USER MOD reduce.3.24.130724 H: found=0, std=0, add=1239, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1240 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 105 HIS : no HD1:sc= -0.839 K(o=-5.9,f=-7.3) USER MOD Set 1.2: A 139 HIS : no HE2:sc= -5.09! C(o=-5.9!,f=-7.9!) USER MOD Set 2.1: A 128 CYS SG : rot -109:sc= -2.05 USER MOD Set 2.2: A 132 THR OG1 : rot 55:sc= -0.652 USER MOD Set 3.1: A 38 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 113 MET CE :methyl -158:sc= -0.23 (180deg=-1.51!) USER MOD Set 3.3: A 121 ASN :FLIP amide:sc= -0.601 F(o=-1.8,f=-0.83) USER MOD Set 4.1: A 90 SER OG : rot -37:sc= 1.27 USER MOD Set 4.2: A 123 SER OG : rot 125:sc= 2.09 USER MOD Single : A 9 ASN :FLIP amide:sc= -2.45 F(o=-5.8!,f=-2.5) USER MOD Single : A 16 MET CE :methyl 168:sc= -2.05 (180deg=-2.51) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN :FLIP amide:sc= -2.99! C(o=-4.9!,f=-3!) USER MOD Single : A 28 MET CE :methyl -152:sc= -0.322 (180deg=-1.67!) USER MOD Single : A 34 THR OG1 : rot -80:sc= -0.51 USER MOD Single : A 35 THR OG1 : rot 50:sc= 0.538 USER MOD Single : A 41 ASN :FLIP amide:sc= -0.107 F(o=-0.95!,f=-0.11) USER MOD Single : A 46 CYS SG : rot 77:sc= 0.409 USER MOD Single : A 47 THR OG1 : rot -81:sc= 1.19 USER MOD Single : A 50 LYS NZ :NH3+ 142:sc= -0.474 (180deg=-0.946) USER MOD Single : A 52 THR OG1 : rot 180:sc=-0.00501 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -162:sc= -0.0906 (180deg=-0.764) USER MOD Single : A 60 HIS : no HD1:sc= -0.752 X(o=-0.75,f=-1.2) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -162:sc= 1.11 (180deg=1.1) USER MOD Single : A 64 SER OG : rot 180:sc= -1.91 USER MOD Single : A 65 SER OG : rot 67:sc= 0.509 USER MOD Single : A 67 HIS :FLIP no HD1:sc= -0.244 F(o=-0.78,f=-0.24) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 CYS SG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 81 THR OG1 : rot -110:sc= -1.38! USER MOD Single : A 84 ASN : amide:sc= -0.261 X(o=-0.26,f=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 21:sc= 0.647 USER MOD Single : A 95 LYS NZ :NH3+ 152:sc= -0.24 (180deg=-1.06) USER MOD Single : A 100 ASN :FLIP amide:sc= -0.205 F(o=-2.4!,f=-0.2) USER MOD Single : A 103 LYS NZ :NH3+ -154:sc= 1.52 (180deg=-0.21) USER MOD Single : A 104 LYS NZ :NH3+ -161:sc= -0.111 (180deg=-0.85) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0.00384 USER MOD Single : A 112 SER OG : rot 59:sc= 0.844 USER MOD Single : A 115 ASN : amide:sc= -4.09! C(o=-4.1!,f=-6.7!) USER MOD Single : A 119 ASN : amide:sc= -0.131 K(o=-0.13,f=-1.2) USER MOD Single : A 120 THR OG1 : rot 63:sc= 0.114 USER MOD Single : A 124 GLN : amide:sc=-0.00213 K(o=-0.0021,f=-1.5!) USER MOD Single : A 129 THR OG1 : rot 120:sc= -0.0819 USER MOD Single : A 131 LYS NZ :NH3+ -158:sc= 0.587 (180deg=0.254) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 GLN : amide:sc= -0.019 K(o=-0.019,f=-0.87) USER MOD Single : A 149 MET CE :methyl 154:sc= -0.181 (180deg=-0.988) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 LYS NZ :NH3+ -114:sc= -4.53! (180deg=-10.6!) USER MOD Single : A 160 SER OG : rot 180:sc= -0.117 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 165 THR OG1 : rot 85:sc= 0.903 USER MOD Single : A 167 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0361) USER MOD Single : A 168 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0887) USER MOD Single : A 174 CYS SG : rot 6:sc= -2.62 USER MOD Single : A 176 GLN : amide:sc= -3.32 K(o=-3.3,f=-7!) USER MOD Single : A 178 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 104 N ASN A 9 2.715 3.133 19.336 1.00 0.00 N ATOM 105 CA ASN A 9 2.128 3.249 17.970 1.00 0.00 C ATOM 106 C ASN A 9 2.915 2.356 17.001 1.00 0.00 C ATOM 107 O ASN A 9 4.129 2.322 17.037 1.00 0.00 O ATOM 108 CB ASN A 9 2.212 4.705 17.504 1.00 0.00 C ATOM 109 CG ASN A 9 1.739 4.805 16.053 1.00 0.00 C ATOM 110 OD1 ASN A 9 2.458 4.267 15.106 1.00 0.00 O flip ATOM 111 ND2 ASN A 9 0.704 5.379 15.777 1.00 0.00 N flip ATOM 0 HA ASN A 9 1.085 2.933 17.991 1.00 0.00 H new ATOM 0 HB2 ASN A 9 1.596 5.338 18.143 1.00 0.00 H new ATOM 0 HB3 ASN A 9 3.237 5.067 17.589 1.00 0.00 H new ATOM 0 HD21 ASN A 9 0.141 5.800 16.516 1.00 0.00 H new ATOM 0 HD22 ASN A 9 0.398 5.440 14.806 1.00 0.00 H new ATOM 118 N PRO A 10 2.234 1.636 16.142 1.00 0.00 N ATOM 119 CA PRO A 10 2.894 0.728 15.154 1.00 0.00 C ATOM 120 C PRO A 10 3.533 1.491 13.988 1.00 0.00 C ATOM 121 O PRO A 10 2.973 2.440 13.475 1.00 0.00 O ATOM 122 CB PRO A 10 1.738 -0.136 14.647 1.00 0.00 C ATOM 123 CG PRO A 10 0.542 0.748 14.753 1.00 0.00 C ATOM 124 CD PRO A 10 0.764 1.598 16.005 1.00 0.00 C ATOM 0 HA PRO A 10 3.710 0.163 15.605 1.00 0.00 H new ATOM 0 HB2 PRO A 10 1.904 -0.459 13.619 1.00 0.00 H new ATOM 0 HB3 PRO A 10 1.621 -1.037 15.249 1.00 0.00 H new ATOM 0 HG2 PRO A 10 0.439 1.375 13.867 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -0.373 0.161 14.836 1.00 0.00 H new ATOM 0 HD2 PRO A 10 0.346 2.598 15.890 1.00 0.00 H new ATOM 0 HD3 PRO A 10 0.291 1.153 16.881 1.00 0.00 H new ATOM 132 N ARG A 11 4.691 1.070 13.555 1.00 0.00 N ATOM 133 CA ARG A 11 5.363 1.749 12.409 1.00 0.00 C ATOM 134 C ARG A 11 5.844 0.687 11.419 1.00 0.00 C ATOM 135 O ARG A 11 6.448 -0.295 11.799 1.00 0.00 O ATOM 136 CB ARG A 11 6.556 2.563 12.914 1.00 0.00 C ATOM 137 CG ARG A 11 6.051 3.747 13.741 1.00 0.00 C ATOM 138 CD ARG A 11 7.232 4.633 14.141 1.00 0.00 C ATOM 139 NE ARG A 11 6.752 5.728 15.029 1.00 0.00 N ATOM 140 CZ ARG A 11 6.374 5.463 16.249 1.00 0.00 C ATOM 141 NH1 ARG A 11 6.424 4.240 16.699 1.00 0.00 N ATOM 142 NH2 ARG A 11 5.945 6.424 17.021 1.00 0.00 N ATOM 0 H ARG A 11 5.203 0.280 13.948 1.00 0.00 H new ATOM 0 HA ARG A 11 4.661 2.422 11.917 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.209 1.934 13.520 1.00 0.00 H new ATOM 0 HB3 ARG A 11 7.149 2.920 12.072 1.00 0.00 H new ATOM 0 HG2 ARG A 11 5.329 4.325 13.164 1.00 0.00 H new ATOM 0 HG3 ARG A 11 5.534 3.388 14.631 1.00 0.00 H new ATOM 0 HD2 ARG A 11 7.989 4.039 14.654 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.704 5.052 13.252 1.00 0.00 H new ATOM 0 HE ARG A 11 6.719 6.687 14.683 1.00 0.00 H new ATOM 0 HH11 ARG A 11 6.759 3.488 16.097 1.00 0.00 H new ATOM 0 HH12 ARG A 11 6.128 4.035 17.653 1.00 0.00 H new ATOM 0 HH21 ARG A 11 5.906 7.381 16.670 1.00 0.00 H new ATOM 0 HH22 ARG A 11 5.649 6.218 17.975 1.00 0.00 H new ATOM 156 N VAL A 12 5.578 0.873 10.155 1.00 0.00 N ATOM 157 CA VAL A 12 6.016 -0.130 9.140 1.00 0.00 C ATOM 158 C VAL A 12 6.620 0.588 7.933 1.00 0.00 C ATOM 159 O VAL A 12 6.164 1.641 7.533 1.00 0.00 O ATOM 160 CB VAL A 12 4.807 -0.958 8.696 1.00 0.00 C ATOM 161 CG1 VAL A 12 3.804 -0.055 7.977 1.00 0.00 C ATOM 162 CG2 VAL A 12 5.265 -2.069 7.749 1.00 0.00 C ATOM 0 H VAL A 12 5.075 1.677 9.780 1.00 0.00 H new ATOM 0 HA VAL A 12 6.768 -0.787 9.577 1.00 0.00 H new ATOM 0 HB VAL A 12 4.333 -1.402 9.571 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.944 -0.646 7.661 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.474 0.734 8.653 1.00 0.00 H new ATOM 0 HG13 VAL A 12 4.278 0.392 7.103 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.403 -2.657 7.434 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.742 -1.628 6.874 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.977 -2.715 8.263 1.00 0.00 H new ATOM 172 N PHE A 13 7.641 0.022 7.351 1.00 0.00 N ATOM 173 CA PHE A 13 8.283 0.663 6.166 1.00 0.00 C ATOM 174 C PHE A 13 8.607 -0.412 5.127 1.00 0.00 C ATOM 175 O PHE A 13 8.790 -1.567 5.455 1.00 0.00 O ATOM 176 CB PHE A 13 9.574 1.358 6.604 1.00 0.00 C ATOM 177 CG PHE A 13 10.578 0.321 7.049 1.00 0.00 C ATOM 178 CD1 PHE A 13 10.519 -0.198 8.347 1.00 0.00 C ATOM 179 CD2 PHE A 13 11.567 -0.121 6.163 1.00 0.00 C ATOM 180 CE1 PHE A 13 11.449 -1.159 8.760 1.00 0.00 C ATOM 181 CE2 PHE A 13 12.497 -1.082 6.575 1.00 0.00 C ATOM 182 CZ PHE A 13 12.439 -1.601 7.874 1.00 0.00 C ATOM 0 H PHE A 13 8.061 -0.860 7.645 1.00 0.00 H new ATOM 0 HA PHE A 13 7.605 1.398 5.731 1.00 0.00 H new ATOM 0 HB2 PHE A 13 9.981 1.944 5.780 1.00 0.00 H new ATOM 0 HB3 PHE A 13 9.367 2.053 7.418 1.00 0.00 H new ATOM 0 HD1 PHE A 13 9.756 0.143 9.031 1.00 0.00 H new ATOM 0 HD2 PHE A 13 11.612 0.280 5.161 1.00 0.00 H new ATOM 0 HE1 PHE A 13 11.403 -1.560 9.762 1.00 0.00 H new ATOM 0 HE2 PHE A 13 13.260 -1.423 5.891 1.00 0.00 H new ATOM 0 HZ PHE A 13 13.157 -2.342 8.192 1.00 0.00 H new ATOM 192 N PHE A 14 8.679 -0.038 3.877 1.00 0.00 N ATOM 193 CA PHE A 14 8.991 -1.036 2.812 1.00 0.00 C ATOM 194 C PHE A 14 10.217 -0.578 2.015 1.00 0.00 C ATOM 195 O PHE A 14 10.350 0.578 1.669 1.00 0.00 O ATOM 196 CB PHE A 14 7.786 -1.161 1.878 1.00 0.00 C ATOM 197 CG PHE A 14 6.624 -1.751 2.642 1.00 0.00 C ATOM 198 CD1 PHE A 14 6.504 -3.140 2.770 1.00 0.00 C ATOM 199 CD2 PHE A 14 5.670 -0.910 3.225 1.00 0.00 C ATOM 200 CE1 PHE A 14 5.428 -3.688 3.479 1.00 0.00 C ATOM 201 CE2 PHE A 14 4.593 -1.459 3.935 1.00 0.00 C ATOM 202 CZ PHE A 14 4.474 -2.847 4.062 1.00 0.00 C ATOM 0 H PHE A 14 8.535 0.916 3.547 1.00 0.00 H new ATOM 0 HA PHE A 14 9.206 -2.003 3.267 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.516 -0.183 1.480 1.00 0.00 H new ATOM 0 HB3 PHE A 14 8.035 -1.794 1.026 1.00 0.00 H new ATOM 0 HD1 PHE A 14 7.242 -3.789 2.322 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.763 0.162 3.128 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.335 -4.760 3.576 1.00 0.00 H new ATOM 0 HE2 PHE A 14 3.855 -0.810 4.384 1.00 0.00 H new ATOM 0 HZ PHE A 14 3.645 -3.270 4.610 1.00 0.00 H new ATOM 212 N ASP A 15 11.107 -1.485 1.712 1.00 0.00 N ATOM 213 CA ASP A 15 12.321 -1.114 0.926 1.00 0.00 C ATOM 214 C ASP A 15 12.041 -1.357 -0.557 1.00 0.00 C ATOM 215 O ASP A 15 11.781 -2.470 -0.967 1.00 0.00 O ATOM 216 CB ASP A 15 13.503 -1.977 1.372 1.00 0.00 C ATOM 217 CG ASP A 15 14.776 -1.506 0.664 1.00 0.00 C ATOM 218 OD1 ASP A 15 14.709 -0.503 -0.028 1.00 0.00 O ATOM 219 OD2 ASP A 15 15.796 -2.156 0.825 1.00 0.00 O ATOM 0 H ASP A 15 11.046 -2.469 1.975 1.00 0.00 H new ATOM 0 HA ASP A 15 12.563 -0.064 1.091 1.00 0.00 H new ATOM 0 HB2 ASP A 15 13.629 -1.909 2.453 1.00 0.00 H new ATOM 0 HB3 ASP A 15 13.311 -3.024 1.139 1.00 0.00 H new ATOM 224 N MET A 16 12.077 -0.330 -1.365 1.00 0.00 N ATOM 225 CA MET A 16 11.792 -0.516 -2.818 1.00 0.00 C ATOM 226 C MET A 16 13.055 -0.277 -3.645 1.00 0.00 C ATOM 227 O MET A 16 13.928 0.480 -3.271 1.00 0.00 O ATOM 228 CB MET A 16 10.709 0.470 -3.254 1.00 0.00 C ATOM 229 CG MET A 16 9.418 0.171 -2.491 1.00 0.00 C ATOM 230 SD MET A 16 8.047 1.094 -3.230 1.00 0.00 S ATOM 231 CE MET A 16 7.856 0.077 -4.716 1.00 0.00 C ATOM 0 H MET A 16 12.291 0.627 -1.083 1.00 0.00 H new ATOM 0 HA MET A 16 11.451 -1.539 -2.981 1.00 0.00 H new ATOM 0 HB2 MET A 16 11.032 1.493 -3.059 1.00 0.00 H new ATOM 0 HB3 MET A 16 10.538 0.389 -4.327 1.00 0.00 H new ATOM 0 HG2 MET A 16 9.207 -0.898 -2.519 1.00 0.00 H new ATOM 0 HG3 MET A 16 9.531 0.446 -1.442 1.00 0.00 H new ATOM 0 HE1 MET A 16 6.924 0.338 -5.218 1.00 0.00 H new ATOM 0 HE2 MET A 16 8.694 0.256 -5.390 1.00 0.00 H new ATOM 0 HE3 MET A 16 7.835 -0.976 -4.436 1.00 0.00 H new ATOM 241 N SER A 17 13.149 -0.925 -4.775 1.00 0.00 N ATOM 242 CA SER A 17 14.340 -0.755 -5.653 1.00 0.00 C ATOM 243 C SER A 17 13.884 -0.784 -7.114 1.00 0.00 C ATOM 244 O SER A 17 12.791 -1.218 -7.418 1.00 0.00 O ATOM 245 CB SER A 17 15.322 -1.899 -5.401 1.00 0.00 C ATOM 246 OG SER A 17 14.759 -3.114 -5.875 1.00 0.00 O ATOM 0 H SER A 17 12.444 -1.571 -5.130 1.00 0.00 H new ATOM 0 HA SER A 17 14.830 0.194 -5.438 1.00 0.00 H new ATOM 0 HB2 SER A 17 16.267 -1.701 -5.907 1.00 0.00 H new ATOM 0 HB3 SER A 17 15.541 -1.977 -4.336 1.00 0.00 H new ATOM 0 HG SER A 17 15.387 -3.849 -5.716 1.00 0.00 H new ATOM 252 N VAL A 18 14.705 -0.322 -8.020 1.00 0.00 N ATOM 253 CA VAL A 18 14.307 -0.325 -9.460 1.00 0.00 C ATOM 254 C VAL A 18 15.373 -1.043 -10.288 1.00 0.00 C ATOM 255 O VAL A 18 16.555 -0.934 -10.028 1.00 0.00 O ATOM 256 CB VAL A 18 14.171 1.118 -9.951 1.00 0.00 C ATOM 257 CG1 VAL A 18 13.136 1.852 -9.096 1.00 0.00 C ATOM 258 CG2 VAL A 18 15.523 1.825 -9.832 1.00 0.00 C ATOM 0 H VAL A 18 15.632 0.057 -7.827 1.00 0.00 H new ATOM 0 HA VAL A 18 13.354 -0.843 -9.570 1.00 0.00 H new ATOM 0 HB VAL A 18 13.849 1.119 -10.992 1.00 0.00 H new ATOM 0 HG11 VAL A 18 13.039 2.880 -9.445 1.00 0.00 H new ATOM 0 HG12 VAL A 18 12.173 1.348 -9.178 1.00 0.00 H new ATOM 0 HG13 VAL A 18 13.458 1.852 -8.055 1.00 0.00 H new ATOM 0 HG21 VAL A 18 15.428 2.853 -10.181 1.00 0.00 H new ATOM 0 HG22 VAL A 18 15.844 1.824 -8.790 1.00 0.00 H new ATOM 0 HG23 VAL A 18 16.262 1.302 -10.440 1.00 0.00 H new ATOM 268 N GLY A 19 14.962 -1.776 -11.288 1.00 0.00 N ATOM 269 CA GLY A 19 15.947 -2.502 -12.141 1.00 0.00 C ATOM 270 C GLY A 19 16.948 -3.248 -11.257 1.00 0.00 C ATOM 271 O GLY A 19 17.958 -3.737 -11.724 1.00 0.00 O ATOM 0 H GLY A 19 13.985 -1.903 -11.551 1.00 0.00 H new ATOM 0 HA2 GLY A 19 15.429 -3.205 -12.793 1.00 0.00 H new ATOM 0 HA3 GLY A 19 16.472 -1.798 -12.786 1.00 0.00 H new ATOM 275 N GLY A 20 16.678 -3.341 -9.983 1.00 0.00 N ATOM 276 CA GLY A 20 17.615 -4.055 -9.065 1.00 0.00 C ATOM 277 C GLY A 20 18.523 -3.039 -8.369 1.00 0.00 C ATOM 278 O GLY A 20 19.184 -3.345 -7.398 1.00 0.00 O ATOM 0 H GLY A 20 15.847 -2.953 -9.536 1.00 0.00 H new ATOM 0 HA2 GLY A 20 17.052 -4.623 -8.324 1.00 0.00 H new ATOM 0 HA3 GLY A 20 18.216 -4.771 -9.626 1.00 0.00 H new ATOM 282 N GLN A 21 18.554 -1.826 -8.856 1.00 0.00 N ATOM 283 CA GLN A 21 19.416 -0.788 -8.218 1.00 0.00 C ATOM 284 C GLN A 21 18.656 -0.155 -7.047 1.00 0.00 C ATOM 285 O GLN A 21 17.443 -0.088 -7.057 1.00 0.00 O ATOM 286 CB GLN A 21 19.763 0.291 -9.250 1.00 0.00 C ATOM 287 CG GLN A 21 20.938 -0.179 -10.112 1.00 0.00 C ATOM 288 CD GLN A 21 20.611 -1.544 -10.723 1.00 0.00 C ATOM 289 OE1 GLN A 21 19.414 -1.765 -11.193 1.00 0.00 O flip ATOM 290 NE2 GLN A 21 21.453 -2.419 -10.773 1.00 0.00 N flip ATOM 0 H GLN A 21 18.021 -1.510 -9.666 1.00 0.00 H new ATOM 0 HA GLN A 21 20.335 -1.245 -7.852 1.00 0.00 H new ATOM 0 HB2 GLN A 21 18.897 0.498 -9.879 1.00 0.00 H new ATOM 0 HB3 GLN A 21 20.020 1.222 -8.745 1.00 0.00 H new ATOM 0 HG2 GLN A 21 21.136 0.546 -10.901 1.00 0.00 H new ATOM 0 HG3 GLN A 21 21.842 -0.247 -9.507 1.00 0.00 H new ATOM 0 HE21 GLN A 21 22.389 -2.248 -10.406 1.00 0.00 H new ATOM 0 HE22 GLN A 21 21.224 -3.325 -11.182 1.00 0.00 H new ATOM 299 N PRO A 22 19.361 0.305 -6.046 1.00 0.00 N ATOM 300 CA PRO A 22 18.733 0.941 -4.848 1.00 0.00 C ATOM 301 C PRO A 22 17.955 2.211 -5.213 1.00 0.00 C ATOM 302 O PRO A 22 18.411 3.027 -5.990 1.00 0.00 O ATOM 303 CB PRO A 22 19.920 1.271 -3.931 1.00 0.00 C ATOM 304 CG PRO A 22 21.126 1.262 -4.814 1.00 0.00 C ATOM 305 CD PRO A 22 20.827 0.278 -5.943 1.00 0.00 C ATOM 0 HA PRO A 22 18.003 0.283 -4.377 1.00 0.00 H new ATOM 0 HB2 PRO A 22 19.790 2.243 -3.456 1.00 0.00 H new ATOM 0 HB3 PRO A 22 20.014 0.536 -3.132 1.00 0.00 H new ATOM 0 HG2 PRO A 22 21.325 2.258 -5.210 1.00 0.00 H new ATOM 0 HG3 PRO A 22 22.012 0.957 -4.258 1.00 0.00 H new ATOM 0 HD2 PRO A 22 21.300 0.583 -6.876 1.00 0.00 H new ATOM 0 HD3 PRO A 22 21.194 -0.722 -5.711 1.00 0.00 H new ATOM 313 N ALA A 23 16.785 2.381 -4.654 1.00 0.00 N ATOM 314 CA ALA A 23 15.972 3.595 -4.960 1.00 0.00 C ATOM 315 C ALA A 23 15.894 4.480 -3.715 1.00 0.00 C ATOM 316 O ALA A 23 16.402 5.583 -3.692 1.00 0.00 O ATOM 317 CB ALA A 23 14.561 3.170 -5.369 1.00 0.00 C ATOM 0 H ALA A 23 16.357 1.729 -3.997 1.00 0.00 H new ATOM 0 HA ALA A 23 16.437 4.150 -5.774 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.965 4.055 -5.593 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.614 2.535 -6.253 1.00 0.00 H new ATOM 0 HB3 ALA A 23 14.097 2.617 -4.553 1.00 0.00 H new ATOM 323 N GLY A 24 15.258 4.004 -2.679 1.00 0.00 N ATOM 324 CA GLY A 24 15.144 4.816 -1.435 1.00 0.00 C ATOM 325 C GLY A 24 14.335 4.039 -0.395 1.00 0.00 C ATOM 326 O GLY A 24 14.043 2.873 -0.570 1.00 0.00 O ATOM 0 H GLY A 24 14.812 3.087 -2.641 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.136 5.044 -1.044 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.660 5.768 -1.652 1.00 0.00 H new ATOM 330 N ARG A 25 13.967 4.678 0.685 1.00 0.00 N ATOM 331 CA ARG A 25 13.171 3.979 1.738 1.00 0.00 C ATOM 332 C ARG A 25 11.802 4.642 1.867 1.00 0.00 C ATOM 333 O ARG A 25 11.671 5.845 1.756 1.00 0.00 O ATOM 334 CB ARG A 25 13.895 4.080 3.084 1.00 0.00 C ATOM 335 CG ARG A 25 15.216 3.311 3.025 1.00 0.00 C ATOM 336 CD ARG A 25 15.855 3.304 4.415 1.00 0.00 C ATOM 337 NE ARG A 25 17.230 2.737 4.327 1.00 0.00 N ATOM 338 CZ ARG A 25 17.840 2.336 5.409 1.00 0.00 C ATOM 339 NH1 ARG A 25 17.244 2.429 6.566 1.00 0.00 N ATOM 340 NH2 ARG A 25 19.046 1.840 5.334 1.00 0.00 N ATOM 0 H ARG A 25 14.183 5.655 0.884 1.00 0.00 H new ATOM 0 HA ARG A 25 13.053 2.932 1.459 1.00 0.00 H new ATOM 0 HB2 ARG A 25 14.084 5.126 3.327 1.00 0.00 H new ATOM 0 HB3 ARG A 25 13.265 3.677 3.877 1.00 0.00 H new ATOM 0 HG2 ARG A 25 15.042 2.290 2.686 1.00 0.00 H new ATOM 0 HG3 ARG A 25 15.889 3.775 2.304 1.00 0.00 H new ATOM 0 HD2 ARG A 25 15.893 4.317 4.815 1.00 0.00 H new ATOM 0 HD3 ARG A 25 15.250 2.713 5.102 1.00 0.00 H new ATOM 0 HE ARG A 25 17.694 2.662 3.422 1.00 0.00 H new ATOM 0 HH11 ARG A 25 16.302 2.815 6.625 1.00 0.00 H new ATOM 0 HH12 ARG A 25 17.720 2.116 7.412 1.00 0.00 H new ATOM 0 HH21 ARG A 25 19.512 1.766 4.430 1.00 0.00 H new ATOM 0 HH22 ARG A 25 19.522 1.527 6.180 1.00 0.00 H new ATOM 354 N ILE A 26 10.781 3.866 2.115 1.00 0.00 N ATOM 355 CA ILE A 26 9.416 4.439 2.270 1.00 0.00 C ATOM 356 C ILE A 26 8.889 4.077 3.654 1.00 0.00 C ATOM 357 O ILE A 26 8.804 2.918 4.010 1.00 0.00 O ATOM 358 CB ILE A 26 8.488 3.861 1.201 1.00 0.00 C ATOM 359 CG1 ILE A 26 9.037 4.205 -0.185 1.00 0.00 C ATOM 360 CG2 ILE A 26 7.089 4.458 1.360 1.00 0.00 C ATOM 361 CD1 ILE A 26 8.212 3.493 -1.259 1.00 0.00 C ATOM 0 H ILE A 26 10.836 2.853 2.217 1.00 0.00 H new ATOM 0 HA ILE A 26 9.454 5.522 2.157 1.00 0.00 H new ATOM 0 HB ILE A 26 8.432 2.778 1.313 1.00 0.00 H new ATOM 0 HG12 ILE A 26 9.003 5.283 -0.342 1.00 0.00 H new ATOM 0 HG13 ILE A 26 10.082 3.905 -0.257 1.00 0.00 H new ATOM 0 HG21 ILE A 26 6.428 4.045 0.597 1.00 0.00 H new ATOM 0 HG22 ILE A 26 6.699 4.214 2.348 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.141 5.541 1.248 1.00 0.00 H new ATOM 0 HD11 ILE A 26 8.606 3.741 -2.245 1.00 0.00 H new ATOM 0 HD12 ILE A 26 8.268 2.415 -1.106 1.00 0.00 H new ATOM 0 HD13 ILE A 26 7.173 3.815 -1.193 1.00 0.00 H new ATOM 373 N VAL A 27 8.532 5.056 4.438 1.00 0.00 N ATOM 374 CA VAL A 27 8.010 4.768 5.801 1.00 0.00 C ATOM 375 C VAL A 27 6.576 5.287 5.909 1.00 0.00 C ATOM 376 O VAL A 27 6.281 6.403 5.527 1.00 0.00 O ATOM 377 CB VAL A 27 8.890 5.469 6.839 1.00 0.00 C ATOM 378 CG1 VAL A 27 8.439 5.070 8.246 1.00 0.00 C ATOM 379 CG2 VAL A 27 10.350 5.054 6.632 1.00 0.00 C ATOM 0 H VAL A 27 8.580 6.045 4.192 1.00 0.00 H new ATOM 0 HA VAL A 27 8.023 3.693 5.983 1.00 0.00 H new ATOM 0 