USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1041 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 121 ASN : amide:sc= 0.537 K(o=-12,f=-13) USER MOD Set 1.2: A 142 ASN : amide:sc= -13! C(o=-12!,f=-13!) USER MOD Set 1.3: A 147 THR OG1 : rot 166:sc= 0.16 USER MOD Set 2.1: A 55 CYS SG : rot 180:sc= -0.299 USER MOD Set 2.2: A 56 SER OG : rot 180:sc= 0.00274 USER MOD Set 3.1: A 38 TYR OH : rot -49:sc= 0.687 USER MOD Set 3.2: A 47 ASN :FLIP amide:sc= 0.973 F(o=0.036,f=1.7) USER MOD Set 4.1: A 35 THR OG1 : rot 141:sc= 1.72 USER MOD Set 4.2: A 66 TYR OH : rot 70:sc= -1.22 USER MOD Set 5.1: A 32 TYR OH : rot 150:sc= 0 USER MOD Set 5.2: A 96 HIS :FLIP no HD1:sc= -0.818 F(o=-1.5,f=-0.82) USER MOD Set 6.1: A 9 SER OG : rot -100:sc= 0.00445 USER MOD Set 6.2: A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -174:sc= -1.55 (180deg=-1.71) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -85:sc= 0.597 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.136) USER MOD Single : A 39 HIS : no HD1:sc= -2.78! X(o=-2.8!,f=-2.3) USER MOD Single : A 45 CYS SG : rot 180:sc= -0.0766 USER MOD Single : A 49 ASN : amide:sc= -0.261 K(o=-0.26,f=-1.5) USER MOD Single : A 50 THR OG1 : rot 120:sc= 1.39 USER MOD Single : A 51 GLN : amide:sc= -0.948 K(o=-0.95,f=-5.7!) USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 61 ASN :FLIP amide:sc= -4.03! C(o=-5.4!,f=-4!) USER MOD Single : A 65 ASN :FLIP amide:sc= -0.118 F(o=-1,f=-0.12) USER MOD Single : A 80 CYS SG : rot 160:sc= -0.686 USER MOD Single : A 82 SER OG : rot 20:sc= -0.543 USER MOD Single : A 84 CYS SG : rot -5:sc= -0.956 USER MOD Single : A 85 SER OG : rot -140:sc= -0.435 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -3.9 K(o=-3.9,f=-6.2!) USER MOD Single : A 105 ASN :FLIP amide:sc= 0.467 F(o=-0.32,f=0.47) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -57:sc= 1.12 USER MOD Single : A 112 THR OG1 : rot 40:sc= -0.869! USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 174:sc= -0.113 (180deg=-0.158) USER MOD Single : A 134 ASN : amide:sc= -0.0124 K(o=-0.012,f=-1.6) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 28:sc= 0.41 USER MOD Single : A 144 ASN : amide:sc= -1.53 K(o=-1.5,f=-7.8!) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 CYS SG : rot 180:sc= -2.49! USER MOD Single : A 158 SER OG : rot 1:sc= 0.562 USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 9 -0.480 11.757 -7.887 1.00 0.00 N ATOM 81 CA SER A 9 -1.826 11.778 -7.326 1.00 0.00 C ATOM 82 C SER A 9 -2.308 10.364 -7.016 1.00 0.00 C ATOM 83 O SER A 9 -3.032 10.143 -6.045 1.00 0.00 O ATOM 84 CB SER A 9 -2.795 12.457 -8.297 1.00 0.00 C ATOM 85 OG SER A 9 -2.864 13.852 -8.056 1.00 0.00 O ATOM 0 HA SER A 9 -1.796 12.345 -6.396 1.00 0.00 H new ATOM 0 HB2 SER A 9 -2.473 12.277 -9.323 1.00 0.00 H new ATOM 0 HB3 SER A 9 -3.787 12.017 -8.193 1.00 0.00 H new ATOM 0 HG SER A 9 -3.667 14.054 -7.531 1.00 0.00 H new ATOM 91 N ALA A 10 -1.901 9.411 -7.847 1.00 0.00 N ATOM 92 CA ALA A 10 -2.288 8.018 -7.661 1.00 0.00 C ATOM 93 C ALA A 10 -1.070 7.140 -7.397 1.00 0.00 C ATOM 94 O ALA A 10 -0.016 7.323 -8.008 1.00 0.00 O ATOM 95 CB ALA A 10 -3.050 7.515 -8.879 1.00 0.00 C ATOM 0 H ALA A 10 -1.303 9.578 -8.656 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.940 7.961 -6.789 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -3.333 6.473 -8.727 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -3.947 8.118 -9.021 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.416 7.593 -9.762 1.00 0.00 H new ATOM 101 N LEU A 11 -1.220 6.187 -6.485 1.00 0.00 N ATOM 102 CA LEU A 11 -0.131 5.280 -6.139 1.00 0.00 C ATOM 103 C LEU A 11 -0.342 3.909 -6.774 1.00 0.00 C ATOM 104 O LEU A 11 -1.454 3.380 -6.777 1.00 0.00 O ATOM 105 CB LEU A 11 -0.021 5.139 -4.620 1.00 0.00 C ATOM 106 CG LEU A 11 0.719 3.901 -4.112 1.00 0.00 C ATOM 107 CD1 LEU A 11 2.139 3.868 -4.656 1.00 0.00 C ATOM 108 CD2 LEU A 11 0.727 3.871 -2.591 1.00 0.00 C ATOM 0 H LEU A 11 -2.085 6.022 -5.971 1.00 0.00 H new ATOM 0 HA LEU A 11 0.797 5.701 -6.527 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.481 6.024 -4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.028 5.133 -4.202 1.00 0.00 H new ATOM 0 HG LEU A 11 0.194 3.015 -4.469 1.00 0.00 H new ATOM 0 HD11 LEU A 11 2.651 2.980 -4.284 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.111 3.841 -5.745 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.675 4.759 -4.329 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.258 2.983 -2.247 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.227 4.762 -2.212 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.298 3.846 -2.222 1.00 0.00 H new ATOM 120 N ARG A 12 0.732 3.338 -7.308 1.00 0.00 N ATOM 121 CA ARG A 12 0.665 2.028 -7.945 1.00 0.00 C ATOM 122 C ARG A 12 1.953 1.244 -7.711 1.00 0.00 C ATOM 123 O ARG A 12 3.050 1.796 -7.787 1.00 0.00 O ATOM 124 CB ARG A 12 0.413 2.180 -9.446 1.00 0.00 C ATOM 125 CG ARG A 12 1.661 2.527 -10.242 1.00 0.00 C ATOM 126 CD ARG A 12 1.445 2.323 -11.733 1.00 0.00 C ATOM 127 NE ARG A 12 2.488 2.965 -12.529 1.00 0.00 N ATOM 128 CZ ARG A 12 2.800 2.595 -13.767 1.00 0.00 C ATOM 129 NH1 ARG A 12 2.153 1.594 -14.346 1.00 0.00 N ATOM 130 NH2 ARG A 12 3.761 3.228 -14.427 1.00 0.00 N ATOM 0 H ARG A 12 1.660 3.762 -7.312 1.00 0.00 H new ATOM 0 HA ARG A 12 -0.162 1.476 -7.499 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -0.006 1.251 -9.831 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -0.335 2.957 -9.603 1.00 0.00 H new ATOM 0 HG2 ARG A 12 1.939 3.564 -10.052 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.492 1.908 -9.906 1.00 0.00 H new ATOM 0 HD2 ARG A 12 1.425 1.256 -11.954 1.00 0.00 H new ATOM 0 HD3 ARG A 12 0.473 2.725 -12.017 1.00 0.00 H new ATOM 0 HE ARG A 12 3.005 3.739 -12.112 1.00 0.00 H new ATOM 0 HH11 ARG A 12 1.413 1.105 -13.842 1.00 0.00 H new ATOM 0 HH12 ARG A 12 2.395 1.312 -15.296 1.00 0.00 H new ATOM 0 HH21 ARG A 12 4.261 3.999 -13.984 1.00 0.00 H new ATOM 0 HH22 ARG A 12 4.000 2.944 -15.377 1.00 0.00 H new ATOM 144 N ILE A 13 1.810 -0.046 -7.427 1.00 0.00 N ATOM 145 CA ILE A 13 2.961 -0.906 -7.183 1.00 0.00 C ATOM 146 C ILE A 13 2.785 -2.264 -7.854 1.00 0.00 C ATOM 147 O ILE A 13 1.697 -2.841 -7.838 1.00 0.00 O ATOM 148 CB ILE A 13 3.196 -1.118 -5.676 1.00 0.00 C ATOM 149 CG1 ILE A 13 3.416 0.226 -4.978 1.00 0.00 C ATOM 150 CG2 ILE A 13 4.386 -2.039 -5.450 1.00 0.00 C ATOM 151 CD1 ILE A 13 3.094 0.200 -3.501 1.00 0.00 C ATOM 0 H ILE A 13 0.909 -0.518 -7.360 1.00 0.00 H new ATOM 0 HA ILE A 13 3.828 -0.402 -7.610 1.00 0.00 H new ATOM 0 HB ILE A 13 2.311 -1.588 -5.248 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.455 0.529 -5.110 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.799 0.983 -5.463 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.540 -2.179 -4.380 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.193 -3.004 -5.918 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.279 -1.594 -5.889 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.273 1.186 -3.072 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.048 -0.072 -3.361 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.729 -0.533 -3.003 1.00 0.00 H new ATOM 163 N LYS A 14 3.863 -2.772 -8.442 1.00 0.00 N ATOM 164 CA LYS A 14 3.830 -4.064 -9.117 1.00 0.00 C ATOM 165 C LYS A 14 4.725 -5.073 -8.404 1.00 0.00 C ATOM 166 O LYS A 14 5.842 -4.749 -8.001 1.00 0.00 O ATOM 167 CB LYS A 14 4.274 -3.913 -10.574 1.00 0.00 C ATOM 168 CG LYS A 14 4.250 -5.216 -11.355 1.00 0.00 C ATOM 169 CD LYS A 14 4.865 -5.050 -12.734 1.00 0.00 C ATOM 170 CE LYS A 14 5.192 -6.396 -13.364 1.00 0.00 C ATOM 171 NZ LYS A 14 6.281 -7.101 -12.633 1.00 0.00 N ATOM 0 H LYS A 14 4.771 -2.308 -8.465 1.00 0.00 H new ATOM 0 HA LYS A 14 2.805 -4.433 -9.092 1.00 0.00 H new ATOM 0 HB2 LYS A 14 3.626 -3.190 -11.070 1.00 0.00 H new ATOM 0 HB3 LYS A 14 5.284 -3.504 -10.597 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.794 -5.982 -10.803 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.222 -5.563 -11.454 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.176 -4.504 -13.378 1.00 0.00 H new ATOM 0 HD3 LYS A 14 5.773 -4.452 -12.659 1.00 0.00 H new ATOM 0 HE2 LYS A 14 4.298 -7.019 -13.373 1.00 0.00 H new ATOM 0 HE3 LYS A 14 5.488 -6.248 -14.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 6.544 -7.964 -13.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 7.109 -6.477 -12.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 5.951 -7.355 -11.680 1.00 0.00 H new ATOM 185 N ILE A 15 4.227 -6.295 -8.253 1.00 0.00 N ATOM 186 CA ILE A 15 4.983 -7.351 -7.591 1.00 0.00 C ATOM 187 C ILE A 15 5.661 -8.263 -8.608 1.00 0.00 C ATOM 188 O ILE A 15 5.116 -8.528 -9.681 1.00 0.00 O ATOM 189 CB ILE A 15 4.080 -8.202 -6.677 1.00 0.00 C ATOM 190 CG1 ILE A 15 3.331 -7.307 -5.688 1.00 0.00 C ATOM 191 CG2 ILE A 15 4.907 -9.243 -5.938 1.00 0.00 C ATOM 192 CD1 ILE A 15 4.231 -6.655 -4.661 1.00 0.00 C ATOM 0 H ILE A 15 3.303 -6.579 -8.580 1.00 0.00 H new ATOM 0 HA ILE A 15 5.743 -6.861 -6.983 1.00 0.00 H new ATOM 0 HB ILE A 15 3.347 -8.721 -7.295 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.803 -6.531 -6.241 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.576 -7.901 -5.173 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.256 -9.836 -5.296 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.399 -9.896 -6.659 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.660 -8.744 -5.328 1.00 0.00 H new ATOM 0 HD11 ILE A 15 3.632 -6.035 -3.993 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.740 -7.425 -4.082 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.970 -6.034 -5.167 1.00 0.00 H new ATOM 204 N LEU A 16 6.851 -8.741 -8.264 1.00 0.00 N ATOM 205 CA LEU A 16 7.604 -9.626 -9.147 1.00 0.00 C ATOM 206 C LEU A 16 7.524 -11.071 -8.667 1.00 0.00 C ATOM 207 O LEU A 16 6.918 -11.920 -9.321 1.00 0.00 O ATOM 208 CB LEU A 16 9.066 -9.181 -9.221 1.00 0.00 C ATOM 209 CG LEU A 16 9.410 -8.187 -10.332 1.00 0.00 C ATOM 210 CD1 LEU A 16 9.181 -8.814 -11.698 1.00 0.00 C ATOM 211 CD2 LEU A 16 8.589 -6.915 -10.182 1.00 0.00 C ATOM 0 H LEU A 16 7.316 -8.531 -7.381 1.00 0.00 H new ATOM 0 HA LEU A 16 7.162 -9.568 -10.142 1.00 0.00 H new ATOM 0 HB2 LEU A 16 9.338 -8.735 -8.265 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.689 -10.067 -9.348 1.00 0.00 H new ATOM 0 HG LEU A 16 10.465 -7.926 -10.247 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.431 -8.093 -12.476 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.813 -9.696 -11.804 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.135 -9.104 -11.794 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.847 -6.219 -10.981 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.528 -7.158 -10.241 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.803 -6.455 -9.217 1.00 0.00 H new ATOM 223 N CYS A 17 8.138 -11.342 -7.520 1.00 0.00 N ATOM 224 CA CYS A 17 8.135 -12.685 -6.951 1.00 0.00 C ATOM 225 C CYS A 17 8.679 -12.673 -5.526 1.00 0.00 C ATOM 226 O CYS A 17 9.133 -11.641 -5.033 1.00 0.00 O ATOM 227 CB CYS A 17 8.966 -13.632 -7.819 1.00 0.00 C ATOM 228 SG CYS A 17 10.700 -13.149 -7.985 1.00 0.00 S ATOM 0 H CYS A 17 8.644 -10.650 -6.967 1.00 0.00 H new ATOM 0 HA CYS A 17 7.104 -13.039 -6.924 1.00 0.00 H new ATOM 0 HB2 CYS A 17 8.918 -14.634 -7.393 1.00 0.00 H new ATOM 0 HB3 CYS A 17 8.518 -13.686 -8.811 1.00 0.00 H new ATOM 0 HG CYS A 17 11.321 -14.011 -8.734 1.00 0.00 H new ATOM 234 N ALA A 18 8.629 -13.827 -4.869 1.00 0.00 N ATOM 235 CA ALA A 18 9.117 -13.949 -3.501 1.00 0.00 C ATOM 236 C ALA A 18 9.878 -15.256 -3.304 1.00 0.00 C ATOM 237 O ALA A 18 9.648 -16.234 -4.015 1.00 0.00 O ATOM 238 CB ALA A 18 7.960 -13.857 -2.517 1.00 0.00 C ATOM 0 H ALA A 18 8.255 -14.691 -5.262 1.00 0.00 H new ATOM 0 HA ALA A 18 9.806 -13.125 -3.313 1.00 0.00 H new ATOM 0 HB1 ALA A 18 8.340 -13.950 -1.499 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.460 -12.895 -2.632 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.250 -14.660 -2.714 1.00 0.00 H new ATOM 244 