.400 -4.671 1.00 0.00 N ATOM 1906 CA GLY A 122 -5.932 1.133 -5.937 1.00 0.00 C ATOM 1907 C GLY A 122 -6.990 0.052 -5.825 1.00 0.00 C ATOM 1908 O GLY A 122 -7.997 0.085 -6.533 1.00 0.00 O ATOM 0 H GLY A 122 -4.270 1.233 -4.666 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -6.392 2.050 -6.305 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -5.186 0.832 -6.673 1.00 0.00 H new ATOM 1912 N CYS A 123 -6.761 -0.907 -4.936 1.00 0.00 N ATOM 1913 CA CYS A 123 -7.701 -2.004 -4.736 1.00 0.00 C ATOM 1914 C CYS A 123 -8.777 -1.620 -3.726 1.00 0.00 C ATOM 1915 O CYS A 123 -9.796 -2.300 -3.601 1.00 0.00 O ATOM 1916 CB CYS A 123 -6.962 -3.256 -4.260 1.00 0.00 C ATOM 1917 SG CYS A 123 -5.722 -3.869 -5.425 1.00 0.00 S ATOM 0 H CYS A 123 -5.933 -0.948 -4.342 1.00 0.00 H new ATOM 0 HA CYS A 123 -8.183 -2.216 -5.691 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -6.475 -3.038 -3.309 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -7.690 -4.045 -4.072 1.00 0.00 H new ATOM 0 HG CYS A 123 -6.196 -4.899 -6.061 1.00 0.00 H new ATOM 1923 N ALA A 124 -8.544 -0.527 -3.007 1.00 0.00 N ATOM 1924 CA ALA A 124 -9.494 -0.052 -2.009 1.00 0.00 C ATOM 1925 C ALA A 124 -10.516 0.894 -2.630 1.00 0.00 C ATOM 1926 O ALA A 124 -11.452 1.337 -1.964 1.00 0.00 O ATOM 1927 CB ALA A 124 -8.760 0.636 -0.868 1.00 0.00 C ATOM 0 H ALA A 124 -7.705 0.046 -3.097 1.00 0.00 H new ATOM 0 HA ALA A 124 -10.030 -0.915 -1.614 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -9.482 0.986 -0.130 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -8.074 -0.069 -0.399 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -8.198 1.485 -1.257 1.00 0.00 H new ATOM 1933 N VAL A 125 -10.331 1.200 -3.910 1.00 0.00 N ATOM 1934 CA VAL A 125 -11.238 2.094 -4.621 1.00 0.00 C ATOM 1935 C VAL A 125 -11.934 1.371 -5.769 1.00 0.00 C ATOM 1936 O VAL A 125 -12.788 1.940 -6.447 1.00 0.00 O ATOM 1937 CB VAL A 125 -10.493 3.321 -5.179 1.00 0.00 C ATOM 1938 CG1 VAL A 125 -10.098 4.264 -4.052 1.00 0.00 C ATOM 1939 CG2 VAL A 125 -9.272 2.887 -5.975 1.00 0.00 C ATOM 0 H VAL A 125 -9.562 0.842 -4.476 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.984 2.428 -3.900 1.00 0.00 H new ATOM 0 HB VAL A 125 -11.164 3.857 -5.851 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -9.573 5.125 -4.465 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -10.993 4.602 -3.529 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -9.445 3.742 -3.353 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -8.758 3.767 -6.362 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -8.596 2.327 -5.328 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -9.585 2.255 -6.806 1.00 0.00 H new ATOM 1949 N ASN A 126 -11.562 0.112 -5.980 1.00 0.00 N ATOM 1950 CA ASN A 126 -12.151 -0.690 -7.047 1.00 0.00 C ATOM 1951 C ASN A 126 -12.735 -1.987 -6.493 1.00 0.00 C ATOM 1952 O ASN A 126 -12.766 -3.008 -7.181 1.00 0.00 O ATOM 1953 CB ASN A 126 -11.102 -1.005 -8.115 1.00 0.00 C ATOM 1954 CG ASN A 126 -10.752 0.207 -8.957 1.00 0.00 C ATOM 1955 OD1 ASN A 126 -11.506 0.594 -9.851 1.00 0.00 O ATOM 1956 ND2 ASN A 126 -9.605 0.812 -8.675 1.00 0.00 N ATOM 0 H ASN A 126 -10.856 -0.374 -5.427 1.00 0.00 H new ATOM 0 HA ASN A 126 -12.958 -0.113 -7.499 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -10.200 -1.383 -7.634 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -11.474 -1.799 -8.763 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -9.317 1.633 -9.208 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -9.012 0.456 -7.925 1.00 0.00 H new ATOM 1963 N CYS A 127 -13.195 -1.937 -5.248 1.00 0.00 N ATOM 1964 CA CYS A 127 -13.778 -3.108 -4.602 1.00 0.00 C ATOM 1965 C CYS A 127 -15.206 -2.824 -4.148 1.00 0.00 C ATOM 1966 O CYS A 127 -15.730 -1.732 -4.366 1.00 0.00 O ATOM 1967 CB CYS A 127 -12.925 -3.534 -3.406 1.00 0.00 C ATOM 1968 SG CYS A 127 -12.968 -5.308 -3.063 1.00 0.00 S ATOM 0 H CYS A 127 -13.176 -1.099 -4.666 1.00 0.00 H new ATOM 0 HA CYS A 127 -13.802 -3.919 -5.329 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -11.892 -3.234 -3.585 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -13.264 -2.995 -2.521 1.00 0.00 H new ATOM 0 HG CYS A 127 -12.253 -5.938 -3.947 1.00 0.00 H new ATOM 1974 N GLU A 128 -15.829 -3.815 -3.518 1.00 0.00 N ATOM 1975 CA GLU A 128 -17.198 -3.671 -3.036 1.00 0.00 C ATOM 1976 C GLU A 128 -17.257 -2.726 -1.839 1.00 0.00 C ATOM 1977 O GLU A 128 -18.105 -1.836 -1.776 1.00 0.00 O ATOM 1978 CB GLU A 128 -17.773 -5.036 -2.651 1.00 0.00 C ATOM 1979 CG GLU A 128 -16.991 -5.737 -1.552 1.00 0.00 C ATOM 1980 CD GLU A 128 -17.547 -7.110 -1.227 1.00 0.00 C ATOM 1981 OE1 GLU A 128 -18.656 -7.183 -0.658 1.00 0.00 O ATOM 1982 OE2 GLU A 128 -16.872 -8.113 -1.543 1.00 0.00 O ATOM 0 H GLU A 128 -15.408 -4.725 -3.330 1.00 0.00 H new ATOM 0 HA GLU A 128 -17.797 -3.247 -3.842 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -18.805 -4.908 -2.326 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -17.794 -5.674 -3.534 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -15.949 -5.834 -1.857 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -17.004 -5.121 -0.653 1.00 0.00 H new ATOM 1989 N LYS A 129 -16.349 -2.926 -0.889 1.00 0.00 N ATOM 1990 CA LYS A 129 -16.295 -2.094 0.307 1.00 0.00 C ATOM 1991 C LYS A 129 -15.597 -0.769 0.016 1.00 0.00 C ATOM 1992 O LYS A 129 -15.537 0.114 0.872 1.00 0.00 O ATOM 1993 CB LYS A 129 -15.566 -2.830 1.433 1.00 0.00 C ATOM 1994 CG LYS A 129 -16.191 -4.168 1.789 1.00 0.00 C ATOM 1995 CD LYS A 129 -15.986 -4.507 3.256 1.00 0.00 C ATOM 1996 CE LYS A 129 -17.036 -3.843 4.133 1.00 0.00 C ATOM 1997 NZ LYS A 129 -16.611 -2.486 4.577 1.00 0.00 N ATOM 0 H LYS A 129 -15.640 -3.658 -0.925 1.00 0.00 H new ATOM 0 HA LYS A 129 -17.318 -1.885 0.621 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -14.528 -2.990 1.139 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -15.552 -2.197 2.320 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -17.258 -4.143 1.566 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -15.754 -4.951 1.169 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -16.029 -5.588 3.390 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -14.993 -4.186 3.569 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -17.974 -3.768 3.583 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -17.228 -4.467 5.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -16.827 -2.368 5.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -15.588 -2.376 4.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -17.121 -1.765 4.027 1.00 0.00 H new ATOM 2011 N LYS A 130 -15.072 -0.636 -1.197 1.00 0.00 N ATOM 2012 CA LYS A 130 -14.381 0.582 -1.603 1.00 0.00 C ATOM 2013 C LYS A 130 -15.003 1.808 -0.941 1.00 0.00 C ATOM 2014 O LYS A 130 -14.301 2.631 -0.355 1.00 0.00 O ATOM 2015 CB LYS A 130 -14.423 0.735 -3.125 1.00 0.00 C ATOM 2016 CG LYS A 130 -15.700 1.379 -3.636 1.00 0.00 C ATOM 2017 CD LYS A 130 -15.632 1.643 -5.131 1.00 0.00 C ATOM 2018 CE LYS A 130 -15.737 0.353 -5.930 1.00 0.00 C ATOM 2019 NZ LYS A 130 -15.818 0.613 -7.394 1.00 0.00 N ATOM 0 H LYS A 130 -15.112 -1.358 -1.917 1.00 0.00 H new ATOM 0 HA LYS A 130 -13.343 0.504 -1.281 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -13.571 1.334 -3.445 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -14.313 -0.248 -3.584 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -16.548 0.730 -3.418 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -15.872 2.317 -3.108 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -16.438 2.318 -5.419 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -14.695 2.145 -5.371 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -14.872 -0.276 -5.720 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -16.619 -0.202 -5.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -15.888 -0.291 -7.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -16.658 1.192 -7.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -14.965 1.120 -7.704 1.00 0.00 H new ATOM 2033 N GLN A 131 -16.324 1.920 -1.038 1.00 0.00 N ATOM 2034 CA GLN A 131 -17.040 3.045 -0.448 1.00 0.00 C ATOM 2035 C GLN A 131 -16.646 3.234 1.013 1.00 0.00 C ATOM 2036 O GLN A 131 -16.311 4.340 1.437 1.00 0.00 O ATOM 2037 CB GLN A 131 -18.550 2.829 -0.557 1.00 0.00 C ATOM 2038 CG GLN A 131 -19.079 2.938 -1.979 1.00 0.00 C ATOM 2039 CD GLN A 131 -19.621 4.318 -2.296 1.00 0.00 C ATOM 2040 OE1 GLN A 131 -20.267 4.951 -1.460 1.00 0.00 O ATOM 2041 NE2 GLN A 131 -19.361 4.792 -3.508 1.00 0.00 N ATOM 0 H GLN A 131 -16.920 1.246 -1.519 1.00 0.00 H new ATOM 0 HA GLN A 131 -16.768 3.946 -0.999 