HB VAL A 27 8.799 6.549 6.723 1.00 0.00 H new ATOM 0 HG11 VAL A 27 9.066 5.570 8.984 1.00 0.00 H new ATOM 0 HG12 VAL A 27 7.400 5.366 8.393 1.00 0.00 H new ATOM 0 HG13 VAL A 27 8.529 3.990 8.364 1.00 0.00 H new ATOM 0 HG21 VAL A 27 10.978 5.552 7.370 1.00 0.00 H new ATOM 0 HG22 VAL A 27 10.441 3.974 6.748 1.00 0.00 H new ATOM 0 HG23 VAL A 27 10.671 5.340 5.630 1.00 0.00 H new ATOM 389 N MET A 28 5.683 4.486 6.424 1.00 0.00 N ATOM 390 CA MET A 28 4.262 4.923 6.559 1.00 0.00 C ATOM 391 C MET A 28 3.847 4.831 8.028 1.00 0.00 C ATOM 392 O MET A 28 4.365 4.026 8.777 1.00 0.00 O ATOM 393 CB MET A 28 3.371 4.013 5.712 1.00 0.00 C ATOM 394 CG MET A 28 3.700 4.217 4.232 1.00 0.00 C ATOM 395 SD MET A 28 2.571 3.234 3.217 1.00 0.00 S ATOM 396 CE MET A 28 3.084 1.607 3.819 1.00 0.00 C ATOM 0 H MET A 28 5.877 3.542 6.759 1.00 0.00 H new ATOM 0 HA MET A 28 4.156 5.952 6.216 1.00 0.00 H new ATOM 0 HB2 MET A 28 3.527 2.971 5.991 1.00 0.00 H new ATOM 0 HB3 MET A 28 2.321 4.239 5.897 1.00 0.00 H new ATOM 0 HG2 MET A 28 3.613 5.272 3.972 1.00 0.00 H new ATOM 0 HG3 MET A 28 4.731 3.924 4.035 1.00 0.00 H new ATOM 0 HE1 MET A 28 2.917 0.862 3.041 1.00 0.00 H new ATOM 0 HE2 MET A 28 4.143 1.632 4.077 1.00 0.00 H new ATOM 0 HE3 MET A 28 2.501 1.346 4.702 1.00 0.00 H new ATOM 406 N GLU A 29 2.921 5.650 8.448 1.00 0.00 N ATOM 407 CA GLU A 29 2.483 5.610 9.874 1.00 0.00 C ATOM 408 C GLU A 29 1.182 4.812 9.996 1.00 0.00 C ATOM 409 O GLU A 29 0.230 5.038 9.275 1.00 0.00 O ATOM 410 CB GLU A 29 2.252 7.038 10.374 1.00 0.00 C ATOM 411 CG GLU A 29 1.955 7.015 11.875 1.00 0.00 C ATOM 412 CD GLU A 29 1.629 8.432 12.351 1.00 0.00 C ATOM 413 OE1 GLU A 29 1.621 9.328 11.524 1.00 0.00 O ATOM 414 OE2 GLU A 29 1.392 8.596 13.537 1.00 0.00 O ATOM 0 H GLU A 29 2.449 6.344 7.868 1.00 0.00 H new ATOM 0 HA GLU A 29 3.256 5.130 10.474 1.00 0.00 H new ATOM 0 HB2 GLU A 29 3.132 7.650 10.177 1.00 0.00 H new ATOM 0 HB3 GLU A 29 1.420 7.493 9.835 1.00 0.00 H new ATOM 0 HG2 GLU A 29 1.117 6.349 12.081 1.00 0.00 H new ATOM 0 HG3 GLU A 29 2.814 6.625 12.421 1.00 0.00 H new ATOM 421 N LEU A 30 1.140 3.888 10.914 1.00 0.00 N ATOM 422 CA LEU A 30 -0.086 3.065 11.117 1.00 0.00 C ATOM 423 C LEU A 30 -0.771 3.510 12.412 1.00 0.00 C ATOM 424 O LEU A 30 -0.148 3.590 13.451 1.00 0.00 O ATOM 425 CB LEU A 30 0.314 1.587 11.236 1.00 0.00 C ATOM 426 CG LEU A 30 0.444 0.946 9.846 1.00 0.00 C ATOM 427 CD1 LEU A 30 -0.947 0.625 9.293 1.00 0.00 C ATOM 428 CD2 LEU A 30 1.174 1.895 8.888 1.00 0.00 C ATOM 0 H LEU A 30 1.913 3.665 11.541 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.766 3.193 10.275 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.260 1.503 11.771 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.432 1.049 11.822 1.00 0.00 H new ATOM 0 HG LEU A 30 1.020 0.025 9.936 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.851 0.171 8.307 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.454 -0.068 9.964 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.528 1.544 9.214 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.259 1.427 7.907 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.613 2.825 8.799 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.170 2.108 9.276 1.00 0.00 H new ATOM 440 N PHE A 31 -2.046 3.791 12.363 1.00 0.00 N ATOM 441 CA PHE A 31 -2.758 4.220 13.604 1.00 0.00 C ATOM 442 C PHE A 31 -3.512 3.026 14.185 1.00 0.00 C ATOM 443 O PHE A 31 -4.368 2.446 13.547 1.00 0.00 O ATOM 444 CB PHE A 31 -3.750 5.335 13.266 1.00 0.00 C ATOM 445 CG PHE A 31 -2.996 6.552 12.790 1.00 0.00 C ATOM 446 CD1 PHE A 31 -2.421 7.428 13.718 1.00 0.00 C ATOM 447 CD2 PHE A 31 -2.870 6.804 11.420 1.00 0.00 C ATOM 448 CE1 PHE A 31 -1.720 8.556 13.275 1.00 0.00 C ATOM 449 CE2 PHE A 31 -2.169 7.931 10.976 1.00 0.00 C ATOM 450 CZ PHE A 31 -1.595 8.807 11.903 1.00 0.00 C ATOM 0 H PHE A 31 -2.623 3.743 11.523 1.00 0.00 H new ATOM 0 HA PHE A 31 -2.036 4.589 14.332 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.443 4.998 12.495 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -4.347 5.584 14.144 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -2.518 7.234 14.776 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -3.314 6.128 10.704 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.276 9.232 13.991 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -2.071 8.124 9.918 1.00 0.00 H new ATOM 0 HZ PHE A 31 -1.055 9.677 11.561 1.00 0.00 H new ATOM 460 N ALA A 32 -3.197 2.652 15.394 1.00 0.00 N ATOM 461 CA ALA A 32 -3.889 1.492 16.019 1.00 0.00 C ATOM 462 C ALA A 32 -5.265 1.919 16.535 1.00 0.00 C ATOM 463 O ALA A 32 -6.232 1.194 16.421 1.00 0.00 O ATOM 464 CB ALA A 32 -3.050 0.968 17.186 1.00 0.00 C ATOM 0 H ALA A 32 -2.490 3.100 15.976 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.014 0.707 15.273 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.556 0.118 17.645 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -2.073 0.654 16.819 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.923 1.758 17.926 1.00 0.00 H new ATOM 470 N ASP A 33 -5.357 3.083 17.118 1.00 0.00 N ATOM 471 CA ASP A 33 -6.669 3.543 17.659 1.00 0.00 C ATOM 472 C ASP A 33 -7.658 3.822 16.520 1.00 0.00 C ATOM 473 O ASP A 33 -8.826 3.501 16.614 1.00 0.00 O ATOM 474 CB ASP A 33 -6.459 4.823 18.474 1.00 0.00 C ATOM 475 CG ASP A 33 -5.960 5.939 17.555 1.00 0.00 C ATOM 476 OD1 ASP A 33 -5.419 5.623 16.508 1.00 0.00 O ATOM 477 OD2 ASP A 33 -6.123 7.093 17.916 1.00 0.00 O ATOM 0 H ASP A 33 -4.582 3.735 17.243 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.081 2.758 18.293 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.393 5.121 18.950 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.737 4.644 19.271 1.00 0.00 H new ATOM 482 N THR A 34 -7.211 4.427 15.454 1.00 0.00 N ATOM 483 CA THR A 34 -8.144 4.730 14.328 1.00 0.00 C ATOM 484 C THR A 34 -8.600 3.430 13.662 1.00 0.00 C ATOM 485 O THR A 34 -9.763 3.246 13.368 1.00 0.00 O ATOM 486 CB THR A 34 -7.429 5.607 13.297 1.00 0.00 C ATOM 487 OG1 THR A 34 -6.791 6.690 13.961 1.00 0.00 O ATOM 488 CG2 THR A 34 -8.445 6.160 12.293 1.00 0.00 C ATOM 0 H THR A 34 -6.246 4.724 15.313 1.00 0.00 H new ATOM 0 HA THR A 34 -9.015 5.256 14.717 1.00 0.00 H new ATOM 0 HB THR A 34 -6.687 5.008 12.769 1.00 0.00 H new ATOM 0 HG1 THR A 34 -7.451 7.387 14.158 1.00 0.00 H new ATOM 0 HG21 THR A 34 -7.931 6.784 11.561 1.00 0.00 H new ATOM 0 HG22 THR A 34 -8.939 5.333 11.782 1.00 0.00 H new ATOM 0 HG23 THR A 34 -9.189 6.757 12.820 1.00 0.00 H new ATOM 496 N THR A 35 -7.690 2.526 13.421 1.00 0.00 N ATOM 497 CA THR A 35 -8.066 1.237 12.772 1.00 0.00 C ATOM 498 C THR A 35 -7.040 0.164 13.150 1.00 0.00 C ATOM 499 O THR A 35 -6.108 -0.091 12.414 1.00 0.00 O ATOM 500 CB THR A 35 -8.072 1.416 11.251 1.00 0.00 C ATOM 501 OG1 THR A 35 -6.845 2.005 10.842 1.00 0.00 O ATOM 502 CG2 THR A 35 -9.235 2.318 10.840 1.00 0.00 C ATOM 0 H THR A 35 -6.700 2.624 13.646 1.00 0.00 H new ATOM 0 HA THR A 35 -9.058 0.934 13.108 1.00 0.00 H new ATOM 0 HB THR A 35 -8.188 0.443 10.773 1.00 0.00 H new ATOM 0 HG1 THR A 35 -6.097 1.506 11.231 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.234 2.442 9.757 1.00 0.00 H new ATOM 0 HG22 THR A 35 -10.175 1.864 11.153 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.126 3.292 11.317 1.00 0.00 H new ATOM 510 N PRO A 36 -7.200 -0.454 14.290 1.00 0.00 N ATOM 511 CA PRO A 36 -6.256 -1.504 14.756 1.00 0.00 C ATOM 512 C PRO A 36 -6.373 -2.791 13.932 1.00 0.00 C ATOM 513 O PRO A 36 -5.394 -3.465 13.678 1.00 0.00 O ATOM 514 CB PRO A 36 -6.633 -1.747 16.223 1.00 0.00 C ATOM 515 CG PRO A 36 -7.991 -1.144 16.433 1.00 0.00 C ATOM 516 CD PRO A 36 -8.297 -0.223 15.243 1.00 0.00 C ATOM 0 HA PRO A 36 -5.219 -1.188 14.642 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.646 -2.814 16.446 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -5.901 -1.291 16.890 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -8.746 -1.926 16.512 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -8.017 -0.581 17.366 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -9.263 -0.461 14.798 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.337 0.821 15.553 1.00 0.00 H new ATOM 524 N ARG A 37 -7.558 -3.139 13.511 1.00 0.00 N ATOM 525 CA ARG A 37 -7.719 -4.380 12.702 1.00 0.00 C ATOM 526 C ARG A 37 -7.021 -4.209 11.350 1.00 0.00 C ATOM 527 O ARG A 37 -6.369 -5.109 10.860 1.00 0.00 O ATOM 528 CB ARG A 37 -9.208 -4.663 12.470 1.00 0.00 C ATOM 529 CG ARG A 37 -9.863 -5.177 13.761 1.00 0.00 C ATOM 530 CD ARG A 37 -10.299 -3.997 14.632 1.00 0.00 C ATOM 531 NE ARG A 37 -10.946 -4.508 15.872 1.00 0.00 N ATOM 532 CZ ARG A 37 -10.224 -5.078 16.797 1.00 0.00 C ATOM 533 NH1 ARG A 37 -8.934 -5.200 16.639 1.00 0.00 N ATOM 534 NH2 ARG A 37 -10.792 -5.529 17.883 1.00 0.00 N ATOM 0 H ARG A 37 -8.418 -2.621 13.691 1.00 0.00 H new ATOM 0 HA ARG A 37 -7.272 -5.215 13.242 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -9.710 -3.754 12.137 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -9.325 -5.401 11.676 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -10.725 -5.799 13.519 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -9.161 -5.805 14.310 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -9.437 -3.381 14.886 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -10.993 -3.362 14.082 1.00 0.00 H new ATOM 0 HE ARG A 37 -11.954 -4.412 15.998 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -8.489 -4.849 15.791 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -8.371 -5.646 17.364 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -11.800 -5.436 18.008 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -10.228 -5.975 18.606 1.00 0.00 H new ATOM 548 N THR A 38 -7.160 -3.063 10.738 1.00 0.00 N ATOM 549 CA THR A 38 -6.511 -2.843 9.412 1.00 0.00 C ATOM 550 C THR A 38 -4.990 -2.877 9.562 1.00 0.00 C ATOM 551 O THR A 38 -4.290 -3.451 8.749 1.00 0.00 O ATOM 552 CB THR A 38 -6.939 -1.485 8.852 1.00 0.00 C ATOM 553 OG1 THR A 38 -8.357 -1.423 8.794 1.00 0.00 O ATOM 554 CG2 THR A 38 -6.360 -1.303 7.447 1.00 0.00 C ATOM 0 H THR A 38 -7.693 -2.271 11.098 1.00 0.00 H new ATOM 0 HA THR A 38 -6.820 -3.634 8.728 1.00 0.00 H new ATOM 0 HB THR A 38 -6.567 -0.692 9.501 1.00 0.00 H new ATOM 0 HG1 THR A 38 -8.632 -0.553 8.437 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.666 -0.335 7.050 1.00 0.00 H new ATOM 0 HG22 THR A 38 -5.272 -1.349 7.493 1.00 0.00 H new ATOM 0 HG23 THR A 38 -6.729 -2.095 6.796 1.00 0.00 H new ATOM 562 N ALA A 39 -4.469 -2.270 10.590 1.00 0.00 N ATOM 563 CA ALA A 39 -2.993 -2.273 10.783 1.00 0.00 C ATOM 564 C ALA A 39 -2.515 -3.714 10.959 1.00 0.00 C ATOM 565 O ALA A 39 -1.411 -4.065 10.588 1.00 0.00 O ATOM 566 CB ALA A 39 -2.641 -1.463 12.033 1.00 0.00 C ATOM 0 H ALA A 39 -5.000 -1.772 11.304 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.507 -1.828 9.915 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -1.560 -1.465 12.175 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -2.990 -0.437 11.912 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.122 -1.909 12.903 1.00 0.00 H new ATOM 572 N GLU A 40 -3.338 -4.550 11.528 1.00 0.00 N ATOM 573 CA GLU A 40 -2.942 -5.971 11.740 1.00 0.00 C ATOM 574 C GLU A 40 -2.871 -6.702 10.397 1.00 0.00 C ATOM 575 O GLU A 40 -2.015 -7.537 10.181 1.00 0.00 O ATOM 576 CB GLU A 40 -3.973 -6.655 12.639 1.00 0.00 C ATOM 577 CG GLU A 40 -3.496 -8.067 12.988 1.00 0.00 C ATOM 578 CD GLU A 40 -4.568 -8.779 13.813 1.00 0.00 C ATOM 579 OE1 GLU A 40 -5.607 -8.181 14.041 1.00 0.00 O ATOM 580 OE2 GLU A 40 -4.333 -9.911 14.203 1.00 0.00 O ATOM 0 H GLU A 40 -4.273 -4.309 11.857 1.00 0.00 H new ATOM 0 HA GLU A 40 -1.961 -6.003 12.214 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.118 -6.074 13.550 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.937 -6.701 12.133 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -3.291 -8.629 12.077 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.563 -8.019 13.549 1.00 0.00 H new ATOM 587 N ASN A 41 -3.768 -6.410 9.496 1.00 0.00 N ATOM 588 CA ASN A 41 -3.749 -7.106 8.178 1.00 0.00 C ATOM 589 C ASN A 41 -2.406 -6.875 7.485 1.00 0.00 C ATOM 590 O ASN A 41 -1.833 -7.778 6.908 1.00 0.00 O ATOM 591 CB ASN A 41 -4.876 -6.560 7.298 1.00 0.00 C ATOM 592 CG ASN A 41 -6.227 -6.921 7.919 1.00 0.00 C ATOM 593 OD1 ASN A 41 -6.257 -7.588 9.040 1.00 0.00 O flip ATOM 594 ND2 ASN A 41 -7.265 -6.592 7.380 1.00 0.00 N flip ATOM 0 H ASN A 41 -4.511 -5.722 9.614 1.00 0.00 H new ATOM 0 HA ASN A 41 -3.891 -8.175 8.336 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -4.785 -5.478 7.202 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -4.802 -6.977 6.294 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -7.242 -6.071 6.504 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -8.160 -6.837 7.804 1.00 0.00 H new ATOM 601 N PHE A 42 -1.894 -5.676 7.537 1.00 0.00 N ATOM 602 CA PHE A 42 -0.583 -5.397 6.879 1.00 0.00 C ATOM 603 C PHE A 42 0.554 -5.715 7.849 1.00 0.00 C ATOM 604 O PHE A 42 1.507 -6.386 7.507 1.00 0.00 O ATOM 605 CB PHE A 42 -0.516 -3.922 6.480 1.00 0.00 C ATOM 606 CG PHE A 42 -1.558 -3.638 5.425 1.00 0.00 C ATOM 607 CD1 PHE A 42 -1.280 -3.901 4.079 1.00 0.00 C ATOM 608 CD2 PHE A 42 -2.802 -3.116 5.795 1.00 0.00 C ATOM 609 CE1 PHE A 42 -2.245 -3.639 3.100 1.00 0.00 C ATOM 610 CE2 PHE A 42 -3.769 -2.854 4.815 1.00 0.00 C ATOM 611 CZ PHE A 42 -3.491 -3.116 3.469 1.00 0.00 C ATOM 0 H PHE A 42 -2.324 -4.878 8.005 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.485 -6.019 5.989 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -0.685 -3.290 7.352 1.00 0.00 H new ATOM 0 HB3 PHE A 42 0.477 -3.682 6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -0.320 -4.306 3.796 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -3.017 -2.915 6.834 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -2.029 -3.840 2.061 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -4.729 -2.450 5.099 1.00 0.00 H new ATOM 0 HZ PHE A 42 -4.237 -2.915 2.714 1.00 0.00 H new ATOM 621 N ARG A 43 0.464 -5.236 9.059 1.00 0.00 N ATOM 622 CA ARG A 43 1.542 -5.508 10.051 1.00 0.00 C ATOM 623 C ARG A 43 1.715 -7.018 10.218 1.00 0.00 C ATOM 624 O ARG A 43 2.819 -7.523 10.291 1.00 0.00 O ATOM 625 CB ARG A 43 1.155 -4.890 11.397 1.00 0.00 C ATOM 626 CG ARG A 43 2.289 -5.095 12.404 1.00 0.00 C ATOM 627 CD ARG A 43 1.885 -4.501 13.753 1.00 0.00 C ATOM 628 NE ARG A 43 0.770 -5.301 14.333 1.00 0.00 N ATOM 629 CZ ARG A 43 1.001 -6.497 14.802 1.00 0.00 C ATOM 630 NH1 ARG A 43 2.209 -6.991 14.763 1.00 0.00 N ATOM 631 NH2 ARG A 43 0.025 -7.199 15.308 1.00 0.00 N ATOM 0 H ARG A 43 -0.310 -4.668 9.404 1.00 0.00 H new ATOM 0 HA ARG A 43 2.478 -5.073 9.701 1.00 0.00 H new ATOM 0 HB2 ARG A 43 0.952 -3.826 11.275 1.00 0.00 H new ATOM 0 HB3 ARG A 43 0.239 -5.348 11.768 1.00 0.00 H new ATOM 0 HG2 ARG A 43 2.506 -6.158 12.513 1.00 0.00 H new ATOM 0 HG3 ARG A 43 3.201 -4.619 12.043 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.738 -4.500 14.432 1.00 0.00 H new ATOM 0 HD3 ARG A 43 1.576 -3.463 13.628 1.00 0.00 H new ATOM 0 HE ARG A 43 -0.173 -4.914 14.364 1.00 0.00 H new ATOM 0 HH11 ARG A 43 2.972 -6.442 14.366 1.00 0.00 H new ATOM 0 HH12 ARG A 43 2.390 -7.926 15.129 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -0.919 -6.813 15.337 1.00 0.00 H new ATOM 0 HH22 ARG A 43 0.206 -8.134 15.674 1.00 0.00 H new ATOM 645 N ALA A 44 0.632 -7.744 10.285 1.00 0.00 N ATOM 646 CA ALA A 44 0.736 -9.221 10.455 1.00 0.00 C ATOM 647 C ALA A 44 1.289 -9.853 9.176 1.00 0.00 C ATOM 648 O ALA A 44 2.174 -10.687 9.218 1.00 0.00 O ATOM 649 CB ALA A 44 -0.651 -9.799 10.745 1.00 0.00 C ATOM 0 H ALA A 44 -0.319 -7.379 10.229 1.00 0.00 H new ATOM 0 HA ALA A 44 1.407 -9.440 11.285 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -0.576 -10.879 10.870 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.047 -9.355 11.659 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -1.320 -9.575 9.914 1.00 0.00 H new ATOM 655 N LEU A 45 0.773 -9.470 8.042 1.00 0.00 N ATOM 656 CA LEU A 45 1.267 -10.059 6.766 1.00 0.00 C ATOM 657 C LEU A 45 2.741 -9.690 6.563 1.00 0.00 C ATOM 658 O LEU A 45 3.527 -10.482 6.085 1.00 0.00 O ATOM 659 CB LEU A 45 0.426 -9.525 5.598 1.00 0.00 C ATOM 660 CG LEU A 45 0.834 -10.224 4.296 1.00 0.00 C ATOM 661 CD1 LEU A 45 0.579 -11.737 4.406 1.00 0.00 C ATOM 662 CD2 LEU A 45 0.014 -9.652 3.132 1.00 0.00 C ATOM 0 H LEU A 45 0.032 -8.776 7.943 1.00 0.00 H new ATOM 0 HA LEU A 45 1.176 -11.144 6.806 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.633 -9.693 5.795 1.00 0.00 H new ATOM 0 HB3 LEU A 45 0.565 -8.448 5.501 1.00 0.00 H new ATOM 0 HG LEU A 45 1.896 -10.054 4.118 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.872 -12.224 3.476 1.00 0.00 H new ATOM 0 HD12 LEU A 45 1.164 -12.146 5.230 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.480 -11.915 4.590 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.303 -10.148 2.205 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.047 -9.819 3.318 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.203 -8.582 3.045 1.00 0.00 H new ATOM 674 N CYS A 46 3.122 -8.494 6.925 1.00 0.00 N ATOM 675 CA CYS A 46 4.545 -8.081 6.752 1.00 0.00 C ATOM 676 C CYS A 46 5.419 -8.789 7.788 1.00 0.00 C ATOM 677 O CYS A 46 6.444 -9.357 7.465 1.00 0.00 O ATOM 678 CB CYS A 46 4.664 -6.567 6.936 1.00 0.00 C ATOM 679 SG CYS A 46 3.620 -5.727 5.718 1.00 0.00 S ATOM 0 H CYS A 46 2.511 -7.786 7.332 1.00 0.00 H new ATOM 0 HA CYS A 46 4.879 -8.355 5.751 1.00 0.00 H new ATOM 0 HB2 CYS A 46 4.361 -6.288 7.945 1.00 0.00 H new ATOM 0 HB3 CYS A 46 5.702 -6.256 6.817 1.00 0.00 H new ATOM 0 HG CYS A 46 2.377 -5.791 6.094 1.00 0.00 H new ATOM 685 N THR A 47 5.025 -8.762 9.032 1.00 0.00 N ATOM 686 CA THR A 47 5.840 -9.435 10.084 1.00 0.00 C ATOM 687 C THR A 47 5.735 -10.952 9.925 1.00 0.00 C ATOM 688 O THR A 47 6.683 -11.676 10.154 1.00 0.00 O ATOM 689 CB THR A 47 5.323 -9.028 11.468 1.00 0.00 C ATOM 690 OG1 THR A 47 3.978 -9.460 11.614 1.00 0.00 O ATOM 691 CG2 THR A 47 5.394 -7.506 11.619 1.00 0.00 C ATOM 0 H THR A 47 4.176 -8.304 9.365 1.00 0.00 H new ATOM 0 HA THR A 47 6.882 -9.134 9.981 1.00 0.00 H new ATOM 0 HB THR A 47 5.940 -9.493 12.237 1.00 0.00 H new ATOM 0 HG1 THR A 47 3.379 -8.819 11.177 1.00 0.00 H new ATOM 0 HG21 THR A 47 5.026 -7.221 12.604 1.00 0.00 H new ATOM 0 HG22 THR A 47 6.427 -7.177 11.509 1.00 0.00 H new ATOM 0 HG23 THR A 47 4.780 -7.035 10.852 1.00 0.00 H new ATOM 699 N GLY A 48 4.590 -11.439 9.532 1.00 0.00 N ATOM 700 CA GLY A 48 4.428 -12.911 9.357 1.00 0.00 C ATOM 701 C GLY A 48 4.358 -13.586 10.728 1.00 0.00 C ATOM 702 O GLY A 48 4.680 -14.747 10.875 1.00 0.00 O ATOM 0 H GLY A 48 3.761 -10.883 9.325 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.522 -13.122 8.790 1.00 0.00 H new ATOM 0 HA3 GLY A 48 5.264 -13.314 8.784 1.00 0.00 H new ATOM 706 N GLU A 49 3.943 -12.866 11.735 1.00 0.00 N ATOM 707 CA GLU A 49 3.859 -13.469 13.096 1.00 0.00 C ATOM 708 C GLU A 49 2.808 -14.583 13.101 1.00 0.00 C ATOM 709 O GLU A 49 2.939 -15.568 13.801 1.00 0.00 O ATOM 710 CB GLU A 49 3.473 -12.386 14.110 1.00 0.00 C ATOM 711 CG GLU A 49 2.021 -11.953 13.884 1.00 0.00 C ATOM 712 CD GLU A 49 1.700 -10.757 14.781 1.00 0.00 C ATOM 713 OE1 GLU A 49 2.550 -10.394 15.578 1.00 0.00 O ATOM 714 OE2 GLU A 49 0.610 -10.224 14.657 1.00 0.00 O ATOM 0 H GLU A 49 3.659 -11.888 11.674 1.00 0.00 H new ATOM 0 HA GLU A 49 4.827 -13.890 13.368 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.595 -12.766 15.124 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.137 -11.528 14.009 1.00 0.00 H new ATOM 0 HG2 GLU A 49 1.868 -11.688 12.838 1.00 0.00 H new ATOM 0 HG3 GLU A 49 1.345 -12.779 14.106 1.00 0.00 H new ATOM 721 N LYS A 50 1.771 -14.437 12.324 1.00 0.00 N ATOM 722 CA LYS A 50 0.718 -15.491 12.283 1.00 0.00 C ATOM 723 C LYS A 50 1.340 -16.812 11.825 1.00 0.00 C ATOM 724 O LYS A 50 0.940 -17.878 12.249 1.00 0.00 O ATOM 725 CB LYS A 50 -0.383 -15.077 11.303 1.00 0.00 C ATOM 726 CG LYS A 50 -0.961 -13.717 11.708 1.00 0.00 C ATOM 727 CD LYS A 50 -1.684 -13.837 13.053 1.00 0.00 C ATOM 728 CE LYS A 50 -2.556 -12.600 13.278 1.00 0.00 C ATOM 729 NZ LYS A 50 -1.687 -11.405 13.469 1.00 0.00 N ATOM 0 H LYS A 50 1.607 -13.635 11.716 1.00 0.00 H new ATOM 0 HA LYS A 50 0.289 -15.616 13.277 1.00 0.00 H new ATOM 0 HB2 LYS A 50 0.020 -15.023 10.292 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -1.173 -15.828 11.292 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -0.162 -12.979 11.780 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -1.653 -13.364 10.943 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -2.300 -14.736 13.068 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -0.958 -13.935 13.860 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -3.218 -12.449 12.425 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -3.191 -12.744 14.