N THR A 19 10.788 -15.265 -2.335 1.00 0.00 N ATOM 245 CA THR A 19 11.585 -16.451 -2.046 1.00 0.00 C ATOM 246 C THR A 19 11.575 -16.770 -0.555 1.00 0.00 C ATOM 247 O THR A 19 11.237 -15.921 0.269 1.00 0.00 O ATOM 248 CB THR A 19 13.043 -16.275 -2.512 1.00 0.00 C ATOM 249 OG1 THR A 19 13.840 -17.371 -2.050 1.00 0.00 O ATOM 250 CG2 THR A 19 13.622 -14.967 -1.995 1.00 0.00 C ATOM 0 H THR A 19 10.991 -14.464 -1.737 1.00 0.00 H new ATOM 0 HA THR A 19 11.133 -17.277 -2.595 1.00 0.00 H new ATOM 0 HB THR A 19 13.053 -16.253 -3.602 1.00 0.00 H new ATOM 0 HG1 THR A 19 14.153 -17.187 -1.140 1.00 0.00 H new ATOM 0 HG21 THR A 19 14.652 -14.865 -2.337 1.00 0.00 H new ATOM 0 HG22 THR A 19 13.030 -14.133 -2.372 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.599 -14.965 -0.905 1.00 0.00 H new ATOM 258 N TYR A 20 11.948 -17.999 -0.216 1.00 0.00 N ATOM 259 CA TYR A 20 11.980 -18.431 1.176 1.00 0.00 C ATOM 260 C TYR A 20 10.579 -18.433 1.778 1.00 0.00 C ATOM 261 O TYR A 20 10.352 -17.880 2.855 1.00 0.00 O ATOM 262 CB TYR A 20 12.897 -17.520 1.994 1.00 0.00 C ATOM 263 CG TYR A 20 14.162 -17.122 1.266 1.00 0.00 C ATOM 264 CD1 TYR A 20 15.082 -18.080 0.858 1.00 0.00 C ATOM 265 CD2 TYR A 20 14.435 -15.789 0.985 1.00 0.00 C ATOM 266 CE1 TYR A 20 16.239 -17.721 0.193 1.00 0.00 C ATOM 267 CE2 TYR A 20 15.589 -15.422 0.319 1.00 0.00 C ATOM 268 CZ TYR A 20 16.488 -16.391 -0.074 1.00 0.00 C ATOM 269 OH TYR A 20 17.638 -16.030 -0.737 1.00 0.00 O ATOM 0 H TYR A 20 12.232 -18.714 -0.886 1.00 0.00 H new ATOM 0 HA TYR A 20 12.370 -19.448 1.205 1.00 0.00 H new ATOM 0 HB2 TYR A 20 12.348 -16.620 2.270 1.00 0.00 H new ATOM 0 HB3 TYR A 20 13.165 -18.027 2.921 1.00 0.00 H new ATOM 0 HD1 TYR A 20 14.890 -19.123 1.064 1.00 0.00 H new ATOM 0 HD2 TYR A 20 13.734 -15.027 1.292 1.00 0.00 H new ATOM 0 HE1 TYR A 20 16.945 -18.478 -0.116 1.00 0.00 H new ATOM 0 HE2 TYR A 20 15.786 -14.381 0.107 1.00 0.00 H new ATOM 0 HH TYR A 20 17.660 -15.056 -0.847 1.00 0.00 H new ATOM 279 N VAL A 21 9.641 -19.060 1.076 1.00 0.00 N ATOM 280 CA VAL A 21 8.261 -19.137 1.540 1.00 0.00 C ATOM 281 C VAL A 21 8.077 -20.283 2.528 1.00 0.00 C ATOM 282 O VAL A 21 8.916 -21.179 2.619 1.00 0.00 O ATOM 283 CB VAL A 21 7.283 -19.325 0.365 1.00 0.00 C ATOM 284 CG1 VAL A 21 5.859 -19.012 0.800 1.00 0.00 C ATOM 285 CG2 VAL A 21 7.693 -18.455 -0.813 1.00 0.00 C ATOM 0 H VAL A 21 9.812 -19.522 0.183 1.00 0.00 H new ATOM 0 HA VAL A 21 8.041 -18.193 2.038 1.00 0.00 H new ATOM 0 HB VAL A 21 7.319 -20.367 0.048 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.182 -19.150 -0.043 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.571 -19.682 1.610 1.00 0.00 H new ATOM 0 HG13 VAL A 21 5.803 -17.980 1.145 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.991 -18.600 -1.634 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.687 -17.408 -0.511 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.695 -18.733 -1.139 1.00 0.00 H new ATOM 394 N ILE A 28 -0.920 -26.859 -1.039 1.00 0.00 N ATOM 395 CA ILE A 28 -1.335 -25.523 -1.449 1.00 0.00 C ATOM 396 C ILE A 28 -1.529 -25.448 -2.960 1.00 0.00 C ATOM 397 O ILE A 28 -0.587 -25.647 -3.728 1.00 0.00 O ATOM 398 CB ILE A 28 -0.309 -24.458 -1.021 1.00 0.00 C ATOM 399 CG1 ILE A 28 -0.077 -24.520 0.490 1.00 0.00 C ATOM 400 CG2 ILE A 28 -0.782 -23.071 -1.433 1.00 0.00 C ATOM 401 CD1 ILE A 28 1.093 -23.682 0.957 1.00 0.00 C ATOM 0 HA ILE A 28 -2.284 -25.321 -0.952 1.00 0.00 H new ATOM 0 HB ILE A 28 0.636 -24.663 -1.524 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.980 -24.186 1.002 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.090 -25.557 0.781 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -0.046 -22.329 -1.124 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -0.901 -23.034 -2.516 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -1.738 -22.856 -0.955 1.00 0.00 H new ATOM 0 HD11 ILE A 28 1.198 -23.774 2.038 1.00 0.00 H new ATOM 0 HD12 ILE A 28 2.006 -24.030 0.473 1.00 0.00 H new ATOM 0 HD13 ILE A 28 0.919 -22.638 0.697 1.00 0.00 H new ATOM 413 N ASP A 29 -2.755 -25.158 -3.380 1.00 0.00 N ATOM 414 CA ASP A 29 -3.073 -25.053 -4.800 1.00 0.00 C ATOM 415 C ASP A 29 -2.512 -23.763 -5.388 1.00 0.00 C ATOM 416 O ASP A 29 -1.752 -23.788 -6.357 1.00 0.00 O ATOM 417 CB ASP A 29 -4.586 -25.110 -5.011 1.00 0.00 C ATOM 418 CG ASP A 29 -4.960 -25.355 -6.460 1.00 0.00 C ATOM 419 OD1 ASP A 29 -4.465 -24.612 -7.334 1.00 0.00 O ATOM 420 OD2 ASP A 29 -5.747 -26.289 -6.720 1.00 0.00 O ATOM 0 H ASP A 29 -3.546 -24.991 -2.758 1.00 0.00 H new ATOM 0 HA ASP A 29 -2.611 -25.896 -5.314 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.007 -25.902 -4.391 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.032 -24.173 -4.677 1.00 0.00 H new ATOM 425 N LYS A 30 -2.892 -22.635 -4.797 1.00 0.00 N ATOM 426 CA LYS A 30 -2.428 -21.333 -5.262 1.00 0.00 C ATOM 427 C LYS A 30 -2.166 -20.398 -4.086 1.00 0.00 C ATOM 428 O LYS A 30 -2.473 -20.726 -2.939 1.00 0.00 O ATOM 429 CB LYS A 30 -3.458 -20.708 -6.205 1.00 0.00 C ATOM 430 CG LYS A 30 -3.587 -21.433 -7.533 1.00 0.00 C ATOM 431 CD LYS A 30 -2.492 -21.019 -8.502 1.00 0.00 C ATOM 432 CE LYS A 30 -2.619 -21.749 -9.831 1.00 0.00 C ATOM 433 NZ LYS A 30 -2.294 -23.197 -9.701 1.00 0.00 N ATOM 0 H LYS A 30 -3.520 -22.596 -3.995 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.493 -21.480 -5.802 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.430 -20.696 -5.711 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.183 -19.670 -6.393 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.540 -22.509 -7.367 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.562 -21.220 -7.972 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.541 -19.943 -8.670 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.517 -21.229 -8.062 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.634 -21.637 -10.211 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -1.953 -21.291 -10.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -2.143 -23.605 -10.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.430 -23.309 -9.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.082 -23.689 -9.234 1.00 0.00 H new ATOM 447 N ILE A 31 -1.599 -19.232 -4.378 1.00 0.00 N ATOM 448 CA ILE A 31 -1.299 -18.249 -3.344 1.00 0.00 C ATOM 449 C ILE A 31 -1.569 -16.832 -3.838 1.00 0.00 C ATOM 450 O ILE A 31 -1.645 -16.587 -5.043 1.00 0.00 O ATOM 451 CB ILE A 31 0.167 -18.349 -2.881 1.00 0.00 C ATOM 452 CG1 ILE A 31 1.105 -18.382 -4.089 1.00 0.00 C ATOM 453 CG2 ILE A 31 0.365 -19.584 -2.015 1.00 0.00 C ATOM 454 CD1 ILE A 31 2.494 -17.863 -3.789 1.00 0.00 C ATOM 0 H ILE A 31 -1.338 -18.945 -5.321 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.954 -18.468 -2.500 1.00 0.00 H new ATOM 0 HB ILE A 31 0.406 -17.469 -2.284 1.00 0.00 H new ATOM 0 HG12 ILE A 31 1.179 -19.407 -4.453 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.670 -17.789 -4.893 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.406 -19.641 -1.695 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.281 -19.522 -1.139 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.112 -20.475 -2.589 1.00 0.00 H new ATOM 0 HD11 ILE A 31 3.105 -17.916 -4.690 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.431 -16.828 -3.453 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.949 -18.471 -3.007 1.00 0.00 H new ATOM 466 N TYR A 32 -1.710 -15.901 -2.901 1.00 0.00 N ATOM 467 CA TYR A 32 -1.972 -14.508 -3.241 1.00 0.00 C ATOM 468 C TYR A 32 -1.416 -13.572 -2.172 1.00 0.00 C ATOM 469 O TYR A 32 -1.280 -13.951 -1.008 1.00 0.00 O ATOM 470 CB TYR A 32 -3.474 -14.275 -3.407 1.00 0.00 C ATOM 471 CG TYR A 32 -4.178 -13.922 -2.116 1.00 0.00 C ATOM 472 CD1 TYR A 32 -4.688 -14.914 -1.287 1.00 0.00 C ATOM 473 CD2 TYR A 32 -4.335 -12.598 -1.726 1.00 0.00 C ATOM 474 CE1 TYR A 32 -5.333 -14.597 -0.107 1.00 0.00 C ATOM 475 CE2 TYR A 32 -4.977 -12.272 -0.547 1.00 0.00 C ATOM 476 CZ TYR A 32 -5.474 -13.274 0.259 1.00 0.00 C ATOM 477 OH TYR A 32 -6.116 -12.953 1.433 1.00 0.00 O ATOM 0 H TYR A 32 -1.647 -16.086 -1.900 1.00 0.00 H new ATOM 0 HA TYR A 32 -1.471 -14.291 -4.184 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -3.631 -13.473 -4.128 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -3.929 -15.173 -3.825 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -4.578 -15.950 -1.570 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -3.949 -11.810 -2.355 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -5.725 -15.380 0.525 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -5.089 -11.237 -0.258 1.00 0.00 H new ATOM 0 HH TYR A 32 -5.747 -12.118 1.790 1.00 0.00 H new ATOM 487 N VAL A 33 -1.095 -12.347 -2.575 1.00 0.00 N ATOM 488 CA VAL A 33 -0.555 -11.355 -1.653 1.00 0.00 C ATOM 489 C VAL A 33 -1.601 -10.303 -1.304 1.00 0.00 C ATOM 490 O VAL A 33 -2.330 -9.825 -2.173 1.00 0.00 O ATOM 491 CB VAL A 33 0.684 -10.656 -2.243 1.00 0.00 C ATOM 492 CG1 VAL A 33 1.219 -9.611 -1.275 1.00 0.00 C ATOM 493 CG2 VAL A 33 1.758 -11.677 -2.586 1.00 0.00 C ATOM 0 H VAL A 33 -1.200 -12.017 -3.535 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.265 -11.889 -0.748 1.00 0.00 H new ATOM 0 HB VAL A 33 0.391 -10.148 -3.162 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.094 -9.128 -1.709 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.449 -8.864 -1.084 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.498 -10.092 -0.338 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.626 -11.166 -3.002 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.051 -12.214 -1.684 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.368 -12.383 -3.319 1.00 0.00 H new ATOM 503 N ARG A 34 -1.669 -9.945 -0.025 1.00 0.00 N ATOM 504 CA ARG A 34 -2.627 -8.949 0.439 1.00 0.00 C ATOM 505 C ARG A 34 -1.917 -7.662 0.848 1.00 0.00 C ATOM 506 O ARG A 34 -1.072 -7.662 1.743 1.00 0.00 O ATOM 507 CB ARG A 34 -3.432 -9.497 1.620 1.00 0.00 C ATOM 508 CG ARG A 34 -4.254 -8.439 2.339 1.00 0.00 C ATOM 509 CD ARG A 34 -5.360 -9.066 3.173 1.00 0.00 C ATOM 510 NE ARG A 34 -6.428 -9.617 2.342 1.00 0.00 N ATOM 511 CZ ARG A 34 -7.477 -10.269 2.830 1.00 0.00 C ATOM 512 NH1 ARG A 34 -7.599 -10.450 4.138 1.00 0.00 N ATOM 513 NH2 ARG A 34 -8.407 -10.740 2.010 1.00 0.00 N ATOM 0 H ARG A 34 -1.072 -10.330 0.707 1.00 0.00 H new ATOM 0 HA ARG A 34 -3.307 -8.724 -0.383 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -4.098 -10.282 1.262 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -2.748 -9.960 2.332 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -3.604 -7.846 2.982 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -4.689 -7.756 1.609 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -4.941 -9.857 3.795 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.775 -8.316 3.847 1.00 0.00 H new ATOM 0 HE ARG A 34 -6.364 -9.494 1.331 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -6.886 -10.088 4.772 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -8.406 -10.951 4.510 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -8.317 -10.602 1.003 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -9.212 -11.241 2.386 1.00 0.00 H new ATOM 527 N THR A 35 -2.267 -6.564 0.184 1.00 0.00 N ATOM 528 CA THR A 35 -1.663 -5.270 0.476 1.00 0.00 C ATOM 529 C THR A 35 -2.707 -4.273 0.965 1.00 0.00 C ATOM 530 O THR A 35 -3.905 -4.461 0.755 1.00 0.00 O ATOM 531 CB THR A 35 -0.955 -4.688 -0.762 1.00 0.00 C ATOM 532 OG1 THR A 35 -1.923 -4.176 -1.685 1.00 0.00 O ATOM 533 CG2 THR A 35 -0.105 -5.748 -1.447 1.00 0.00 C ATOM 0 H THR A 35 -2.965 -6.546 -0.559 1.00 0.00 H new ATOM 0 HA THR A 35 -0.927 -5.436 1.262 1.00 0.00 H new ATOM 0 HB THR A 35 -0.303 -3.878 -0.433 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.591 -3.342 -2.077 1.00 0.00 H new ATOM 0 HG21 THR A 35 0.385 -5.314 -2.318 1.00 0.00 H new ATOM 0 HG22 THR A 35 0.650 -6.115 -0.751 1.00 0.00 H new ATOM 0 HG23 THR A 35 -0.740 -6.576 -1.763 1.00 0.00 H new ATOM 541 N GLY A 36 -2.245 -3.211 1.618 1.00 0.00 N ATOM 542 CA GLY A 36 -3.154 -2.199 2.125 1.00 0.00 