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -18.797 1.844 -0.161 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -19.060 3.562 0.069 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.280 2.696 -2.679 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.867 2.200 -2.127 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -18.822 4.233 -4.169 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -19.700 5.715 -3.778 1.00 0.00 H new ATOM 2050 N GLU A 132 -16.690 2.148 1.778 1.00 0.00 N ATOM 2051 CA GLU A 132 -16.338 2.196 3.193 1.00 0.00 C ATOM 2052 C GLU A 132 -14.989 2.878 3.395 1.00 0.00 C ATOM 2053 O GLU A 132 -14.705 3.413 4.468 1.00 0.00 O ATOM 2054 CB GLU A 132 -16.301 0.783 3.780 1.00 0.00 C ATOM 2055 CG GLU A 132 -16.693 0.724 5.247 1.00 0.00 C ATOM 2056 CD GLU A 132 -18.023 1.397 5.524 1.00 0.00 C ATOM 2057 OE1 GLU A 132 -19.071 0.755 5.303 1.00 0.00 O ATOM 2058 OE2 GLU A 132 -18.015 2.567 5.961 1.00 0.00 O ATOM 0 H GLU A 132 -16.966 1.225 1.443 1.00 0.00 H new ATOM 0 HA GLU A 132 -17.100 2.777 3.712 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -16.972 0.143 3.207 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -15.296 0.377 3.664 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -16.745 -0.318 5.564 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -15.917 1.201 5.846 1.00 0.00 H new ATOM 2065 N HIS A 133 -14.159 2.855 2.357 1.00 0.00 N ATOM 2066 CA HIS A 133 -12.838 3.472 2.420 1.00 0.00 C ATOM 2067 C HIS A 133 -12.879 4.898 1.881 1.00 0.00 C ATOM 2068 O HIS A 133 -12.342 5.820 2.496 1.00 0.00 O ATOM 2069 CB HIS A 133 -11.827 2.643 1.627 1.00 0.00 C ATOM 2070 CG HIS A 133 -11.667 1.244 2.139 1.00 0.00 C ATOM 2071 ND1 HIS A 133 -10.556 0.822 2.838 1.00 0.00 N ATOM 2072 CD2 HIS A 133 -12.486 0.170 2.052 1.00 0.00 C ATOM 2073 CE1 HIS A 133 -10.698 -0.453 3.157 1.00 0.00 C ATOM 2074 NE2 HIS A 133 -11.861 -0.872 2.692 1.00 0.00 N ATOM 0 H HIS A 133 -14.377 2.416 1.462 1.00 0.00 H new ATOM 0 HA HIS A 133 -12.529 3.506 3.465 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -12.139 2.606 0.583 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.859 3.144 1.653 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -13.451 0.138 1.569 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -9.984 -1.050 3.705 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -12.234 -1.816 2.792 1.00 0.00 H new ATOM 2083 N ILE A 134 -13.517 5.072 0.728 1.00 0.00 N ATOM 2084 CA ILE A 134 -13.626 6.387 0.107 1.00 0.00 C ATOM 2085 C ILE A 134 -13.883 7.468 1.151 1.00 0.00 C ATOM 2086 O ILE A 134 -13.355 8.576 1.056 1.00 0.00 O ATOM 2087 CB ILE A 134 -14.755 6.422 -0.940 1.00 0.00 C ATOM 2088 CG1 ILE A 134 -14.253 5.884 -2.281 1.00 0.00 C ATOM 2089 CG2 ILE A 134 -15.288 7.838 -1.098 1.00 0.00 C ATOM 2090 CD1 ILE A 134 -13.943 4.403 -2.261 1.00 0.00 C ATOM 0 H ILE A 134 -13.966 4.320 0.205 1.00 0.00 H new ATOM 0 HA ILE A 134 -12.675 6.582 -0.388 1.00 0.00 H new ATOM 0 HB ILE A 134 -15.569 5.785 -0.595 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -15.005 6.079 -3.046 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -13.355 6.431 -2.569 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -16.085 7.846 -1.841 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -15.679 8.188 -0.143 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -14.482 8.496 -1.423 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -13.592 4.091 -3.245 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -13.169 4.203 -1.520 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.844 3.846 -2.004 1.00 0.00 H new ATOM 2102 N LYS A 135 -14.696 7.139 2.149 1.00 0.00 N ATOM 2103 CA LYS A 135 -15.022 8.080 3.214 1.00 0.00 C ATOM 2104 C LYS A 135 -13.786 8.409 4.045 1.00 0.00 C ATOM 2105 O LYS A 135 -13.596 9.549 4.466 1.00 0.00 O ATOM 2106 CB LYS A 135 -16.117 7.504 4.115 1.00 0.00 C ATOM 2107 CG LYS A 135 -15.733 6.191 4.775 1.00 0.00 C ATOM 2108 CD LYS A 135 -16.604 5.900 5.986 1.00 0.00 C ATOM 2109 CE LYS A 135 -18.064 5.736 5.596 1.00 0.00 C ATOM 2110 NZ LYS A 135 -18.978 5.996 6.743 1.00 0.00 N ATOM 0 H LYS A 135 -15.142 6.226 2.243 1.00 0.00 H new ATOM 0 HA LYS A 135 -15.385 8.999 2.754 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -16.360 8.232 4.889 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -17.020 7.353 3.524 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -15.828 5.379 4.054 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -14.687 6.228 5.078 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -16.254 4.993 6.478 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -16.508 6.711 6.708 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -18.301 6.420 4.781 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -18.229 4.725 5.