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -2.121 -10.582 13.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -1.581 -11.212 14.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -0.752 -11.585 13.051 1.00 0.00 H new ATOM 743 N GLY A 51 2.315 -16.749 10.958 1.00 0.00 N ATOM 744 CA GLY A 51 2.960 -17.995 10.467 1.00 0.00 C ATOM 745 C GLY A 51 2.260 -18.456 9.191 1.00 0.00 C ATOM 746 O GLY A 51 1.270 -17.889 8.773 1.00 0.00 O ATOM 0 H GLY A 51 2.692 -15.884 10.569 1.00 0.00 H new ATOM 0 HA2 GLY A 51 4.018 -17.818 10.272 1.00 0.00 H new ATOM 0 HA3 GLY A 51 2.902 -18.773 11.229 1.00 0.00 H new ATOM 750 N THR A 52 2.767 -19.480 8.570 1.00 0.00 N ATOM 751 CA THR A 52 2.135 -19.983 7.318 1.00 0.00 C ATOM 752 C THR A 52 0.799 -20.646 7.646 1.00 0.00 C ATOM 753 O THR A 52 0.669 -21.357 8.621 1.00 0.00 O ATOM 754 CB THR A 52 3.055 -21.009 6.650 1.00 0.00 C ATOM 755 OG1 THR A 52 4.266 -20.375 6.262 1.00 0.00 O ATOM 756 CG2 THR A 52 2.360 -21.598 5.418 1.00 0.00 C ATOM 0 H THR A 52 3.594 -19.993 8.874 1.00 0.00 H new ATOM 0 HA THR A 52 1.971 -19.145 6.641 1.00 0.00 H new ATOM 0 HB THR A 52 3.277 -21.812 7.353 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.857 -21.031 5.836 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.016 -22.328 4.944 1.00 0.00 H new ATOM 0 HG22 THR A 52 1.434 -22.086 5.721 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.135 -20.800 4.711 1.00 0.00 H new ATOM 764 N GLY A 53 -0.198 -20.420 6.834 1.00 0.00 N ATOM 765 CA GLY A 53 -1.524 -21.042 7.097 1.00 0.00 C ATOM 766 C GLY A 53 -1.365 -22.564 7.151 1.00 0.00 C ATOM 767 O GLY A 53 -0.695 -23.157 6.329 1.00 0.00 O ATOM 0 H GLY A 53 -0.150 -19.832 6.002 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -1.932 -20.673 8.038 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -2.230 -20.766 6.314 1.00 0.00 H new ATOM 771 N ARG A 54 -1.970 -23.201 8.116 1.00 0.00 N ATOM 772 CA ARG A 54 -1.847 -24.684 8.226 1.00 0.00 C ATOM 773 C ARG A 54 -2.368 -25.348 6.948 1.00 0.00 C ATOM 774 O ARG A 54 -1.873 -26.372 6.524 1.00 0.00 O ATOM 775 CB ARG A 54 -2.662 -25.176 9.423 1.00 0.00 C ATOM 776 CG ARG A 54 -2.068 -24.609 10.714 1.00 0.00 C ATOM 777 CD ARG A 54 -2.808 -25.195 11.918 1.00 0.00 C ATOM 778 NE ARG A 54 -2.488 -26.645 12.038 1.00 0.00 N ATOM 779 CZ ARG A 54 -2.904 -27.322 13.073 1.00 0.00 C ATOM 780 NH1 ARG A 54 -3.601 -26.728 14.003 1.00 0.00 N ATOM 781 NH2 ARG A 54 -2.625 -28.592 13.177 1.00 0.00 N ATOM 0 H ARG A 54 -2.545 -22.759 8.834 1.00 0.00 H new ATOM 0 HA ARG A 54 -0.798 -24.946 8.364 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -3.702 -24.864 9.321 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -2.658 -26.265 9.456 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -1.006 -24.849 10.774 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -2.150 -23.522 10.718 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -2.517 -24.671 12.828 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -3.883 -25.057 11.801 1.00 0.00 H new ATOM 0 HE ARG A 54 -1.943 -27.109 11.311 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -3.820 -25.735 13.920 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -3.927 -27.257 14.812 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -2.082 -29.056 12.449 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -2.950 -29.121 13.986 1.00 0.00 H new ATOM 795 N SER A 55 -3.367 -24.776 6.334 1.00 0.00 N ATOM 796 CA SER A 55 -3.923 -25.381 5.089 1.00 0.00 C ATOM 797 C SER A 55 -2.834 -25.443 4.015 1.00 0.00 C ATOM 798 O SER A 55 -2.892 -26.249 3.108 1.00 0.00 O ATOM 799 CB SER A 55 -5.086 -24.528 4.584 1.00 0.00 C ATOM 800 OG SER A 55 -4.589 -23.271 4.140 1.00 0.00 O ATOM 0 H SER A 55 -3.823 -23.916 6.640 1.00 0.00 H new ATOM 0 HA SER A 55 -4.276 -26.389 5.305 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.599 -25.038 3.768 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.817 -24.383 5.379 1.00 0.00 H new ATOM 0 HG SER A 55 -5.332 -22.722 3.814 1.00 0.00 H new ATOM 806 N GLY A 56 -1.846 -24.593 4.106 1.00 0.00 N ATOM 807 CA GLY A 56 -0.751 -24.592 3.089 1.00 0.00 C ATOM 808 C GLY A 56 -0.822 -23.297 2.281 1.00 0.00 C ATOM 809 O GLY A 56 -1.503 -23.213 1.278 1.00 0.00 O ATOM 0 H GLY A 56 -1.749 -23.896 4.844 1.00 0.00 H new ATOM 0 HA2 GLY A 56 0.219 -24.676 3.580 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -0.850 -25.453 2.429 1.00 0.00 H new ATOM 813 N LYS A 57 -0.128 -22.284 2.718 1.00 0.00 N ATOM 814 CA LYS A 57 -0.147 -20.985 1.993 1.00 0.00 C ATOM 815 C LYS A 57 0.854 -20.046 2.662 1.00 0.00 C ATOM 816 O LYS A 57 0.487 -19.188 3.436 1.00 0.00 O ATOM 817 CB LYS A 57 -1.549 -20.371 2.071 1.00 0.00 C ATOM 818 CG LYS A 57 -1.674 -19.251 1.038 1.00 0.00 C ATOM 819 CD LYS A 57 -3.105 -18.705 1.044 1.00 0.00 C ATOM 820 CE LYS A 57 -3.336 -17.864 -0.212 1.00 0.00 C ATOM 821 NZ LYS A 57 -2.097 -17.101 -0.534 1.00 0.00 N ATOM 0 H LYS A 57 0.456 -22.301 3.554 1.00 0.00 H new ATOM 0 HA LYS A 57 0.117 -21.138 0.947 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -2.303 -21.136 1.887 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -1.731 -19.979 3.072 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -0.968 -18.452 1.265 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -1.421 -19.627 0.047 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -3.819 -19.528 1.080 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -3.271 -18.100 1.935 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -3.607 -18.508 -1.049 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -4.168 -17.178 -0.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -2.329 -16.318 -1.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -1.687 -16.719 0.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -1.409 -17.733 -0.991 1.00 0.00 H new ATOM 835 N PRO A 58 2.114 -20.223 2.376 1.00 0.00 N ATOM 836 CA PRO A 58 3.202 -19.393 2.971 1.00 0.00 C ATOM 837 C PRO A 58 2.924 -17.891 2.870 1.00 0.00 C ATOM 838 O PRO A 58 2.588 -17.376 1.823 1.00 0.00 O ATOM 839 CB PRO A 58 4.433 -19.783 2.149 1.00 0.00 C ATOM 840 CG PRO A 58 4.149 -21.171 1.679 1.00 0.00 C ATOM 841 CD PRO A 58 2.642 -21.238 1.452 1.00 0.00 C ATOM 0 HA PRO A 58 3.316 -19.575 4.040 1.00 0.00 H new ATOM 0 HB2 PRO A 58 4.581 -19.103 1.310 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.340 -19.747 2.752 1.00 0.00 H new ATOM 0 HG2 PRO A 58 4.692 -21.390 0.760 1.00 0.00 H new ATOM 0 HG3 PRO A 58 4.465 -21.906 2.419 1.00 0.00 H new ATOM 0 HD2 PRO A 58 2.381 -21.015 0.418 1.00 0.00 H new ATOM 0 HD3 PRO A 58 2.246 -22.229 1.674 1.00 0.00 H new ATOM 849 N LEU A 59 3.067 -17.191 3.963 1.00 0.00 N ATOM 850 CA LEU A 59 2.821 -15.721 3.959 1.00 0.00 C ATOM 851 C LEU A 59 4.156 -14.988 3.814 1.00 0.00 C ATOM 852 O LEU A 59 5.043 -15.125 4.633 1.00 0.00 O ATOM 853 CB LEU A 59 2.155 -15.320 5.283 1.00 0.00 C ATOM 854 CG LEU A 59 0.636 -15.509 5.193 1.00 0.00 C ATOM 855 CD1 LEU A 59 0.318 -16.891 4.620 1.00 0.00 C ATOM 856 CD2 LEU A 59 0.023 -15.393 6.591 1.00 0.00 C ATOM 0 H LEU A 59 3.346 -17.578 4.865 1.00 0.00 H new ATOM 0 HA LEU A 59 2.169 -15.455 3.127 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.556 -15.924 6.097 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.386 -14.280 5.514 1.00 0.00 H new ATOM 0 HG LEU A 59 0.219 -14.741 4.542 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -0.763 -17.020 4.558 1.00 0.00 H new ATOM 0 HD12 LEU A 59 0.751 -16.980 3.624 1.00 0.00 H new ATOM 0 HD13 LEU A 59 0.738 -17.659 5.269 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.057 -15.527 6.527 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.446 -16.161 7.239 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.242 -14.408 7.004 1.00 0.00 H new ATOM 868 N HIS A 60 4.303 -14.206 2.782 1.00 0.00 N ATOM 869 CA HIS A 60 5.577 -13.458 2.587 1.00 0.00 C ATOM 870 C HIS A 60 5.290 -12.145 1.857 1.00 0.00 C ATOM 871 O HIS A 60 5.244 -12.091 0.645 1.00 0.00 O ATOM 872 CB HIS A 60 6.550 -14.301 1.759 1.00 0.00 C ATOM 873 CG HIS A 60 7.090 -15.420 2.608 1.00 0.00 C ATOM 874 ND1 HIS A 60 6.563 -16.704 2.564 1.00 0.00 N ATOM 875 CD2 HIS A 60 8.109 -15.463 3.528 1.00 0.00 C ATOM 876 CE1 HIS A 60 7.262 -17.458 3.434 1.00 0.00 C ATOM 877 NE2 HIS A 60 8.213 -16.749 4.045 1.00 0.00 N ATOM 0 H HIS A 60 3.595 -14.052 2.064 1.00 0.00 H new ATOM 0 HA HIS A 60 6.023 -13.245 3.559 1.00 0.00 H new ATOM 0 HB2 HIS A 60 6.043 -14.706 0.883 1.00 0.00 H new ATOM 0 HB3 HIS A 60 7.368 -13.679 1.394 1.00 0.00 H new ATOM 0 HD2 HIS A 60 8.733 -14.627 3.807 1.00 0.00 H new ATOM 0 HE1 HIS A 60 7.076 -18.506 3.615 1.00 0.00 H new ATOM 0 HE2 HIS A 60 8.877 -17.081 4.745 1.00 0.00 H new ATOM 886 N TYR A 61 5.098 -11.087 2.592 1.00 0.00 N ATOM 887 CA TYR A 61 4.817 -9.771 1.954 1.00 0.00 C ATOM 888 C TYR A 61 6.003 -9.388 1.068 1.00 0.00 C ATOM 889 O TYR A 61 5.850 -8.772 0.031 1.00 0.00 O ATOM 890 CB TYR A 61 4.631 -8.716 3.045 1.00 0.00 C ATOM 891 CG TYR A 61 4.006 -7.474 2.457 1.00 0.00 C ATOM 892 CD1 TYR A 61 4.793 -6.545 1.766 1.00 0.00 C ATOM 893 CD2 TYR A 61 2.632 -7.254 2.607 1.00 0.00 C ATOM 894 CE1 TYR A 61 4.204 -5.396 1.225 1.00 0.00 C ATOM 895 CE2 TYR A 61 2.043 -6.106 2.069 1.00 0.00 C ATOM 896 CZ TYR A 61 2.829 -5.176 1.378 1.00 0.00 C ATOM 897 OH TYR A 61 2.248 -4.042 0.845 1.00 0.00 O ATOM 0 H TYR A 61 5.124 -11.076 3.612 1.00 0.00 H new ATOM 0 HA TYR A 61 3.912 -9.832 1.350 1.00 0.00 H new ATOM 0 HB2 TYR A 61 3.999 -9.110 3.840 1.00 0.00 H new ATOM 0 HB3 TYR A 61 5.593 -8.472 3.495 1.00 0.00 H new ATOM 0 HD1 TYR A 61 5.853 -6.715 1.650 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.026 -7.972 3.139 1.00 0.00 H new ATOM 0 HE1 TYR A 61 4.809 -4.679 0.690 1.00 0.00 H new ATOM 0 HE2 TYR A 61 0.983 -5.937 2.186 1.00 0.00 H new ATOM 0 HH TYR A 61 1.288 -4.044 1.040 1.00 0.00 H new ATOM 907 N LYS A 62 7.189 -9.748 1.479 1.00 0.00 N ATOM 908 CA LYS A 62 8.401 -9.410 0.681 1.00 0.00 C ATOM 909 C LYS A 62 8.241 -9.929 -0.749 1.00 0.00 C ATOM 910 O LYS A 62 7.355 -10.705 -1.044 1.00 0.00 O ATOM 911 CB LYS A 62 9.625 -10.072 1.318 1.00 0.00 C ATOM 912 CG LYS A 62 9.830 -9.542 2.725 1.00 0.00 C ATOM 913 CD LYS A 62 11.111 -10.148 3.294 1.00 0.00 C ATOM 914 CE LYS A 62 11.190 -9.827 4.777 1.00 0.00 C ATOM 915 NZ LYS A 62 12.429 -10.422 5.353 1.00 0.00 N ATOM 0 H LYS A 62 7.371 -10.265 2.339 1.00 0.00 H new ATOM 0 HA LYS A 62 8.529 -8.328 0.663 1.00 0.00 H new ATOM 0 HB2 LYS A 62 9.491 -11.153 1.344 1.00 0.00 H new ATOM 0 HB3 LYS A 62 10.511 -9.875 0.714 1.00 0.00 H new ATOM 0 HG2 LYS A 62 9.899 -8.454 2.713 1.00 0.00 H new ATOM 0 HG3 LYS A 62 8.978 -9.800 3.354 1.00 0.00 H new ATOM 0 HD2 LYS A 62 11.118 -11.227 3.141 1.00 0.00 H new ATOM 0 HD3 LYS A 62 11.981 -9.747 2.774 1.00 0.00 H new ATOM 0 HE2 LYS A 62 11.190 -8.747 4.926 1.00 0.00 H new ATOM 0 HE3 LYS A 62 10.313 -10.220 5.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 12.341 -10.473 6.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 12.565 -11.379 4.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 13.247 -9.830 5.104 1.00 0.00 H new ATOM 929 N ASP A 63 9.102 -9.507 -1.636 1.00 0.00 N ATOM 930 CA ASP A 63 9.021 -9.972 -3.051 1.00 0.00 C ATOM 931 C ASP A 63 7.646 -9.641 -3.633 1.00 0.00 C ATOM 932 O ASP A 63 7.014 -10.467 -4.259 1.00 0.00 O ATOM 933 CB ASP A 63 9.253 -11.485 -3.111 1.00 0.00 C ATOM 934 CG ASP A 63 10.675 -11.803 -2.643 1.00 0.00 C ATOM 935 OD1 ASP A 63 11.475 -10.884 -2.576 1.00 0.00 O ATOM 936 OD2 ASP A 63 10.939 -12.959 -2.360 1.00 0.00 O ATOM 0 H ASP A 63 9.862 -8.856 -1.440 1.00 0.00 H new ATOM 0 HA ASP A 63 9.788 -9.464 -3.636 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.528 -12.000 -2.481 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.104 -11.846 -4.129 1.00 0.00 H new ATOM 941 N SER A 64 7.184 -8.433 -3.440 1.00 0.00 N ATOM 942 CA SER A 64 5.855 -8.036 -3.992 1.00 0.00 C ATOM 943 C SER A 64 6.063 -6.961 -5.062 1.00 0.00 C ATOM 944 O SER A 64 7.040 -6.242 -5.047 1.00 0.00 O ATOM 945 CB SER A 64 4.979 -7.478 -2.869 1.00 0.00 C ATOM 946 OG SER A 64 5.535 -6.260 -2.394 1.00 0.00 O ATOM 0 H SER A 64 7.672 -7.702 -2.922 1.00 0.00 H new ATOM 0 HA SER A 64 5.364 -8.904 -4.431 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.966 -7.310 -3.234 1.00 0.00 H new ATOM 0 HB3 SER A 64 4.909 -8.200 -2.055 1.00 0.00 H new ATOM 0 HG SER A 64 4.973 -5.902 -1.676 1.00 0.00 H new ATOM 952 N SER A 65 5.157 -6.854 -5.997 1.00 0.00 N ATOM 953 CA SER A 65 5.308 -5.832 -7.074 1.00 0.00 C ATOM 954 C SER A 65 4.000 -5.057 -7.235 1.00 0.00 C ATOM 955 O SER A 65 2.927 -5.580 -7.016 1.00 0.00 O ATOM 956 CB SER A 65 5.647 -6.531 -8.393 1.00 0.00 C ATOM 957 OG SER A 65 5.911 -5.552 -9.389 1.00 0.00 O ATOM 0 H SER A 65 4.318 -7.431 -6.062 1.00 0.00 H new ATOM 0 HA SER A 65 6.108 -5.142 -6.807 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.515 -7.177 -8.263 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.819 -7.168 -8.703 1.00 0.00 H new ATOM 0 HG SER A 65 6.732 -5.067 -9.162 1.00 0.00 H new ATOM 963 N PHE A 66 4.082 -3.812 -7.619 1.00 0.00 N ATOM 964 CA PHE A 66 2.838 -3.008 -7.796 1.00 0.00 C ATOM 965 C PHE A 66 2.169 -3.392 -9.119 1.00 0.00 C ATOM 966 O PHE A 66 2.777 -3.355 -10.170 1.00 0.00 O ATOM 967 CB PHE A 66 3.188 -1.518 -7.801 1.00 0.00 C ATOM 968 CG PHE A 66 3.388 -1.044 -6.380 1.00 0.00 C ATOM 969 CD1 PHE A 66 4.532 -1.424 -5.667 1.00 0.00 C ATOM 970 CD2 PHE A 66 2.423 -0.228 -5.777 1.00 0.00 C ATOM 971 CE1 PHE A 66 4.708 -0.987 -4.348 1.00 0.00 C ATOM 972 CE2 PHE A 66 2.602 0.209 -4.459 1.00 0.00 C ATOM 973 CZ PHE A 66 3.744 -0.171 -3.744 1.00 0.00 C ATOM 0 H PHE A 66 4.952 -3.318 -7.817 1.00 0.00 H new ATOM 0 HA PHE A 66 2.151 -3.210 -6.974 1.00 0.00 H new ATOM 0 HB2 PHE A 66 4.093 -1.348 -8.383 1.00 0.00 H new ATOM 0 HB3 PHE A 66 2.391 -0.948 -8.277 1.00 0.00 H new ATOM 0 HD1 PHE A 66 5.277 -2.052 -6.133 1.00 0.00 H new ATOM 0 HD2 PHE A 66 1.541 0.064 -6.328 1.00 0.00 H new ATOM 0 HE1 PHE A 66 5.589 -1.280 -3.796 1.00 0.00 H new ATOM 0 HE2 PHE A 66 1.859 0.840 -3.994 1.00 0.00 H new ATOM 0 HZ PHE A 66 3.881 0.165 -2.727 1.00 0.00 H new ATOM 983 N HIS A 67 0.922 -3.776 -9.063 1.00 0.00 N ATOM 984 CA HIS A 67 0.204 -4.184 -10.303 1.00 0.00 C ATOM 985 C HIS A 67 -0.009 -2.981 -11.229 1.00 0.00 C ATOM 986 O HIS A 67 0.214 -3.067 -12.421 1.00 0.00 O ATOM 987 CB HIS A 67 -1.153 -4.783 -9.924 1.00 0.00 C ATOM 988 CG HIS A 67 -1.821 -5.337 -11.152 1.00 0.00 C ATOM 989 ND1 HIS A 67 -3.065 -5.128 -11.693 1.00 0.00 N flip ATOM 990 CD2 HIS A 67 -1.191 -6.247 -11.989 1.00 0.00 C flip ATOM 991 CE1 HIS A 67 -3.204 -5.893 -12.845 1.00 0.00 C flip ATOM 992 NE2 HIS A 67 -2.051 -6.549 -12.980 1.00 0.00 N flip ATOM 0 H HIS A 67 0.368 -3.825 -8.208 1.00 0.00 H new ATOM 0 HA HIS A 67 0.806 -4.924 -10.830 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.020 -5.571 -9.183 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -1.784 -4.020 -9.467 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -0.193 -6.641 -11.868 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -4.065 -5.945 -13.495 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -1.846 -7.199 -13.739 1.00 0.00 H new ATOM 1001 N ARG A 68 -0.459 -1.867 -10.704 1.00 0.00 N ATOM 1002 CA ARG A 68 -0.703 -0.675 -11.577 1.00 0.00 C ATOM 1003 C ARG A 68 -0.090 0.584 -10.959 1.00 0.00 C ATOM 1004 O ARG A 68 0.004 0.721 -9.755 1.00 0.00 O ATOM 1005 CB ARG A 68 -2.209 -0.472 -11.740 1.00 0.00 C ATOM 1006 CG ARG A 68 -2.810 -1.668 -12.480 1.00 0.00 C ATOM 1007 CD ARG A 68 -4.302 -1.427 -12.716 1.00 0.00 C ATOM 1008 NE ARG A 68 -4.929 -2.674 -13.236 1.00 0.00 N ATOM 1009 CZ ARG A 68 -6.222 -2.842 -13.148 1.00 0.00 C ATOM 1010 NH1 ARG A 68 -6.963 -1.915 -12.604 1.00 0.00 N ATOM 1011 NH2 ARG A 68 -6.770 -3.934 -13.603 1.00 0.00 N ATOM 0 H ARG A 68 -0.667 -1.731 -9.715 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.238 -0.851 -12.547 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -2.679 -0.362 -10.763 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.405 0.447 -12.293 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -2.300 -1.814 -13.432 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.666 -2.579 -11.898 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -4.784 -1.125 -11.786 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.442 -0.613 -13.427 1.00 0.00 H new ATOM 0 HE ARG A 68 -4.349 -3.397 -13.661 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.533 -1.061 -12.249 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -7.972 -2.044 -12.534 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -6.190 -4.657 -14.028 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -7.779 -4.065 -13.534 1.00 0.00 H new ATOM 1025 N VAL A 69 0.315 1.509 -11.788 1.00 0.00 N ATOM 1026 CA VAL A 69 0.916 2.779 -11.286 1.00 0.00 C ATOM 1027 C VAL A 69 0.486 3.923 -12.205 1.00 0.00 