C ATOM 543 C GLY A 36 -2.464 -1.209 3.044 1.00 0.00 C ATOM 544 O GLY A 36 -1.574 -1.579 3.809 1.00 0.00 O ATOM 0 H GLY A 36 -1.258 -3.033 1.805 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.600 -1.663 1.287 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.969 -2.683 2.663 1.00 0.00 H new ATOM 548 N ILE A 37 -2.875 0.052 2.966 1.00 0.00 N ATOM 549 CA ILE A 37 -2.291 1.097 3.797 1.00 0.00 C ATOM 550 C ILE A 37 -3.136 1.349 5.040 1.00 0.00 C ATOM 551 O ILE A 37 -4.364 1.406 4.968 1.00 0.00 O ATOM 552 CB ILE A 37 -2.139 2.417 3.017 1.00 0.00 C ATOM 553 CG1 ILE A 37 -1.220 2.218 1.809 1.00 0.00 C ATOM 554 CG2 ILE A 37 -1.599 3.510 3.926 1.00 0.00 C ATOM 555 CD1 ILE A 37 -1.895 1.530 0.644 1.00 0.00 C ATOM 0 H ILE A 37 -3.610 0.375 2.336 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.304 0.746 4.098 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.121 2.724 2.656 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.848 3.189 1.481 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.353 1.632 2.114 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.497 4.436 3.360 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.288 3.666 4.756 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -0.625 3.213 4.314 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.185 1.422 -0.176 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.242 0.545 0.955 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.745 2.126 0.312 1.00 0.00 H new ATOM 567 N TYR A 38 -2.472 1.501 6.180 1.00 0.00 N ATOM 568 CA TYR A 38 -3.162 1.747 7.441 1.00 0.00 C ATOM 569 C TYR A 38 -2.580 2.964 8.153 1.00 0.00 C ATOM 570 O TYR A 38 -1.396 3.273 8.012 1.00 0.00 O ATOM 571 CB TYR A 38 -3.067 0.518 8.346 1.00 0.00 C ATOM 572 CG TYR A 38 -3.773 -0.699 7.792 1.00 0.00 C ATOM 573 CD1 TYR A 38 -3.415 -1.233 6.560 1.00 0.00 C ATOM 574 CD2 TYR A 38 -4.798 -1.314 8.500 1.00 0.00 C ATOM 575 CE1 TYR A 38 -4.058 -2.344 6.050 1.00 0.00 C ATOM 576 CE2 TYR A 38 -5.445 -2.427 7.998 1.00 0.00 C ATOM 577 CZ TYR A 38 -5.072 -2.938 6.773 1.00 0.00 C ATOM 578 OH TYR A 38 -5.715 -4.045 6.268 1.00 0.00 O ATOM 0 H TYR A 38 -1.456 1.458 6.257 1.00 0.00 H new ATOM 0 HA TYR A 38 -4.210 1.947 7.219 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -2.016 0.276 8.507 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -3.491 0.761 9.320 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -2.621 -0.772 5.992 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -5.094 -0.915 9.459 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -3.769 -2.746 5.090 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -6.239 -2.894 8.562 1.00 0.00 H new ATOM 0 HH TYR A 38 -5.980 -3.875 5.340 1.00 0.00 H new ATOM 588 N HIS A 39 -3.420 3.652 8.919 1.00 0.00 N ATOM 589 CA HIS A 39 -2.990 4.835 9.655 1.00 0.00 C ATOM 590 C HIS A 39 -3.232 4.661 11.152 1.00 0.00 C ATOM 591 O HIS A 39 -4.347 4.850 11.636 1.00 0.00 O ATOM 592 CB HIS A 39 -3.728 6.074 9.148 1.00 0.00 C ATOM 593 CG HIS A 39 -3.468 7.302 9.963 1.00 0.00 C ATOM 594 ND1 HIS A 39 -4.066 8.518 9.705 1.00 0.00 N ATOM 595 CD2 HIS A 39 -2.669 7.498 11.039 1.00 0.00 C ATOM 596 CE1 HIS A 39 -3.645 9.409 10.585 1.00 0.00 C ATOM 597 NE2 HIS A 39 -2.797 8.815 11.406 1.00 0.00 N ATOM 0 H HIS A 39 -4.403 3.411 9.046 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.921 4.966 9.490 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -3.434 6.264 8.116 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -4.799 5.872 9.143 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -2.047 6.757 11.519 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -3.943 10.446 10.626 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -2.315 9.262 12.186 1.00 0.00 H new ATOM 606 N GLY A 40 -2.179 4.300 11.879 1.00 0.00 N ATOM 607 CA GLY A 40 -2.299 4.106 13.312 1.00 0.00 C ATOM 608 C GLY A 40 -3.026 2.824 13.665 1.00 0.00 C ATOM 609 O GLY A 40 -3.926 2.823 14.504 1.00 0.00 O ATOM 0 H GLY A 40 -1.245 4.139 11.501 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.304 4.091 13.758 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.830 4.953 13.747 1.00 0.00 H new ATOM 613 N GLY A 41 -2.636 1.728 13.021 1.00 0.00 N ATOM 614 CA GLY A 41 -3.269 0.448 13.284 1.00 0.00 C ATOM 615 C GLY A 41 -4.710 0.406 12.813 1.00 0.00 C ATOM 616 O GLY A 41 -5.552 -0.242 13.432 1.00 0.00 O ATOM 0 H GLY A 41 -1.893 1.703 12.322 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.705 -0.342 12.788 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.233 0.241 14.354 1.00 0.00 H new ATOM 620 N GLU A 42 -4.992 1.102 11.716 1.00 0.00 N ATOM 621 CA GLU A 42 -6.341 1.142 11.164 1.00 0.00 C ATOM 622 C GLU A 42 -6.304 1.240 9.642 1.00 0.00 C ATOM 623 O GLU A 42 -5.441 1.895 9.057 1.00 0.00 O ATOM 624 CB GLU A 42 -7.117 2.327 11.743 1.00 0.00 C ATOM 625 CG GLU A 42 -7.216 2.308 13.259 1.00 0.00 C ATOM 626 CD GLU A 42 -7.708 3.624 13.829 1.00 0.00 C ATOM 627 OE1 GLU A 42 -6.898 4.570 13.922 1.00 0.00 O ATOM 628 OE2 GLU A 42 -8.903 3.708 14.182 1.00 0.00 O ATOM 0 H GLU A 42 -4.305 1.645 11.193 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.846 0.216 11.439 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.635 3.253 11.430 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.122 2.333 11.322 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.891 1.509 13.565 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.238 2.077 13.680 1.00 0.00 H new ATOM 635 N PRO A 43 -7.262 0.571 8.983 1.00 0.00 N ATOM 636 CA PRO A 43 -7.362 0.566 7.521 1.00 0.00 C ATOM 637 C PRO A 43 -7.787 1.920 6.964 1.00 0.00 C ATOM 638 O PRO A 43 -8.506 2.675 7.620 1.00 0.00 O ATOM 639 CB PRO A 43 -8.435 -0.488 7.242 1.00 0.00 C ATOM 640 CG PRO A 43 -9.264 -0.522 8.479 1.00 0.00 C ATOM 641 CD PRO A 43 -8.323 -0.231 9.615 1.00 0.00 C ATOM 0 HA PRO A 43 -6.403 0.353 7.048 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -9.034 -0.222 6.371 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -7.990 -1.462 7.037 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.063 0.218 8.434 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -9.738 -1.495 8.604 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -8.818 0.318 10.416 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -7.927 -1.147 10.053 1.00 0.00 H new ATOM 649 N LEU A 44 -7.340 2.223 5.750 1.00 0.00 N ATOM 650 CA LEU A 44 -7.675 3.487 5.104 1.00 0.00 C ATOM 651 C LEU A 44 -8.707 3.277 4.000 1.00 0.00 C ATOM 652 O LEU A 44 -9.618 4.088 3.827 1.00 0.00 O ATOM 653 CB LEU A 44 -6.417 4.136 4.525 1.00 0.00 C ATOM 654 CG LEU A 44 -5.609 5.009 5.487 1.00 0.00 C ATOM 655 CD1 LEU A 44 -4.833 4.144 6.468 1.00 0.00 C ATOM 656 CD2 LEU A 44 -4.667 5.921 4.715 1.00 0.00 C ATOM 0 H LEU A 44 -6.744 1.610 5.193 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.104 4.149 5.856 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.766 3.347 4.148 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.708 4.746 3.670 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.302 5.631 6.053 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -4.264 4.782 7.144 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.529 3.533 7.044 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.149 3.496 5.920 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.100 6.535 5.415 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.980 5.317 4.123 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.246 6.566 4.053 1.00 0.00 H new ATOM 668 N CYS A 45 -8.559 2.186 3.258 1.00 0.00 N ATOM 669 CA CYS A 45 -9.478 1.869 2.172 1.00 0.00 C ATOM 670 C CYS A 45 -9.474 0.373 1.874 1.00 0.00 C ATOM 671 O CYS A 45 -8.593 -0.358 2.327 1.00 0.00 O ATOM 672 CB CYS A 45 -9.103 2.652 0.913 1.00 0.00 C ATOM 673 SG CYS A 45 -10.446 2.809 -0.287 1.00 0.00 S ATOM 0 H CYS A 45 -7.811 1.505 3.389 1.00 0.00 H new ATOM 0 HA CYS A 45 -10.482 2.156 2.485 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -8.772 3.649 1.204 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -8.256 2.162 0.432 1.00 0.00 H new ATOM 0 HG CYS A 45 -10.032 3.488 -1.315 1.00 0.00 H new ATOM 679 N ASP A 46 -10.465 -0.077 1.112 1.00 0.00 N ATOM 680 CA ASP A 46 -10.576 -1.486 0.755 1.00 0.00 C ATOM 681 C ASP A 46 -9.212 -2.064 0.391 1.00 0.00 C ATOM 682 O ASP A 46 -8.522 -1.545 -0.486 1.00 0.00 O ATOM 683 CB ASP A 46 -11.547 -1.663 -0.413 1.00 0.00 C ATOM 684 CG ASP A 46 -12.752 -0.749 -0.309 1.00 0.00 C ATOM 685 OD1 ASP A 46 -12.591 0.472 -0.520 1.00 0.00 O ATOM 686 OD2 ASP A 46 -13.856 -1.253 -0.016 1.00 0.00 O ATOM 0 H ASP A 46 -11.203 0.514 0.730 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.959 -2.026 1.621 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -11.025 -1.465 -1.349 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -11.883 -2.699 -0.448 1.00 0.00 H new ATOM 691 N ASN A 47 -8.830 -3.139 1.071 1.00 0.00 N ATOM 692 CA ASN A 47 -7.547 -3.786 0.821 1.00 0.00 C ATOM 693 C ASN A 47 -7.464 -4.291 -0.617 1.00 0.00 C ATOM 694 O ASN A 47 -8.483 -4.573 -1.247 1.00 0.00 O ATOM 695 CB ASN A 47 -7.340 -4.949 1.794 1.00 0.00 C ATOM 696 CG ASN A 47 -7.401 -4.508 3.243 1.00 0.00 C ATOM 697 OD1 ASN A 47 -6.491 -3.622 3.631 1.00 0.00 O flip ATOM 698 ND2 ASN A 47 -8.257 -4.958 4.005 1.00 0.00 N flip ATOM 0 H ASN A 47 -9.390 -3.581 1.800 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.760 -3.048 0.975 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -8.102 -5.708 1.616 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.374 -5.415 1.599 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -8.937 -5.637 3.664 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -8.286 -4.651 4.977 1.00 0.00 H new ATOM 705 N VAL A 48 -6.242 -4.402 -1.130 1.00 0.00 N ATOM 706 CA VAL A 48 -6.025 -4.873 -2.492 1.00 0.00 C ATOM 707 C VAL A 48 -5.384 -6.256 -2.499 1.00 0.00 C ATOM 708 O VAL A 48 -4.467 -6.530 -1.725 1.00 0.00 O ATOM 709 CB VAL A 48 -5.133 -3.902 -3.287 1.00 0.00 C ATOM 710 CG1 VAL A 48 -4.947 -4.394 -4.714 1.00 0.00 C ATOM 711 CG2 VAL A 48 -5.725 -2.501 -3.270 1.00 0.00 C ATOM 0 H VAL A 48 -5.388 -4.172 -0.622 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.004 -4.927 -2.968 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.153 -3.864 -2.811 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.314 -3.695 -5.260 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.476 -5.377 -4.702 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -5.918 -4.463 -5.204 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.082 -1.827 -3.836 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.717 -2.520 -3.721 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.801 -2.150 -2.241 1.00 0.00 H new ATOM 721 N ASN A 49 -5.872 -7.125 -3.379 1.00 0.00 N ATOM 722 CA ASN A 49 -5.346 -8.481 -3.487 1.00 0.00 C ATOM 723 C ASN A 49 -4.777 -8.734 -4.880 1.00 0.00 C ATOM 724 O ASN A 49 -5.262 -8.186 -5.870 1.00 0.00 O ATOM 725 CB ASN A 49 -6.443 -9.502 -3.179 1.00 0.00 C ATOM 726 CG ASN A 49 -7.788 -9.094 -3.747 1.00 0.00 C ATOM 727 OD1 ASN A 49 -8.397 -8.124 -3.296 1.00 0.00 O ATOM 728 ND2 ASN A 49 -8.259 -9.836 -4.743 1.00 0.00 N ATOM 0 H ASN A 49 -6.631 -6.914 -4.027 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.542 -8.591 -2.760 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.158 -10.472 -3.587 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -6.529 -9.624 -2.099 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -9.160 -9.610 -5.165 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -7.720 -10.631 -5.085 1.00 0.00 H new ATOM 735 N THR A 50 -3.744 -9.569 -4.949 1.00 0.00 N ATOM 736 CA THR A 50 -3.109 -9.895 -6.219 1.00 0.00 C ATOM 737 C THR A 50 -3.660 -11.196 -6.791 1.00 0.00 C ATOM 738 O THR A 50 -4.348 -11.946 -6.100 1.00 0.00 O ATOM 739 CB THR A 50 -1.581 -10.021 -6.066 1.00 0.00 C ATOM 740 OG1 THR A 50 -1.265 -11.072 -5.147 1.00 0.00 O ATOM 741 CG2 THR A 50 -0.977 -8.713 -5.577 1.00 0.00 C ATOM 0 H THR A 50 -3.330 -10.031 -4.140 1.00 0.00 H new ATOM 0 HA THR A 50 -3.332 -9.077 -6.904 1.00 0.00 H new ATOM 0 HB THR A 50 -1.158 -10.255 -7.043 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.724 -11.752 -5.601 1.00 0.00 H new ATOM 0 HG21 THR A 50 0.102 -8.826 -5.476 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.194 -7.921 -6.294 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.406 -8.453 -4.609 1.00 0.00 H new ATOM 749 N GLN A 51 -3.352 -11.457 -8.058 1.00 0.00 N ATOM 750 CA GLN A 51 -3.817 -12.669 -8.722 1.00 0.00 C ATOM 751 C GLN A 51 -3.429 -13.910 -7.925 1.00 0.00 C ATOM 752 O GLN A 51 -2.754 -13.815 -6.900 1.00 0.00 O ATOM 753 CB GLN A 51 -3.239 -12.754 -10.136 1.00 0.00 C ATOM 754 CG GLN A 51 -1.720 -12.826 -10.169 1.00 0.00 C ATOM 755 CD GLN A 51 -1.183 -13.194 -11.538 1.00 0.00 C ATOM 756 OE1 GLN A 51 -0.569 -14.247 -11.714 1.00 0.00 O ATOM 757 NE2 GLN A 51 -1.413 -12.327 -12.517 1.00 0.00 N ATOM 0 H GLN A 51 -2.783 -10.846 -8.644 1.00 0.00 H new ATOM 0 HA GLN A 51 -4.904 -12.625 -8.783 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.647 -13.633 -10.634 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -3.566 -11.884 -10.706 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.308 -11.863 -9.868 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.379 -13.561 -9.440 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -1.926 -11.467 -12.326 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.076 -12.521 -13.460 1.00 0.00 H new ATOM 766 N ARG A 52 -3.860 -15.073 -8.403 1.00 0.00 N ATOM 767 CA ARG A 52 -3.559 -16.332 -7.734 1.00 0.00 C ATOM 768 C ARG A 52 -2.491 -17.111 -8.496 1.00 0.00 C ATOM 769 O ARG A 52 -2.744 -17.635 -9.581 1.00 0.00 O ATOM 770 CB ARG A 52 -4.826 -17.180 -7.603 1.00 0.00 C ATOM 771 CG ARG A 52 -5.603 -16.921 -6.322 1.00 0.00 C ATOM 772 CD ARG A 52 -6.821 -17.824 -6.217 1.00 0.00 C ATOM 773 NE ARG A 52 -7.947 -17.316 -6.997 1.00 0.00 N ATOM 774 CZ ARG A 52 -9.208 -17.683 -6.792 1.00 0.00 C ATOM 775 NH1 ARG A 52 -9.501 -18.555 -5.838 1.00 0.00 N ATOM 776 NH2 ARG A 52 -10.177 -17.177 -7.543 1.00 0.00 N ATOM 0 H ARG A 52 -4.419 -15.169 -9.251 1.00 0.00 H new ATOM 0 HA ARG A 52 -3.178 -16.103 -6.739 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -5.474 -16.984 -8.457 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -4.553 -18.234 -7.646 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -4.953 -17.083 -5.462 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -5.918 -15.878 -6.291 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.562 -18.824 -6.564 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.116 -17.915 -5.172 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.755 -16.643 -7.739 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -8.758 -18.946 -5.259 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -10.469 -18.835 -5.683 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.955 -16.506 -8.278 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -11.144 -17.459 -7.385 1.00 0.00 H new ATOM 790 N VAL A 53 -1.294 -17.181 -7.921 1.00 0.00 N ATOM 791 CA VAL A 53 -0.187 -17.895 -8.545 1.00 0.00 C ATOM 792 C VAL A 53 0.218 -19.111 -7.719 1.00 0.00 C ATOM 793 O VAL A 53 0.044 -19.151 -6.500 1.00 0.00 O ATOM 794 CB VAL A 53 1.039 -16.981 -8.727 1.00 0.00 C ATOM 795 CG1 VAL A 53 0.604 -15.574 -9.106 1.00 0.00 C ATOM 796 CG2 VAL A 53 1.884 -16.964 -7.461 1.00 0.00 C ATOM 0 H VAL A 53 -1.067 -16.752 -7.024 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.535 -18.224 -9.524 1.00 0.00 H new ATOM 0 HB VAL A 53 1.649 -17.378 -9.538 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.484 -14.942 -9.230 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.045 -15.606 -10.041 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.029 -15.164 -8.319 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.746 -16.313 -7.608 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.286 -16.592 -6.629 1.00 0.00 H new ATOM 0 HG23 VAL A 53 2.226 -17.975 -7.238 1.00 0.00 H new ATOM 806 N PRO A 54 0.771 -20.128 -8.395 1.00 0.00 N ATOM 807 CA PRO A 54 1.214 -21.365 -7.744 1.00 0.00 C ATOM 808 C PRO A 54 2.443 -21.151 -6.867 1.00 0.00 C ATOM 809 O PRO A 54 3.392 -20.475 -7.267 1.00 0.00 O ATOM 810 CB PRO A 54 1.549 -22.285 -8.920 1.00 0.00 C ATOM 811 CG PRO A 54 1.878 -21.362 -10.042 1.00 0.00 C ATOM 812 CD PRO A 54 1.008 -20.150 -9.848 1.00 0.00 C ATOM 0 HA PRO A 54 0.454 -21.767 -7.074 1.00 0.00 H new ATOM 0 HB2 PRO A 54 2.390 -22.938 -8.685 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.706 -22.929 -9.171 1.00 0.00 H new ATOM 0 HG2 PRO A 54 2.934 -21.091 -10.028 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.682 -21.833 -11.005 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.504 -19.241 -10.188 1.00 0.00 H new ATOM 0 HD3 PRO A 54 0.075 -20.232 -10.406 1.00 0.00 H new ATOM 820 N CYS A 55 2.419 -21.729 -5.672 1.00 0.00 N ATOM 821 CA CYS A 55 3.532 -21.601 -4.738 1.00 0.00 C ATOM 822 C CYS A 55 4.864 -21.834 -5.444 1.00 0.00 C ATOM 823 O CYS A 55 5.810 -21.064 -5.278 1.00 0.00 O ATOM 824 CB CYS A 55 3.374 -22.591 -3.583 1.00 0.00 C ATOM 825 SG CYS A 55 3.172 -24.310 -4.108 1.00 0.00 S ATOM 0 H CYS A 55 1.641 -22.291 -5.326 1.00 0.00 H new ATOM 0 HA CYS A 55 3.524 -20.586 -4.340 1.00 0.00 H new ATOM 0 HB2 CYS A 55 4.248 -22.520 -2.936 1.00 0.00 H new ATOM 0 HB3 CYS A 55 2.510 -22.301 -2.985 1.00 0.00 H new ATOM 0 HG CYS A 55 3.048 -25.072 -3.062 1.00 0.00 H new ATOM 831 N SER A 56 4.931 -22.902 -6.232 1.00 0.00 N ATOM 832 CA SER A 56 6.149 -23.240 -6.960 1.00 0.00 C ATOM 833 C SER A 56 6.664 -22.038 -7.745 1.00 0.00 C ATOM 834 O SER A 56 7.866 -21.892 -7.961 1.00 0.00 O ATOM 835 CB SER A 56 5.892 -24.412 -7.910 1.00 0.00 C ATOM 836 OG SER A 56 5.240 -25.477 -7.240 1.00 0.00 O ATOM 0 H SER A 56 4.156 -23.548 -6.383 1.00 0.00 H new ATOM 0 HA SER A 56 6.908 -23.530 -6.234 1.00 0.00 H new ATOM 0 HB2 SER A 56 5.281 -24.077 -8.749 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.837 -24.763 -8.324 1.00 0.00 H new ATOM 0 HG SER A 56 5.085 -26.213 -7.868 1.00 0.00 H new ATOM 842 N ASN A 57 5.743 -21.179 -8.171 1.00 0.00 N ATOM 843 CA ASN A 57 6.103 -19.988 -8.933 1.00 0.00 C ATOM 844 C ASN A 57 5.377 -18.759 -8.396 1.00 0.00 C ATOM 845 O ASN A 57 4.294 -18.396 -8.857 1.00 0.00 O ATOM 846 CB ASN A 57 5.770 -20.186 -10.413 1.00 0.00 C ATOM 847 CG ASN A 57 6.792 -21.050 -11.125 1.00 0.00 C ATOM 848 OD1 ASN A 57 6.867 -22.258 -10.897 1.00 0.00 O ATOM 849 ND2 ASN A 57 7.586 -20.435 -11.994 1.00 0.00 N ATOM 0 H ASN A 57 4.743 -21.285 -8.002 1.00 0.00 H new ATOM 0 HA ASN A 57 7.176 -19.828 -8.827 1.00 0.00 H new ATOM 0 HB2 ASN A 57 4.785 -20.644 -10.503 1.00 0.00 H new ATOM 0 HB3 ASN A 57 5.715 -19.214 -10.903 1.00 0.00 H new ATOM 0 HD21 ASN A 57 8.293 -20.966 -12.503 1.00 0.00 H new ATOM 0 HD22 ASN A 57 7.489 -19.432 -12.152 1.00 0.00 H new ATOM 856 N PRO A 58 5.986 -18.100 -7.399 1.00 0.00 N ATOM 857 CA PRO A 58 5.416 -16.900 -6.779 1.00 0.00 C ATOM 858 C PRO A 58 5.436 -15.698 -7.717 1.00 0.00 C ATOM 859 O PRO A 58 5.042 -14.595 -7.335 1.00 0.00 O ATOM 860 CB PRO A 58 6.330 -16.655 -5.576 1.00 0.00 C ATOM 861 CG PRO A 58 7.627 -17.286 -5.950 1.00 0.00 C ATOM 862 CD PRO A 58 7.278 -18.475 -6.801 1.00 0.00 C ATOM 0 HA PRO A 58 4.367 -17.036 -6.514 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.450 -15.589 -5.381 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.920 -17.101 -4.670 1.00 0.00 H new ATOM 0 HG2 PRO A 58 8.258 -16.586 -6.497 1.00 0.00 H new ATOM 0 HG3 PRO A 58 8.183 -17.590 -5.063 1.00 0.00 H new ATOM 0 HD2 PRO A 58 8.035 -18.659 -7.563 1.00 0.00 H new ATOM 0 HD3 PRO A 58 7.196 -19.385 -6.206 1.00 0.00 H new ATOM 870 N ARG A 59 5.895 -15.918 -8.944 1.00 0.00 N ATOM 871 CA ARG A 59 5.966 -14.852 -9.936 1.00 0.00 C ATOM 872 C ARG A 59 4.588 -14.245 -10.182 1.00 0.00 C ATOM 873 O ARG A 59 3.750 -14.839 -10.861 1.00 0.00 O ATOM 874 CB ARG A 59 6.542 -15.385 -11.249 1.00 0.00 C ATOM 875 CG ARG A 59 7.271 -14.331 -12.066 1.00 0.00 C ATOM 876 CD ARG A 59 7.264 -14.672 -13.548 1.00 0.00 C ATOM 877 NE ARG A 59 8.083 -13.747 -14.327 1.00 0.00 N ATOM 878 CZ ARG A 59 9.405 -13.836 -14.421 1.00 0.00 C ATOM 879 NH1 ARG A 59 10.054 -14.804 -13.788 1.00 0.00 N ATOM 880 NH2 ARG A 59 10.080 -12.957 -15.149 1.00 0.00 N ATOM 0 H ARG A 59 6.223 -16.825 -9.275 1.00 0.00 H new ATOM 0 HA ARG A 59 6.623 -14.073 -9.549 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.229 -16.202 -11.029 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.733 -15.802 -11.848 1.00 0.00 H new ATOM 0 HG2 ARG A 59 6.800 -13.360 -11.913 1.00 0.00 H new ATOM 0 HG3 ARG A 59 8.300 -14.245 -11.716 1.00 0.00 H new ATOM 0 HD2 ARG A 59 7.633 -15.688 -13.688 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.240 -14.650 -13.920 1.00 0.00 H new ATOM 0 HE ARG A 59 7.614 -12.991 -14.826 1.00 0.00 H new ATOM 0 HH11 ARG A 59 9.538 -15.482 -13.228 1.00 0.00 H new ATOM 0 HH12 ARG A 59 11.069 -14.870 -13.862 1.00 0.00 H new ATOM 0 HH21 ARG A 59 9.584 -12.211 -15.638 1.00 0.00 H new ATOM 0 HH22 ARG A 59 11.095 -13.026 -15.220 1.00 0.00 H new ATOM 894 N TRP A 60 4.360 -13.061 -9.625 1.00 0.00 N ATOM 895 CA TRP A 60 3.083 -12.375 -9.784 1.00 0.00 C ATOM 896 C TRP A 60 3.105 -11.460 -11.004 1.00 0.00 C ATOM 897 O TRP A 60 2.174 -11.464 -11.809 1.00 0.00 O ATOM 898 CB TRP A 60 2.758 -11.563 -8.529 1.00 0.00 C ATOM 899 CG TRP A 60 2.045 -12.357 -7.476 1.00 0.00 C ATOM 900 CD1 TRP A 60 0.723 -12.701 -7.463 1.00 0.00 C ATOM 901 CD2 TRP A 60 2.616 -12.905 -6.283 1.00 0.00 C ATOM 902 NE1 TRP A 60 0.438 -13.429 -6.334 1.00 0.00 N ATOM 903 CE2 TRP A 60 1.582 -13.569 -5.593 1.00 0.00 C ATOM 904 CE3 TRP A 60 3.899 -12.900 -5.730 1.00 0.00 C ATOM 905 CZ2 TRP A 60 1.794 -14.219 -4.381 1.00 0.00 C ATOM 906 CZ3 TRP A 60 4.108 -13.546 -4.526 1.00 0.00 C ATOM 907 CH2 TRP A 60 3.061 -14.199 -3.863 1.00 0.00 C ATOM 0 H TRP A 60 5.043 -12.556 -9.059 1.00 0.00 H new ATOM 0 HA TRP A 60 2.310 -13.129 -9.932 1.00 0.00 H new ATOM 0 HB2 TRP A 60 3.684 -11.167 -8.111 1.00 0.00 H new ATOM 0 HB3 TRP A 60 2.143 -10.707 -8.808 1.00 0.00 H new ATOM 0 HD1 TRP A 60 0.007 -12.439 -8.228 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -0.477 -13.805 -6.087 1.00 0.00 H new ATOM 0 HE3 TRP A 60 4.713 -12.400 -6.234 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 0.988 -14.721 -3.867 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 5.096 -13.547 -4.089 1.00 0.00 H new ATOM 0 HH2 TRP A 60 3.257 -14.696 -2.925 1.00 0.00 H new ATOM 918 N ASN A 61 4.172 -10.679 -11.134 1.00 0.00 N ATOM 919 CA ASN A 61 4.313 -9.759 -12.257 1.00 0.00 C ATOM 920 C ASN A 61 2.977 -9.105 -12.596 1.00 0.00 C ATOM 921 O ASN A 61 2.584 -9.042 -13.760 1.00 0.00 O ATOM 922 CB ASN A 61 4.858 -10.497 -13.482 1.00 0.00 C ATOM 923 CG ASN A 61 3.783 -11.281 -14.210 1.00 0.00 C ATOM 924 OD1 ASN A 61 3.440 -12.448 -13.677 1.00 0.00 O flip ATOM 925 ND2 ASN A 61 3.269 -10.843 -15.239 1.00 0.00 N flip ATOM 0 H ASN A 61 4.951 -10.665 -10.476 1.00 0.00 H new ATOM 0 HA ASN A 61 5.016 -8.978 -11.969 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.306 -9.777 -14.167 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.651 -11.176 -13.170 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.564 -9.941 -15.612 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.548 -11.382 -15.718 1.00 0.00 H new ATOM 932 N GLU A 62 2.284 -8.620 -11.570 1.00 0.00 N ATOM 933 CA GLU A 62 0.992 -7.971 -11.760 1.00 0.00 C ATOM 934 C GLU A 62 1.022 -6.537 -11.239 1.00 0.00 C ATOM 935 O GLU A 62 1.543 -6.270 -10.156 1.00 0.00 O ATOM 936 CB GLU A 62 -0.109 -8.761 -11.050 1.00 0.00 C ATOM 937 CG GLU A 62 -1.454 -8.054 -11.037 1.00 0.00 C ATOM 938 CD GLU A 62 -2.621 -9.020 -10.991 1.00 0.00 C ATOM 939 OE1 GLU A 62 -2.824 -9.655 -9.935 1.00 0.00 O ATOM 940 OE2 GLU A 62 -3.331 -9.142 -12.011 1.00 0.00 O ATOM 0 H GLU A 62 2.595 -8.664 -10.600 1.00 0.00 H new ATOM 0 HA GLU A 62 0.780 -7.946 -12.829 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.222 -9.729 -11.538 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.200 -8.955 -10.023 