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -19.964 5.874 6.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -18.769 5.327 7.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -18.840 6.969 7.084 1.00 0.00 H new ATOM 2124 N ASN A 136 -12.949 7.403 4.277 1.00 0.00 N ATOM 2125 CA ASN A 136 -11.731 7.587 5.057 1.00 0.00 C ATOM 2126 C ASN A 136 -10.853 8.676 4.448 1.00 0.00 C ATOM 2127 O ASN A 136 -10.199 9.434 5.164 1.00 0.00 O ATOM 2128 CB ASN A 136 -10.950 6.274 5.140 1.00 0.00 C ATOM 2129 CG ASN A 136 -9.455 6.496 5.256 1.00 0.00 C ATOM 2130 OD1 ASN A 136 -9.006 7.469 5.862 1.00 0.00 O ATOM 2131 ND2 ASN A 136 -8.675 5.593 4.674 1.00 0.00 N ATOM 0 H ASN A 136 -13.092 6.452 3.936 1.00 0.00 H new ATOM 0 HA ASN A 136 -12.017 7.896 6.062 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -11.297 5.702 6.000 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -11.158 5.674 4.254 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -7.661 5.690 4.719 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -9.090 4.802 4.182 1.00 0.00 H new ATOM 2138 N ILE A 137 -10.845 8.747 3.121 1.00 0.00 N ATOM 2139 CA ILE A 137 -10.049 9.744 2.415 1.00 0.00 C ATOM 2140 C ILE A 137 -10.600 11.147 2.642 1.00 0.00 C ATOM 2141 O ILE A 137 -9.842 12.103 2.807 1.00 0.00 O ATOM 2142 CB ILE A 137 -10.005 9.460 0.902 1.00 0.00 C ATOM 2143 CG1 ILE A 137 -9.297 8.131 0.630 1.00 0.00 C ATOM 2144 CG2 ILE A 137 -9.307 10.597 0.170 1.00 0.00 C ATOM 2145 CD1 ILE A 137 -10.247 6.976 0.403 1.00 0.00 C ATOM 0 H ILE A 137 -11.380 8.127 2.513 1.00 0.00 H new ATOM 0 HA ILE A 137 -9.038 9.684 2.817 1.00 0.00 H new ATOM 0 HB ILE A 137 -11.027 9.388 0.531 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -8.657 8.242 -0.245 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -8.647 7.896 1.473 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -9.284 10.382 -0.898 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -9.849 11.527 0.341 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -8.287 10.698 0.542 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -9.676 6.067 0.216 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -10.870 6.838 1.287 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -10.881 7.190 -0.458 1.00 0.00 H new ATOM 2157 N MET A 138 -11.923 11.264 2.649 1.00 0.00 N ATOM 2158 CA MET A 138 -12.576 12.551 2.859 1.00 0.00 C ATOM 2159 C MET A 138 -12.240 13.113 4.237 1.00 0.00 C ATOM 2160 O MET A 138 -12.074 14.322 4.404 1.00 0.00 O ATOM 2161 CB MET A 138 -14.091 12.410 2.709 1.00 0.00 C ATOM 2162 CG MET A 138 -14.519 11.850 1.362 1.00 0.00 C ATOM 2163 SD MET A 138 -13.952 12.859 -0.021 1.00 0.00 S ATOM 2164 CE MET A 138 -12.396 12.060 -0.407 1.00 0.00 C ATOM 0 H MET A 138 -12.565 10.483 2.512 1.00 0.00 H new ATOM 0 HA MET A 138 -12.207 13.244 2.103 1.00 0.00 H new ATOM 0 HB2 MET A 138 -14.467 11.760 3.499 1.00 0.00 H new ATOM 0 HB3 MET A 138 -14.554 13.386 2.851 1.00 0.00 H new ATOM 0 HG2 MET A 138 -14.128 10.838 1.253 1.00 0.00 H new ATOM 0 HG3 MET A 138 -15.606 11.777 1.332 1.00 0.00 H new ATOM 0 HE1 MET A 138 -12.287 11.979 -1.489 1.00 0.00 H new ATOM 0 HE2 MET A 138 -11.574 12.650 -0.002 1.00 0.00 H new ATOM 0 HE3 MET A 138 -12.379 11.064 0.035 1.00 0.00 H new ATOM 2174 N THR A 139 -12.141 12.227 5.224 1.00 0.00 N ATOM 2175 CA THR A 139 -11.827 12.635 6.588 1.00 0.00 C ATOM 2176 C THR A 139 -10.375 13.086 6.706 1.00 0.00 C ATOM 2177 O THR A 139 -9.926 13.492 7.779 1.00 0.00 O ATOM 2178 CB THR A 139 -12.080 11.492 7.588 1.00 0.00 C ATOM 2179 OG1 THR A 139 -12.102 12.006 8.925 1.00 0.00 O ATOM 2180 CG2 THR A 139 -11.007 10.420 7.469 1.00 0.00 C ATOM 0 H THR A 139 -12.274 11.223 5.104 1.00 0.00 H new ATOM 0 HA THR A 139 -12.485 13.470 6.828 1.00 0.00 H new ATOM 0 HB THR A 139 -13.046 11.044 7.356 1.00 0.00 H new ATOM 0 HG1 THR A 139 -11.375 