C ATOM 1028 O VAL A 69 1.303 4.664 -12.715 1.00 0.00 O ATOM 1029 CB VAL A 69 2.437 2.672 -11.318 1.00 0.00 C ATOM 1030 CG1 VAL A 69 2.915 1.748 -10.196 1.00 0.00 C ATOM 1031 CG2 VAL A 69 2.875 2.111 -12.670 1.00 0.00 C ATOM 0 H VAL A 69 0.254 1.438 -12.804 1.00 0.00 H new ATOM 0 HA VAL A 69 0.582 2.964 -10.265 1.00 0.00 H new ATOM 0 HB VAL A 69 2.874 3.660 -11.175 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.002 1.675 -10.223 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.602 2.153 -9.233 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.481 0.757 -10.331 1.00 0.00 H new ATOM 0 HG21 VAL A 69 3.962 2.033 -12.697 1.00 0.00 H new ATOM 0 HG22 VAL A 69 2.437 1.123 -12.813 1.00 0.00 H new ATOM 0 HG23 VAL A 69 2.539 2.776 -13.466 1.00 0.00 H new ATOM 1041 N ILE A 70 -0.786 4.059 -12.440 1.00 0.00 N ATOM 1042 CA ILE A 70 -1.266 5.135 -13.349 1.00 0.00 C ATOM 1043 C ILE A 70 -1.231 6.489 -12.627 1.00 0.00 C ATOM 1044 O ILE A 70 -1.674 6.603 -11.500 1.00 0.00 O ATOM 1045 CB ILE A 70 -2.698 4.806 -13.775 1.00 0.00 C ATOM 1046 CG1 ILE A 70 -2.739 3.375 -14.331 1.00 0.00 C ATOM 1047 CG2 ILE A 70 -3.157 5.792 -14.854 1.00 0.00 C ATOM 1048 CD1 ILE A 70 -4.139 2.785 -14.136 1.00 0.00 C ATOM 0 H ILE A 70 -1.517 3.470 -12.041 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.621 5.196 -14.226 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.363 4.886 -12.915 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.480 3.378 -15.390 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -1.999 2.756 -13.823 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.177 5.554 -15.154 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -3.123 6.807 -14.458 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.498 5.718 -15.719 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.164 1.770 -14.532 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -4.381 2.767 -13.073 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.869 3.398 -14.664 1.00 0.00 H new ATOM 1060 N PRO A 71 -0.709 7.511 -13.265 1.00 0.00 N ATOM 1061 CA PRO A 71 -0.623 8.872 -12.660 1.00 0.00 C ATOM 1062 C PRO A 71 -1.997 9.535 -12.524 1.00 0.00 C ATOM 1063 O PRO A 71 -2.895 9.289 -13.305 1.00 0.00 O ATOM 1064 CB PRO A 71 0.262 9.658 -13.636 1.00 0.00 C ATOM 1065 CG PRO A 71 0.113 8.961 -14.947 1.00 0.00 C ATOM 1066 CD PRO A 71 -0.145 7.487 -14.629 1.00 0.00 C ATOM 0 HA PRO A 71 -0.221 8.837 -11.647 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -0.055 10.698 -13.705 1.00 0.00 H new ATOM 0 HB3 PRO A 71 1.302 9.663 -13.308 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -0.712 9.384 -15.520 1.00 0.00 H new ATOM 0 HG3 PRO A 71 1.013 9.076 -15.552 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.840 7.040 -15.341 1.00 0.00 H new ATOM 0 HD3 PRO A 71 0.774 6.902 -14.671 1.00 0.00 H new ATOM 1074 N GLY A 72 -2.165 10.374 -11.540 1.00 0.00 N ATOM 1075 CA GLY A 72 -3.478 11.054 -11.356 1.00 0.00 C ATOM 1076 C GLY A 72 -4.458 10.099 -10.673 1.00 0.00 C ATOM 1077 O GLY A 72 -5.027 10.410 -9.645 1.00 0.00 O ATOM 0 H GLY A 72 -1.450 10.618 -10.855 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -3.352 11.954 -10.754 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -3.874 11.369 -12.321 1.00 0.00 H new ATOM 1081 N PHE A 73 -4.661 8.938 -11.235 1.00 0.00 N ATOM 1082 CA PHE A 73 -5.605 7.971 -10.612 1.00 0.00 C ATOM 1083 C PHE A 73 -4.992 7.405 -9.330 1.00 0.00 C ATOM 1084 O PHE A 73 -5.204 7.922 -8.253 1.00 0.00 O ATOM 1085 CB PHE A 73 -5.891 6.830 -11.592 1.00 0.00 C ATOM 1086 CG PHE A 73 -6.702 7.356 -12.752 1.00 0.00 C ATOM 1087 CD1 PHE A 73 -8.099 7.368 -12.680 1.00 0.00 C ATOM 1088 CD2 PHE A 73 -6.056 7.833 -13.899 1.00 0.00 C ATOM 1089 CE1 PHE A 73 -8.853 7.857 -13.755 1.00 0.00 C ATOM 1090 CE2 PHE A 73 -6.810 8.322 -14.974 1.00 0.00 C ATOM 1091 CZ PHE A 73 -8.207 8.334 -14.901 1.00 0.00 C ATOM 0 H PHE A 73 -4.215 8.620 -12.095 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.537 8.482 -10.370 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.955 6.402 -11.952 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -6.434 6.030 -11.088 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -8.597 7.000 -11.795 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.977 7.824 -13.955 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.932 7.866 -13.699 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -6.313 8.690 -15.859 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.787 8.712 -15.730 1.00 0.00 H new ATOM 1101 N MET A 74 -4.231 6.346 -9.435 1.00 0.00 N ATOM 1102 CA MET A 74 -3.611 5.755 -8.213 1.00 0.00 C ATOM 1103 C MET A 74 -2.791 4.522 -8.594 1.00 0.00 C ATOM 1104 O MET A 74 -2.701 4.154 -9.750 1.00 0.00 O ATOM 1105 CB MET A 74 -4.712 5.335 -7.229 1.00 0.00 C ATOM 1106 CG MET A 74 -5.836 4.622 -7.986 1.00 0.00 C ATOM 1107 SD MET A 74 -7.147 4.161 -6.826 1.00 0.00 S ATOM 1108 CE MET A 74 -8.204 3.293 -8.012 1.00 0.00 C ATOM 0 H MET A 74 -4.013 5.868 -10.309 1.00 0.00 H new ATOM 0 HA MET A 74 -2.963 6.498 -7.749 1.00 0.00 H new ATOM 0 HB2 MET A 74 -4.299 4.675 -6.466 1.00 0.00 H new ATOM 0 HB3 MET A 74 -5.106 6.211 -6.714 1.00 0.00 H new ATOM 0 HG2 MET A 74 -6.236 5.273 -8.763 1.00 0.00 H new ATOM 0 HG3 MET A 74 -5.447 3.734 -8.484 1.00 0.00 H new ATOM 0 HE1 MET A 74 -9.091 2.917 -7.502 1.00 0.00 H new ATOM 0 HE2 MET A 74 -8.504 3.980 -8.803 1.00 0.00 H new ATOM 0 HE3 MET A 74 -7.654 2.458 -8.447 1.00 0.00 H new ATOM 1118 N CYS A 75 -2.201 3.875 -7.623 1.00 0.00 N ATOM 1119 CA CYS A 75 -1.394 2.651 -7.902 1.00 0.00 C ATOM 1120 C CYS A 75 -2.046 1.466 -7.187 1.00 0.00 C ATOM 1121 O CYS A 75 -2.392 1.548 -6.025 1.00 0.00 O ATOM 1122 CB CYS A 75 0.036 2.852 -7.384 1.00 0.00 C ATOM 1123 SG CYS A 75 0.445 4.615 -7.413 1.00 0.00 S ATOM 0 H CYS A 75 -2.244 4.145 -6.640 1.00 0.00 H new ATOM 0 HA CYS A 75 -1.356 2.460 -8.974 1.00 0.00 H new ATOM 0 HB2 CYS A 75 0.125 2.464 -6.369 1.00 0.00 H new ATOM 0 HB3 CYS A 75 0.740 2.294 -8.002 1.00 0.00 H new ATOM 0 HG CYS A 75 1.656 4.787 -6.972 1.00 0.00 H new ATOM 1129 N GLN A 76 -2.234 0.371 -7.872 1.00 0.00 N ATOM 1130 CA GLN A 76 -2.886 -0.808 -7.230 1.00 0.00 C ATOM 1131 C GLN A 76 -1.826 -1.771 -6.693 1.00 0.00 C ATOM 1132 O GLN A 76 -0.762 -1.926 -7.261 1.00 0.00 O ATOM 1133 CB GLN A 76 -3.752 -1.534 -8.262 1.00 0.00 C ATOM 1134 CG GLN A 76 -4.523 -2.665 -7.579 1.00 0.00 C ATOM 1135 CD GLN A 76 -5.420 -3.364 -8.602 1.00 0.00 C ATOM 1136 OE1 GLN A 76 -5.548 -2.911 -9.723 1.00 0.00 O ATOM 1137 NE2 GLN A 76 -6.048 -4.455 -8.265 1.00 0.00 N ATOM 0 H GLN A 76 -1.965 0.241 -8.847 1.00 0.00 H new ATOM 0 HA GLN A 76 -3.506 -0.463 -6.402 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -4.447 -0.834 -8.725 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.126 -1.936 -9.059 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -3.827 -3.381 -7.141 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -5.126 -2.267 -6.763 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.941 -4.835 -7.325 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -6.647 -4.929 -8.942 1.00 0.00 H new ATOM 1146 N GLY A 77 -2.115 -2.424 -5.597 1.00 0.00 N ATOM 1147 CA GLY A 77 -1.138 -3.385 -5.009 1.00 0.00 C ATOM 1148 C GLY A 77 -1.898 -4.577 -4.417 1.00 0.00 C ATOM 1149 O GLY A 77 -3.100 -4.682 -4.549 1.00 0.00 O ATOM 0 H GLY A 77 -2.991 -2.331 -5.082 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -0.440 -3.727 -5.774 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -0.548 -2.894 -4.235 1.00 0.00 H new ATOM 1153 N GLY A 78 -1.206 -5.476 -3.769 1.00 0.00 N ATOM 1154 CA GLY A 78 -1.895 -6.660 -3.173 1.00 0.00 C ATOM 1155 C GLY A 78 -1.861 -7.822 -4.167 1.00 0.00 C ATOM 1156 O GLY A 78 -2.517 -8.829 -3.985 1.00 0.00 O ATOM 0 H GLY A 78 -0.197 -5.443 -3.626 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.406 -6.949 -2.243 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -2.926 -6.408 -2.926 1.00 0.00 H new ATOM 1160 N ASP A 79 -1.097 -7.690 -5.217 1.00 0.00 N ATOM 1161 CA ASP A 79 -1.014 -8.784 -6.227 1.00 0.00 C ATOM 1162 C ASP A 79 -0.590 -10.086 -5.543 1.00 0.00 C ATOM 1163 O ASP A 79 -0.712 -11.159 -6.101 1.00 0.00 O ATOM 1164 CB ASP A 79 0.017 -8.411 -7.294 1.00 0.00 C ATOM 1165 CG ASP A 79 -0.012 -9.447 -8.418 1.00 0.00 C ATOM 1166 OD1 ASP A 79 -0.835 -10.347 -8.346 1.00 0.00 O ATOM 1167 OD2 ASP A 79 0.786 -9.325 -9.332 1.00 0.00 O ATOM 0 H ASP A 79 -0.525 -6.870 -5.420 1.00 0.00 H new ATOM 0 HA ASP A 79 -1.990 -8.922 -6.692 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -0.200 -7.420 -7.693 1.00 0.00 H new ATOM 0 HB3 ASP A 79 1.013 -8.366 -6.852 1.00 0.00 H new ATOM 1172 N PHE A 80 -0.081 -10.002 -4.345 1.00 0.00 N ATOM 1173 CA PHE A 80 0.364 -11.235 -3.637 1.00 0.00 C ATOM 1174 C PHE A 80 -0.742 -12.295 -3.676 1.00 0.00 C ATOM 1175 O PHE A 80 -0.497 -13.442 -3.994 1.00 0.00 O ATOM 1176 CB PHE A 80 0.685 -10.892 -2.180 1.00 0.00 C ATOM 1177 CG PHE A 80 1.219 -12.119 -1.480 1.00 0.00 C ATOM 1178 CD1 PHE A 80 2.577 -12.443 -1.568 1.00 0.00 C ATOM 1179 CD2 PHE A 80 0.352 -12.934 -0.741 1.00 0.00 C ATOM 1180 CE1 PHE A 80 3.069 -13.580 -0.919 1.00 0.00 C ATOM 1181 CE2 PHE A 80 0.844 -14.071 -0.092 1.00 0.00 C ATOM 1182 CZ PHE A 80 2.203 -14.395 -0.181 1.00 0.00 C ATOM 0 H PHE A 80 0.046 -9.133 -3.826 1.00 0.00 H new ATOM 0 HA PHE A 80 1.252 -11.629 -4.131 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.419 -10.088 -2.138 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -0.211 -10.532 -1.674 1.00 0.00 H new ATOM 0 HD1 PHE A 80 3.246 -11.815 -2.137 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -0.697 -12.684 -0.672 1.00 0.00 H new ATOM 0 HE1 PHE A 80 4.118 -13.829 -0.987 1.00 0.00 H new ATOM 0 HE2 PHE A 80 0.175 -14.699 0.478 1.00 0.00 H new ATOM 0 HZ PHE A 80 2.583 -15.273 0.320 1.00 0.00 H new ATOM 1192 N THR A 81 -1.955 -11.932 -3.359 1.00 0.00 N ATOM 1193 CA THR A 81 -3.056 -12.934 -3.386 1.00 0.00 C ATOM 1194 C THR A 81 -3.389 -13.292 -4.836 1.00 0.00 C ATOM 1195 O THR A 81 -3.779 -14.402 -5.136 1.00 0.00 O ATOM 1196 CB THR A 81 -4.293 -12.350 -2.705 1.00 0.00 C ATOM 1197 OG1 THR A 81 -4.765 -11.240 -3.458 1.00 0.00 O ATOM 1198 CG2 THR A 81 -3.932 -11.895 -1.291 1.00 0.00 C ATOM 0 H THR A 81 -2.230 -10.989 -3.084 1.00 0.00 H new ATOM 0 HA THR A 81 -2.741 -13.833 -2.856 1.00 0.00 H new ATOM 0 HB THR A 81 -5.072 -13.110 -2.650 1.00 0.00 H new ATOM 0 HG1 THR A 81 -4.603 -10.413 -2.958 1.00 0.00 H new ATOM 0 HG21 THR A 81 -4.815 -11.479 -0.806 1.00 0.00 H new ATOM 0 HG22 THR A 81 -3.570 -12.747 -0.716 1.00 0.00 H new ATOM 0 HG23 THR A 81 -3.153 -11.134 -1.341 1.00 0.00 H new ATOM 1206 N ALA A 82 -3.237 -12.358 -5.739 1.00 0.00 N ATOM 1207 CA ALA A 82 -3.544 -12.639 -7.172 1.00 0.00 C ATOM 1208 C ALA A 82 -3.658 -11.316 -7.935 1.00 0.00 C ATOM 1209 O ALA A 82 -2.991 -11.102 -8.928 1.00 0.00 O ATOM 1210 CB ALA A 82 -4.869 -13.406 -7.272 1.00 0.00 C ATOM 0 H ALA A 82 -2.913 -11.411 -5.544 1.00 0.00 H new ATOM 0 HA ALA A 82 -2.745 -13.241 -7.605 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.093 -13.611 -8.319 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -4.787 -14.347 -6.728 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -5.670 -12.806 -6.841 1.00 0.00 H new ATOM 1216 N GLY A 83 -4.499 -10.428 -7.477 1.00 0.00 N ATOM 1217 CA GLY A 83 -4.658 -9.118 -8.173 1.00 0.00 C ATOM 1218 C GLY A 83 -5.796 -9.212 -9.192 1.00 0.00 C ATOM 1219 O GLY A 83 -6.094 -8.265 -9.892 1.00 0.00 O ATOM 0 H GLY A 83 -5.083 -10.553 -6.650 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -4.870 -8.333 -7.447 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -3.729 -8.846 -8.674 1.00 0.00 H new ATOM 1223 N ASN A 84 -6.435 -10.347 -9.280 1.00 0.00 N ATOM 1224 CA ASN A 84 -7.555 -10.501 -10.255 1.00 0.00 C ATOM 1225 C ASN A 84 -8.862 -10.042 -9.608 1.00 0.00 C ATOM 1226 O ASN A 84 -9.928 -10.173 -10.177 1.00 0.00 O ATOM 1227 CB ASN A 84 -7.675 -11.971 -10.664 1.00 0.00 C ATOM 1228 CG ASN A 84 -6.350 -12.445 -11.260 1.00 0.00 C ATOM 1229 OD1 ASN A 84 -5.875 -13.517 -10.941 1.00 0.00 O ATOM 1230 ND2 ASN A 84 -5.725 -11.687 -12.120 1.00 0.00 N ATOM 0 H ASN A 84 -6.231 -11.174 -8.720 1.00 0.00 H new ATOM 0 HA ASN A 84 -7.355 -9.893 -11.138 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.935 -12.580 -9.798 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -8.477 -12.093 -11.392 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -4.840 -11.995 -12.523 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -6.122 -10.787 -12.389 1.00 0.00 H new ATOM 1237 N GLY A 85 -8.790 -9.511 -8.417 1.00 0.00 N ATOM 1238 CA GLY A 85 -10.029 -9.044 -7.726 1.00 0.00 C ATOM 1239 C GLY A 85 -10.534 -10.148 -6.796 1.00 0.00 C ATOM 1240 O GLY A 85 -10.981 -9.890 -5.695 1.00 0.00 O ATOM 0 H GLY A 85 -7.926 -9.380 -7.891 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -9.822 -8.138 -7.156 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -10.795 -8.791 -8.459 1.00 0.00 H new ATOM 1244 N THR A 86 -10.462 -11.378 -7.226 1.00 0.00 N ATOM 1245 CA THR A 86 -10.931 -12.499 -6.362 1.00 0.00 C ATOM 1246 C THR A 86 -9.923 -12.715 -5.232 1.00 0.00 C ATOM 1247 O THR A 86 -10.215 -13.351 -4.238 1.00 0.00 O ATOM 1248 CB THR A 86 -11.046 -13.776 -7.198 1.00 0.00 C ATOM 1249 OG1 THR A 86 -9.755 -14.162 -7.648 1.00 0.00 O ATOM 1250 CG2 THR A 86 -11.952 -13.520 -8.403 1.00 0.00 C ATOM 0 H THR A 86 -10.099 -11.655 -8.138 1.00 0.00 H new ATOM 0 HA THR A 86 -11.907 -12.256 -5.942 1.00 0.00 H new ATOM 0 HB THR A 86 -11.473 -14.572 -6.589 1.00 0.00 H new ATOM 0 HG1 THR A 86 -9.826 -14.981 -8.182 1.00 0.00 H new ATOM 0 HG21 THR A 86 -12.033 -14.430 -8.997 1.00 0.00 H new ATOM 0 HG22 THR A 86 -12.942 -13.223 -8.057 1.00 0.00 H new ATOM 0 HG23 THR A 86 -11.528 -12.724 -9.015 1.00 0.00 H new ATOM 1258 N GLY A 87 -8.738 -12.190 -5.381 1.00 0.00 N ATOM 1259 CA GLY A 87 -7.703 -12.359 -4.323 1.00 0.00 C ATOM 1260 C GLY A 87 -7.931 -11.331 -3.215 1.00 0.00 C ATOM 1261 O GLY A 87 -8.994 -10.754 -3.098 1.00 0.00 O ATOM 0 H GLY A 87 -8.441 -11.649 -6.193 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.749 -13.368 -3.912 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -6.708 -12.234 -4.750 1.00 0.00 H new ATOM 1265 N GLY A 88 -6.940 -11.097 -2.400 1.00 0.00 N ATOM 1266 CA GLY A 88 -7.100 -10.107 -1.299 1.00 0.00 C ATOM 1267 C GLY A 88 -7.760 -10.784 -0.097 1.00 0.00 C ATOM 1268 O GLY A 88 -8.576 -10.200 0.588 1.00 0.00 O ATOM 0 H GLY A 88 -6.027 -11.548 -2.449 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -6.128 -9.703 -1.014 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -7.708 -9.267 -1.636 1.00 0.00 H new ATOM 1272 N GLU A 89 -7.412 -12.013 0.165 1.00 0.00 N ATOM 1273 CA GLU A 89 -8.018 -12.730 1.323 1.00 0.00 C ATOM 1274 C GLU A 89 -7.747 -11.955 2.611 1.00 0.00 C ATOM 1275 O GLU A 89 -6.746 -11.281 2.746 1.00 0.00 O ATOM 1276 CB GLU A 89 -7.416 -14.130 1.438 1.00 0.00 C ATOM 1277 CG GLU A 89 -7.809 -14.956 0.214 1.00 0.00 C ATOM 1278 CD GLU A 89 -9.324 -15.166 0.198 1.00 0.00 C ATOM 1279 OE1 GLU A 89 -9.940 -14.982 1.235 1.00 0.00 O ATOM 1280 OE2 GLU A 89 -9.843 -15.508 -0.852 1.00 0.00 O ATOM 0 H GLU A 89 -6.734 -12.553 -0.373 1.00 0.00 H new ATOM 0 HA GLU A 89 -9.094 -12.810 1.167 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -6.331 -14.066 1.513 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -7.770 -14.616 2.347 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.493 -14.447 -0.697 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.299 -15.919 0.234 1.00 0.00 H new ATOM 1287 N SER A 90 -8.640 -12.053 3.558 1.00 0.00 N ATOM 1288 CA SER A 90 -8.456 -11.330 4.853 1.00 0.00 C ATOM 1289 C SER A 90 -8.305 -12.350 5.984 1.00 0.00 C ATOM 1290 O SER A 90 -8.881 -13.419 5.949 1.00 0.00 O ATOM 1291 CB SER A 90 -9.678 -10.451 5.122 1.00 0.00 C ATOM 1292 OG SER A 90 -9.842 -9.533 4.048 1.00 0.00 O ATOM 0 H SER A 90 -9.495 -12.606 3.492 1.00 0.00 H new ATOM 0 HA SER A 90 -7.564 -10.706 4.801 1.00 0.00 H new ATOM 0 HB2 SER A 90 -10.569 -11.070 5.226 1.00 0.00 H new ATOM 0 HB3 SER A 90 -9.553 -9.912 6.061 1.00 0.00 H new ATOM 0 HG SER A 90 -8.962 -9.240 3.731 1.00 0.00 H new ATOM 1298 N ILE A 91 -7.529 -12.031 6.984 1.00 0.00 N ATOM 1299 CA ILE A 91 -7.337 -12.988 8.110 1.00 0.00 C ATOM 1300 C ILE A 91 -8.642 -13.140 8.898 1.00 0.00 C ATOM 1301 O ILE A 91 -8.960 -14.206 9.387 1.00 0.00 O ATOM 1302 CB ILE A 91 -6.225 -12.473 9.033 1.00 0.00 C ATOM 1303 CG1 ILE A 91 -6.703 -11.227 9.790 1.00 0.00 C ATOM 1304 CG2 ILE A 91 -4.996 -12.112 8.196 1.00 0.00 C ATOM 1305 CD1 ILE A 91 -5.577 -10.715 10.688 1.00 0.00 C ATOM 0 H ILE A 91 -7.021 -11.151 7.070 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.053 -13.962 7.711 1.00 0.00 H new ATOM 0 HB ILE A 91 -5.970 -13.253 9.750 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.001 -10.452 9.084 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.581 -11.467 10.390 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.205 -11.746 8.850 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -4.646 -12.996 7.663 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.260 -11.336 7.477 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.915 -9.830 11.227 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.300 -11.490 11.402 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -4.712 -10.459 10.076 1.00 0.00 H new ATOM 1317 N TYR A 92 -9.400 -12.085 9.032 1.00 0.00 N ATOM 1318 CA TYR A 92 -10.679 -12.183 9.795 1.00 0.00 C ATOM 1319 C TYR A 92 -11.664 -13.072 9.035 1.00 0.00 C ATOM 1320 O TYR A 92 -12.397 -13.844 9.621 1.00 0.00 O ATOM 1321 CB TYR A 92 -11.284 -10.789 9.969 1.00 0.00 C ATOM 1322 CG TYR A 92 -10.294 -9.892 10.678 1.00 0.00 C ATOM 1323 CD1 TYR A 92 -9.851 -10.217 11.967 1.00 0.00 C ATOM 1324 CD2 TYR A 92 -9.815 -8.738 10.043 1.00 0.00 C ATOM 1325 CE1 TYR A 92 -8.931 -9.390 12.619 1.00 0.00 C ATOM 1326 CE2 TYR A 92 -8.895 -7.911 10.698 1.00 0.00 C ATOM 1327 CZ TYR A 92 -8.453 -8.237 11.986 1.00 0.00 C ATOM 1328 OH TYR A 92 -7.545 -7.424 12.630 1.00 0.00 O ATOM 0 H TYR A 92 -9.191 -11.163 8.648 1.00 0.00 H new ATOM 0 HA TYR A 92 -10.479 -12.616 10.775 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -11.540 -10.368 8.996 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -12.209 -10.852 10.542 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -10.220 -11.106 12.457 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -10.155 -8.487 9.049 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -8.589 -9.641 13.612 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -8.526 -7.021 10.210 1.00 0.00 H new ATOM 0 HH TYR A 92 -7.094 -7.932 13.336 1.00 0.00 H new ATOM 1338 N GLY A 93 -11.691 -12.967 7.735 1.00 0.00 N ATOM 1339 CA GLY A 93 -12.635 -13.803 6.942 1.00 0.00 C ATOM 1340 C GLY A 93 -14.038 -13.204 7.030 1.00 0.00 C ATOM 1341 O GLY A 93 -15.016 -13.833 6.680 1.00 0.00 O ATOM 0 H GLY A 93 -11.101 -12.339 7.188 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -12.312 -13.850 5.902 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.639 -14.825 7.320 1.00 0.00 H new ATOM 1345 N ALA A 94 -14.145 -11.990 7.500 1.00 0.00 N ATOM 1346 CA ALA A 94 -15.486 -11.347 7.616 1.00 0.00 C ATOM 1347 C ALA A 94 -15.351 -9.841 7.377 1.00 0.00 C ATOM 1348 O ALA A 94 -14.298 -9.264 7.562 1.00 0.00 O ATOM 1349 CB ALA A 94 -16.049 -11.592 9.016 1.00 0.00 C ATOM 0 H ALA A 94 -13.361 -11.415 7.809 1.00 0.00 H new ATOM 0 HA ALA A 94 -16.160 -11.774 6.873 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -17.029 -11.122 9.101 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -16.144 -12.664 9.187 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -15.376 -11.164 9.759 1.00 0.00 H new ATOM 1355 N LYS A 95 -16.412 -9.202 6.966 1.00 0.00 N ATOM 1356 CA LYS A 95 -16.353 -7.732 6.712 1.00 0.00 C ATOM 1357 C LYS A 95 -16.832 -6.972 7.951 1.00 0.00 C ATOM 1358 O LYS A 95 -17.682 -7.438 8.685 1.00 0.00 O ATOM 1359 CB LYS A 95 -17.258 -7.384 5.530 1.00 0.00 C ATOM 1360 CG LYS A 95 -16.706 -8.020 4.253 1.00 0.00 C ATOM 1361 CD LYS A 95 -17.564 -7.592 3.061 1.00 0.00 C ATOM 1362 CE LYS A 95 -17.043 -8.261 1.789 1.00 0.00 C ATOM 1363 NZ LYS A 95 -16.877 -9.722 2.027 1.00 0.00 N ATOM 0 H LYS A 95 -17.320 -9.634 6.794 1.00 0.00 H new ATOM 0 HA LYS A 95 -15.325 -7.449 6.487 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -18.271 -7.741 5.717 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -17.319 -6.302 5.412 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -15.671 -7.714 4.099 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -16.707 -9.106 4.345 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -18.604 -7.870 3.230 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -17.537 -6.508 2.951 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -17.738 -8.093 0.966 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -16.090 -7.819 1.