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.503 -7.390 -10.174 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.540 -7.429 -11.926 1.00 0.00 H new ATOM 947 N TRP A 63 0.460 -5.620 -12.017 1.00 0.00 N ATOM 948 CA TRP A 63 0.422 -4.213 -11.635 1.00 0.00 C ATOM 949 C TRP A 63 -0.723 -3.943 -10.665 1.00 0.00 C ATOM 950 O TRP A 63 -1.886 -3.872 -11.065 1.00 0.00 O ATOM 951 CB TRP A 63 0.274 -3.330 -12.875 1.00 0.00 C ATOM 952 CG TRP A 63 1.586 -2.954 -13.495 1.00 0.00 C ATOM 953 CD1 TRP A 63 2.175 -3.533 -14.583 1.00 0.00 C ATOM 954 CD2 TRP A 63 2.471 -1.915 -13.063 1.00 0.00 C ATOM 955 NE1 TRP A 63 3.373 -2.917 -14.852 1.00 0.00 N ATOM 956 CE2 TRP A 63 3.578 -1.921 -13.935 1.00 0.00 C ATOM 957 CE3 TRP A 63 2.437 -0.979 -12.026 1.00 0.00 C ATOM 958 CZ2 TRP A 63 4.637 -1.028 -13.799 1.00 0.00 C ATOM 959 CZ3 TRP A 63 3.489 -0.094 -11.891 1.00 0.00 C ATOM 960 CH2 TRP A 63 4.577 -0.123 -12.774 1.00 0.00 C ATOM 0 H TRP A 63 0.024 -5.825 -12.916 1.00 0.00 H new ATOM 0 HA TRP A 63 1.361 -3.973 -11.136 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -0.333 -3.853 -13.614 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -0.265 -2.422 -12.604 1.00 0.00 H new ATOM 0 HD1 TRP A 63 1.760 -4.354 -15.148 1.00 0.00 H new ATOM 0 HE1 TRP A 63 4.007 -3.162 -15.612 1.00 0.00 H new ATOM 0 HE3 TRP A 63 1.602 -0.948 -11.342 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 5.476 -1.049 -14.478 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 3.473 0.632 -11.092 1.00 0.00 H new ATOM 0 HH2 TRP A 63 5.384 0.583 -12.643 1.00 0.00 H new ATOM 971 N LEU A 64 -0.388 -3.793 -9.388 1.00 0.00 N ATOM 972 CA LEU A 64 -1.389 -3.530 -8.360 1.00 0.00 C ATOM 973 C LEU A 64 -1.594 -2.030 -8.170 1.00 0.00 C ATOM 974 O LEU A 64 -0.656 -1.301 -7.852 1.00 0.00 O ATOM 975 CB LEU A 64 -0.970 -4.171 -7.036 1.00 0.00 C ATOM 976 CG LEU A 64 -2.107 -4.608 -6.112 1.00 0.00 C ATOM 977 CD1 LEU A 64 -3.002 -5.621 -6.810 1.00 0.00 C ATOM 978 CD2 LEU A 64 -1.550 -5.187 -4.819 1.00 0.00 C ATOM 0 H LEU A 64 0.569 -3.849 -9.040 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.332 -3.968 -8.686 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.353 -5.042 -7.256 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.341 -3.463 -6.496 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.707 -3.732 -5.866 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.806 -5.921 -6.137 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.428 -5.173 -7.707 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.414 -6.497 -7.086 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.373 -5.493 -4.173 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.927 -6.052 -5.046 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -0.951 -4.432 -4.310 1.00 0.00 H new ATOM 990 N ASN A 65 -2.829 -1.578 -8.366 1.00 0.00 N ATOM 991 CA ASN A 65 -3.158 -0.165 -8.215 1.00 0.00 C ATOM 992 C ASN A 65 -3.832 0.096 -6.871 1.00 0.00 C ATOM 993 O ASN A 65 -4.745 -0.627 -6.473 1.00 0.00 O ATOM 994 CB ASN A 65 -4.071 0.292 -9.354 1.00 0.00 C ATOM 995 CG ASN A 65 -3.453 0.059 -10.719 1.00 0.00 C ATOM 996 OD1 ASN A 65 -3.343 -1.205 -11.110 1.00 0.00 O flip ATOM 997 ND2 ASN A 65 -3.081 1.004 -11.414 1.00 0.00 N flip ATOM 0 H ASN A 65 -3.617 -2.169 -8.629 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.230 0.405 -8.252 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -5.020 -0.241 -9.292 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -4.293 1.352 -9.235 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -3.185 1.960 -11.073 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -2.669 0.832 -12.331 1.00 0.00 H new ATOM 1004 N TYR A 66 -3.376 1.133 -6.178 1.00 0.00 N ATOM 1005 CA TYR A 66 -3.933 1.489 -4.879 1.00 0.00 C ATOM 1006 C TYR A 66 -4.902 2.661 -5.004 1.00 0.00 C ATOM 1007 O TYR A 66 -4.591 3.673 -5.631 1.00 0.00 O ATOM 1008 CB TYR A 66 -2.813 1.841 -3.899 1.00 0.00 C ATOM 1009 CG TYR A 66 -1.999 0.647 -3.455 1.00 0.00 C ATOM 1010 CD1 TYR A 66 -1.068 0.061 -4.303 1.00 0.00 C ATOM 1011 CD2 TYR A 66 -2.160 0.106 -2.185 1.00 0.00 C ATOM 1012 CE1 TYR A 66 -0.324 -1.031 -3.901 1.00 0.00 C ATOM 1013 CE2 TYR A 66 -1.418 -0.985 -1.774 1.00 0.00 C ATOM 1014 CZ TYR A 66 -0.502 -1.550 -2.636 1.00 0.00 C ATOM 1015 OH TYR A 66 0.240 -2.636 -2.231 1.00 0.00 O ATOM 0 H TYR A 66 -2.622 1.742 -6.494 1.00 0.00 H new ATOM 0 HA TYR A 66 -4.481 0.627 -4.499 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -2.149 2.569 -4.365 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.247 2.321 -3.022 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.923 0.466 -5.294 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -2.877 0.546 -1.508 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.394 -1.476 -4.574 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -1.555 -1.393 -0.783 1.00 0.00 H new ATOM 0 HH TYR A 66 1.175 -2.367 -2.111 1.00 0.00 H new ATOM 1025 N ASP A 67 -6.077 2.514 -4.402 1.00 0.00 N ATOM 1026 CA ASP A 67 -7.093 3.560 -4.444 1.00 0.00 C ATOM 1027 C ASP A 67 -6.792 4.650 -3.420 1.00 0.00 C ATOM 1028 O ASP A 67 -7.694 5.143 -2.740 1.00 0.00 O ATOM 1029 CB ASP A 67 -8.478 2.966 -4.183 1.00 0.00 C ATOM 1030 CG ASP A 67 -9.583 3.759 -4.853 1.00 0.00 C ATOM 1031 OD1 ASP A 67 -9.421 4.120 -6.037 1.00 0.00 O ATOM 1032 OD2 ASP A 67 -10.611 4.018 -4.193 1.00 0.00 O ATOM 0 H ASP A 67 -6.350 1.682 -3.879 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.080 4.006 -5.438 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.503 1.938 -4.543 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -8.659 2.932 -3.109 1.00 0.00 H new ATOM 1037 N ILE A 68 -5.521 5.021 -3.314 1.00 0.00 N ATOM 1038 CA ILE A 68 -5.102 6.053 -2.373 1.00 0.00 C ATOM 1039 C ILE A 68 -4.621 7.301 -3.104 1.00 0.00 C ATOM 1040 O ILE A 68 -4.301 7.253 -4.292 1.00 0.00 O ATOM 1041 CB ILE A 68 -3.979 5.548 -1.448 1.00 0.00 C ATOM 1042 CG1 ILE A 68 -2.661 5.445 -2.218 1.00 0.00 C ATOM 1043 CG2 ILE A 68 -4.353 4.202 -0.846 1.00 0.00 C ATOM 1044 CD1 ILE A 68 -1.829 6.707 -2.163 1.00 0.00 C ATOM 0 H ILE A 68 -4.763 4.623 -3.868 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.974 6.303 -1.769 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.849 6.264 -0.636 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.078 4.617 -1.815 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.876 5.206 -3.260 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.549 3.859 -0.195 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.270 4.305 -0.267 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.508 3.477 -1.645 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.910 6.562 -2.730 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.394 7.534 -2.593 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.583 6.936 -1.126 1.00 0.00 H new ATOM 1056 N TYR A 69 -4.570 8.418 -2.386 1.00 0.00 N ATOM 1057 CA TYR A 69 -4.128 9.680 -2.967 1.00 0.00 C ATOM 1058 C TYR A 69 -2.812 10.135 -2.343 1.00 0.00 C ATOM 1059 O TYR A 69 -2.719 10.319 -1.129 1.00 0.00 O ATOM 1060 CB TYR A 69 -5.197 10.757 -2.773 1.00 0.00 C ATOM 1061 CG TYR A 69 -5.443 11.595 -4.007 1.00 0.00 C ATOM 1062 CD1 TYR A 69 -5.506 11.011 -5.266 1.00 0.00 C ATOM 1063 CD2 TYR A 69 -5.611 12.971 -3.914 1.00 0.00 C ATOM 1064 CE1 TYR A 69 -5.730 11.773 -6.396 1.00 0.00 C ATOM 1065 CE2 TYR A 69 -5.837 13.740 -5.039 1.00 0.00 C ATOM 1066 CZ TYR A 69 -5.895 13.137 -6.278 1.00 0.00 C ATOM 1067 OH TYR A 69 -6.118 13.900 -7.401 1.00 0.00 O ATOM 0 H TYR A 69 -4.829 8.475 -1.401 1.00 0.00 H new ATOM 0 HA TYR A 69 -3.969 9.524 -4.034 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -6.131 10.280 -2.476 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -4.898 11.411 -1.954 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.378 9.943 -5.363 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.564 13.447 -2.946 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -5.776 11.303 -7.367 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.968 14.808 -4.949 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.213 14.841 -7.144 1.00 0.00 H new ATOM 1077 N ILE A 70 -1.798 10.316 -3.182 1.00 0.00 N ATOM 1078 CA ILE A 70 -0.488 10.751 -2.714 1.00 0.00 C ATOM 1079 C ILE A 70 -0.597 12.025 -1.883 1.00 0.00 C ATOM 1080 O ILE A 70 -0.131 12.095 -0.745 1.00 0.00 O ATOM 1081 CB ILE A 70 0.476 11.000 -3.890 1.00 0.00 C ATOM 1082 CG1 ILE A 70 1.149 9.692 -4.311 1.00 0.00 C ATOM 1083 CG2 ILE A 70 1.518 12.040 -3.509 1.00 0.00 C ATOM 1084 CD1 ILE A 70 0.364 8.913 -5.343 1.00 0.00 C ATOM 0 H ILE A 70 -1.858 10.168 -4.189 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.092 9.947 -2.093 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.096 11.381 -4.736 1.00 0.00 H new ATOM 0 HG12 ILE A 70 2.138 9.914 -4.711 1.00 0.00 H new ATOM 0 HG13 ILE A 70 1.294 9.068 -3.430 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.192 12.205 -4.350 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.021 12.976 -3.253 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.089 11.686 -2.651 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.901 7.998 -5.594 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.616 8.659 -4.939 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.241 9.519 -6.240 1.00 0.00 H new ATOM 1096 N PRO A 71 -1.227 13.057 -2.462 1.00 0.00 N ATOM 1097 CA PRO A 71 -1.415 14.347 -1.791 1.00 0.00 C ATOM 1098 C PRO A 71 -2.407 14.262 -0.636 1.00 0.00 C ATOM 1099 O PRO A 71 -2.728 15.269 -0.006 1.00 0.00 O ATOM 1100 CB PRO A 71 -1.962 15.248 -2.901 1.00 0.00 C ATOM 1101 CG PRO A 71 -2.614 14.313 -3.861 1.00 0.00 C ATOM 1102 CD PRO A 71 -1.807 13.045 -3.815 1.00 0.00 C ATOM 0 HA PRO A 71 -0.490 14.712 -1.344 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.675 15.972 -2.508 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -1.164 15.815 -3.380 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.651 14.126 -3.581 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.626 14.732 -4.867 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.431 12.166 -3.977 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.034 13.033 -4.583 1.00 0.00 H new ATOM 1110 N ASP A 72 -2.888 13.054 -0.364 1.00 0.00 N ATOM 1111 CA ASP A 72 -3.842 12.837 0.717 1.00 0.00 C ATOM 1112 C ASP A 72 -3.337 11.770 1.683 1.00 0.00 C ATOM 1113 O ASP A 72 -3.962 11.500 2.709 1.00 0.00 O ATOM 1114 CB ASP A 72 -5.202 12.425 0.150 1.00 0.00 C ATOM 1115 CG ASP A 72 -6.347 12.771 1.082 1.00 0.00 C ATOM 1116 OD1 ASP A 72 -6.352 13.896 1.624 1.00 0.00 O ATOM 1117 OD2 ASP A 72 -7.237 11.916 1.269 1.00 0.00 O ATOM 0 H ASP A 72 -2.633 12.210 -0.877 1.00 0.00 H new ATOM 0 HA ASP A 72 -3.952 13.773 1.264 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.357 12.918 -0.810 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.203 11.352 -0.039 1.00 0.00 H new ATOM 1122 N LEU A 73 -2.202 11.166 1.347 1.00 0.00 N ATOM 1123 CA LEU A 73 -1.612 10.127 2.184 1.00 0.00 C ATOM 1124 C LEU A 73 -0.934 10.734 3.408 1.00 0.00 C ATOM 1125 O LEU A 73 0.067 11.444 3.306 1.00 0.00 O ATOM 1126 CB LEU A 73 -0.601 9.309 1.379 1.00 0.00 C ATOM 1127 CG LEU A 73 -0.430 7.849 1.801 1.00 0.00 C ATOM 1128 CD1 LEU A 73 0.068 7.762 3.236 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -1.740 7.092 1.643 1.00 0.00 C ATOM 0 H LEU A 73 -1.672 11.378 0.501 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.413 9.470 2.524 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.899 9.331 0.331 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.369 9.801 1.445 1.00 0.00 H new ATOM 0 HG LEU A 73 0.314 7.388 1.152 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.184 6.716 3.518 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.030 8.268 3.319 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.652 8.240 3.901 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.600 6.055 1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -2.505 7.554 2.268 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.055 7.124 0.600 