12.653 9.039 1.00 0.00 H new ATOM 0 HG21 THR A 139 -11.208 9.623 8.185 1.00 0.00 H new ATOM 0 HG22 THR A 139 -11.013 10.010 6.459 1.00 0.00 H new ATOM 0 HG23 THR A 139 -10.031 10.858 7.677 1.00 0.00 H new ATOM 2188 N LEU A 140 -9.646 13.012 5.599 1.00 0.00 N ATOM 2189 CA LEU A 140 -8.243 13.413 5.578 1.00 0.00 C ATOM 2190 C LEU A 140 -8.108 14.904 5.284 1.00 0.00 C ATOM 2191 O LEU A 140 -9.083 15.567 4.933 1.00 0.00 O ATOM 2192 CB LEU A 140 -7.476 12.604 4.531 1.00 0.00 C ATOM 2193 CG LEU A 140 -7.569 11.083 4.658 1.00 0.00 C ATOM 2194 CD1 LEU A 140 -6.719 10.406 3.594 1.00 0.00 C ATOM 2195 CD2 LEU A 140 -7.143 10.637 6.048 1.00 0.00 C ATOM 0 H LEU A 140 -10.002 12.678 4.704 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.819 13.215 6.563 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -7.839 12.889 3.543 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -6.425 12.889 4.579 1.00 0.00 H new ATOM 0 HG LEU A 140 -8.607 10.787 4.506 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.797 9.324 3.700 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.071 10.700 2.605 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -5.678 10.708 3.713 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.216 9.552 6.120 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -6.113 10.945 6.229 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -7.795 11.094 6.793 1.00 0.00 H new ATOM 2207 N GLU A 141 -6.893 15.422 5.428 1.00 0.00 N ATOM 2208 CA GLU A 141 -6.631 16.835 5.177 1.00 0.00 C ATOM 2209 C GLU A 141 -6.862 17.178 3.708 1.00 0.00 C ATOM 2210 O GLU A 141 -6.826 16.303 2.843 1.00 0.00 O ATOM 2211 CB GLU A 141 -5.196 17.189 5.575 1.00 0.00 C ATOM 2212 CG GLU A 141 -4.596 18.314 4.749 1.00 0.00 C ATOM 2213 CD GLU A 141 -3.272 18.803 5.304 1.00 0.00 C ATOM 2214 OE1 GLU A 141 -3.166 18.955 6.539 1.00 0.00 O ATOM 2215 OE2 GLU A 141 -2.342 19.033 4.503 1.00 0.00 O ATOM 0 H GLU A 141 -6.075 14.886 5.717 1.00 0.00 H new ATOM 0 HA GLU A 141 -7.323 17.420 5.783 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -5.179 17.473 6.627 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -4.571 16.302 5.474 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -4.452 17.971 3.725 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -5.299 19.146 4.710 1.00 0.00 H new ATOM 2222 N GLU A 142 -7.101 18.457 3.436 1.00 0.00 N ATOM 2223 CA GLU A 142 -7.340 18.915 2.072 1.00 0.00 C ATOM 2224 C GLU A 142 -6.191 18.511 1.153 1.00 0.00 C ATOM 2225 O GLU A 142 -6.407 17.927 0.092 1.00 0.00 O ATOM 2226 CB GLU A 142 -7.519 20.435 2.045 1.00 0.00 C ATOM 2227 CG GLU A 142 -8.412 20.923 0.917 1.00 0.00 C ATOM 2228 CD GLU A 142 -8.040 22.312 0.438 1.00 0.00 C ATOM 2229 OE1 GLU A 142 -7.196 22.417 -0.477 1.00 0.00 O ATOM 2230 OE2 GLU A 142 -8.592 23.294 0.977 1.00 0.00 O ATOM 0 H GLU A 142 -7.134 19.194 4.141 1.00 0.00 H new ATOM 0 HA GLU A 142 -8.254 18.442 1.712 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -7.940 20.760 2.997 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -6.540 20.906 1.952 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -8.349 20.226 0.082 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -9.449 20.924 1.254 1.00 0.00 H new ATOM 2237 N SER A 143 -4.969 18.828 1.569 1.00 0.00 N ATOM 2238 CA SER A 143 -3.785 18.502 0.782 1.00 0.00 C ATOM 2239 C SER A 143 -3.709 17.003 0.510 1.00 0.00 C ATOM 2240 O SER A 143 -3.735 16.566 -0.640 1.00 0.00 O ATOM 2241 CB SER A 143 -2.521 18.965 1.508 1.00 0.00 C ATOM 2242 OG SER A 143 -1.390 18.899 0.656 1.00 0.00 O ATOM 0 H SER A 143 -4.773 19.310 2.446 1.00 0.00 H new ATOM 0 HA SER A 143 -3.859 19.023 -0.172 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.655 19.987 1.861 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.354 18.343 2.387 1.00 0.00 H new ATOM 0 HG SER A 143 -0.595 19.202 1.143 1.00 0.00 H new ATOM 2248 N VAL A 144 -3.615 16.218 1.579 1.00 0.00 N ATOM 2249 CA VAL A 144 -3.536 14.767 1.458 1.00 0.00 C ATOM 2250 C VAL A 144 -4.663 14.227 0.586 1.00 0.00 C ATOM 2251 O VAL A 144 -4.438 13.386 -0.284 1.00 0.00 O ATOM 2252 CB VAL A 144 -3.595 14.085 2.838 1.00 0.00 C ATOM 2253 CG1 VAL A 144 -4.858 14.494 3.581 1.00 0.00 C ATOM 2254 CG2 VAL A 144 -3.521 12.573 2.687 1.00 0.00 C ATOM 0 H VAL A 144 -3.592 16.563 2.539 1.00 0.00 H new