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -16.992 -10.235 1.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -15.928 -9.906 2.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -17.595 -10.047 2.706 1.00 0.00 H new ATOM 1377 N PHE A 96 -16.302 -5.800 8.181 1.00 0.00 N ATOM 1378 CA PHE A 96 -16.730 -4.997 9.364 1.00 0.00 C ATOM 1379 C PHE A 96 -16.968 -3.548 8.928 1.00 0.00 C ATOM 1380 O PHE A 96 -16.491 -3.113 7.898 1.00 0.00 O ATOM 1381 CB PHE A 96 -15.643 -5.039 10.441 1.00 0.00 C ATOM 1382 CG PHE A 96 -14.378 -4.401 9.918 1.00 0.00 C ATOM 1383 CD1 PHE A 96 -14.172 -3.025 10.075 1.00 0.00 C ATOM 1384 CD2 PHE A 96 -13.406 -5.186 9.286 1.00 0.00 C ATOM 1385 CE1 PHE A 96 -12.997 -2.434 9.598 1.00 0.00 C ATOM 1386 CE2 PHE A 96 -12.231 -4.595 8.807 1.00 0.00 C ATOM 1387 CZ PHE A 96 -12.026 -3.219 8.965 1.00 0.00 C ATOM 0 H PHE A 96 -15.588 -5.363 7.598 1.00 0.00 H new ATOM 0 HA PHE A 96 -17.651 -5.413 9.773 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -15.983 -4.515 11.334 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -15.447 -6.071 10.732 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -14.920 -2.420 10.565 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -13.563 -6.248 9.168 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -12.839 -1.372 9.718 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -11.483 -5.200 8.316 1.00 0.00 H new ATOM 0 HZ PHE A 96 -11.118 -2.763 8.598 1.00 0.00 H new ATOM 1397 N ALA A 97 -17.709 -2.800 9.702 1.00 0.00 N ATOM 1398 CA ALA A 97 -17.990 -1.379 9.335 1.00 0.00 C ATOM 1399 C ALA A 97 -17.148 -0.443 10.205 1.00 0.00 C ATOM 1400 O ALA A 97 -16.814 -0.759 11.330 1.00 0.00 O ATOM 1401 CB ALA A 97 -19.474 -1.082 9.564 1.00 0.00 C ATOM 0 H ALA A 97 -18.133 -3.112 10.575 1.00 0.00 H new ATOM 0 HA ALA A 97 -17.738 -1.221 8.286 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -19.683 -0.046 9.297 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -20.078 -1.745 8.944 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.720 -1.243 10.614 1.00 0.00 H new ATOM 1407 N ASP A 98 -16.805 0.710 9.693 1.00 0.00 N ATOM 1408 CA ASP A 98 -15.988 1.675 10.488 1.00 0.00 C ATOM 1409 C ASP A 98 -16.542 3.088 10.290 1.00 0.00 C ATOM 1410 O ASP A 98 -16.037 3.860 9.499 1.00 0.00 O ATOM 1411 CB ASP A 98 -14.534 1.626 10.012 1.00 0.00 C ATOM 1412 CG ASP A 98 -13.670 2.512 10.911 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -14.192 3.013 11.892 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -12.501 2.674 10.603 1.00 0.00 O ATOM 0 H ASP A 98 -17.056 1.026 8.756 1.00 0.00 H new ATOM 0 HA ASP A 98 -16.032 1.409 11.544 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -14.167 0.600 10.035 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -14.468 1.965 8.978 1.00 0.00 H new ATOM 1419 N GLU A 99 -17.576 3.429 11.007 1.00 0.00 N ATOM 1420 CA GLU A 99 -18.172 4.789 10.870 1.00 0.00 C ATOM 1421 C GLU A 99 -17.160 5.849 11.308 1.00 0.00 C ATOM 1422 O GLU A 99 -17.182 6.972 10.844 1.00 0.00 O ATOM 1423 CB GLU A 99 -19.423 4.885 11.747 1.00 0.00 C ATOM 1424 CG GLU A 99 -20.127 6.221 11.494 1.00 0.00 C ATOM 1425 CD GLU A 99 -21.322 6.356 12.439 1.00 0.00 C ATOM 1426 OE1 GLU A 99 -21.528 5.455 13.234 1.00 0.00 O ATOM 1427 OE2 GLU A 99 -22.011 7.358 12.352 1.00 0.00 O ATOM 0 H GLU A 99 -18.037 2.822 11.685 1.00 0.00 H new ATOM 0 HA GLU A 99 -18.440 4.960 9.827 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -20.099 4.059 11.526 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -19.149 4.800 12.799 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -19.432 7.046 11.650 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -20.461 6.278 10.458 1.00 0.00 H new ATOM 1434 N ASN A 100 -16.281 5.509 12.211 1.00 0.00 N ATOM 1435 CA ASN A 100 -15.280 6.504 12.690 1.00 0.00 C ATOM 1436 C ASN A 100 -14.479 7.055 11.507 1.00 0.00 C ATOM 1437 O ASN A 100 -14.132 6.340 10.589 1.00 0.00 O ATOM 1438 CB ASN A 100 -14.326 5.834 13.682 1.00 0.00 C ATOM 1439 CG ASN A 100 -15.113 5.352 14.901 1.00 0.00 C ATOM 1440 OD1 ASN A 100 -16.404 5.536 14.944 1.00 0.00 O flip ATOM 1441 ND2 ASN A 100 -14.547 4.805 15.827 1.00 0.00 N flip ATOM 0 H ASN A 100 -16.213 4.585 12.638 1.00 0.00 H new ATOM 0 HA ASN A 100 -15.803 7.325 13.181 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -13.821 4.993 13.206 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -13.552 6.537 13.990 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -13.538 4.661 15.794 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -15.081 4.490 16.637 1.00 0.00 H new ATOM 1448 N PHE A 101 -14.181 8.326 11.532 1.00 0.00 N ATOM 1449 CA PHE A 101 -13.400 8.944 10.422 1.00 0.00 C ATOM 1450 C PHE A 101 -12.587 10.114 10.982 1.00 0.00 C ATOM 1451 O PHE A 101 -12.563 11.194 10.427 1.00 0.00 O ATOM 1452 CB PHE A 101 -14.360 9.449 9.342 1.00 0.00 C ATOM 1453 CG PHE A 101 -13.572 9.946 8.152 1.00 0.00 C ATOM 1454 CD1 PHE A 101 -13.026 9.031 7.244 1.00 0.00 C ATOM 1455 CD2 PHE A 101 -13.390 11.321 7.954 1.00 0.00 C ATOM 1456 CE1 PHE A 101 -12.298 9.490 6.140 1.00 0.00 C ATOM 1457 CE2 PHE A 101 -12.663 11.780 6.850 1.00 0.00 C ATOM 1458 CZ PHE A 101 -12.116 10.864 5.943 1.00 0.00 C ATOM 0 H PHE A 101 -14.447 8.967 12.279 1.00 0.00 H new ATOM 0 HA PHE A 101 -12.728 8.207 9.983 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -15.032 8.648 9.036 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -14.981 10.252 9.740 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.166 7.971 7.395 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -13.811 12.027 8.654 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -11.877 8.784 5.440 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -12.524 12.840 6.698 1.00 0.00 H new ATOM 0 HZ PHE A 101 -11.554 11.218 5.091 1.00 0.00 H new ATOM 1468 N ILE A 102 -11.928 9.903 12.088 1.00 0.00 N ATOM 1469 CA ILE A 102 -11.120 10.993 12.707 1.00 0.00 C ATOM 1470 C ILE A 102 -10.049 11.480 11.727 1.00 0.00 C ATOM 1471 O ILE A 102 -9.708 12.645 11.699 1.00 0.00 O ATOM 1472 CB ILE A 102 -10.447 10.460 13.971 1.00 0.00 C ATOM 1473 CG1 ILE A 102 -11.522 10.015 14.968 1.00 0.00 C ATOM 1474 CG2 ILE A 102 -9.593 11.564 14.598 1.00 0.00 C ATOM 1475 CD1 ILE A 102 -10.868 9.256 16.126 1.00 0.00 C ATOM 0 H ILE A 102 -11.914 9.017 12.593 1.00 0.00 H new ATOM 0 HA ILE A 102 -11.775 11.827 12.957 1.00 0.00 H new ATOM 0 HB ILE A 102 -9.812 9.611 13.717 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -12.061 10.883 15.348 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -12.253 9.378 14.470 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -9.113 11.184 15.500 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -8.830 11.882 13.887 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -10.227 12.413 14.854 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -11.635 8.941 16.834 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -10.349 8.379 15.739 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -10.154 9.907 16.631 1.00 0.00 H new ATOM 1487 N LYS A 103 -9.505 10.599 10.933 1.00 0.00 N ATOM 1488 CA LYS A 103 -8.448 11.023 9.971 1.00 0.00 C ATOM 1489 C LYS A 103 -9.095 11.653 8.736 1.00 0.00 C ATOM 1490 O LYS A 103 -10.108 11.193 8.245 1.00 0.00 O ATOM 1491 CB LYS A 103 -7.627 9.802 9.551 1.00 0.00 C ATOM 1492 CG LYS A 103 -7.093 9.083 10.795 1.00 0.00 C ATOM 1493 CD LYS A 103 -6.109 9.989 11.540 1.00 0.00 C ATOM 1494 CE LYS A 103 -5.340 9.166 12.575 1.00 0.00 C ATOM 1495 NZ LYS A 103 -4.278 10.010 13.191 1.00 0.00 N ATOM 0 H LYS A 103 -9.745 9.608 10.908 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.797 11.756 10.448 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -8.244 9.122 8.963 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.798 10.111 8.914 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.920 8.812 11.452 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.599 8.156 10.505 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -5.415 10.447 10.835 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -6.646 10.800 12.031 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -6.021 8.801 13.344 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -4.895 8.291 12.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.507 9.402 13.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.907 10.674 12.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.678 10.544 13.989 1.00 0.00 H new ATOM 1509 N LYS A 104 -8.513 12.709 8.232 1.00 0.00 N ATOM 1510 CA LYS A 104 -9.082 13.383 7.028 1.00 0.00 C ATOM 1511 C LYS A 104 -8.419 12.826 5.768 1.00 0.00 C ATOM 1512 O LYS A 104 -7.312 12.327 5.805 1.00 0.00 O ATOM 1513 CB LYS A 104 -8.814 14.887 7.105 1.00 0.00 C ATOM 1514 CG LYS A 104 -9.657 15.608 6.050 1.00 0.00 C ATOM 1515 CD LYS A 104 -9.289 17.090 6.029 1.00 0.00 C ATOM 1516 CE LYS A 104 -10.276 17.850 5.143 1.00 0.00 C ATOM 1517 NZ LYS A 104 -10.593 17.033 3.938 1.00 0.00 N ATOM 0 H LYS A 104 -7.664 13.135 8.604 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.156 13.201 6.992 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.058 15.261 8.099 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -7.755 15.088 6.940 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -9.486 15.166 5.068 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -10.717 15.489 6.273 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -9.307 17.494 7.041 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.274 17.218 5.653 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -11.188 18.066 5.699 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -9.850 18.808 4.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -10.988 17.646 3.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -9.725 16.581 3.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -11.288 16.301 4.188 1.00 0.00 H new ATOM 1531 N HIS A 105 -9.084 12.920 4.649 1.00 0.00 N ATOM 1532 CA HIS A 105 -8.492 12.411 3.381 1.00 0.00 C ATOM 1533 C HIS A 105 -7.838 13.578 2.640 1.00 0.00 C ATOM 1534 O HIS A 105 -8.389 14.124 1.706 1.00 0.00 O ATOM 1535 CB HIS A 105 -9.594 11.808 2.507 1.00 0.00 C ATOM 1536 CG HIS A 105 -8.984 11.218 1.266 1.00 0.00 C ATOM 1537 ND1 HIS A 105 -8.140 10.118 1.305 1.00 0.00 N ATOM 1538 CD2 HIS A 105 -9.086 11.564 -0.061 1.00 0.00 C ATOM 1539 CE1 HIS A 105 -7.771 9.841 0.041 1.00 0.00 C ATOM 1540 NE2 HIS A 105 -8.319 10.693 -0.826 1.00 0.00 N ATOM 0 H HIS A 105 -10.014 13.329 4.559 1.00 0.00 H new ATOM 0 HA HIS A 105 -7.748 11.645 3.601 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -10.132 11.039 3.061 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -10.320 12.575 2.239 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -9.671 12.385 -0.449 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -7.114 9.030 -0.236 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -8.200 10.703 -1.839 1.00 0.00 H new ATOM 1549 N THR A 106 -6.666 13.972 3.061 1.00 0.00 N ATOM 1550 CA THR A 106 -5.979 15.112 2.392 1.00 0.00 C ATOM 1551 C THR A 106 -5.825 14.809 0.900 1.00 0.00 C ATOM 1552 O THR A 106 -5.998 15.670 0.061 1.00 0.00 O ATOM 1553 CB THR A 106 -4.600 15.312 3.024 1.00 0.00 C ATOM 1554 OG1 THR A 106 -4.729 15.318 4.440 1.00 0.00 O ATOM 1555 CG2 THR A 106 -4.021 16.650 2.565 1.00 0.00 C ATOM 0 H THR A 106 -6.156 13.553 3.839 1.00 0.00 H new ATOM 0 HA THR A 106 -6.569 16.020 2.515 1.00 0.00 H new ATOM 0 HB THR A 106 -3.937 14.502 2.719 1.00 0.00 H new ATOM 0 HG1 THR A 106 -3.847 15.444 4.848 1.00 0.00 H new ATOM 0 HG21 THR A 106 -3.038 16.795 3.014 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.927 16.653 1.479 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.684 17.458 2.874 1.00 0.00 H new ATOM 1563 N GLY A 107 -5.506 13.585 0.564 1.00 0.00 N ATOM 1564 CA GLY A 107 -5.348 13.214 -0.874 1.00 0.00 C ATOM 1565 C GLY A 107 -4.019 12.478 -1.084 1.00 0.00 C ATOM 1566 O GLY A 107 -3.934 11.280 -0.900 1.00 0.00 O ATOM 0 H GLY A 107 -5.348 12.825 1.226 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.177 12.580 -1.188 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.379 14.110 -1.494 1.00 0.00 H new ATOM 1570 N PRO A 108 -2.989 13.185 -1.483 1.00 0.00 N ATOM 1571 CA PRO A 108 -1.645 12.581 -1.739 1.00 0.00 C ATOM 1572 C PRO A 108 -0.949 12.096 -0.461 1.00 0.00 C ATOM 1573 O PRO A 108 -1.006 12.735 0.571 1.00 0.00 O ATOM 1574 CB PRO A 108 -0.850 13.721 -2.386 1.00 0.00 C ATOM 1575 CG PRO A 108 -1.508 14.975 -1.913 1.00 0.00 C ATOM 1576 CD PRO A 108 -2.988 14.637 -1.730 1.00 0.00 C ATOM 0 HA PRO A 108 -1.724 11.691 -2.363 1.00 0.00 H new ATOM 0 HB2 PRO A 108 0.198 13.689 -2.087 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -0.874 13.650 -3.473 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -1.068 15.316 -0.976 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -1.379 15.779 -2.637 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -3.423 15.185 -0.894 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -3.569 14.892 -2.616 1.00 0.00 H new ATOM 1584 N GLY A 109 -0.276 10.977 -0.532 1.00 0.00 N ATOM 1585 CA GLY A 109 0.445 10.453 0.663 1.00 0.00 C ATOM 1586 C GLY A 109 -0.547 9.832 1.650 1.00 0.00 C ATOM 1587 O GLY A 109 -0.269 9.721 2.827 1.00 0.00 O ATOM 0 H GLY A 109 -0.195 10.402 -1.371 1.00 0.00 H new ATOM 0 HA2 GLY A 109 1.178 9.707 0.356 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.994 11.260 1.148 1.00 0.00 H new ATOM 1591 N ILE A 110 -1.699 9.431 1.184 1.00 0.00 N ATOM 1592 CA ILE A 110 -2.710 8.821 2.102 1.00 0.00 C ATOM 1593 C ILE A 110 -2.953 7.359 1.719 1.00 0.00 C ATOM 1594 O ILE A 110 -3.132 7.028 0.563 1.00 0.00 O ATOM 1595 CB ILE A 110 -4.026 9.592 1.986 1.00 0.00 C ATOM 1596 CG1 ILE A 110 -3.785 11.086 2.238 1.00 0.00 C ATOM 1597 CG2 ILE A 110 -5.025 9.058 3.012 1.00 0.00 C ATOM 1598 CD1 ILE A 110 -3.031 11.287 3.557 1.00 0.00 C ATOM 0 H ILE A 110 -1.986 9.498 0.208 1.00 0.00 H new ATOM 0 HA ILE A 110 -2.337 8.868 3.125 1.00 0.00 H new ATOM 0 HB ILE A 110 -4.427 9.459 0.981 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -3.212 11.513 1.415 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -4.738 11.615 2.271 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -5.962 9.608 2.928 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -5.208 8.000 2.825 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -4.619 9.184 4.015 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -2.867 12.352 3.724 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -3.619 10.878 4.378 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -2.070 10.775 3.509 1.00 0.00 H new ATOM 1610 N LEU A 111 -2.978 6.481 2.689 1.00 0.00 N ATOM 1611 CA LEU A 111 -3.229 5.039 2.392 1.00 0.00 C ATOM 1612 C LEU A 111 -4.724 4.755 2.544 1.00 0.00 C ATOM 1613 O LEU A 111 -5.356 5.206 3.478 1.00 0.00 O ATOM 1614 CB LEU A 111 -2.454 4.158 3.376 1.00 0.00 C ATOM 1615 CG LEU A 111 -0.953 4.194 3.067 1.00 0.00 C ATOM 1616 CD1 LEU A 111 -0.680 3.552 1.700 1.00 0.00 C ATOM 1617 CD2 LEU A 111 -0.461 5.643 3.064 1.00 0.00 C ATOM 0 H LEU A 111 -2.835 6.701 3.675 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.901 4.818 1.376 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.629 4.502 4.396 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.818 3.132 3.318 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.420 3.633 3.835 1.00 0.00 H new ATOM 0 HD11 LEU A 111 0.389 3.583 1.491 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -1.018 2.516 1.711 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.217 4.101 0.926 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.606 5.664 2.844 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -1.000 6.209 2.304 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.639 6.090 4.042 1.00 0.00 H new ATOM 1629 N SER A 112 -5.295 4.009 1.638 1.00 0.00 N ATOM 1630 CA SER A 112 -6.748 3.698 1.742 1.00 0.00 C ATOM 1631 C SER A 112 -7.013 2.292 1.207 1.00 0.00 C ATOM 1632 O SER A 112 -6.432 1.869 0.227 1.00 0.00 O ATOM 1633 CB SER A 112 -7.545 4.713 0.921 1.00 0.00 C ATOM 1634 OG SER A 112 -8.935 4.461 1.083 1.00 0.00 O ATOM 0 H SER A 112 -4.819 3.603 0.832 1.00 0.00 H new ATOM 0 HA SER A 112 -7.055 3.750 2.787 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.307 5.726 1.244 1.00 0.00 H new ATOM 0 HB3 SER A 112 -7.271 4.642 -0.132 1.00 0.00 H new ATOM 0 HG SER A 112 -9.172 4.531 2.031 1.00 0.00 H new ATOM 1640 N MET A 113 -7.890 1.563 1.841 1.00 0.00 N ATOM 1641 CA MET A 113 -8.197 0.185 1.364 1.00 0.00 C ATOM 1642 C MET A 113 -9.271 0.257 0.277 1.00 0.00 C ATOM 1643 O MET A 113 -10.234 0.988 0.391 1.00 0.00 O ATOM 1644 CB MET A 113 -8.715 -0.658 2.532 1.00 0.00 C ATOM 1645 CG MET A 113 -7.597 -0.848 3.561 1.00 0.00 C ATOM 1646 SD MET A 113 -8.143 -2.009 4.840 1.00 0.00 S ATOM 1647 CE MET A 113 -9.563 -1.052 5.428 1.00 0.00 C ATOM 0 H MET A 113 -8.407 1.862 2.668 1.00 0.00 H new ATOM 0 HA MET A 113 -7.293 -0.271 0.960 1.00 0.00 H new ATOM 0 HB2 MET A 113 -9.571 -0.168 2.996 1.00 0.00 H new ATOM 0 HB3 MET A 113 -9.059 -1.627 2.170 1.00 0.00 H new ATOM 0 HG2 MET A 113 -6.699 -1.225 3.072 1.00 0.00 H new ATOM 0 HG3 MET A 113 -7.336 0.110 4.012 1.00 0.00 H new ATOM 0 HE1 MET A 113 -9.817 -1.363 6.442 1.00 0.00 H new ATOM 0 HE2 MET A 113 -9.313 0.009 5.426 1.00 0.00 H new ATOM 0 HE3 MET A 113 -10.416 -1.225 4.771 1.00 0.00 H new ATOM 1657 N ALA A 114 -9.113 -0.492 -0.781 1.00 0.00 N ATOM 1658 CA ALA A 114 -10.129 -0.457 -1.870 1.00 0.00 C ATOM 1659 C ALA A 114 -11.477 -0.925 -1.320 1.00 0.00 C ATOM 1660 O ALA A 114 -11.554 -1.874 -0.568 1.00 0.00 O ATOM 1661 CB ALA A 114 -9.690 -1.382 -3.007 1.00 0.00 C ATOM 0 H ALA A 114 -8.328 -1.124 -0.937 1.00 0.00 H new ATOM 0 HA ALA A 114 -10.224 0.561 -2.249 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -10.433 -1.357 -3.804 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -8.728 -1.048 -3.397 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -9.595 -2.401 -2.631 1.00 0.00 H new ATOM 1667 N ASN A 115 -12.542 -0.268 -1.696 1.00 0.00 N ATOM 1668 CA ASN A 115 -13.885 -0.676 -1.199 1.00 0.00 C ATOM 1669 C ASN A 115 -14.930 -0.367 -2.266 1.00 0.00 C ATOM 1670 O ASN A 115 -15.191 0.777 -2.583 1.00 0.00 O ATOM 1671 CB ASN A 115 -14.225 0.103 0.069 1.00 0.00 C ATOM 1672 CG ASN A 115 -13.144 -0.129 1.126 1.00 0.00 C ATOM 1673 OD1 ASN A 115 -12.721 -1.247 1.346 1.00 0.00 O ATOM 1674 ND2 ASN A 115 -12.674 0.889 1.795 1.00 0.00 N ATOM 0 H ASN A 115 -12.538 0.534 -2.326 1.00 0.00 H new ATOM 0 HA ASN A 115 -13.879 -1.744 -0.980 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -14.303 1.166 -0.157 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -15.195 -0.214 0.452 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -11.952 0.746 2.502 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -13.028 1.828 1.611 1.00 0.00 H new ATOM 1681 N ALA A 116 -15.534 -1.375 -2.814 1.00 0.00 N ATOM 1682 CA ALA A 116 -16.570 -1.146 -3.855 1.00 0.00 C ATOM 1683 C ALA A 116 -17.802 -0.513 -3.207 1.00 0.00 C ATOM 1684 O ALA A 116 -18.530 0.238 -3.825 1.00 0.00 O ATOM 1685 CB ALA A 116 -16.948 -2.480 -4.496 1.00 0.00 C ATOM 0 H ALA A 116 -15.356 -2.353 -2.587 1.00 0.00 H new ATOM 0 HA ALA A 116 -16.182 -0.477 -4.623 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -17.708 -2.314 -5.260 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -16.065 -2.927 -4.953 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -17.341 -3.152 -3.733 1.00 0.00 H new ATOM 1691 N GLY A 117 -18.034 -0.813 -1.958 1.00 0.00 N ATOM 1692 CA GLY A 117 -19.212 -0.237 -1.243 1.00 0.00 C ATOM 1693 C GLY A 117 -18.787 0.180 0.166 1.00 0.00 C ATOM 1694 O GLY A 117 -17.714 -0.156 0.624 1.00 0.00 O ATOM 0 H GLY A 117 -17.454 -1.437 -1.397 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -19.600 0.623 -1.789 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -20.016 -0.971 -1.192 1.00 0.00 H new ATOM 1698 N PRO A 118 -19.627 0.912 0.848 1.00 0.00 N ATOM 1699 CA PRO A 118 -19.341 1.392 2.232 1.00 0.00 C ATOM 1700 C PRO A 118 -19.295 0.240 3.239 1.00 0.00 C ATOM 1701 O PRO A 118 -19.878 -0.806 3.031 1.00 0.00 O ATOM 1702 CB PRO A 118 -20.504 2.338 2.542 1.00 0.00 C ATOM 1703 CG PRO A 118 -21.611 1.885 1.653 1.00 0.00 C ATOM 1704 CD PRO A 118 -20.946 1.363 0.379 1.00 0.00 C ATOM 0 HA PRO A 118 -18.366 1.875 2.303 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -20.791 2.281 3.592 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -20.235 3.375 2.341 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -22.201 1.104 2.133 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -22.292 2.706 1.429 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -21.515 0.547 -0.067 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -20.859 2.142 -0.378 1.00 0.00 H new ATOM 1712 N ASN A 119 -18.603 0.427 4.326 1.00 0.00 N ATOM 1713 CA ASN A 119 -18.510 -0.651 5.353 1.00 0.00 C ATOM 1714 C ASN A 119 -17.999 -1.935 4.700 1.00 0.00 C ATOM 1715 O ASN A 119 -18.518 -3.009 4.929 1.00 0.00 O ATOM 1716 CB ASN A 119 -19.889 -0.898 5.967 1.00 0.00 C ATOM 1717 CG ASN A 119 -20.424 0.405 6.564 1.00 0.00 C ATOM 1718 OD1 ASN A 119 -19.687 1.159 7.168 1.00 0.00 O ATOM 1719 ND2 ASN A 119 -21.686 0.704 6.418 1.00 0.00 N ATOM 0 H ASN A 119 -18.095 1.283 4.550 1.00 0.00 H new ATOM 0 HA ASN A 119 -17.818 -0.345 6.138 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -20.576 -1.271 5.207 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -19.823 -1.664 6.740 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -22.054 1.571 6.811 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -22.305 0.071 5.911 1.00 0.00 H new ATOM 1726 N THR A 120 -16.980 -1.831 3.890 1.00 0.00 N ATOM 1727 CA THR A 120 -16.418 -3.031 3.219 1.00 0.00 C ATOM 1728 C THR A 120 -14.906 -3.044 3.421 1.00 0.00 C ATOM 1729 O THR A 120 -14.218 -2.088 3.120 1.00 0.00 O ATOM 1730 CB THR A 120 -16.735 -2.970 1.722 1.00 0.00 C ATOM 1731 OG1 THR A 120 -18.142 -2.937 1.538 1.00 0.00 O ATOM 1732 CG2 THR A 120 -16.149 -4.196 1.017 1.00 0.00 C ATOM 0 H THR A 120 -16.510 -0.954 3.664 1.00 0.00 H new ATOM 0 HA THR A 120 -16.855 -3.935 3.643 1.00 0.00 H new ATOM 0 HB THR A 120 -16.293 -2.070 1.295 1.00 0.00 H new ATOM 0 HG1 THR A 120 -18.506 -2.124 1.946 1.00 0.00 H new ATOM 0 HG21 THR A 120 -16.378 -4.147 -0.048 1.00 0.00 H new ATOM 0 HG22 THR A 120 -15.068 -4.213 1.156 1.00 0.00 H new ATOM 0 HG23 THR A 120 -16.584 -5.102 1.440 1.00 0.00 H new ATOM 1740 N ASN A 121 -14.386 -4.119 3.934 1.00 0.00 N ATOM 1741 CA ASN A 121 -12.916 -4.208 4.166 1.00 0.00 C ATOM 1742 C ASN A 121 -12.262 -4.988 3.024 1.00 0.00 C ATOM 1743 O ASN A 121 -12.444 -6.182 2.890 1.00 0.00 O ATOM 1744 CB ASN A 121 -12.652 -4.933 5.487 1.00 0.00 C ATOM 1745 CG ASN A 121 -11.149 -4.950 5.767 1.00 0.00 C ATOM 1746 OD1 ASN A 121 -10.561 -3.859 6.175 1.00 0.00 O flip ATOM 1747 ND2 ASN A 121 -10.502 -5.967 5.613 1.00 0.00 N flip ATOM 0 H ASN A 121 -14.917 -4.947 4.205 1.00 0.00 H new ATOM 0 HA ASN A 121 -12.496 -3.203 4.208 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -13.179 -4.433 6.300 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -13.035 -5.952 5.438 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -10.961 -6.820 5.294 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -9.500 -5.967 5.803 1.00 0.00 H new ATOM 1754 N GLY A 122 -11.497 -4.320 2.202 1.00 0.00 N ATOM 1755 CA GLY A 122 -10.819 -5.014 1.069 1.00 0.00 C ATOM 1756 C GLY A 122 -9.328 -5.146 1.378 1.00 0.00 C ATOM 1757 O GLY A 122 -8.640 -4.167 1.588 1.00 0.00 O ATOM 0 H GLY A 122 -11.312 -3.319 2.267 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -11.259 -5.999 0.915 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -10.963 -4.453 0.145 1.00 0.00 H new ATOM 1761 N SER A 123 -8.821 -6.348 1.409 1.00 0.00 N ATOM 1762 CA SER A 123 -7.372 -6.533 1.705 1.00 0.00 C ATOM 1763 C SER A 123 -6.547 -5.738 0.693 1.00 0.00 C ATOM 1764 O SER A 123 -5.500 -5.208 1.010 1.00 0.00 O ATOM 1765 CB SER A 123 -7.015 -8.015 1.605 1.00 0.00 C ATOM 1766 OG SER A 123 -7.880 -8.765 2.447 1.00 0.00 O ATOM 0 H SER A 123 -9.345 -7.207 1.243 1.00 0.00 H new ATOM 0 HA SER A 123 -7.156 -6.178 2.713 1.00 0.00 H new ATOM 0 HB2 SER A 123 -7.109 -8.354 0.573 1.00 0.00 H new ATOM 0 HB3 SER A 123 -5.977 -8.171 1.899 1.00 0.00 H new ATOM 0 HG SER A 123 -8.325 -9.462 1.921 1.00 0.00 H new ATOM 1772 N GLN A 124 -7.011 -5.647 -0.523 1.00 0.00 N ATOM 1773 CA GLN A 124 -6.256 -4.883 -1.553 1.00 0.00 C ATOM 1774 C GLN A 124 -6.362 -3.389 -1.247 1.00 0.00 C ATOM 1775 O GLN A 124 -7.374 -2.914 -0.773 1.00 0.00 O ATOM 1776 CB GLN A 124 -6.847 -5.161 -2.937 1.00 0.00 C ATOM 1777 CG GLN A 124 -6.668 -6.641 -3.283 1.00 0.00 C ATOM 1778 CD GLN A 124 -7.305 -6.928 -4.643 1.00 0.00 C ATOM 1779 OE1 GLN A 124 -8.085 -6.139 -5.140 1.00 0.00 O ATOM 1780 NE2 GLN A 124 -7.004 -8.032 -5.270 1.00 0.00 N ATOM 0 H GLN A 124 -7.881 -6.069 -0.847 1.00 0.00 H new ATOM 0 HA GLN A 124 -5.210 -5.190 -1.540 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -7.905 -4.899 -2.951 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -6.355 -4.540 -3.685 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -5.608 -6.894 -3.305 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -7.128 -7.263 -2.515 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -6.349 -8.693 -4.852 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -7.423 -8.233 -6.178 1.00 0.00 H new ATOM 1789 N PHE A 125 -5.322 -2.644 -1.513 1.00 0.00 N ATOM 1790 CA PHE A 125 -5.358 -1.179 -1.238 1.00 0.00 C ATOM 1791 C PHE A 125 -4.763 -0.427 -2.428 1.00 0.00 C ATOM 1792 O PHE A 125 -4.091 -1.000 -3.262 1.00 0.00 O ATOM 1793 CB PHE A 125 -4.538 -0.879 0.019 1.00 0.00 C ATOM 1794 CG PHE A 125 -3.086 -1.204 -0.238 1.00 0.00 C ATOM 1795 CD1 PHE A 125 -2.627 -2.519 -0.103 1.00 0.00 C ATOM 1796 CD2 PHE A 125 -2.196 -0.187 -0.613 1.00 0.00 C ATOM 1797 CE1 PHE A 125 -1.281 -2.820 -0.342 1.00 0.00 C ATOM 1798 CE2 PHE A 125 -0.850 -0.490 -0.851 1.00 0.00 C ATOM 1799 CZ PHE A 125 -0.392 -1.806 -0.715 1.00 0.00 C ATOM 0 H PHE A 125 -4.448 -2.988 -1.910 1.00 0.00 H new ATOM 0 HA PHE A 125 -6.389 -0.859 -1.084 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -4.644 0.171 0.293 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.910 -1.467 0.858 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -3.312 -3.302 0.186 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.548 0.828 -0.718 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -0.928 -3.836 -0.238 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -0.164 0.293 -1.140 1.00 0.00 H new ATOM 0 HZ PHE A 125 0.647 -2.038 -0.898 1.00 0.00 H new ATOM 1809 N PHE A 126 -5.007 0.853 -2.513 1.00 0.00 N ATOM 1810 CA PHE A 126 -4.458 1.647 -3.649 1.00 0.00 C ATOM 1811 C PHE A 126 -3.806 2.921 -3.113 1.00 0.00 C ATOM 1812 O PHE A 126 -4.118 3.383 -2.034 1.00 0.00 O ATOM 1813 CB PHE A 126 -5.597 2.024 -4.600 1.00 0.00 C ATOM 1814 CG PHE A 126 -6.576 2.920 -3.880 1.00 0.00 C ATOM 1815 CD1 PHE A 126 -7.611 2.358 -3.123 1.00 0.00 C ATOM 1816 CD2 PHE A 126 -6.450 4.311 -3.972 1.00 0.00 C ATOM 1817 CE1 PHE A 126 -8.518 3.189 -2.455 1.00 0.00 C ATOM 1818 CE2 PHE A 126 -7.358 5.140 -3.303 1.00 0.00 C ATOM 1819 CZ PHE A 126 -8.392 4.580 -2.545 1.00 0.00 C ATOM 0 H PHE A 126 -5.564 1.384 -1.843 1.00 0.00 H new ATOM 0 HA PHE A 126 -3.715 1.054 -4.182 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -5.199 2.533 -5.478 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -6.102 1.125 -4.954 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -7.709 1.285 -3.055 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -5.653 4.744 -4.558 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -9.316 2.756 -1.870 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -7.260 6.213 -3.372 1.00 0.00 H new ATOM 0 HZ PHE A 126 -9.092 5.221 -2.030 1.00 0.00 H new ATOM 1829 N ILE A 127 -2.905 3.493 -3.865 1.00 0.00 N ATOM 1830 CA ILE A 127 -2.224 4.744 -3.413 1.00 0.00 C ATOM 1831 C ILE A 127 -2.519 5.868 -4.406 1.00 0.00 C ATOM 1832 O ILE A 127 -2.411 5.691 -5.602 1.00 0.00 O ATOM 1833 CB ILE A 127 -0.715 4.507 -3.343 1.00 0.00 C ATOM 1834 CG1 ILE A 127 -0.430 3.321 -2.416 1.00 0.00 C ATOM 1835 CG2 ILE A 127 -0.024 5.758 -2.795 1.00 0.00 C ATOM 1836 CD1 ILE A 127 1.069 3.006 -2.429 1.00 0.00 C ATOM 0 H ILE A 127 -2.609 3.147 -4.778 1.00 0.00 H new ATOM 0 HA ILE A 127 -2.592 5.024 -2.426 1.00 0.00 H new ATOM 0 HB ILE A 127 -0.335 4.291 -4.341 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.754 3.554 -1.402 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -0.998 2.449 -2.740 1.00 0.00 H new ATOM 0 HG21 ILE A 127 1.051 5.588 -2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -0.228 6.603 -3.452 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -0.403 5.975 -1.796 1.00 0.00 H new ATOM 0 HD11 ILE A 127 1.269 2.162 -1.769 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.379 2.755 -3.443 1.00 0.00 H new ATOM 0 HD13 ILE A 127 1.627 3.877 -2.084 1.00 0.00 H new ATOM 1848 N CYS A 128 -2.884 7.025 -3.920 1.00 0.00 N ATOM 1849 CA CYS A 128 -3.184 8.167 -4.834 1.00 0.00 C ATOM 1850 C CYS A 128 -2.169 9.285 -4.590 1.00 0.00 C ATOM 1851 O CYS A 128 -1.977 9.731 -3.477 1.00 0.00 O ATOM 1852 CB CYS A 128 -4.597 8.687 -4.552 1.00 0.00 C ATOM 1853 SG CYS A 128 -5.180 9.649 -5.969 1.00 0.00 S ATOM 0 H CYS A 128 -2.988 7.229 -2.926 1.00 0.00 H new ATOM 0 HA CYS A 128 -3.121 7.836 -5.871 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -5.272 7.852 -4.363 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -4.596 9.306 -3.655 1.00 0.00 H new ATOM 0 HG CYS A 128 -5.222 10.909 -5.651 1.00 0.00 H new ATOM 1859 N THR A 129 -1.511 9.737 -5.625 1.00 0.00 N ATOM 1860 CA THR A 129 -0.501 10.823 -5.456 1.00 0.00 C ATOM 1861 C THR A 129 -1.135 12.174 -5.793 1.00 0.00 C ATOM 1862 O THR A 129 -0.492 13.202 -5.737 1.00 0.00 O ATOM 1863 CB THR A 129 0.674 10.565 -6.402 1.00 0.00 C ATOM 1864 OG1 THR A 129 0.258 10.785 -7.743 1.00 0.00 O ATOM 1865 CG2 THR A 129 1.147 9.119 -6.246 1.00 0.00 C ATOM 0 H THR A 129 -1.629 9.401 -6.581 1.00 0.00 H new ATOM 0 HA THR A 129 -0.150 10.837 -4.424 1.00 0.00 H new ATOM 0 HB THR A 129 1.492 11.243 -6.159 1.00 0.00 H new ATOM 0 HG1 THR A 129 0.801 11.497 -8.141 1.00 0.00 H new ATOM 0 HG21 THR A 129 1.984 8.935 -6.920 1.00 0.00 H new ATOM 0 HG22 THR A 129 1.465 8.949 -5.217 1.00 0.00 H new ATOM 0 HG23 THR A 129 0.329 8.440 -6.489 1.00 0.00 H new ATOM 1873 N ALA A 130 -2.391 12.180 -6.146 1.00 0.00 N ATOM 1874 CA ALA A 130 -3.064 13.466 -6.491 1.00 0.00 C ATOM 1875 C ALA A 130 -4.545 13.382 -6.116 1.00 0.00 C ATOM 1876 O ALA A 130 -5.077 12.315 -5.887 1.00 0.00 O ATOM 1877 CB ALA A 130 -2.934 13.724 -7.993 1.00 0.00 C ATOM 0 H ALA A 130 -2.981 11.351 -6.211 1.00 0.00 H new ATOM 0 HA ALA A 130 -2.594 14.281 -5.940 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.426 14.664 -8.245 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -1.879 13.783 -8.262 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -3.404 12.909 -8.544 1.00 0.00 H new ATOM 1883 N LYS A 131 -5.217 14.498 -6.051 1.00 0.00 N ATOM 1884 CA LYS A 131 -6.663 14.472 -5.692 1.00 0.00 C ATOM 1885 C LYS A 131 -7.456 13.854 -6.845 1.00 0.00 C ATOM 1886 O LYS A 131 -7.211 14.139 -7.999 1.00 0.00 O ATOM 1887 CB LYS A 131 -7.151 15.900 -5.441 1.00 0.00 C ATOM 1888 CG LYS A 131 -6.424 16.484 -4.228 1.00 0.00 C ATOM 1889 CD LYS A 131 -6.992 17.870 -3.912 1.00 0.00 C ATOM 1890 CE LYS A 131 -6.188 18.506 -2.776 1.00 0.00 C ATOM 1891 NZ LYS A 131 -6.563 17.865 -1.483 1.00 0.00 N ATOM 0 H LYS A 131 -4.829 15.424 -6.230 1.00 0.00 H new ATOM 0 HA LYS A 131 -6.808 13.878 -4.790 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.967 16.518 -6.320 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -8.227 15.902 -5.269 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -6.543 15.826 -3.368 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -5.355 16.555 -4.430 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -6.951 18.502 -4.799 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -8.041 17.788 -3.628 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -5.120 18.384 -2.959 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -6.383 19.577 -2.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -6.328 18.505 -0.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.584 17.669 -1.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -6.039 16.974 -1.372 1.00 0.00 H new ATOM 1905 N THR A 132 -8.401 13.004 -6.537 1.00 0.00 N ATOM 1906 CA THR A 132 -9.212 12.357 -7.611 1.00 0.00 C ATOM 1907 C THR A 132 -10.661 12.841 -7.517 1.00 0.00 C ATOM 1908 O THR A 132 -11.427 12.380 -6.695 1.00 0.00 O ATOM 1909 CB THR A 132 -9.172 10.838 -7.421 1.00 0.00 C ATOM 1910 OG1 THR A 132 -9.276 10.539 -6.036 1.00 0.00 O ATOM 1911 CG2 THR A 132 -7.853 10.280 -7.964 1.00 0.00 C ATOM 0 H THR A 132 -8.646 12.730 -5.586 1.00 0.00 H new ATOM 0 HA THR A 132 -8.805 12.619 -8.588 1.00 0.00 H new ATOM 0 HB THR A 132 -10.002 10.383 -7.962 1.00 0.00 H new ATOM 0 HG1 THR A 132 -10.082 10.959 -5.670 1.00 0.00 H new ATOM 0 HG21 THR A 132 -7.831 9.199 -7.826 1.00 0.00 H new ATOM 0 HG22 THR A 132 -7.770 10.512 -9.026 1.00 0.00 H new ATOM 0 HG23 THR A 132 -7.019 10.732 -7.427 1.00 0.00 H new ATOM 1919 N GLU A 133 -11.043 13.765 -8.357 1.00 0.00 N ATOM 1920 CA GLU A 133 -12.443 14.273 -8.314 1.00 0.00 C ATOM 1921 C GLU A 133 -13.411 13.142 -8.673 1.00 0.00 C ATOM 1922 O GLU A 133 -14.493 13.045 -8.130 1.00 0.00 O ATOM 1923 CB GLU A 133 -12.600 15.421 -9.314 1.00 0.00 C ATOM 1924 CG GLU A 133 -13.990 16.045 -9.163 1.00 0.00 C ATOM 1925 CD GLU A 133 -14.181 17.128 -10.228 1.00 0.00 C ATOM 1926 OE1 GLU A 133 -13.271 17.322 -11.017 1.00 0.00 O ATOM 1927 OE2 GLU A 133 -15.233 17.743 -10.235 1.00 0.00 O ATOM 0 H GLU A 133 -10.448 14.188 -9.069 1.00 0.00 H new ATOM 0 HA GLU A 133 -12.667 14.634 -7.310 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -11.831 16.174 -9.142 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.464 15.053 -10.331 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -14.758 15.278 -9.267 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.101 16.475 -8.168 1.00 0.00 H new ATOM 1934 N TRP A 134 -13.034 12.287 -9.586 1.00 0.00 N ATOM 1935 CA TRP A 134 -13.941 11.169 -9.975 1.00 0.00 C ATOM 1936 C TRP A 134 -14.086 10.192 -8.801 1.00 0.00 C ATOM 1937 O TRP A 134 -15.130 9.603 -8.601 1.00 0.00 O ATOM 1938 CB TRP A 134 -13.388 10.446 -11.212 1.00 0.00 C ATOM 1939 CG TRP A 134 -11.896 10.341 -11.133 1.00 0.00 C ATOM 1940 CD1 TRP A 134 -11.211 9.194 -10.921 1.00 0.00 C ATOM 1941 CD2 TRP A 134 -10.894 11.391 -11.282 1.00 0.00 C ATOM 1942 NE1 TRP A 134 -9.858 9.475 -10.911 1.00 0.00 N ATOM 1943 CE2 TRP A 134 -9.611 10.813 -11.131 1.00 0.00 C ATOM 1944 CE3 TRP A 134 -10.973 12.775 -11.525 1.00 0.00 C ATOM 1945 CZ2 TRP A 134 -8.449 11.579 -11.217 1.00 0.00 C ATOM 1946 CZ3 TRP A 134 -9.804 13.548 -11.613 1.00 0.00 C ATOM 1947 CH2 TRP A 134 -8.545 12.952 -11.458 1.00 0.00 C ATOM 0 H TRP A 134 -12.141 12.314 -10.077 1.00 0.00 H new ATOM 0 HA TRP A 134 -14.923 11.571 -10.223 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -13.825 9.450 -11.285 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -13.673 10.986 -12.115 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -11.650 8.217 -10.782 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -9.130 8.777 -10.759 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -11.938 13.245 -11.644 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -7.481 11.114 -11.098 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -9.876 14.609 -11.801 