1.00 0.00 H new ATOM 1141 N PRO A 74 -1.488 10.447 4.596 1.00 0.00 N ATOM 1142 CA PRO A 74 -0.951 10.952 5.863 1.00 0.00 C ATOM 1143 C PRO A 74 0.386 10.312 6.222 1.00 0.00 C ATOM 1144 O PRO A 74 0.536 9.092 6.164 1.00 0.00 O ATOM 1145 CB PRO A 74 -2.023 10.561 6.883 1.00 0.00 C ATOM 1146 CG PRO A 74 -2.709 9.384 6.280 1.00 0.00 C ATOM 1147 CD PRO A 74 -2.681 9.607 4.793 1.00 0.00 C ATOM 0 HA PRO A 74 -0.751 12.023 5.824 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.580 10.310 7.847 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.721 11.380 7.057 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.200 8.457 6.546 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.733 9.301 6.643 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.605 8.667 4.247 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.585 10.106 4.444 1.00 0.00 H new ATOM 1155 N ARG A 75 1.354 11.144 6.593 1.00 0.00 N ATOM 1156 CA ARG A 75 2.678 10.659 6.962 1.00 0.00 C ATOM 1157 C ARG A 75 2.577 9.456 7.895 1.00 0.00 C ATOM 1158 O ARG A 75 3.314 8.482 7.750 1.00 0.00 O ATOM 1159 CB ARG A 75 3.484 11.772 7.633 1.00 0.00 C ATOM 1160 CG ARG A 75 4.240 12.653 6.652 1.00 0.00 C ATOM 1161 CD ARG A 75 3.292 13.495 5.813 1.00 0.00 C ATOM 1162 NE ARG A 75 3.954 14.668 5.249 1.00 0.00 N ATOM 1163 CZ ARG A 75 3.440 15.400 4.267 1.00 0.00 C ATOM 1164 NH1 ARG A 75 2.264 15.083 3.744 1.00 0.00 N ATOM 1165 NH2 ARG A 75 4.103 16.454 3.807 1.00 0.00 N ATOM 0 H ARG A 75 1.246 12.157 6.646 1.00 0.00 H new ATOM 0 HA ARG A 75 3.189 10.348 6.051 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.809 12.394 8.221 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.194 11.326 8.329 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.921 13.306 7.198 1.00 0.00 H new ATOM 0 HG3 ARG A 75 4.851 12.030 5.998 1.00 0.00 H new ATOM 0 HD2 ARG A 75 2.884 12.886 5.006 1.00 0.00 H new ATOM 0 HD3 ARG A 75 2.451 13.814 6.428 1.00 0.00 H new ATOM 0 HE ARG A 75 4.860 14.940 5.630 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.751 14.275 4.096 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.872 15.647 2.990 1.00 0.00 H new ATOM 0 HH21 ARG A 75 5.008 16.702 4.208 1.00 0.00 H new ATOM 0 HH22 ARG A 75 3.708 17.016 3.053 1.00 0.00 H new ATOM 1179 N ALA A 76 1.658 9.532 8.852 1.00 0.00 N ATOM 1180 CA ALA A 76 1.459 8.450 9.808 1.00 0.00 C ATOM 1181 C ALA A 76 1.170 7.134 9.094 1.00 0.00 C ATOM 1182 O ALA A 76 1.711 6.089 9.456 1.00 0.00 O ATOM 1183 CB ALA A 76 0.328 8.793 10.766 1.00 0.00 C ATOM 0 H ALA A 76 1.039 10.332 8.986 1.00 0.00 H new ATOM 0 HA ALA A 76 2.379 8.329 10.379 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.191 7.976 11.474 1.00 0.00 H new ATOM 0 HB2 ALA A 76 0.575 9.706 11.308 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.593 8.943 10.203 1.00 0.00 H new ATOM 1189 N ALA A 77 0.315 7.192 8.079 1.00 0.00 N ATOM 1190 CA ALA A 77 -0.045 6.004 7.314 1.00 0.00 C ATOM 1191 C ALA A 77 1.195 5.318 6.750 1.00 0.00 C ATOM 1192 O ALA A 77 2.279 5.901 6.721 1.00 0.00 O ATOM 1193 CB ALA A 77 -1.004 6.370 6.191 1.00 0.00 C ATOM 0 H ALA A 77 -0.142 8.049 7.767 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.541 5.305 7.987 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.264 5.474 5.628 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.908 6.809 6.613 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.528 7.090 5.526 1.00 0.00 H new ATOM 1199 N ARG A 78 1.028 4.077 6.305 1.00 0.00 N ATOM 1200 CA ARG A 78 2.135 3.312 5.744 1.00 0.00 C ATOM 1201 C ARG A 78 1.620 2.116 4.948 1.00 0.00 C ATOM 1202 O ARG A 78 0.422 1.829 4.943 1.00 0.00 O ATOM 1203 CB ARG A 78 3.068 2.833 6.857 1.00 0.00 C ATOM 1204 CG ARG A 78 2.406 1.881 7.840 1.00 0.00 C ATOM 1205 CD ARG A 78 3.195 1.780 9.136 1.00 0.00 C ATOM 1206 NE ARG A 78 2.881 2.872 10.054 1.00 0.00 N ATOM 1207 CZ ARG A 78 3.099 2.817 11.363 1.00 0.00 C ATOM 1208 NH1 ARG A 78 3.629 1.730 11.905 1.00 0.00 N ATOM 1209 NH2 ARG A 78 2.786 3.852 12.133 1.00 0.00 N ATOM 0 H ARG A 78 0.137 3.580 6.322 1.00 0.00 H new ATOM 0 HA ARG A 78 2.690 3.964 5.070 1.00 0.00 H new ATOM 0 HB2 ARG A 78 3.930 2.338 6.409 1.00 0.00 H new ATOM 0 HB3 ARG A 78 3.445 3.699 7.401 1.00 0.00 H new ATOM 0 HG2 ARG A 78 1.394 2.224 8.055 1.00 0.00 H new ATOM 0 HG3 ARG A 78 2.318 0.893 7.388 1.00 0.00 H new ATOM 0 HD2 ARG A 78 2.979 0.827 9.619 1.00 0.00 H new ATOM 0 HD3 ARG A 78 4.262 1.789 8.913 1.00 0.00 H new ATOM 0 HE ARG A 78 2.472 3.723 9.669 1.00 0.00 H new ATOM 0 HH11 ARG A 78 3.871 0.933 11.317 1.00 0.00 H new ATOM 0 HH12 ARG A 78 3.795 1.691 12.911 1.00 0.00 H new ATOM 0 HH21 ARG A 78 2.378 4.690 11.719 1.00 0.00 H new ATOM 0 HH22 ARG A 78 2.954 3.809 13.138 1.00 0.00 H new ATOM 1223 N LEU A 79 2.532 1.422 4.277 1.00 0.00 N ATOM 1224 CA LEU A 79 2.171 0.256 3.477 1.00 0.00 C ATOM 1225 C LEU A 79 2.323 -1.028 4.286 1.00 0.00 C ATOM 1226 O LEU A 79 3.293 -1.196 5.026 1.00 0.00 O ATOM 1227 CB LEU A 79 3.041 0.187 2.220 1.00 0.00 C ATOM 1228 CG LEU A 79 2.650 -0.875 1.191 1.00 0.00 C ATOM 1229 CD1 LEU A 79 1.277 -0.574 0.610 1.00 0.00 C ATOM 1230 CD2 LEU A 79 3.693 -0.957 0.087 1.00 0.00 C ATOM 0 H LEU A 79 3.527 1.646 4.271 1.00 0.00 H new ATOM 0 HA LEU A 79 1.126 0.356 3.183 1.00 0.00 H new ATOM 0 HB2 LEU A 79 3.019 1.162 1.733 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.072 0.007 2.525 1.00 0.00 H new ATOM 0 HG LEU A 79 2.605 -1.842 1.693 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.015 -1.340 -0.120 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.537 -0.567 1.410 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.294 0.401 0.123 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.398 -1.718 -0.636 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.770 0.008 -0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.659 -1.221 0.518 1.00 0.00 H new ATOM 1242 N CYS A 80 1.360 -1.931 4.138 1.00 0.00 N ATOM 1243 CA CYS A 80 1.387 -3.201 4.854 1.00 0.00 C ATOM 1244 C CYS A 80 1.008 -4.354 3.930 1.00 0.00 C ATOM 1245 O CYS A 80 -0.039 -4.326 3.282 1.00 0.00 O ATOM 1246 CB CYS A 80 0.435 -3.157 6.050 1.00 0.00 C ATOM 1247 SG CYS A 80 0.563 -1.648 7.039 1.00 0.00 S ATOM 0 H CYS A 80 0.551 -1.807 3.529 1.00 0.00 H new ATOM 0 HA CYS A 80 2.403 -3.365 5.213 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -0.589 -3.257 5.690 1.00 0.00 H new ATOM 0 HB3 CYS A 80 0.633 -4.016 6.690 1.00 0.00 H new ATOM 0 HG CYS A 80 -0.521 -1.496 7.741 1.00 0.00 H new ATOM 1253 N LEU A 81 1.866 -5.367 3.873 1.00 0.00 N ATOM 1254 CA LEU A 81 1.623 -6.530 3.027 1.00 0.00 C ATOM 1255 C LEU A 81 1.850 -7.824 3.802 1.00 0.00 C ATOM 1256 O LEU A 81 2.507 -7.829 4.842 1.00 0.00 O ATOM 1257 CB LEU A 81 2.533 -6.491 1.799 1.00 0.00 C ATOM 1258 CG LEU A 81 3.969 -6.024 2.042 1.00 0.00 C ATOM 1259 CD1 LEU A 81 4.865 -7.207 2.375 1.00 0.00 C ATOM 1260 CD2 LEU A 81 4.499 -5.276 0.827 1.00 0.00 C ATOM 0 H LEU A 81 2.737 -5.406 4.403 1.00 0.00 H new ATOM 0 HA LEU A 81 0.583 -6.501 2.702 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.566 -7.490 1.364 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.080 -5.835 1.056 1.00 0.00 H new ATOM 0 HG LEU A 81 3.971 -5.342 2.892 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.883 -6.856 2.545 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.497 -7.701 3.274 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.859 -7.913 1.545 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.522 -4.951 1.017 1.00 0.00 H new ATOM 0 HD22 LEU A 81 4.483 -5.935 -0.041 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.872 -4.406 0.633 1.00 0.00 H new ATOM 1272 N SER A 82 1.303 -8.920 3.286 1.00 0.00 N ATOM 1273 CA SER A 82 1.444 -10.221 3.930 1.00 0.00 C ATOM 1274 C SER A 82 1.021 -11.343 2.987 1.00 0.00 C ATOM 1275 O SER A 82 -0.039 -11.278 2.364 1.00 0.00 O ATOM 1276 CB SER A 82 0.608 -10.273 5.210 1.00 0.00 C ATOM 1277 OG SER A 82 -0.777 -10.309 4.914 1.00 0.00 O ATOM 0 H SER A 82 0.758 -8.933 2.424 1.00 0.00 H new ATOM 0 HA SER A 82 2.495 -10.361 4.184 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.882 -11.154 5.791 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.828 -9.402 5.828 1.00 0.00 H new ATOM 0 HG SER A 82 -0.906 -10.604 3.988 1.00 0.00 H new ATOM 1283 N ILE A 83 1.858 -12.370 2.887 1.00 0.00 N ATOM 1284 CA ILE A 83 1.572 -13.507 2.021 1.00 0.00 C ATOM 1285 C ILE A 83 0.669 -14.517 2.721 1.00 0.00 C ATOM 1286 O ILE A 83 0.777 -14.728 3.930 1.00 0.00 O ATOM 1287 CB ILE A 83 2.865 -14.214 1.574 1.00 0.00 C ATOM 1288 CG1 ILE A 83 3.847 -13.201 0.981 1.00 0.00 C ATOM 1289 CG2 ILE A 83 2.549 -15.307 0.565 1.00 0.00 C ATOM 1290 CD1 ILE A 83 5.291 -13.646 1.054 1.00 0.00 C ATOM 0 H ILE A 83 2.740 -12.438 3.395 1.00 0.00 H new ATOM 0 HA ILE A 83 1.061 -13.114 1.142 1.00 0.00 H new ATOM 0 HB ILE A 83 3.330 -14.675 2.446 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.584 -13.019 -0.061 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.740 -12.253 1.507 1.00 0.00 H new ATOM 0 HG21 ILE A 83 3.473 -15.797 0.259 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.882 -16.040 1.019 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.065 -14.868 -0.307 1.00 0.00 H new ATOM 0 HD11 ILE A 83 5.930 -12.880 0.616 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.572 -13.801 2.096 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.413 -14.579 0.503 1.00 0.00 H new ATOM 1302 N CYS A 84 -0.219 -15.140 1.954 1.00 0.00 N ATOM 1303 CA CYS A 84 -1.140 -16.130 2.500 1.00 0.00 C ATOM 1304 C CYS A 84 -1.455 -17.207 1.468 1.00 0.00 C ATOM 1305 O CYS A 84 -1.357 -16.974 0.263 1.00 0.00 O ATOM 1306 CB CYS A 84 -2.432 -15.455 2.961 1.00 0.00 C ATOM 1307 SG CYS A 84 -2.184 -14.137 4.174 1.00 0.00 S ATOM 0 H CYS A 84 -0.321 -14.977 0.952 1.00 0.00 H new ATOM 0 HA CYS A 84 -0.660 -16.603 3.357 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -2.944 -15.042 2.092 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.091 -16.210 3.390 1.00 0.00 H new ATOM 0 HG CYS A 84 -0.930 -14.091 4.514 1.00 0.00 H new ATOM 1313 N SER A 85 -1.832 -18.388 1.948 1.00 0.00 N ATOM 1314 CA SER A 85 -2.156 -19.504 1.067 1.00 0.00 C ATOM 1315 C SER A 85 -3.663 -19.738 1.018 1.00 0.00 C ATOM 1316 O SER A 85 -4.378 -19.459 1.982 1.00 0.00 O ATOM 1317 CB SER A 85 -1.446 -20.775 1.536 1.00 0.00 C ATOM 1318 OG SER A 85 -2.174 -21.932 1.164 1.00 0.00 O ATOM 0 H SER A 85 -1.921 -18.597 2.942 1.00 0.00 H new ATOM 0 HA SER A 85 -1.812 -19.254 0.063 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.446 -20.817 1.105 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.326 -20.750 2.619 1.00 0.00 H new ATOM 0 HG SER A 85 -2.147 -22.585 1.895 1.00 0.00 H new ATOM 1324 N VAL A 86 -4.140 -20.251 -0.111 1.00 0.00 N ATOM 1325 CA VAL A 86 -5.562 -20.525 -0.286 1.00 0.00 C ATOM 1326 C VAL A 86 -5.784 -21.885 -0.937 1.00 0.00 C ATOM 1327 O VAL A 86 -5.248 -22.168 -2.009 1.00 0.00 O ATOM 1328 CB VAL A 86 -6.240 -19.440 -1.145 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -5.843 -19.591 -2.606 1.00 0.00 C ATOM 1330 CG2 VAL A 86 -7.751 -19.503 -0.986 1.00 0.00 C ATOM 0 H VAL A 86 -3.563 -20.486 -0.919 1.00 0.00 H new ATOM 0 HA VAL A 86 -6.009 -20.524 0.708 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.901 -18.463 -0.800 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.331 -18.817 -3.198 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.762 -19.493 -2.701 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -6.151 -20.572 -2.967 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.214 -18.730 -1.599 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -8.110 -20.482 -1.304 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -8.014 -19.342 0.060 1.00 0.00 H new ATOM 1340 N LYS A 87 -6.577 -22.726 -0.282 1.00 0.00 N ATOM 1341 CA LYS A 87 -6.873 -24.058 -0.796 1.00 0.00 C ATOM 1342 C LYS A 87 -8.244 -24.531 -0.325 1.00 0.00 C ATOM 1343 O LYS A 87 -8.586 -24.402 0.850 1.00 0.00 O ATOM 1344 CB LYS A 87 -5.798 -25.050 -0.347 1.00 0.00 C ATOM 1345 CG LYS A 87 -6.148 -26.499 -0.638 1.00 0.00 C ATOM 1346 CD LYS A 87 -5.767 -26.892 -2.055 1.00 0.00 C ATOM 1347 CE LYS A 87 -6.145 -28.334 -2.355 1.00 0.00 C ATOM 1348 NZ LYS A 87 -7.578 -28.464 -2.738 1.00 0.00 N ATOM 0 H LYS A 87 -7.027 -22.508 0.607 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.880 -24.007 -1.885 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.859 -24.805 -0.844 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.632 -24.933 0.724 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.634 -27.148 0.071 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.217 -26.652 -0.492 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -6.264 -26.230 -2.763 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.694 -26.760 -2.194 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -5.518 -28.713 -3.162 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -5.946 -28.951 -1.