ATOM 0 HA VAL A 144 -2.578 14.539 0.990 1.00 0.00 H new ATOM 0 HB VAL A 144 -2.736 14.411 3.424 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -4.883 14.003 4.554 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -4.864 15.575 3.720 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -5.733 14.198 3.002 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -3.564 12.107 3.671 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -4.360 12.226 2.084 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -2.586 12.302 2.197 1.00 0.00 H new ATOM 2264 N GLN A 145 -5.876 14.715 0.827 1.00 0.00 N ATOM 2265 CA GLN A 145 -7.039 14.280 0.063 1.00 0.00 C ATOM 2266 C GLN A 145 -6.774 14.378 -1.436 1.00 0.00 C ATOM 2267 O GLN A 145 -7.160 13.496 -2.204 1.00 0.00 O ATOM 2268 CB GLN A 145 -8.262 15.121 0.432 1.00 0.00 C ATOM 2269 CG GLN A 145 -9.111 14.508 1.535 1.00 0.00 C ATOM 2270 CD GLN A 145 -10.314 15.361 1.886 1.00 0.00 C ATOM 2271 OE1 GLN A 145 -11.052 15.792 0.870 1.00 0.00 O flip ATOM 2272 NE2 GLN A 145 -10.578 15.630 3.059 1.00 0.00 N flip ATOM 0 H GLN A 145 -6.078 15.411 1.545 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.235 13.237 0.311 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -7.931 16.110 0.747 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -8.879 15.259 -0.456 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -9.449 13.520 1.222 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -8.498 14.367 2.425 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -9.984 15.278 3.809 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -11.391 16.205 3.280 1.00 0.00 H new ATOM 2281 N HIS A 146 -6.113 15.456 -1.846 1.00 0.00 N ATOM 2282 CA HIS A 146 -5.795 15.669 -3.253 1.00 0.00 C ATOM 2283 C HIS A 146 -4.914 14.544 -3.788 1.00 0.00 C ATOM 2284 O HIS A 146 -5.312 13.804 -4.688 1.00 0.00 O ATOM 2285 CB HIS A 146 -5.095 17.015 -3.442 1.00 0.00 C ATOM 2286 CG HIS A 146 -4.087 17.015 -4.550 1.00 0.00 C ATOM 2287 ND1 HIS A 146 -4.394 16.660 -5.847 1.00 0.00 N ATOM 2288 CD2 HIS A 146 -2.772 17.333 -4.550 1.00 0.00 C ATOM 2289 CE1 HIS A 146 -3.310 16.757 -6.595 1.00 0.00 C ATOM 2290 NE2 HIS A 146 -2.312 17.164 -5.833 1.00 0.00 N ATOM 0 H HIS A 146 -5.787 16.195 -1.224 1.00 0.00 H new ATOM 0 HA HIS A 146 -6.729 15.672 -3.814 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -5.845 17.780 -3.644 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -4.600 17.292 -2.511 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -2.192 17.659 -3.699 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -3.250 16.540 -7.651 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -1.355 17.327 -6.146 1.00 0.00 H new ATOM 2299 N VAL A 147 -3.714 14.422 -3.229 1.00 0.00 N ATOM 2300 CA VAL A 147 -2.777 13.387 -3.649 1.00 0.00 C ATOM 2301 C VAL A 147 -3.408 12.003 -3.556 1.00 0.00 C ATOM 2302 O VAL A 147 -3.267 11.182 -4.463 1.00 0.00 O ATOM 2303 CB VAL A 147 -1.494 13.413 -2.797 1.00 0.00 C ATOM 2304 CG1 VAL A 147 -0.556 12.289 -3.209 1.00 0.00 C ATOM 2305 CG2 VAL A 147 -0.804 14.764 -2.913 1.00 0.00 C ATOM 0 H VAL A 147 -3.368 15.027 -2.484 1.00 0.00 H new ATOM 0 HA VAL A 147 -2.519 13.596 -4.687 1.00 0.00 H new ATOM 0 HB VAL A 147 -1.769 13.260 -1.753 1.00 0.00 H new ATOM 0 HG11 VAL A 147 0.345 12.324 -2.596 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -1.054 11.330 -3.068 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -0.286 12.407 -4.258 1.00 0.00 H new ATOM 0 HG21 VAL A 147 0.100 14.764 -2.305 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -0.541 14.950 -3.954 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -1.477 15.547 -2.563 1.00 0.00 H new ATOM 2315 N VAL A 148 -4.106 11.749 -2.454 1.00 0.00 N ATOM 2316 CA VAL A 148 -4.761 10.464 -2.242 1.00 0.00 C ATOM 2317 C VAL A 148 -5.761 10.168 -3.354 1.00 0.00 C ATOM 2318 O VAL A 148 -5.863 9.035 -3.825 1.00 0.00 O ATOM 2319 CB VAL A 148 -5.491 10.423 -0.886 1.00 0.00 C ATOM 2320 CG1 VAL A 148 -6.544 9.324 -0.880 1.00 0.00 C ATOM 2321 CG2 VAL A 148 -4.497 10.226 0.248 1.00 0.00 C ATOM 0 H VAL A 148 -4.232 12.417 -1.694 1.00 0.00 H new ATOM 0 HA VAL A 148 -3.979 9.705 -2.248 1.00 0.00 H new ATOM 0 HB VAL A 148 -5.995 11.378 -0.735 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -7.050 9.310 0.086 