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -7.650 13.553 -11.525 1.00 0.00 H new ATOM 1958 N LEU A 135 -13.054 10.023 -8.016 1.00 0.00 N ATOM 1959 CA LEU A 135 -13.145 9.094 -6.849 1.00 0.00 C ATOM 1960 C LEU A 135 -13.555 9.883 -5.605 1.00 0.00 C ATOM 1961 O LEU A 135 -13.474 9.394 -4.495 1.00 0.00 O ATOM 1962 CB LEU A 135 -11.795 8.429 -6.598 1.00 0.00 C ATOM 1963 CG LEU A 135 -11.295 7.731 -7.870 1.00 0.00 C ATOM 1964 CD1 LEU A 135 -10.273 6.676 -7.479 1.00 0.00 C ATOM 1965 CD2 LEU A 135 -12.448 7.048 -8.608 1.00 0.00 C ATOM 0 H LEU A 135 -12.153 10.487 -8.132 1.00 0.00 H new ATOM 0 HA LEU A 135 -13.887 8.325 -7.065 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -11.069 9.176 -6.277 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.885 7.704 -5.789 1.00 0.00 H new ATOM 0 HG LEU A 135 -10.851 8.478 -8.528 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.909 6.172 -8.375 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -9.437 7.152 -6.966 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.738 5.947 -6.816 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -12.068 6.561 -9.506 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -12.906 6.303 -7.957 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -13.193 7.793 -8.888 1.00 0.00 H new ATOM 1977 N ASP A 136 -13.985 11.103 -5.775 1.00 0.00 N ATOM 1978 CA ASP A 136 -14.389 11.921 -4.597 1.00 0.00 C ATOM 1979 C ASP A 136 -15.483 11.193 -3.818 1.00 0.00 C ATOM 1980 O ASP A 136 -16.516 10.840 -4.353 1.00 0.00 O ATOM 1981 CB ASP A 136 -14.918 13.274 -5.074 1.00 0.00 C ATOM 1982 CG ASP A 136 -15.192 14.171 -3.865 1.00 0.00 C ATOM 1983 OD1 ASP A 136 -14.871 13.759 -2.763 1.00 0.00 O ATOM 1984 OD2 ASP A 136 -15.719 15.253 -4.062 1.00 0.00 O ATOM 0 H ASP A 136 -14.074 11.568 -6.678 1.00 0.00 H new ATOM 0 HA ASP A 136 -13.525 12.075 -3.950 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -14.192 13.748 -5.734 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -15.832 13.136 -5.652 1.00 0.00 H new ATOM 1989 N GLY A 137 -15.262 10.963 -2.551 1.00 0.00 N ATOM 1990 CA GLY A 137 -16.277 10.257 -1.727 1.00 0.00 C ATOM 1991 C GLY A 137 -15.798 10.214 -0.276 1.00 0.00 C ATOM 1992 O GLY A 137 -14.962 10.993 0.136 1.00 0.00 O ATOM 0 H GLY A 137 -14.416 11.237 -2.052 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -17.237 10.769 -1.792 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -16.430 9.245 -2.103 1.00 0.00 H new ATOM 1996 N LYS A 138 -16.320 9.309 0.500 1.00 0.00 N ATOM 1997 CA LYS A 138 -15.895 9.214 1.924 1.00 0.00 C ATOM 1998 C LYS A 138 -14.383 9.004 1.996 1.00 0.00 C ATOM 1999 O LYS A 138 -13.709 9.542 2.852 1.00 0.00 O ATOM 2000 CB LYS A 138 -16.600 8.034 2.574 1.00 0.00 C ATOM 2001 CG LYS A 138 -18.102 8.300 2.579 1.00 0.00 C ATOM 2002 CD LYS A 138 -18.788 7.213 3.390 1.00 0.00 C ATOM 2003 CE LYS A 138 -20.305 7.382 3.304 1.00 0.00 C ATOM 2004 NZ LYS A 138 -20.957 6.550 4.355 1.00 0.00 N ATOM 0 H LYS A 138 -17.024 8.630 0.211 1.00 0.00 H new ATOM 0 HA LYS A 138 -16.155 10.135 2.446 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -16.381 7.116 2.028 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -16.238 7.893 3.593 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -18.311 9.280 3.008 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -18.487 8.310 1.559 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -18.501 6.231 3.015 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -18.466 7.264 4.430 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -20.573 8.430 3.436 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -20.660 7.084 2.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -21.989 6.664 4.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -20.711 5.550 4.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -20.627 6.854 5.293 1.00 0.00 H new ATOM 2018 N HIS A 139 -13.844 8.223 1.099 1.00 0.00 N ATOM 2019 CA HIS A 139 -12.374 7.975 1.103 1.00 0.00 C ATOM 2020 C HIS A 139 -11.930 7.487 2.485 1.00 0.00 C ATOM 2021 O HIS A 139 -11.270 8.195 3.219 1.00 0.00 O ATOM 2022 CB HIS A 139 -11.631 9.269 0.759 1.00 0.00 C ATOM 2023 CG HIS A 139 -11.706 9.517 -0.722 1.00 0.00 C ATOM 2024 ND1 HIS A 139 -11.197 8.618 -1.649 1.00 0.00 N ATOM 2025 CD2 HIS A 139 -12.219 10.561 -1.453 1.00 0.00 C ATOM 2026 CE1 HIS A 139 -11.411 9.133 -2.874 1.00 0.00 C ATOM 2027 NE2 HIS A 139 -12.030 10.314 -2.808 1.00 0.00 N ATOM 0 H HIS A 139 -14.361 7.745 0.361 1.00 0.00 H new ATOM 0 HA HIS A 139 -12.142 7.212 0.360 1.00 0.00 H new ATOM 0 HB2 HIS A 139 -12.070 10.107 1.301 1.00 0.00 H new ATOM 0 HB3 HIS A 139 -10.590 9.197 1.073 1.00 0.00 H new ATOM 0 HD1 HIS A 139 -10.743 7.729 -1.440 1.00 0.00 H new ATOM 0 HD2 HIS A 139 -12.695 11.438 -1.039 1.00 0.00 H new ATOM 0 HE1 HIS A 139 -11.119 8.651 -3.795 1.00 0.00 H new ATOM 2036 N VAL A 140 -12.274 6.279 2.842 1.00 0.00 N ATOM 2037 CA VAL A 140 -11.854 5.750 4.170 1.00 0.00 C ATOM 2038 C VAL A 140 -10.340 5.536 4.161 1.00 0.00 C ATOM 2039 O VAL A 140 -9.788 5.016 3.211 1.00 0.00 O ATOM 2040 CB VAL A 140 -12.560 4.419 4.437 1.00 0.00 C ATOM 2041 CG1 VAL A 140 -12.230 3.940 5.851 1.00 0.00 C ATOM 2042 CG2 VAL A 140 -14.073 4.608 4.304 1.00 0.00 C ATOM 0 H VAL A 140 -12.826 5.638 2.273 1.00 0.00 H new ATOM 0 HA VAL A 140 -12.121 6.459 4.953 1.00 0.00 H new ATOM 0 HB VAL A 140 -12.221 3.678 3.714 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -12.733 2.992 6.041 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -11.153 3.805 5.947 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -12.569 4.682 6.575 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -14.576 3.660 4.494 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.412 5.350 5.027 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -14.310 4.949 3.296 1.00 0.00 H new ATOM 2052 N VAL A 141 -9.660 5.939 5.203 1.00 0.00 N ATOM 2053 CA VAL A 141 -8.177 5.766 5.244 1.00 0.00 C ATOM 2054 C VAL A 141 -7.777 5.039 6.529 1.00 0.00 C ATOM 2055 O VAL A 141 -8.413 5.183 7.554 1.00 0.00 O ATOM 2056 CB VAL A 141 -7.510 7.143 5.214 1.00 0.00 C ATOM 2057 CG1 VAL A 141 -7.999 7.926 3.993 1.00 0.00 C ATOM 2058 CG2 VAL A 141 -7.872 7.909 6.489 1.00 0.00 C ATOM 0 H VAL A 141 -10.067 6.380 6.027 1.00 0.00 H new ATOM 0 HA VAL A 141 -7.856 5.179 4.383 1.00 0.00 H new ATOM 0 HB VAL A 141 -6.429 7.021 5.154 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -7.522 8.906 3.974 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -7.743 7.381 3.085 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.081 8.050 4.049 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -7.398 8.891 6.471 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -8.954 8.029 6.546 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -7.522 7.353 7.359 1.00 0.00 H new ATOM 2068 N PHE A 142 -6.725 4.261 6.483 1.00 0.00 N ATOM 2069 CA PHE A 142 -6.278 3.525 7.703 1.00 0.00 C ATOM 2070 C PHE A 142 -4.849 3.941 8.073 1.00 0.00 C ATOM 2071 O PHE A 142 -4.326 3.552 9.098 1.00 0.00 O ATOM 2072 CB PHE A 142 -6.325 2.018 7.435 1.00 0.00 C ATOM 2073 CG PHE A 142 -5.265 1.643 6.427 1.00 0.00 C ATOM 2074 CD1 PHE A 142 -5.527 1.765 5.058 1.00 0.00 C ATOM 2075 CD2 PHE A 142 -4.022 1.168 6.864 1.00 0.00 C ATOM 2076 CE1 PHE A 142 -4.544 1.413 4.124 1.00 0.00 C ATOM 2077 CE2 PHE A 142 -3.041 0.814 5.929 1.00 0.00 C ATOM 2078 CZ PHE A 142 -3.302 0.936 4.560 1.00 0.00 C ATOM 0 H PHE A 142 -6.156 4.104 5.651 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.943 3.768 8.532 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -6.167 1.469 8.364 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -7.310 1.736 7.062 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -6.486 2.130 4.722 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -3.820 1.075 7.921 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -4.744 1.510 3.067 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -2.083 0.447 6.265 1.00 0.00 H new ATOM 0 HZ PHE A 142 -2.545 0.662 3.840 1.00 0.00 H new ATOM 2088 N GLY A 143 -4.214 4.735 7.250 1.00 0.00 N ATOM 2089 CA GLY A 143 -2.821 5.175 7.569 1.00 0.00 C ATOM 2090 C GLY A 143 -2.445 6.368 6.683 1.00 0.00 C ATOM 2091 O GLY A 143 -3.230 6.823 5.876 1.00 0.00 O ATOM 0 H GLY A 143 -4.596 5.096 6.376 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -2.748 5.452 8.621 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -2.123 4.354 7.407 1.00 0.00 H new ATOM 2095 N GLN A 144 -1.250 6.879 6.829 1.00 0.00 N ATOM 2096 CA GLN A 144 -0.823 8.047 5.999 1.00 0.00 C ATOM 2097 C GLN A 144 0.662 7.912 5.649 1.00 0.00 C ATOM 2098 O GLN A 144 1.373 7.107 6.218 1.00 0.00 O ATOM 2099 CB GLN A 144 -1.050 9.344 6.783 1.00 0.00 C ATOM 2100 CG GLN A 144 -0.123 9.376 7.999 1.00 0.00 C ATOM 2101 CD GLN A 144 -0.525 10.533 8.914 1.00 0.00 C ATOM 2102 OE1 GLN A 144 -1.696 10.776 9.126 1.00 0.00 O ATOM 2103 NE2 GLN A 144 0.404 11.262 9.471 1.00 0.00 N ATOM 0 H GLN A 144 -0.550 6.538 7.488 1.00 0.00 H new ATOM 0 HA GLN A 144 -1.410 8.072 5.081 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -0.858 10.206 6.144 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -2.090 9.410 7.104 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -0.183 8.432 8.541 1.00 0.00 H new ATOM 0 HG3 GLN A 144 0.912 9.494 7.678 1.00 0.00 H new ATOM 0 HE21 GLN A 144 1.387 11.058 9.293 1.00 0.00 H new ATOM 0 HE22 GLN A 144 0.146 12.035 10.084 1.00 0.00 H new ATOM 2112 N VAL A 145 1.140 8.694 4.712 1.00 0.00 N ATOM 2113 CA VAL A 145 2.566 8.614 4.318 1.00 0.00 C ATOM 2114 C VAL A 145 3.361 9.701 5.048 1.00 0.00 C ATOM 2115 O VAL A 145 2.976 10.853 5.074 1.00 0.00 O ATOM 2116 CB VAL A 145 2.662 8.848 2.811 1.00 0.00 C ATOM 2117 CG1 VAL A 145 4.114 9.073 2.427 1.00 0.00 C ATOM 2118 CG2 VAL A 145 2.121 7.629 2.060 1.00 0.00 C ATOM 0 H VAL A 145 0.592 9.388 4.203 1.00 0.00 H new ATOM 0 HA VAL A 145 2.972 7.636 4.578 1.00 0.00 H new ATOM 0 HB VAL A 145 2.071 9.725 2.545 1.00 0.00 H new ATOM 0 HG11 VAL A 145 4.184 9.240 1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.499 9.945 2.956 1.00 0.00 H new ATOM 0 HG13 VAL A 145 4.702 8.196 2.697 1.00 0.00 H new ATOM 0 HG21 VAL A 145 2.192 7.802 0.986 1.00 0.00 H new ATOM 0 HG22 VAL A 145 2.707 6.749 2.325 1.00 0.00 H new ATOM 0 HG23 VAL A 145 1.078 7.467 2.333 1.00 0.00 H new ATOM 2128 N VAL A 146 4.475 9.341 5.632 1.00 0.00 N ATOM 2129 CA VAL A 146 5.311 10.349 6.350 1.00 0.00 C ATOM 2130 C VAL A 146 6.607 10.580 5.569 1.00 0.00 C ATOM 2131 O VAL A 146 7.150 11.667 5.557 1.00 0.00 O ATOM 2132 CB VAL A 146 5.640 9.832 7.753 1.00 0.00 C ATOM 2133 CG1 VAL A 146 4.367 9.806 8.599 1.00 0.00 C ATOM 2134 CG2 VAL A 146 6.212 8.416 7.657 1.00 0.00 C ATOM 0 H VAL A 146 4.842 8.390 5.642 1.00 0.00 H new ATOM 0 HA VAL A 146 4.764 11.288 6.431 1.00 0.00 H new ATOM 0 HB VAL A 146 6.374 10.491 8.217 1.00 0.00 H new ATOM 0 HG11 VAL A 146 4.601 9.438 9.598 1.00 0.00 H new ATOM 0 HG12 VAL A 146 3.957 10.813 8.670 1.00 0.00 H new ATOM 0 HG13 VAL A 146 3.634 9.148 8.133 1.00 0.00 H new ATOM 0 HG21 VAL A 146 6.446 8.049 8.657 1.00 0.00 H new ATOM 0 HG22 VAL A 146 5.478 7.758 7.192 1.00 0.00 H new ATOM 0 HG23 VAL A 146 7.120 8.431 7.054 1.00 0.00 H new ATOM 2144 N GLU A 147 7.105 9.565 4.914 1.00 0.00 N ATOM 2145 CA GLU A 147 8.366 9.718 4.131 1.00 0.00 C ATOM 2146 C GLU A 147 8.297 8.842 2.876 1.00 0.00 C ATOM 2147 O GLU A 147 7.411 8.023 2.728 1.00 0.00 O ATOM 2148 CB GLU A 147 9.560 9.286 4.984 1.00 0.00 C ATOM 2149 CG GLU A 147 9.650 10.171 6.230 1.00 0.00 C ATOM 2150 CD GLU A 147 10.899 9.797 7.032 1.00 0.00 C ATOM 2151 OE1 GLU A 147 11.515 8.798 6.698 1.00 0.00 O ATOM 2152 OE2 GLU A 147 11.217 10.516 7.964 1.00 0.00 O ATOM 0 H GLU A 147 6.691 8.633 4.888 1.00 0.00 H new ATOM 0 HA GLU A 147 8.486 10.763 3.844 1.00 0.00 H new ATOM 0 HB2 GLU A 147 9.452 8.241 5.275 1.00 0.00 H new ATOM 0 HB3 GLU A 147 10.480 9.362 4.404 1.00 0.00 H new ATOM 0 HG2 GLU A 147 9.691 11.221 5.941 1.00 0.00 H new ATOM 0 HG3 GLU A 147 8.759 10.044 6.844 1.00 0.00 H new ATOM 2159 N GLY A 148 9.232 9.001 1.977 1.00 0.00 N ATOM 2160 CA GLY A 148 9.231 8.172 0.734 1.00 0.00 C ATOM 2161 C GLY A 148 8.586 8.951 -0.413 1.00 0.00 C ATOM 2162 O GLY A 148 8.439 8.450 -1.509 1.00 0.00 O ATOM 0 H GLY A 148 9.998 9.670 2.049 1.00 0.00 H new ATOM 0 HA2 GLY A 148 10.252 7.897 0.469 1.00 0.00 H new ATOM 0 HA3 GLY A 148 8.686 7.244 0.906 1.00 0.00 H new ATOM 2166 N MET A 149 8.200 10.171 -0.172 1.00 0.00 N ATOM 2167 CA MET A 149 7.567 10.976 -1.254 1.00 0.00 C ATOM 2168 C MET A 149 8.552 11.145 -2.415 1.00 0.00 C ATOM 2169 O MET A 149 8.166 11.217 -3.564 1.00 0.00 O ATOM 2170 CB MET A 149 7.180 12.351 -0.707 1.00 0.00 C ATOM 2171 CG MET A 149 6.097 12.191 0.360 1.00 0.00 C ATOM 2172 SD MET A 149 5.496 13.824 0.864 1.00 0.00 S ATOM 2173 CE MET A 149 4.587 14.223 -0.651 1.00 0.00 C ATOM 0 H MET A 149 8.295 10.646 0.726 1.00 0.00 H new ATOM 0 HA MET A 149 6.674 10.462 -1.611 1.00 0.00 H new ATOM 0 HB2 MET A 149 8.054 12.844 -0.281 1.00 0.00 H new ATOM 0 HB3 MET A 149 6.818 12.986 -1.515 1.00 0.00 H new ATOM 0 HG2 MET A 149 5.273 11.593 -0.030 1.00 0.00 H new ATOM 0 HG3 MET A 149 6.497 11.658 1.222 1.00 0.00 H new ATOM 0 HE1 MET A 149 3.787 14.926 -0.421 1.00 0.00 H new ATOM 0 HE2 MET A 149 5.267 14.671 -1.376 1.00 0.00 H new ATOM 0 HE3 MET A 149 4.160 13.312 -1.070 1.00 0.00 H new ATOM 2183 N ASP A 150 9.820 11.223 -2.130 1.00 0.00 N ATOM 2184 CA ASP A 150 10.815 11.398 -3.226 1.00 0.00 C ATOM 2185 C ASP A 150 10.815 10.165 -4.135 1.00 0.00 C ATOM 2186 O ASP A 150 10.877 10.275 -5.344 1.00 0.00 O ATOM 2187 CB ASP A 150 12.209 11.586 -2.623 1.00 0.00 C ATOM 2188 CG ASP A 150 12.257 12.906 -1.852 1.00 0.00 C ATOM 2189 OD1 ASP A 150 11.346 13.702 -2.020 1.00 0.00 O ATOM 2190 OD2 ASP A 150 13.203 13.100 -1.106 1.00 0.00 O ATOM 0 H ASP A 150 10.211 11.174 -1.189 1.00 0.00 H new ATOM 0 HA ASP A 150 10.548 12.276 -3.814 1.00 0.00 H new ATOM 0 HB2 ASP A 150 12.444 10.755 -1.958 1.00 0.00 H new ATOM 0 HB3 ASP A 150 12.961 11.586 -3.412 1.00 0.00 H new ATOM 2195 N VAL A 151 10.758 8.991 -3.566 1.00 0.00 N ATOM 2196 CA VAL A 151 10.770 7.757 -4.403 1.00 0.00 C ATOM 2197 C VAL A 151 9.364 7.450 -4.931 1.00 0.00 C ATOM 2198 O VAL A 151 9.206 6.937 -6.021 1.00 0.00 O ATOM 2199 CB VAL A 151 11.272 6.575 -3.569 1.00 0.00 C ATOM 2200 CG1 VAL A 151 10.392 6.401 -2.334 1.00 0.00 C ATOM 2201 CG2 VAL A 151 11.223 5.299 -4.413 1.00 0.00 C ATOM 0 H VAL A 151 10.704 8.833 -2.560 1.00 0.00 H new ATOM 0 HA VAL A 151 11.435 7.918 -5.251 1.00 0.00 H new ATOM 0 HB VAL A 151 12.298 6.767 -3.255 1.00 0.00 H new ATOM 0 HG11 VAL A 151 10.754 5.559 -1.745 1.00 0.00 H new ATOM 0 HG12 VAL A 151 10.428 7.308 -1.731 1.00 0.00 H new ATOM 0 HG13 VAL A 151 9.364 6.212 -2.643 1.00 0.00 H new ATOM 0 HG21 VAL A 151 11.580 4.457 -3.820 1.00 0.00 H new ATOM 0 HG22 VAL A 151 10.197 5.111 -4.729 1.00 0.00 H new ATOM 0 HG23 VAL A 151 11.857 5.419 -5.291 1.00 0.00 H new ATOM 2211 N VAL A 152 8.343 7.742 -4.172 1.00 0.00 N ATOM 2212 CA VAL A 152 6.965 7.441 -4.657 1.00 0.00 C ATOM 2213 C VAL A 152 6.768 8.082 -6.032 1.00 0.00 C ATOM 2214 O VAL A 152 6.193 7.494 -6.928 1.00 0.00 O ATOM 2215 CB VAL A 152 5.928 7.980 -3.653 1.00 0.00 C ATOM 2216 CG1 VAL A 152 5.579 9.437 -3.970 1.00 0.00 C ATOM 2217 CG2 VAL A 152 4.657 7.135 -3.722 1.00 0.00 C ATOM 0 H VAL A 152 8.401 8.171 -3.248 1.00 0.00 H new ATOM 0 HA VAL A 152 6.829 6.363 -4.744 1.00 0.00 H new ATOM 0 HB VAL A 152 6.356 7.926 -2.652 1.00 0.00 H new ATOM 0 HG11 VAL A 152 4.845 9.800 -3.250 1.00 0.00 H new ATOM 0 HG12 VAL A 152 6.480 10.048 -3.910 1.00 0.00 H new ATOM 0 HG13 VAL A 152 5.163 9.501 -4.976 1.00 0.00 H new ATOM 0 HG21 VAL A 152 3.926 7.519 -3.011 1.00 0.00 H new ATOM 0 HG22 VAL A 152 4.243 7.182 -4.729 1.00 0.00 H new ATOM 0 HG23 VAL A 152 4.894 6.100 -3.475 1.00 0.00 H new ATOM 2227 N LYS A 153 7.253 9.282 -6.214 1.00 0.00 N ATOM 2228 CA LYS A 153 7.109 9.952 -7.536 1.00 0.00 C ATOM 2229 C LYS A 153 7.872 9.152 -8.594 1.00 0.00 C ATOM 2230 O LYS A 153 7.477 9.080 -9.741 1.00 0.00 O ATOM 2231 CB LYS A 153 7.680 11.369 -7.460 1.00 0.00 C ATOM 2232 CG LYS A 153 6.848 12.209 -6.491 1.00 0.00 C ATOM 2233 CD LYS A 153 7.343 13.656 -6.514 1.00 0.00 C ATOM 2234 CE LYS A 153 6.596 14.468 -5.455 1.00 0.00 C ATOM 2235 NZ LYS A 153 7.001 15.898 -5.550 1.00 0.00 N ATOM 0 H LYS A 153 7.742 9.826 -5.503 1.00 0.00 H new ATOM 0 HA LYS A 153 6.054 10.003 -7.804 1.00 0.00 H new ATOM 0 HB2 LYS A 153 8.718 11.336 -7.129 1.00 0.00 H new ATOM 0 HB3 LYS A 153 7.676 11.827 -8.449 1.00 0.00 H new ATOM 0 HG2 LYS A 153 5.795 12.169 -6.770 1.00 0.00 H new ATOM 0 HG3 LYS A 153 6.926 11.803 -5.482 1.00 0.00 H new ATOM 0 HD2 LYS A 153 8.416 13.688 -6.322 1.00 0.00 H new ATOM 0 HD3 LYS A 153 7.183 14.091 -7.501 1.00 0.00 H new ATOM 0 HE2 LYS A 153 5.520 14.373 -5.601 1.00 0.00 H new ATOM 0 HE3 LYS A 153 6.818 14.081 -4.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 6.494 16.451 -4.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 8.025 15.980 -5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 6.767 16.263 -6.495 1.00 0.00 H new ATOM 2249 N ALA A 154 8.971 8.557 -8.216 1.00 0.00 N ATOM 2250 CA ALA A 154 9.770 7.767 -9.195 1.00 0.00 C ATOM 2251 C ALA A 154 8.934 6.606 -9.734 1.00 0.00 C ATOM 2252 O ALA A 154 9.021 6.251 -10.890 1.00 0.00 O ATOM 2253 CB ALA A 154 11.018 7.216 -8.502 1.00 0.00 C ATOM 0 H ALA A 154 9.350 8.584 -7.270 1.00 0.00 H new ATOM 0 HA ALA A 154 10.063 8.412 -10.024 1.00 0.00 H new ATOM 0 HB1 ALA A 154 11.605 6.637 -9.215 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.619 8.043 -8.124 1.00 0.00 H new ATOM 0 HB3 ALA A 154 10.720 6.575 -7.672 1.00 0.00 H new ATOM 2259 N ILE A 155 8.128 6.008 -8.904 1.00 0.00 N ATOM 2260 CA ILE A 155 7.287 4.869 -9.372 1.00 0.00 C ATOM 2261 C ILE A 155 6.168 5.384 -10.282 1.00 0.00 C ATOM 2262 O ILE A 155 5.761 4.724 -11.218 1.00 0.00 O ATOM 2263 CB ILE A 155 6.675 4.165 -8.159 1.00 0.00 C ATOM 2264 CG1 ILE A 155 7.795 3.598 -7.284 1.00 0.00 C ATOM 2265 CG2 ILE A 155 5.765 3.026 -8.629 1.00 0.00 C ATOM 2266 CD1 ILE A 155 7.203 3.060 -5.981 1.00 0.00 C ATOM 0 H ILE A 155 8.014 6.257 -7.922 1.00 0.00 H new ATOM 0 HA ILE A 155 7.907 4.169 -9.932 1.00 0.00 H new ATOM 0 HB ILE A 155 6.087 4.880 -7.582 1.00 0.00 H new ATOM 0 HG12 ILE A 155 8.317 2.802 -7.814 1.00 0.00 H new ATOM 0 HG13 ILE A 155 8.530 4.373 -7.069 1.00 0.00 H new ATOM 0 HG21 ILE A 155 5.331 2.526 -7.763 1.00 0.00 H new ATOM 0 HG22 ILE A 155 4.968 3.431 -9.252 1.00 0.00 H new ATOM 0 HG23 ILE A 155 6.348 2.309 -9.207 1.00 0.00 H new ATOM 0 HD11 ILE A 155 8.001 2.656 -5.358 1.00 0.00 H new ATOM 0 HD12 ILE A 155 6.701 3.868 -5.449 1.00 0.00 H new ATOM 0 HD13 ILE A 155 6.484 2.272 -6.206 1.00 0.00 H new ATOM 2278 N GLU A 156 5.650 6.545 -10.000 1.00 0.00 N ATOM 2279 CA GLU A 156 4.540 7.094 -10.831 1.00 0.00 C ATOM 2280 C GLU A 156 5.062 7.629 -12.171 1.00 0.00 C ATOM 2281 O GLU A 156 4.447 7.432 -13.199 1.00 0.00 O ATOM 2282 CB GLU A 156 3.858 8.228 -10.058 1.00 0.00 C ATOM 2283 CG GLU A 156 2.645 8.735 -10.841 1.00 0.00 C ATOM 2284 CD GLU A 156 2.039 9.936 -10.112 1.00 0.00 C ATOM 2285 OE1 GLU A 156 2.560 10.296 -9.068 1.00 0.00 O ATOM 2286 OE2 GLU A 156 1.064 10.477 -10.609 1.00 0.00 O ATOM 0 H GLU A 156 5.947 7.141 -9.227 1.00 0.00 H new ATOM 0 HA GLU A 156 3.830 6.294 -11.040 1.00 0.00 H new ATOM 0 HB2 GLU A 156 3.546 7.874 -9.076 1.00 0.00 H new ATOM 0 HB3 GLU A 156 4.563 9.043 -9.894 1.00 0.00 H new ATOM 0 HG2 GLU A 156 2.942 9.020 -11.850 1.00 0.00 H new ATOM 0 HG3 GLU A 156 1.903 7.942 -10.939 1.00 0.00 H new ATOM 2293 N LYS A 157 6.173 8.317 -12.178 1.00 0.00 N ATOM 2294 CA LYS A 157 6.683 8.866 -13.470 1.00 0.00 C ATOM 2295 C LYS A 157 6.986 7.718 -14.435 1.00 0.00 C ATOM 2296 O LYS A 157 6.808 7.840 -15.630 1.00 0.00 O ATOM 2297 CB LYS A 157 7.946 9.701 -13.232 1.00 0.00 C ATOM 2298 CG LYS A 157 9.116 8.794 -12.844 1.00 0.00 C ATOM 2299 CD LYS A 157 10.333 9.657 -12.499 1.00 0.00 C ATOM 2300 CE LYS A 157 11.592 8.787 -12.465 1.00 0.00 C ATOM 2301 NZ LYS A 157 11.273 7.460 -11.865 1.00 0.00 N ATOM 0 H LYS A 157 6.743 8.521 -11.357 1.00 0.00 H new ATOM 0 HA LYS A 157 5.919 9.509 -13.907 1.00 0.00 H new ATOM 0 HB2 LYS A 157 8.195 10.262 -14.133 1.00 0.00 H new ATOM 0 HB3 LYS A 157 7.765 10.430 -12.442 1.00 0.00 H new ATOM 0 HG2 LYS A 157 8.842 8.173 -11.991 1.00 0.00 H new ATOM 0 HG3 LYS A 157 9.356 8.119 -13.666 1.00 0.00 H new ATOM 0 HD2 LYS A 157 10.448 10.451 -13.237 1.00 0.00 H new ATOM 0 HD3 LYS A 157 10.186 10.139 -11.532 1.00 0.00 H new ATOM 0 HE2 LYS A 157 11.982 8.656 -13.474 1.00 0.00 H new ATOM 0 HE3 LYS A 157 12.371 9.281 -11.