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -7.796 -29.462 -2.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -8.178 -28.126 -1.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.763 -27.895 -3.589 1.00 0.00 H new ATOM 1454 N GLU A 94 -12.780 -22.144 0.667 1.00 0.00 N ATOM 1455 CA GLU A 94 -11.341 -22.367 0.745 1.00 0.00 C ATOM 1456 C GLU A 94 -10.820 -22.066 2.147 1.00 0.00 C ATOM 1457 O GLU A 94 -11.594 -21.768 3.057 1.00 0.00 O ATOM 1458 CB GLU A 94 -10.612 -21.496 -0.280 1.00 0.00 C ATOM 1459 CG GLU A 94 -11.074 -21.722 -1.710 1.00 0.00 C ATOM 1460 CD GLU A 94 -12.286 -20.886 -2.070 1.00 0.00 C ATOM 1461 OE1 GLU A 94 -12.343 -19.711 -1.650 1.00 0.00 O ATOM 1462 OE2 GLU A 94 -13.179 -21.406 -2.772 1.00 0.00 O ATOM 0 HA GLU A 94 -11.148 -23.416 0.522 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -10.757 -20.447 -0.022 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.542 -21.694 -0.217 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.258 -21.486 -2.393 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.311 -22.777 -1.849 1.00 0.00 H new ATOM 1469 N GLU A 95 -9.503 -22.146 2.313 1.00 0.00 N ATOM 1470 CA GLU A 95 -8.879 -21.883 3.604 1.00 0.00 C ATOM 1471 C GLU A 95 -7.722 -20.900 3.459 1.00 0.00 C ATOM 1472 O GLU A 95 -6.809 -21.112 2.660 1.00 0.00 O ATOM 1473 CB GLU A 95 -8.379 -23.188 4.228 1.00 0.00 C ATOM 1474 CG GLU A 95 -7.713 -22.999 5.581 1.00 0.00 C ATOM 1475 CD GLU A 95 -8.693 -23.103 6.733 1.00 0.00 C ATOM 1476 OE1 GLU A 95 -9.614 -23.942 6.654 1.00 0.00 O ATOM 1477 OE2 GLU A 95 -8.539 -22.346 7.714 1.00 0.00 O ATOM 0 H GLU A 95 -8.849 -22.391 1.570 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.630 -21.439 4.258 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.219 -23.874 4.339 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.671 -23.659 3.546 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -6.931 -23.749 5.705 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.227 -22.024 5.609 1.00 0.00 H new ATOM 1484 N HIS A 96 -7.767 -19.822 4.236 1.00 0.00 N ATOM 1485 CA HIS A 96 -6.723 -18.805 4.195 1.00 0.00 C ATOM 1486 C HIS A 96 -5.792 -18.932 5.397 1.00 0.00 C ATOM 1487 O HIS A 96 -6.245 -18.997 6.541 1.00 0.00 O ATOM 1488 CB HIS A 96 -7.343 -17.408 4.162 1.00 0.00 C ATOM 1489 CG HIS A 96 -7.838 -17.005 2.807 1.00 0.00 C ATOM 1490 ND1 HIS A 96 -8.618 -17.663 1.917 1.00 0.00 N flip ATOM 1491 CD2 HIS A 96 -7.536 -15.792 2.225 1.00 0.00 C flip ATOM 1492 CE1 HIS A 96 -8.772 -16.843 0.826 1.00 0.00 C flip ATOM 1493 NE2 HIS A 96 -8.110 -15.720 1.037 1.00 0.00 N flip ATOM 0 H HIS A 96 -8.516 -19.631 4.902 1.00 0.00 H new ATOM 0 HA HIS A 96 -6.139 -18.957 3.287 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -8.172 -17.370 4.869 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -6.603 -16.683 4.500 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -6.925 -15.021 2.671 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -9.342 -17.078 -0.061 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -8.052 -14.931 0.393 1.00 0.00 H new ATOM 1502 N CYS A 97 -4.491 -18.969 5.131 1.00 0.00 N ATOM 1503 CA CYS A 97 -3.497 -19.091 6.191 1.00 0.00 C ATOM 1504 C CYS A 97 -2.317 -18.157 5.940 1.00 0.00 C ATOM 1505 O CYS A 97 -1.670 -18.202 4.894 1.00 0.00 O ATOM 1506 CB CYS A 97 -3.006 -20.536 6.296 1.00 0.00 C ATOM 1507 SG CYS A 97 -2.458 -21.011 7.952 1.00 0.00 S ATOM 0 H CYS A 97 -4.100 -18.916 4.190 1.00 0.00 H new ATOM 0 HA CYS A 97 -3.969 -18.807 7.132 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.809 -21.205 5.985 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.182 -20.680 5.597 1.00 0.00 H new ATOM 0 HG CYS A 97 -2.064 -22.250 7.940 1.00 0.00 H new ATOM 1513 N PRO A 98 -2.030 -17.289 6.921 1.00 0.00 N ATOM 1514 CA PRO A 98 -0.928 -16.327 6.829 1.00 0.00 C ATOM 1515 C PRO A 98 0.437 -17.002 6.894 1.00 0.00 C ATOM 1516 O PRO A 98 0.584 -18.075 7.480 1.00 0.00 O ATOM 1517 CB PRO A 98 -1.139 -15.428 8.051 1.00 0.00 C ATOM 1518 CG PRO A 98 -1.884 -16.277 9.021 1.00 0.00 C ATOM 1519 CD PRO A 98 -2.760 -17.180 8.196 1.00 0.00 C ATOM 0 HA PRO A 98 -0.934 -15.789 5.881 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.188 -15.094 8.466 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.705 -14.533 7.791 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.198 -16.857 9.639 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -2.481 -15.665 9.697 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -2.892 -18.153 8.668 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -3.754 -16.757 8.055 1.00 0.00 H new ATOM 1527 N LEU A 99 1.435 -16.367 6.289 1.00 0.00 N ATOM 1528 CA LEU A 99 2.791 -16.906 6.279 1.00 0.00 C ATOM 1529 C LEU A 99 3.790 -15.878 6.799 1.00 0.00 C ATOM 1530 O LEU A 99 4.589 -16.169 7.689 1.00 0.00 O ATOM 1531 CB LEU A 99 3.177 -17.339 4.863 1.00 0.00 C ATOM 1532 CG LEU A 99 2.132 -18.155 4.102 1.00 0.00 C ATOM 1533 CD1 LEU A 99 2.514 -18.276 2.635 1.00 0.00 C ATOM 1534 CD2 LEU A 99 1.970 -19.533 4.728 1.00 0.00 C ATOM 0 H LEU A 99 1.331 -15.478 5.799 1.00 0.00 H new ATOM 0 HA LEU A 99 2.816 -17.774 6.938 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.406 -16.446 4.281 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.094 -17.925 4.921 1.00 0.00 H new ATOM 0 HG LEU A 99 1.176 -17.635 4.166 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.759 -18.860 2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.577 -17.282 2.192 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.480 -18.773 2.550 1.00 0.00 H new ATOM 0 HD21 LEU A 99 1.222 -20.099 4.173 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.923 -20.061 4.696 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.649 -19.426 5.764 1.00 0.00 H new ATOM 1546 N ALA A 100 3.738 -14.674 6.239 1.00 0.00 N ATOM 1547 CA ALA A 100 4.635 -13.601 6.649 1.00 0.00 C ATOM 1548 C ALA A 100 3.918 -12.255 6.648 1.00 0.00 C ATOM 1549 O ALA A 100 2.721 -12.179 6.373 1.00 0.00 O ATOM 1550 CB ALA A 100 5.852 -13.554 5.738 1.00 0.00 C ATOM 0 H ALA A 100 3.084 -14.417 5.500 1.00 0.00 H new ATOM 0 HA ALA A 100 4.965 -13.806 7.667 1.00 0.00 H new ATOM 0 HB1 ALA A 100 6.513 -12.748 6.056 1.00 0.00 H new ATOM 0 HB2 ALA A 100 6.385 -14.503 5.793 1.00 0.00 H new ATOM 0 HB3 ALA A 100 5.531 -13.377 4.711 1.00 0.00 H new ATOM 1556 N TRP A 101 4.658 -11.197 6.959 1.00 0.00 N ATOM 1557 CA TRP A 101 4.091 -9.853 6.994 1.00 0.00 C ATOM 1558 C TRP A 101 5.192 -8.798 6.995 1.00 0.00 C ATOM 1559 O TRP A 101 6.092 -8.827 7.833 1.00 0.00 O ATOM 1560 CB TRP A 101 3.205 -9.683 8.229 1.00 0.00 C ATOM 1561 CG TRP A 101 3.941 -9.877 9.520 1.00 0.00 C ATOM 1562 CD1 TRP A 101 4.032 -11.029 10.248 1.00 0.00 C ATOM 1563 CD2 TRP A 101 4.688 -8.888 10.237 1.00 0.00 C ATOM 1564 NE1 TRP A 101 4.790 -10.816 11.373 1.00 0.00 N ATOM 1565 CE2 TRP A 101 5.206 -9.511 11.390 1.00 0.00 C ATOM 1566 CE3 TRP A 101 4.973 -7.538 10.016 1.00 0.00 C ATOM 1567 CZ2 TRP A 101 5.989 -8.828 12.317 1.00 0.00 C ATOM 1568 CZ3 TRP A 101 5.750 -6.861 10.937 1.00 0.00 C ATOM 1569 CH2 TRP A 101 6.251 -7.507 12.075 1.00 0.00 C ATOM 0 H TRP A 101 5.650 -11.243 7.190 1.00 0.00 H new ATOM 0 HA TRP A 101 3.484 -9.718 6.099 1.00 0.00 H new ATOM 0 HB2 TRP A 101 2.764 -8.686 8.217 1.00 0.00 H new ATOM 0 HB3 TRP A 101 2.382 -10.396 8.178 1.00 0.00 H new ATOM 0 HD1 TRP A 101 3.575 -11.970 9.978 1.00 0.00 H new ATOM 0 HE1 TRP A 101 5.008 -11.516 12.082 1.00 0.00 H new ATOM 0 HE3 TRP A 101 4.593 -7.032 9.141 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.376 -9.323 13.195 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 5.975 -5.817 10.777 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.856 -6.951 12.775 1.00 0.00 H new ATOM 1580 N GLY A 102 5.114 -7.867 6.049 1.00 0.00 N ATOM 1581 CA GLY A 102 6.111 -6.815 5.959 1.00 0.00 C ATOM 1582 C GLY A 102 5.491 -5.439 5.817 1.00 0.00 C ATOM 1583 O GLY A 102 4.605 -5.234 4.988 1.00 0.00 O ATOM 0 H GLY A 102 4.379 -7.822 5.343 1.00 0.00 H new ATOM 0 HA2 GLY A 102 6.739 -6.837 6.850 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.761 -7.007 5.105 1.00 0.00 H new ATOM 1587 N ASN A 103 5.957 -4.495 6.628 1.00 0.00 N ATOM 1588 CA ASN A 103 5.440 -3.132 6.590 1.00 0.00 C ATOM 1589 C ASN A 103 6.451 -2.185 5.950 1.00 0.00 C ATOM 1590 O ASN A 103 7.623 -2.165 6.328 1.00 0.00 O ATOM 1591 CB ASN A 103 5.100 -2.653 8.002 1.00 0.00 C ATOM 1592 CG ASN A 103 4.428 -3.731 8.831 1.00 0.00 C ATOM 1593 OD1 ASN A 103 4.912 -4.860 8.911 1.00 0.00 O ATOM 1594 ND2 ASN A 103 3.306 -3.386 9.453 1.00 0.00 N ATOM 0 H ASN A 103 6.691 -4.649 7.319 1.00 0.00 H new ATOM 0 HA ASN A 103 4.533 -3.131 5.985 1.00 0.00 H new ATOM 0 HB2 ASN A 103 6.012 -2.329 8.503 1.00 0.00 H new ATOM 0 HB3 ASN A 103 4.445 -1.784 7.940 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.809 -4.069 10.025 1.00 0.00 H new ATOM 0 HD22 ASN A 103 2.941 -2.438 9.358 1.00 0.00 H new ATOM 1601 N ILE A 104 5.989 -1.402 4.981 1.00 0.00 N ATOM 1602 CA ILE A 104 6.853 -0.452 4.291 1.00 0.00 C ATOM 1603 C ILE A 104 6.355 0.978 4.475 1.00 0.00 C ATOM 1604 O ILE A 104 5.241 1.314 4.077 1.00 0.00 O ATOM 1605 CB ILE A 104 6.941 -0.762 2.785 1.00 0.00 C ATOM 1606 CG1 ILE A 104 7.463 -2.184 2.564 1.00 0.00 C ATOM 1607 CG2 ILE A 104 7.836 0.250 2.086 1.00 0.00 C ATOM 1608 CD1 ILE A 104 7.442 -2.617 1.115 1.00 0.00 C ATOM 0 H ILE A 104 5.022 -1.407 4.656 1.00 0.00 H new ATOM 0 HA ILE A 104 7.845 -0.549 4.733 1.00 0.00 H new ATOM 0 HB ILE A 104 5.941 -0.691 2.356 1.00 0.00 H new ATOM 0 HG12 ILE A 104 8.484 -2.250 2.940 1.00 0.00 H new ATOM 0 HG13 ILE A 104 6.862 -2.878 3.151 1.00 0.00 H new ATOM 0 HG21 ILE A 104 7.888 0.017 1.023 1.00 0.00 H new ATOM 0 HG22 ILE A 104 7.426 1.251 2.218 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.837 0.208 2.516 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.825 -3.634 1.034 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.419 -2.584 0.740 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.066 -1.946 0.526 1.00 0.00 H new ATOM 1620 N ASN A 105 7.191 1.816 5.080 1.00 0.00 N ATOM 1621 CA ASN A 105 6.836 3.211 5.316 1.00 0.00 C ATOM 1622 C ASN A 105 6.873 4.009 4.016 1.00 0.00 C ATOM 1623 O ASN A 105 7.926 4.500 3.606 1.00 0.00 O ATOM 1624 CB ASN A 105 7.789 3.835 6.338 1.00 0.00 C ATOM 1625 CG ASN A 105 7.126 4.930 7.152 1.00 0.00 C ATOM 1626 OD1 ASN A 105 6.649 4.577 8.340 1.00 0.00 O flip ATOM 1627 ND2 ASN A 105 7.046 6.079 6.717 1.00 0.00 N flip ATOM 0 H ASN A 105 8.118 1.554 5.415 1.00 0.00 H new ATOM 0 HA ASN A 105 5.820 3.240 5.711 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.157 3.059 7.009 1.00 0.00 H new ATOM 0 HB3 ASN A 105 8.656 4.245 5.820 1.00 0.00 H new ATOM 0 HD21 ASN A 105 7.427 6.304 5.798 1.00 0.00 H new ATOM 0 HD22 ASN A 105 6.599 6.806 7.276 1.00 0.00 H new ATOM 1634 N LEU A 106 5.718 4.135 3.373 1.00 0.00 N ATOM 1635 CA LEU A 106 5.617 4.875 2.120 1.00 0.00 C ATOM 1636 C LEU A 106 6.562 6.073 2.117 1.00 0.00 C ATOM 1637 O LEU A 106 7.133 6.424 1.084 1.00 0.00 O ATOM 1638 CB LEU A 106 4.179 5.345 1.896 1.00 0.00 C ATOM 1639 CG LEU A 106 3.152 4.249 1.610 1.00 0.00 C ATOM 1640 CD1 LEU A 106 1.742 4.759 