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -7.273 9.514 -1.668 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -6.065 8.360 -1.053 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -5.030 10.199 1.198 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -3.963 9.286 0.105 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -3.784 11.051 0.255 1.00 0.00 H new ATOM 2331 N MET A 149 -6.496 11.193 -3.771 1.00 0.00 N ATOM 2332 CA MET A 149 -7.487 11.043 -4.830 1.00 0.00 C ATOM 2333 C MET A 149 -6.813 10.915 -6.192 1.00 0.00 C ATOM 2334 O MET A 149 -7.217 10.102 -7.024 1.00 0.00 O ATOM 2335 CB MET A 149 -8.447 12.234 -4.833 1.00 0.00 C ATOM 2336 CG MET A 149 -9.466 12.196 -3.705 1.00 0.00 C ATOM 2337 SD MET A 149 -10.987 11.347 -4.170 1.00 0.00 S ATOM 2338 CE MET A 149 -10.571 9.655 -3.754 1.00 0.00 C ATOM 0 H MET A 149 -6.424 12.137 -3.392 1.00 0.00 H new ATOM 0 HA MET A 149 -8.052 10.131 -4.637 1.00 0.00 H new ATOM 0 HB2 MET A 149 -7.870 13.156 -4.759 1.00 0.00 H new ATOM 0 HB3 MET A 149 -8.974 12.263 -5.787 1.00 0.00 H new ATOM 0 HG2 MET A 149 -9.027 11.698 -2.841 1.00 0.00 H new ATOM 0 HG3 MET A 149 -9.702 13.215 -3.400 1.00 0.00 H new ATOM 0 HE1 MET A 149 -11.397 9.201 -3.207 1.00 0.00 H new ATOM 0 HE2 MET A 149 -10.387 9.090 -4.668 1.00 0.00 H new ATOM 0 HE3 MET A 149 -9.675 9.643 -3.134 1.00 0.00 H new ATOM 2348 N THR A 150 -5.781 11.724 -6.415 1.00 0.00 N ATOM 2349 CA THR A 150 -5.052 11.703 -7.676 1.00 0.00 C ATOM 2350 C THR A 150 -4.485 10.317 -7.960 1.00 0.00 C ATOM 2351 O THR A 150 -4.531 9.837 -9.092 1.00 0.00 O ATOM 2352 CB THR A 150 -3.900 12.726 -7.676 1.00 0.00 C ATOM 2353 OG1 THR A 150 -4.420 14.049 -7.506 1.00 0.00 O ATOM 2354 CG2 THR A 150 -3.109 12.650 -8.973 1.00 0.00 C ATOM 0 H THR A 150 -5.432 12.402 -5.738 1.00 0.00 H new ATOM 0 HA THR A 150 -5.764 11.969 -8.457 1.00 0.00 H new ATOM 0 HB THR A 150 -3.233 12.489 -6.847 1.00 0.00 H new ATOM 0 HG1 THR A 150 -4.772 14.148 -6.597 1.00 0.00 H new ATOM 0 HG21 THR A 150 -2.301 13.381 -8.950 1.00 0.00 H new ATOM 0 HG22 THR A 150 -2.690 11.650 -9.086 1.00 0.00 H new ATOM 0 HG23 THR A 150 -3.768 12.864 -9.814 1.00 0.00 H new ATOM 2362 N ALA A 151 -3.950 9.678 -6.924 1.00 0.00 N ATOM 2363 CA ALA A 151 -3.377 8.345 -7.063 1.00 0.00 C ATOM 2364 C ALA A 151 -4.299 7.430 -7.861 1.00 0.00 C ATOM 2365 O ALA A 151 -3.857 6.730 -8.772 1.00 0.00 O ATOM 2366 CB ALA A 151 -3.094 7.747 -5.692 1.00 0.00 C ATOM 0 H ALA A 151 -3.902 10.062 -5.980 1.00 0.00 H new ATOM 0 HA ALA A 151 -2.438 8.436 -7.609 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -2.666 6.751 -5.811 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -2.390 8.383 -5.156 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -4.023 7.678 -5.126 1.00 0.00 H new ATOM 2372 N ILE A 152 -5.581 7.442 -7.513 1.00 0.00 N ATOM 2373 CA ILE A 152 -6.566 6.613 -8.198 1.00 0.00 C ATOM 2374 C ILE A 152 -6.573 6.894 -9.697 1.00 0.00 C ATOM 2375 O ILE A 152 -6.465 5.976 -10.510 1.00 0.00 O ATOM 2376 CB ILE A 152 -7.982 6.842 -7.638 1.00 0.00 C ATOM 2377 CG1 ILE A 152 -8.150 6.113 -6.303 1.00 0.00 C ATOM 2378 CG2 ILE A 152 -9.029 6.374 -8.638 1.00 0.00 C ATOM 2379 CD1 ILE A 152 -7.741 6.942 -5.106 1.00 0.00 C ATOM 0 H ILE A 152 -5.962 8.016 -6.761 1.00 0.00 H new ATOM 0 HA ILE A 152 -6.280 5.575 -8.026 1.00 0.00 H new ATOM 0 HB ILE A 152 -8.121 7.910 -7.468 1.00 0.00 H new ATOM 0 HG12 ILE A 152 -9.192 5.815 -6.190 1.00 0.00 H new ATOM 0 HG13 ILE A 152 -7.558 5.198 -6.321 1.00 0.00 H new ATOM 0 HG21 ILE A 152 -10.025 6.542 -8.228 1.00 0.00 H new ATOM 0 HG22 ILE A 152 -8.920 6.933 -9.567 1.00 0.00 H new ATOM 0 HG23 ILE A 152 -8.893 5.311 -8.836 1.00 0.00 H new ATOM 0 HD11 ILE A 152 -7.887 6.362 -4.195 1.00 0.00 H new ATOM 0 HD12 ILE A 152 -6.690 7.218 -5.196 1.00 0.00 H new ATOM 0 HD13 ILE A 152 -8.351 7.845 -5.063 1.00 0.00 H new ATOM 2391 N GLN A 153 -6.698 8.168 -10.054 1.00 0.00 N ATOM 2392 CA GLN A 153 -6.718 8.569 -11.456 1.00 0.00 C ATOM 2393 C GLN A 153 -5.508 8.012 -12.199 1.00 0.00 C ATOM 2394 O GLN A 153 -5.636 7.480 -13.301 1.00 0.00 O ATOM 2395 CB GLN A 153 -6.744 10.094 -11.571 1.00 0.00 C ATOM 2396 CG GLN A 153 -7.667 10.764 -10.567 1.00 0.00 C ATOM 2397 CD GLN A 153 -9.001 10.055 -10.435 1.00 0.00 C ATOM 2398 OE1 GLN A 153 -9.620 9.684 -11.433 1.00 0.00 O ATOM 2399 NE2 GLN A 153 -9.450 