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 11.777 7.358 -10.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 10.248 7.391 -11.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 11.571 6.705 -12.515 1.00 0.00 H new ATOM 2315 N VAL A 158 7.435 6.602 -13.930 1.00 0.00 N ATOM 2316 CA VAL A 158 7.735 5.452 -14.831 1.00 0.00 C ATOM 2317 C VAL A 158 6.430 4.737 -15.180 1.00 0.00 C ATOM 2318 O VAL A 158 6.375 3.926 -16.083 1.00 0.00 O ATOM 2319 CB VAL A 158 8.688 4.475 -14.134 1.00 0.00 C ATOM 2320 CG1 VAL A 158 9.999 5.190 -13.805 1.00 0.00 C ATOM 2321 CG2 VAL A 158 8.048 3.970 -12.840 1.00 0.00 C ATOM 0 H VAL A 158 7.607 6.436 -12.938 1.00 0.00 H new ATOM 0 HA VAL A 158 8.210 5.818 -15.741 1.00 0.00 H new ATOM 0 HB VAL A 158 8.887 3.631 -14.794 1.00 0.00 H new ATOM 0 HG11 VAL A 158 10.678 4.496 -13.309 1.00 0.00 H new ATOM 0 HG12 VAL A 158 10.458 5.551 -14.726 1.00 0.00 H new ATOM 0 HG13 VAL A 158 9.798 6.034 -13.145 1.00 0.00 H new ATOM 0 HG21 VAL A 158 8.727 3.275 -12.345 1.00 0.00 H new ATOM 0 HG22 VAL A 158 7.848 4.814 -12.180 1.00 0.00 H new ATOM 0 HG23 VAL A 158 7.113 3.460 -13.071 1.00 0.00 H new ATOM 2331 N GLY A 159 5.378 5.030 -14.465 1.00 0.00 N ATOM 2332 CA GLY A 159 4.075 4.367 -14.749 1.00 0.00 C ATOM 2333 C GLY A 159 3.435 4.991 -15.988 1.00 0.00 C ATOM 2334 O GLY A 159 3.888 5.998 -16.496 1.00 0.00 O ATOM 0 H GLY A 159 5.365 5.700 -13.696 1.00 0.00 H new ATOM 0 HA2 GLY A 159 4.227 3.299 -14.906 1.00 0.00 H new ATOM 0 HA3 GLY A 159 3.409 4.472 -13.893 1.00 0.00 H new ATOM 2338 N SER A 160 2.384 4.395 -16.480 1.00 0.00 N ATOM 2339 CA SER A 160 1.709 4.944 -17.689 1.00 0.00 C ATOM 2340 C SER A 160 0.274 4.418 -17.750 1.00 0.00 C ATOM 2341 O SER A 160 -0.125 3.584 -16.961 1.00 0.00 O ATOM 2342 CB SER A 160 2.468 4.504 -18.941 1.00 0.00 C ATOM 2343 OG SER A 160 1.923 5.163 -20.076 1.00 0.00 O ATOM 0 H SER A 160 1.963 3.549 -16.096 1.00 0.00 H new ATOM 0 HA SER A 160 1.697 6.033 -17.638 1.00 0.00 H new ATOM 0 HB2 SER A 160 3.527 4.743 -18.841 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.395 3.423 -19.064 1.00 0.00 H new ATOM 0 HG SER A 160 2.409 4.884 -20.880 1.00 0.00 H new ATOM 2349 N SER A 161 -0.504 4.894 -18.682 1.00 0.00 N ATOM 2350 CA SER A 161 -1.909 4.412 -18.793 1.00 0.00 C ATOM 2351 C SER A 161 -1.909 2.885 -18.887 1.00 0.00 C ATOM 2352 O SER A 161 -2.814 2.224 -18.419 1.00 0.00 O ATOM 2353 CB SER A 161 -2.554 5.003 -20.047 1.00 0.00 C ATOM 2354 OG SER A 161 -2.443 6.420 -20.010 1.00 0.00 O ATOM 0 H SER A 161 -0.228 5.595 -19.370 1.00 0.00 H new ATOM 0 HA SER A 161 -2.476 4.725 -17.916 1.00 0.00 H new ATOM 0 HB2 SER A 161 -2.066 4.612 -20.940 1.00 0.00 H new ATOM 0 HB3 SER A 161 -3.602 4.710 -20.103 1.00 0.00 H new ATOM 0 HG SER A 161 -2.854 6.801 -20.814 1.00 0.00 H new ATOM 2360 N SER A 162 -0.896 2.322 -19.488 1.00 0.00 N ATOM 2361 CA SER A 162 -0.832 0.839 -19.611 1.00 0.00 C ATOM 2362 C SER A 162 -0.918 0.209 -18.219 1.00 0.00 C ATOM 2363 O SER A 162 -1.453 -0.867 -18.046 1.00 0.00 O ATOM 2364 CB SER A 162 0.487 0.441 -20.271 1.00 0.00 C ATOM 2365 OG SER A 162 0.614 1.118 -21.515 1.00 0.00 O ATOM 0 H SER A 162 -0.110 2.826 -19.899 1.00 0.00 H new ATOM 0 HA SER A 162 -1.664 0.487 -20.221 1.00 0.00 H new ATOM 0 HB2 SER A 162 1.324 0.694 -19.619 1.00 0.00 H new ATOM 0 HB3 SER A 162 0.518 -0.637 -20.426 1.00 0.00 H new ATOM 0 HG SER A 162 1.460 0.866 -21.940 1.00 0.00 H new ATOM 2371 N GLY A 163 -0.394 0.873 -17.223 1.00 0.00 N ATOM 2372 CA GLY A 163 -0.446 0.313 -15.840 1.00 0.00 C ATOM 2373 C GLY A 163 0.852 -0.438 -15.536 1.00 0.00 C ATOM 2374 O GLY A 163 0.943 -1.170 -14.570 1.00 0.00 O ATOM 0 H GLY A 163 0.068 1.779 -17.307 1.00 0.00 H new ATOM 0 HA2 GLY A 163 -0.590 1.116 -15.118 1.00 0.00 H new ATOM 0 HA3 GLY A 163 -1.298 -0.360 -15.742 1.00 0.00 H new ATOM 2378 N ARG A 164 1.860 -0.261 -16.352 1.00 0.00 N ATOM 2379 CA ARG A 164 3.158 -0.961 -16.113 1.00 0.00 C ATOM 2380 C ARG A 164 4.265 0.077 -15.909 1.00 0.00 C ATOM 2381 O ARG A 164 4.262 1.127 -16.520 1.00 0.00 O ATOM 2382 CB ARG A 164 3.496 -1.830 -17.327 1.00 0.00 C ATOM 2383 CG ARG A 164 2.433 -2.917 -17.490 1.00 0.00 C ATOM 2384 CD ARG A 164 2.825 -3.842 -18.645 1.00 0.00 C ATOM 2385 NE ARG A 164 1.692 -4.759 -18.952 1.00 0.00 N ATOM 2386 CZ ARG A 164 1.748 -5.537 -19.999 1.00 0.00 C ATOM 2387 NH1 ARG A 164 2.797 -5.513 -20.774 1.00 0.00 N ATOM 2388 NH2 ARG A 164 0.755 -6.339 -20.270 1.00 0.00 N ATOM 0 H ARG A 164 1.840 0.340 -17.176 1.00 0.00 H new ATOM 0 HA ARG A 164 3.077 -1.588 -15.225 1.00 0.00 H new ATOM 0 HB2 ARG A 164 3.543 -1.215 -18.226 1.00 0.00 H new ATOM 0 HB3 ARG A 164 4.479 -2.284 -17.200 1.00 0.00 H new ATOM 0 HG2 ARG A 164 2.338 -3.489 -16.567 1.00 0.00 H new ATOM 0 HG3 ARG A 164 1.461 -2.464 -17.686 1.00 0.00 H new ATOM 0 HD2 ARG A 164 3.080 -3.253 -19.526 1.00 0.00 H new ATOM 0 HD3 ARG A 164 3.711 -4.418 -18.379 1.00 0.00 H new ATOM 0 HE ARG A 164 0.873 -4.779 -18.345 1.00 0.00 H new ATOM 0 HH11 ARG A 164 3.573 -4.886 -20.562 1.00 0.00 H new ATOM 0 HH12 ARG A 164 2.841 -6.121 -21.592 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -0.065 -6.358 -19.664 1.00 0.00 H new ATOM 0 HH22 ARG A 164 0.799 -6.947 -21.088 1.00 0.00 H new ATOM 2402 N THR A 165 5.212 -0.208 -15.057 1.00 0.00 N ATOM 2403 CA THR A 165 6.317 0.765 -14.821 1.00 0.00 C ATOM 2404 C THR A 165 7.377 0.611 -15.913 1.00 0.00 C ATOM 2405 O THR A 165 7.576 -0.458 -16.453 1.00 0.00 O ATOM 2406 CB THR A 165 6.956 0.494 -13.456 1.00 0.00 C ATOM 2407 OG1 THR A 165 7.483 -0.826 -13.436 1.00 0.00 O ATOM 2408 CG2 THR A 165 5.908 0.645 -12.349 1.00 0.00 C ATOM 0 H THR A 165 5.269 -1.070 -14.515 1.00 0.00 H new ATOM 0 HA THR A 165 5.915 1.778 -14.842 1.00 0.00 H new ATOM 0 HB THR A 165 7.759 1.212 -13.286 1.00 0.00 H new ATOM 0 HG1 THR A 165 8.383 -0.825 -13.824 1.00 0.00 H new ATOM 0 HG21 THR A 165 6.370 0.451 -11.381 1.00 0.00 H new ATOM 0 HG22 THR A 165 5.508 1.659 -12.363 1.00 0.00 H new ATOM 0 HG23 THR A 165 5.099 -0.067 -12.514 1.00 0.00 H new ATOM 2416 N ALA A 166 8.064 1.672 -16.235 1.00 0.00 N ATOM 2417 CA ALA A 166 9.119 1.583 -17.285 1.00 0.00 C ATOM 2418 C ALA A 166 10.245 0.682 -16.780 1.00 0.00 C ATOM 2419 O ALA A 166 10.850 -0.056 -17.532 1.00 0.00 O ATOM 2420 CB ALA A 166 9.671 2.981 -17.576 1.00 0.00 C ATOM 0 H ALA A 166 7.942 2.595 -15.818 1.00 0.00 H new ATOM 0 HA ALA A 166 8.697 1.168 -18.200 1.00 0.00 H new ATOM 0 HB1 ALA A 166 10.442 2.915 -18.344 1.00 0.00 H new ATOM 0 HB2 ALA A 166 8.864 3.625 -17.926 1.00 0.00 H new ATOM 0 HB3 ALA A 166 10.100 3.400 -16.666 1.00 0.00 H new ATOM 2426 N LYS A 167 10.525 0.737 -15.505 1.00 0.00 N ATOM 2427 CA LYS A 167 11.605 -0.112 -14.924 1.00 0.00 C ATOM 2428 C LYS A 167 10.978 -1.149 -13.991 1.00 0.00 C ATOM 2429 O LYS A 167 9.882 -0.970 -13.499 1.00 0.00 O ATOM 2430 CB LYS A 167 12.573 0.768 -14.129 1.00 0.00 C ATOM 2431 CG LYS A 167 13.250 1.764 -15.072 1.00 0.00 C ATOM 2432 CD LYS A 167 14.299 2.567 -14.301 1.00 0.00 C ATOM 2433 CE LYS A 167 14.888 3.645 -15.211 1.00 0.00 C ATOM 2434 NZ LYS A 167 15.819 3.016 -16.190 1.00 0.00 N ATOM 0 H LYS A 167 10.047 1.340 -14.835 1.00 0.00 H new ATOM 0 HA LYS A 167 12.147 -0.616 -15.724 1.00 0.00 H new ATOM 0 HB2 LYS A 167 12.036 1.301 -13.345 1.00 0.00 H new ATOM 0 HB3 LYS A 167 13.323 0.149 -13.637 1.00 0.00 H new ATOM 0 HG2 LYS A 167 13.719 1.234 -15.901 1.00 0.00 H new ATOM 0 HG3 LYS A 167 12.507 2.435 -15.503 1.00 0.00 H new ATOM 0 HD2 LYS A 167 13.847 3.026 -13.422 1.00 0.00 H new ATOM 0 HD3 LYS A 167 15.089 1.906 -13.945 1.00 0.00 H new ATOM 0 HE2 LYS A 167 14.089 4.168 -15.737 1.00 0.00 H new ATOM 0 HE3 LYS A 167 15.418 4.389 -14.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 16.296 3.758 -16.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 16.529 2.452 -15.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 15.282 2.399 -16.832 1.00 0.00 H new ATOM 2448 N LYS A 168 11.660 -2.232 -13.742 1.00 0.00 N ATOM 2449 CA LYS A 168 11.094 -3.272 -12.841 1.00 0.00 C ATOM 2450 C LYS A 168 11.067 -2.740 -11.409 1.00 0.00 C ATOM 2451 O LYS A 168 12.049 -2.223 -10.913 1.00 0.00 O ATOM 2452 CB LYS A 168 11.970 -4.525 -12.900 1.00 0.00 C ATOM 2453 CG LYS A 168 11.910 -5.124 -14.306 1.00 0.00 C ATOM 2454 CD LYS A 168 12.683 -6.444 -14.330 1.00 0.00 C ATOM 2455 CE LYS A 168 12.737 -6.980 -15.761 1.00 0.00 C ATOM 2456 NZ LYS A 168 11.387 -7.471 -16.158 1.00 0.00 N ATOM 0 H LYS A 168 12.583 -2.441 -14.123 1.00 0.00 H new ATOM 0 HA LYS A 168 10.081 -3.519 -13.158 1.00 0.00 H new ATOM 0 HB2 LYS A 168 12.999 -4.274 -12.644 1.00 0.00 H new ATOM 0 HB3 LYS A 168 11.628 -5.256 -12.167 1.00 0.00 H new ATOM 0 HG2 LYS A 168 10.873 -5.292 -14.598 1.00 0.00 H new ATOM 0 HG3 LYS A 168 12.336 -4.427 -15.028 1.00 0.00 H new ATOM 0 HD2 LYS A 168 13.693 -6.293 -13.949 1.00 0.00 H new ATOM 0 HD3 LYS A 168 12.201 -7.171 -13.676 1.00 0.00 H new ATOM 0 HE2 LYS A 168 13.065 -6.195 -16.443 1.00 0.00 H new ATOM 0 HE3 LYS A 168 13.465 -7.788 -15.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 11.459 -8.001 -17.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 11.011 -8.093 -15.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 10.747 -6.661 -16.287 1.00 0.00 H new ATOM 2470 N VAL A 169 9.950 -2.859 -10.736 1.00 0.00 N ATOM 2471 CA VAL A 169 9.861 -2.357 -9.332 1.00 0.00 C ATOM 2472 C VAL A 169 9.439 -3.499 -8.405 1.00 0.00 C ATOM 2473 O VAL A 169 8.427 -4.138 -8.608 1.00 0.00 O ATOM 2474 CB VAL A 169 8.823 -1.236 -9.262 1.00 0.00 C ATOM 2475 CG1 VAL A 169 8.801 -0.647 -7.851 1.00 0.00 C ATOM 2476 CG2 VAL A 169 9.191 -0.140 -10.265 1.00 0.00 C ATOM 0 H VAL A 169 9.096 -3.282 -11.099 1.00 0.00 H new ATOM 0 HA VAL A 169 10.833 -1.977 -9.019 1.00 0.00 H new ATOM 0 HB VAL A 169 7.838 -1.637 -9.503 1.00 0.00 H new ATOM 0 HG11 VAL A 169 8.061 0.152 -7.802 1.00 0.00 H new ATOM 0 HG12 VAL A 169 8.541 -1.427 -7.135 1.00 0.00 H new ATOM 0 HG13 VAL A 169 9.785 -0.246 -7.609 1.00 0.00 H new ATOM 0 HG21 VAL A 169 8.452 0.660 -10.217 1.00 0.00 H new ATOM 0 HG22 VAL A 169 10.176 0.260 -10.022 1.00 0.00 H new ATOM 0 HG23 VAL A 169 9.208 -0.558 -11.271 1.00 0.00 H new ATOM 2486 N VAL A 170 10.209 -3.749 -7.382 1.00 0.00 N ATOM 2487 CA VAL A 170 9.864 -4.841 -6.423 1.00 0.00 C ATOM 2488 C VAL A 170 10.405 -4.479 -5.044 1.00 0.00 C ATOM 2489 O VAL A 170 11.325 -3.694 -4.916 1.00 0.00 O ATOM 2490 CB VAL A 170 10.486 -6.159 -6.891 1.00 0.00 C ATOM 2491 CG1 VAL A 170 10.094 -7.278 -5.925 1.00 0.00 C ATOM 2492 CG2 VAL A 170 9.978 -6.499 -8.293 1.00 0.00 C ATOM 0 H VAL A 170 11.067 -3.242 -7.166 1.00 0.00 H new ATOM 0 HA VAL A 170 8.781 -4.958 -6.376 1.00 0.00 H new ATOM 0 HB VAL A 170 11.571 -6.058 -6.914 1.00 0.00 H new ATOM 0 HG11 VAL A 170 10.536 -8.217 -6.257 1.00 0.00 H new ATOM 0 HG12 VAL A 170 10.457 -7.039 -4.925 1.00 0.00 H new ATOM 0 HG13 VAL A 170 9.009 -7.376 -5.903 1.00 0.00 H new ATOM 0 HG21 VAL A 170 10.423 -7.438 -8.623 1.00 0.00 H new ATOM 0 HG22 VAL A 170 8.893 -6.599 -8.272 1.00 0.00 H new ATOM 0 HG23 VAL A 170 10.256 -5.703 -8.984 1.00 0.00 H new ATOM 2502 N VAL A 171 9.846 -5.037 -4.006 1.00 0.00 N ATOM 2503 CA VAL A 171 10.338 -4.708 -2.640 1.00 0.00 C ATOM 2504 C VAL A 171 11.481 -5.649 -2.269 1.00 0.00 C ATOM 2505 O VAL A 171 11.316 -6.851 -2.203 1.00 0.00 O ATOM 2506 CB VAL A 171 9.199 -4.869 -1.626 1.00 0.00 C ATOM 2507 CG1 VAL A 171 9.297 -3.781 -0.563 1.00 0.00 C ATOM 2508 CG2 VAL A 171 7.859 -4.745 -2.340 1.00 0.00 C ATOM 0 H VAL A 171 9.074 -5.703 -4.044 1.00 0.00 H new ATOM 0 HA VAL A 171 10.693 -3.677 -2.626 1.00 0.00 H new ATOM 0 HB VAL A 171 9.278 -5.849 -1.155 1.00 0.00 H new ATOM 0 HG11 VAL A 171 8.486 -3.900 0.155 1.00 0.00 H new ATOM 0 HG12 VAL A 171 10.253 -3.862 -0.046 1.00 0.00 H new ATOM 0 HG13 VAL A 171 9.222 -2.802 -1.036 1.00 0.00 H new ATOM 0 HG21 VAL A 171 7.050 -4.860 -1.618 1.00 0.00 H new ATOM 0 HG22 VAL A 171 7.788 -3.765 -2.812 1.00 0.00 H new ATOM 0 HG23 VAL A 171 7.779 -5.521 -3.101 1.00 0.00 H new ATOM 2518 N GLU A 172 12.638 -5.109 -2.015 1.00 0.00 N ATOM 2519 CA GLU A 172 13.789 -5.966 -1.635 1.00 0.00 C ATOM 2520 C GLU A 172 13.510 -6.621 -0.283 1.00 0.00 C ATOM 2521 O GLU A 172 14.056 -7.659 0.036 1.00 0.00 O ATOM 2522 CB GLU A 172 15.056 -5.111 -1.536 1.00 0.00 C ATOM 2523 CG GLU A 172 15.418 -4.568 -2.921 1.00 0.00 C ATOM 2524 CD GLU A 172 16.728 -3.782 -2.834 1.00 0.00 C ATOM 2525 OE1 GLU A 172 17.165 -3.520 -1.726 1.00 0.00 O ATOM 2526 OE2 GLU A 172 17.270 -3.454 -3.876 1.00 0.00 O ATOM 0 H GLU A 172 12.835 -4.109 -2.055 1.00 0.00 H new ATOM 0 HA GLU A 172 13.932 -6.737 -2.392 1.00 0.00 H new ATOM 0 HB2 GLU A 172 14.897 -4.286 -0.841 1.00 0.00 H new ATOM 0 HB3 GLU A 172 15.879 -5.707 -1.141 1.00 0.00 H new ATOM 0 HG2 GLU A 172 15.521 -5.389 -3.630 1.00 0.00 H new ATOM 0 HG3 GLU A 172 14.620 -3.925 -3.291 1.00 0.00 H new ATOM 2533 N ASP A 173 12.670 -6.022 0.524 1.00 0.00 N ATOM 2534 CA ASP A 173 12.376 -6.620 1.859 1.00 0.00 C ATOM 2535 C ASP A 173 11.261 -5.837 2.558 1.00 0.00 C ATOM 2536 O ASP A 173 10.854 -4.782 2.115 1.00 0.00 O ATOM 2537 CB ASP A 173 13.638 -6.572 2.726 1.00 0.00 C ATOM 2538 CG ASP A 173 13.408 -7.369 4.012 1.00 0.00 C ATOM 2539 OD1 ASP A 173 13.615 -8.572 3.986 1.00 0.00 O ATOM 2540 OD2 ASP A 173 13.028 -6.765 5.001 1.00 0.00 O ATOM 0 H ASP A 173 12.180 -5.152 0.317 1.00 0.00 H new ATOM 0 HA ASP A 173 12.056 -7.652 1.719 1.00 0.00 H new ATOM 0 HB2 ASP A 173 14.484 -6.985 2.177 1.00 0.00 H new ATOM 0 HB3 ASP A 173 13.887 -5.538 2.966 1.00 0.00 H new ATOM 2545 N CYS A 174 10.775 -6.351 3.658 1.00 0.00 N ATOM 2546 CA CYS A 174 9.694 -5.647 4.408 1.00 0.00 C ATOM 2547 C CYS A 174 9.796 -6.012 5.893 1.00 0.00 C ATOM 2548 O CYS A 174 10.282 -7.068 6.247 1.00 0.00 O ATOM 2549 CB CYS A 174 8.331 -6.081 3.864 1.00 0.00 C ATOM 2550 SG CYS A 174 7.896 -7.706 4.535 1.00 0.00 S ATOM 0 H CYS A 174 11.082 -7.232 4.070 1.00 0.00 H new ATOM 0 HA CYS A 174 9.802 -4.569 4.288 1.00 0.00 H new ATOM 0 HB2 CYS A 174 7.570 -5.349 4.136 1.00 0.00 H new ATOM 0 HB3 CYS A 174 8.359 -6.122 2.775 1.00 0.00 H new ATOM 0 HG CYS A 174 8.778 -8.060 5.422 1.00 0.00 H new ATOM 2556 N GLY A 175 9.342 -5.153 6.763 1.00 0.00 N ATOM 2557 CA GLY A 175 9.415 -5.466 8.221 1.00 0.00 C ATOM 2558 C GLY A 175 8.729 -4.360 9.020 1.00 0.00 C ATOM 2559 O GLY A 175 8.314 -3.356 8.477 1.00 0.00 O ATOM 0 H GLY A 175 8.925 -4.251 6.531 1.00 0.00 H new ATOM 0 HA2 GLY A 175 8.935 -6.424 8.422 1.00 0.00 H new ATOM 0 HA3 GLY A 175 10.456 -5.560 8.531 1.00 0.00 H new ATOM 2563 N GLN A 176 8.608 -4.534 10.311 1.00 0.00 N ATOM 2564 CA GLN A 176 7.947 -3.493 11.153 1.00 0.00 C ATOM 2565 C GLN A 176 8.998 -2.772 11.999 1.00 0.00 C ATOM 2566 O GLN A 176 9.689 -3.376 12.795 1.00 0.00 O ATOM 2567 CB GLN A 176 6.928 -4.160 12.079 1.00 0.00 C ATOM 2568 CG GLN A 176 6.163 -3.085 12.854 1.00 0.00 C ATOM 2569 CD GLN A 176 5.164 -3.748 13.803 1.00 0.00 C ATOM 2570 OE1 GLN A 176 4.945 -4.941 13.737 1.00 0.00 O ATOM 2571 NE2 GLN A 176 4.549 -3.019 14.694 1.00 0.00 N ATOM 0 H GLN A 176 8.939 -5.354 10.819 1.00 0.00 H new ATOM 0 HA GLN A 176 7.443 -2.774 10.507 1.00 0.00 H new ATOM 0 HB2 GLN A 176 6.234 -4.767 11.497 1.00 0.00 H new ATOM 0 HB3 GLN A 176 7.435 -4.831 12.772 1.00 0.00 H new ATOM 0 HG2 GLN A 176 6.859 -2.465 13.419 1.00 0.00 H new ATOM 0 HG3 GLN A 176 5.639 -2.426 12.161 1.00 0.00 H new ATOM 0 HE21 GLN A 176 4.733 -2.017 14.749 1.00 0.00 H new ATOM 0 HE22 GLN A 176 3.884 -3.451 15.336 1.00 0.00 H new ATOM 2580 N LEU A 177 9.118 -1.482 11.844 1.00 0.00 N ATOM 2581 CA LEU A 177 10.117 -0.725 12.651 1.00 0.00 C ATOM 2582 C LEU A 177 9.768 -0.863 14.134 1.00 0.00 C ATOM 2583 O LEU A 177 10.633 -0.963 14.982 1.00 0.00 O ATOM 2584 CB LEU A 177 10.086 0.753 12.250 1.00 0.00 C ATOM 2585 CG LEU A 177 11.186 1.521 12.996 1.00 0.00 C ATOM 2586 CD1 LEU A 177 12.565 1.123 12.456 1.00 0.00 C ATOM 2587 CD2 LEU A 177 10.974 3.025 12.793 1.00 0.00 C ATOM 0 H LEU A 177 8.568 -0.920 11.194 1.00 0.00 H new ATOM 0 HA LEU A 177 11.115 -1.124 12.470 1.00 0.00 H new ATOM 0 HB2 LEU A 177 10.229 0.850 11.174 1.00 0.00 H new ATOM 0 HB3 LEU A 177 9.111 1.181 12.482 1.00 0.00 H new ATOM 0 HG LEU A 177 11.138 1.279 14.058 1.00 0.00 H new ATOM 0 HD11 LEU A 177 13.338 1.673 12.992 1.00 0.00 H new ATOM 0 HD12 LEU A 177 12.717 0.053 12.598 1.00 0.00 H new ATOM 0 HD13 LEU A 177 12.622 1.359 11.393 1.00 0.00 H new ATOM 0 HD21 LEU A 177 11.752 3.577 13.320 1.00 0.00 H new ATOM 0 HD22 LEU A 177 11.021 3.259 11.729 1.00 0.00 H new ATOM 0 HD23 LEU A 177 9.998 3.311 13.185 1.00 0.00 H new ATOM 2599 N SER A 178 8.502 -0.872 14.454 1.00 0.00 N ATOM 2600 CA SER A 178 8.090 -1.004 15.880 1.00 0.00 C ATOM 2601 C SER A 178 6.575 -1.196 15.957 1.00 0.00 C ATOM 2602 O SER A 178 6.142 -2.045 16.717 1.00 0.00 O ATOM 2603 CB SER A 178 8.482 0.261 16.644 1.00 0.00 C ATOM 2604 OG SER A 178 8.214 0.077 18.027 1.00 0.00 O ATOM 2605 OXT SER A 178 5.871 -0.489 15.253 1.00 0.00 O ATOM 0 H SER A 178 7.734 -0.793 13.787 1.00 0.00 H new ATOM 0 HA SER A 178 8.589 -1.866 16.323 1.00 0.00 H new ATOM 0 HB2 SER A 178 9.539 0.478 16.493 1.00 0.00 H new ATOM 0 HB3 SER A 178 7.923 1.117 16.264 1.00 0.00 H new ATOM 0 HG SER A 178 8.466 0.886 18.519 1.00 0.00 H new