9.862 -9.201 1.00 0.00 N ATOM 0 H GLN A 153 -6.787 8.940 -9.393 1.00 0.00 H new ATOM 0 HA GLN A 153 -7.620 8.161 -11.912 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -5.733 10.478 -11.435 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -7.056 10.369 -12.579 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -7.178 10.794 -9.593 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -7.838 11.797 -10.870 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -8.904 10.186 -8.403 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -10.341 9.389 -9.051 1.00 0.00 H new ATOM 2408 N GLU A 154 -4.334 8.138 -11.587 1.00 0.00 N ATOM 2409 CA GLU A 154 -3.102 7.648 -12.193 1.00 0.00 C ATOM 2410 C GLU A 154 -3.137 6.130 -12.346 1.00 0.00 C ATOM 2411 O GLU A 154 -2.706 5.587 -13.364 1.00 0.00 O ATOM 2412 CB GLU A 154 -1.894 8.058 -11.347 1.00 0.00 C ATOM 2413 CG GLU A 154 -0.639 7.257 -11.649 1.00 0.00 C ATOM 2414 CD GLU A 154 0.631 8.054 -11.423 1.00 0.00 C ATOM 2415 OE1 GLU A 154 1.146 8.041 -10.285 1.00 0.00 O ATOM 2416 OE2 GLU A 154 1.110 8.691 -12.385 1.00 0.00 O ATOM 0 H GLU A 154 -4.211 8.575 -10.673 1.00 0.00 H new ATOM 0 HA GLU A 154 -3.012 8.094 -13.184 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -1.688 9.116 -11.512 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -2.144 7.942 -10.292 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -0.621 6.366 -11.021 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -0.670 6.916 -12.684 1.00 0.00 H new ATOM 2423 N LEU A 155 -3.652 5.451 -11.327 1.00 0.00 N ATOM 2424 CA LEU A 155 -3.744 3.995 -11.347 1.00 0.00 C ATOM 2425 C LEU A 155 -4.543 3.516 -12.555 1.00 0.00 C ATOM 2426 O LEU A 155 -4.179 2.536 -13.204 1.00 0.00 O ATOM 2427 CB LEU A 155 -4.394 3.488 -10.058 1.00 0.00 C ATOM 2428 CG LEU A 155 -3.476 3.385 -8.840 1.00 0.00 C ATOM 2429 CD1 LEU A 155 -4.269 3.574 -7.556 1.00 0.00 C ATOM 2430 CD2 LEU A 155 -2.751 2.046 -8.829 1.00 0.00 C ATOM 0 H LEU A 155 -4.012 5.885 -10.477 1.00 0.00 H new ATOM 0 HA LEU A 155 -2.734 3.593 -11.420 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -5.223 4.150 -9.808 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -4.819 2.503 -10.252 1.00 0.00 H new ATOM 0 HG LEU A 155 -2.731 4.178 -8.903 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -3.599 3.497 -6.700 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -4.741 4.557 -7.561 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -5.037 2.804 -7.486 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -2.102 1.991 -7.955 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -3.481 1.237 -8.791 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -2.150 1.950 -9.733 1.00 0.00 H new ATOM 2442 N MET A 156 -5.633 4.216 -12.853 1.00 0.00 N ATOM 2443 CA MET A 156 -6.482 3.864 -13.985 1.00 0.00 C ATOM 2444 C MET A 156 -5.843 4.301 -15.300 1.00 0.00 C ATOM 2445 O MET A 156 -6.163 3.770 -16.363 1.00 0.00 O ATOM 2446 CB MET A 156 -7.861 4.509 -13.836 1.00 0.00 C ATOM 2447 CG MET A 156 -8.423 4.423 -12.426 1.00 0.00 C ATOM 2448 SD MET A 156 -10.224 4.344 -12.400 1.00 0.00 S ATOM 2449 CE MET A 156 -10.527 4.098 -10.652 1.00 0.00 C ATOM 0 H MET A 156 -5.949 5.030 -12.326 1.00 0.00 H new ATOM 0 HA MET A 156 -6.596 2.780 -13.999 1.00 0.00 H new ATOM 0 HB2 MET A 156 -7.797 5.557 -14.129 1.00 0.00 H new ATOM 0 HB3 MET A 156 -8.555 4.027 -14.525 1.00 0.00 H new ATOM 0 HG2 MET A 156 -8.017 3.541 -11.931 1.00 0.00 H new ATOM 0 HG3 MET A 156 -8.093 5.290 -11.854 1.00 0.00 H new ATOM 0 HE1 MET A 156 -11.324 3.366 -10.520 1.00 0.00 H new ATOM 0 HE2 MET A 156 -9.618 3.735 -10.173 1.00 0.00 H new ATOM 0 HE3 MET A 156 -10.824 5.043 -10.198 1.00 0.00 H new ATOM 2459 N SER A 157 -4.938 5.271 -15.219 1.00 0.00 N ATOM 2460 CA SER A 157 -4.257 5.782 -16.403 1.00 0.00 C ATOM 2461 C SER A 157 -2.984 4.989 -16.682 1.00 0.00 C ATOM 2462 O SER A 157 -2.344 5.163 -17.719 1.00 0.00 O ATOM 2463 CB SER A 157 -3.920 7.263 -16.224 1.00 0.00 C ATOM 2464 OG SER A 157 -5.059 8.000 -15.814 1.00 0.00 O ATOM 0 H SER A 157 -4.659 5.719 -14.346 1.00 0.00 H new ATOM 0 HA SER A 157 -4.928 5.670 -17.255 1.00 0.00 H new ATOM 0 HB2 SER A 157 -3.127 7.372 -15.484 1.00 0.00 H new ATOM 0 HB3 SER A 157 -3.539 7.668 -17.161 1.00 0.00 H new ATOM 0 HG SER A 157 -5.141 7.960 -14.838 1.00 0.00 H new