1.864 1.00 0.00 C ATOM 1641 CD2 LEU A 106 3.290 3.748 0.179 1.00 0.00 C ATOM 0 H LEU A 106 4.838 3.734 3.698 1.00 0.00 H new ATOM 0 HA LEU A 106 5.905 4.207 1.308 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.856 5.896 2.779 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.173 6.047 1.062 1.00 0.00 H new ATOM 0 HG LEU A 106 3.342 3.415 2.286 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.025 3.965 1.655 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.649 5.068 2.905 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.540 5.610 1.214 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.551 2.968 -0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.127 4.574 -0.513 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.291 3.342 0.031 1.00 0.00 H new ATOM 1653 N PHE A 107 6.723 6.695 3.279 1.00 0.00 N ATOM 1654 CA PHE A 107 7.600 7.853 3.411 1.00 0.00 C ATOM 1655 C PHE A 107 8.904 7.472 4.105 1.00 0.00 C ATOM 1656 O PHE A 107 8.933 7.241 5.314 1.00 0.00 O ATOM 1657 CB PHE A 107 6.898 8.964 4.196 1.00 0.00 C ATOM 1658 CG PHE A 107 5.628 9.442 3.552 1.00 0.00 C ATOM 1659 CD1 PHE A 107 5.646 10.001 2.285 1.00 0.00 C ATOM 1660 CD2 PHE A 107 4.416 9.332 4.215 1.00 0.00 C ATOM 1661 CE1 PHE A 107 4.479 10.442 1.690 1.00 0.00 C ATOM 1662 CE2 PHE A 107 3.246 9.770 3.625 1.00 0.00 C ATOM 1663 CZ PHE A 107 3.277 10.327 2.361 1.00 0.00 C ATOM 0 H PHE A 107 6.258 6.417 4.143 1.00 0.00 H new ATOM 0 HA PHE A 107 7.834 8.216 2.410 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.674 8.603 5.200 1.00 0.00 H new ATOM 0 HB3 PHE A 107 7.580 9.807 4.306 1.00 0.00 H new ATOM 0 HD1 PHE A 107 6.583 10.093 1.756 1.00 0.00 H new ATOM 0 HD2 PHE A 107 4.386 8.899 5.204 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.507 10.876 0.701 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.308 9.677 4.152 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.364 10.672 1.899 1.00 0.00 H new ATOM 1673 N ASP A 108 9.982 7.406 3.330 1.00 0.00 N ATOM 1674 CA ASP A 108 11.290 7.053 3.868 1.00 0.00 C ATOM 1675 C ASP A 108 11.669 7.974 5.024 1.00 0.00 C ATOM 1676 O ASP A 108 10.888 8.838 5.424 1.00 0.00 O ATOM 1677 CB ASP A 108 12.353 7.126 2.771 1.00 0.00 C ATOM 1678 CG ASP A 108 12.643 8.551 2.341 1.00 0.00 C ATOM 1679 OD1 ASP A 108 12.174 9.485 3.024 1.00 0.00 O ATOM 1680 OD2 ASP A 108 13.340 8.731 1.320 1.00 0.00 O ATOM 0 H ASP A 108 9.975 7.592 2.327 1.00 0.00 H new ATOM 0 HA ASP A 108 11.237 6.031 4.244 1.00 0.00 H new ATOM 0 HB2 ASP A 108 13.273 6.663 3.129 1.00 0.00 H new ATOM 0 HB3 ASP A 108 12.021 6.549 1.908 1.00 0.00 H new ATOM 1685 N TYR A 109 12.871 7.784 5.555 1.00 0.00 N ATOM 1686 CA TYR A 109 13.353 8.595 6.667 1.00 0.00 C ATOM 1687 C TYR A 109 13.334 10.078 6.308 1.00 0.00 C ATOM 1688 O TYR A 109 12.995 10.926 7.135 1.00 0.00 O ATOM 1689 CB TYR A 109 14.769 8.172 7.059 1.00 0.00 C ATOM 1690 CG TYR A 109 15.679 7.931 5.875 1.00 0.00 C ATOM 1691 CD1 TYR A 109 15.691 6.705 5.222 1.00 0.00 C ATOM 1692 CD2 TYR A 109 16.525 8.930 5.410 1.00 0.00 C ATOM 1693 CE1 TYR A 109 16.521 6.480 4.141 1.00 0.00 C ATOM 1694 CE2 TYR A 109 17.357 8.714 4.328 1.00 0.00 C ATOM 1695 CZ TYR A 109 17.351 7.488 3.697 1.00 0.00 C ATOM 1696 OH TYR A 109 18.179 7.269 2.620 1.00 0.00 O ATOM 0 H TYR A 109 13.530 7.075 5.233 1.00 0.00 H new ATOM 0 HA TYR A 109 12.686 8.436 7.515 1.00 0.00 H new ATOM 0 HB2 TYR A 109 15.207 8.943 7.692 1.00 0.00 H new ATOM 0 HB3 TYR A 109 14.715 7.262 7.656 1.00 0.00 H new ATOM 0 HD1 TYR A 109 15.040 5.914 5.565 1.00 0.00 H new ATOM 0 HD2 TYR A 109 16.533 9.891 5.902 1.00 0.00 H new ATOM 0 HE1 TYR A 109 16.520 5.520 3.646 1.00 0.00 H new ATOM 0 HE2 TYR A 109 18.008 9.501 3.978 1.00 0.00 H new ATOM 0 HH TYR A 109 18.697 8.080 2.435 1.00 0.00 H new ATOM 1706 N THR A 110 13.699 10.384 5.067 1.00 0.00 N ATOM 1707 CA THR A 110 13.725 11.763 4.596 1.00 0.00 C ATOM 1708 C THR A 110 12.362 12.187 4.061 1.00 0.00 C ATOM 1709 O THR A 110 12.271 12.998 3.139 1.00 0.00 O ATOM 1710 CB THR A 110 14.781 11.960 3.492 1.00 0.00 C ATOM 1711 OG1 THR A 110 14.797 13.328 3.068 1.00 0.00 O ATOM 1712 CG2 THR A 110 14.493 11.058 2.301 1.00 0.00 C ATOM 0 H THR A 110 13.981 9.695 4.370 1.00 0.00 H new ATOM 0 HA THR A 110 13.986 12.385 5.453 1.00 0.00 H new ATOM 0 HB THR A 110 15.756 11.695 3.901 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.903 13.585 2.758 1.00 0.00 H new ATOM 0 HG21 THR A 110 15.252 11.215 1.534 1.00 0.00 H new ATOM 0 HG22 THR A 110 14.510 10.016 2.621 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.511 11.296 1.893 1.00 0.00 H new ATOM 1720 N ASP A 111 11.304 11.636 4.646 1.00 0.00 N ATOM 1721 CA ASP A 111 9.945 11.959 4.230 1.00 0.00 C ATOM 1722 C ASP A 111 9.866 12.128 2.715 1.00 0.00 C ATOM 1723 O ASP A 111 9.399 13.152 2.217 1.00 0.00 O ATOM 1724 CB ASP A 111 9.466 13.235 4.923 1.00 0.00 C ATOM 1725 CG ASP A 111 10.555 14.286 5.019 1.00 0.00 C ATOM 1726 OD1 ASP A 111 11.303 14.274 6.018 1.00 0.00 O ATOM 1727 OD2 ASP A 111 10.658 15.120 4.095 1.00 0.00 O ATOM 0 H ASP A 111 11.362 10.963 5.410 1.00 0.00 H new ATOM 0 HA ASP A 111 9.297 11.132 4.520 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.617 13.645 4.376 1.00 0.00 H new ATOM 0 HB3 ASP A 111 9.112 12.990 5.924 1.00 0.00 H new ATOM 1732 N THR A 112 10.327 11.115 1.987 1.00 0.00 N ATOM 1733 CA THR A 112 10.312 11.152 0.531 1.00 0.00 C ATOM 1734 C THR A 112 9.755 9.855 -0.046 1.00 0.00 C ATOM 1735 O THR A 112 10.335 8.784 0.135 1.00 0.00 O ATOM 1736 CB THR A 112 11.722 11.390 -0.041 1.00 0.00 C ATOM 1737 OG1 THR A 112 12.324 12.522 0.598 1.00 0.00 O ATOM 1738 CG2 THR A 112 11.666 11.620 -1.543 1.00 0.00 C ATOM 0 H THR A 112 10.715 10.259 2.383 1.00 0.00 H new ATOM 0 HA THR A 112 9.667 11.982 0.243 1.00 0.00 H new ATOM 0 HB THR A 112 12.323 10.501 0.151 1.00 0.00 H new ATOM 0 HG1 THR A 112 12.110 12.510 1.554 1.00 0.00 H new ATOM 0 HG21 THR A 112 12.674 11.786 -1.924 1.00 0.00 H new ATOM 0 HG22 THR A 112 11.234 10.745 -2.029 1.00 0.00 H new ATOM 0 HG23 THR A 112 11.050 12.494 -1.755 1.00 0.00 H new ATOM 1746 N LEU A 113 8.628 9.959 -0.742 1.00 0.00 N ATOM 1747 CA LEU A 113 7.992 8.793 -1.346 1.00 0.00 C ATOM 1748 C LEU A 113 9.023 7.910 -2.041 1.00 0.00 C ATOM 1749 O LEU A 113 9.793 8.378 -2.880 1.00 0.00 O ATOM 1750 CB LEU A 113 6.923 9.233 -2.348 1.00 0.00 C ATOM 1751 CG LEU A 113 5.514 9.422 -1.786 1.00 0.00 C ATOM 1752 CD1 LEU A 113 4.620 10.112 -2.805 1.00 0.00 C ATOM 1753 CD2 LEU A 113 4.920 8.082 -1.374 1.00 0.00 C ATOM 0 H LEU A 113 8.136 10.838 -0.902 1.00 0.00 H new ATOM 0 HA LEU A 113 7.521 8.214 -0.552 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.242 10.173 -2.800 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.877 8.494 -3.148 1.00 0.00 H new ATOM 0 HG LEU A 113 5.579 10.056 -0.902 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.621 10.238 -2.387 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.036 11.089 -3.051 1.00 0.00 H new ATOM 0 HD13 LEU A 113 4.561 9.504 -3.708 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.917 8.236 -0.976 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.870 7.424 -2.242 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.548 7.626 -0.609 1.00 0.00 H new ATOM 1765 N VAL A 114 9.032 6.629 -1.688 1.00 0.00 N ATOM 1766 CA VAL A 114 9.966 5.678 -2.280 1.00 0.00 C ATOM 1767 C VAL A 114 9.818 5.634 -3.796 1.00 0.00 C ATOM 1768 O VAL A 114 8.949 6.296 -4.365 1.00 0.00 O ATOM 1769 CB VAL A 114 9.759 4.261 -1.713 1.00 0.00 C ATOM 1770 CG1 VAL A 114 10.193 4.199 -0.257 1.00 0.00 C ATOM 1771 CG2 VAL A 114 8.307 3.834 -1.864 1.00 0.00 C ATOM 0 H VAL A 114 8.403 6.225 -0.994 1.00 0.00 H new ATOM 0 HA VAL A 114 10.969 6.020 -2.026 1.00 0.00 H new ATOM 0 HB VAL A 114 10.379 3.567 -2.281 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.039 3.190 0.126 1.00 0.00 H new ATOM 0 HG12 VAL A 114 11.249 4.459 -0.181 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.603 4.903 0.329 1.00 0.00 H new ATOM 0 HG21 VAL A 114 8.179 2.830 -1.458 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.665 4.529 -1.323 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.035 3.836 -2.920 1.00 0.00 H new ATOM 1781 N SER A 115 10.672 4.850 -4.446 1.00 0.00 N ATOM 1782 CA SER A 115 10.639 4.722 -5.898 1.00 0.00 C ATOM 1783 C SER A 115 11.618 3.652 -6.372 1.00 0.00 C ATOM 1784 O SER A 115 12.504 3.232 -5.628 1.00 0.00 O ATOM 1785 CB SER A 115 10.972 6.062 -6.558 1.00 0.00 C ATOM 1786 OG SER A 115 12.278 6.490 -6.211 1.00 0.00 O ATOM 0 H SER A 115 11.395 4.294 -3.990 1.00 0.00 H new ATOM 0 HA SER A 115 9.632 4.423 -6.188 1.00 0.00 H new ATOM 0 HB2 SER A 115 10.892 5.967 -7.641 1.00 0.00 H new ATOM 0 HB3 SER A 115 10.245 6.814 -6.249 1.00 0.00 H new ATOM 0 HG SER A 115 12.468 7.347 -6.646 1.00 0.00 H new ATOM 1792 N GLY A 116 11.451 3.214 -7.616 1.00 0.00 N ATOM 1793 CA GLY A 116 12.326 2.197 -8.169 1.00 0.00 C ATOM 1794 C GLY A 116 12.136 0.847 -7.507 1.00 0.00 C ATOM 1795 O GLY A 116 11.794 0.768 -6.326 1.00 0.00 O ATOM 0 H GLY A 116 10.725 3.546 -8.251 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.139 2.103 -9.239 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.363 2.512 -8.053 1.00 0.00 H new ATOM 1799 N LYS A 117 12.356 -0.220 -8.268 1.00 0.00 N ATOM 1800 CA LYS A 117 12.206 -1.574 -7.749 1.00 0.00 C ATOM 1801 C LYS A 117 12.738 -1.673 -6.323 1.00 0.00 C ATOM 1802 O LYS A 117 13.554 -0.856 -5.898 1.00 0.00 O ATOM 1803 CB LYS A 117 12.941 -2.571 -8.649 1.00 0.00 C ATOM 1804 CG LYS A 117 12.285 -3.939 -8.704 1.00 0.00 C ATOM 1805 CD LYS A 117 13.028 -4.877 -9.641 1.00 0.00 C ATOM 1806 CE LYS A 117 14.094 -5.673 -8.904 1.00 0.00 C ATOM 1807 NZ LYS A 117 15.150 -6.174 -9.827 1.00 0.00 N ATOM 0 H LYS A 117 12.639 -0.173 -9.247 1.00 0.00 H new ATOM 0 HA LYS A 117 11.143 -1.817 -7.739 1.00 0.00 H new ATOM 0 HB2 LYS A 117 12.997 -2.163 -9.658 1.00 0.00 H new ATOM 0 HB3 LYS A 117 13.965 -2.683 -8.293 1.00 0.00 H new ATOM 0 HG2 LYS A 117 12.257 -4.370 -7.703 1.00 0.00 H new ATOM 0 HG3 LYS A 117 11.252 -3.835 -9.036 1.00 0.00 H new ATOM 0 HD2 LYS A 117 12.320 -5.561 -10.109 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.491 -4.301 -10.442 1.00 0.00 H new ATOM 0 HE2 LYS A 117 14.549 -5.047 -8.137 1.00 0.00 H new ATOM 0 HE3 LYS A 117 13.629 -6.516 -8.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 15.857 -6.711 -9.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 14.720 -6.792 -10.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 15.611 -5.369 -10.296 1.00 0.00 H new ATOM 1821 N MET A 118 12.270 -2.678 -5.590 1.00 0.00 N ATOM 1822 CA MET A 118 12.701 -2.883 -4.212 1.00 0.00 C ATOM 1823 C MET A 118 12.506 -4.337 -3.793 1.00 0.00 C ATOM 1824 O MET A 118 11.550 -4.990 -4.210 1.00 0.00 O ATOM 1825 CB MET A 118 11.926 -1.960 -3.270 1.00 0.00 C ATOM 1826 CG MET A 118 12.135 -2.280 -1.798 1.00 0.00 C ATOM 1827 SD MET A 118 10.684 -1.908 -0.794 1.00 0.00 S ATOM 1828 CE MET A 118 11.165 -0.340 -0.073 1.00 0.00 C ATOM 0 H MET A 118 11.593 -3.362 -5.927 1.00 0.00 H new ATOM 0 HA MET A 118 13.763 -2.644 -4.150 1.00 0.00 H new ATOM 0 HB2 MET A 118 12.227 -0.929 -3.456 1.00 0.00 H new ATOM 0 HB3 MET A 118 10.863 -2.028 -3.501 1.00 0.00 H new ATOM 0 HG2 MET A 118 12.385 -3.336 -1.692 1.00 0.00 H new ATOM 0 HG3 MET A 118 12.986 -1.712 -1.424 1.00 0.00 H new ATOM 0 HE1 MET A 118 10.329 0.073 0.491 1.00 0.00 H new ATOM 0 HE2 MET A 118 12.013 -0.491 0.595 1.00 0.00 H new ATOM 0 HE3 MET A 118 11.446 0.354 -0.865 1.00 0.00 H new ATOM 1838 N ALA A 119 13.419 -4.837 -2.966 1.00 0.00 N ATOM 1839 CA ALA A 119 13.345 -6.213 -2.489 1.00 0.00 C ATOM 1840 C ALA A 119 13.740 -6.306 -1.019 1.00 0.00 C ATOM 1841 O ALA A 119 14.915 -6.184 -0.672 1.00 0.00 O ATOM 1842 CB ALA A 119 14.235 -7.112 -3.335 1.00 0.00 C ATOM 0 H ALA A 119 14.218 -4.310 -2.613 1.00 0.00 H new ATOM 0 HA ALA A 119 12.313 -6.550 -2.582 1.00 0.00 H new ATOM 0 HB1 ALA A 119 14.171 -8.137 -2.968 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.906 -7.077 -4.373 1.00 0.00 H new ATOM 0 HB3 ALA A 119 15.267 -6.767 -3.270 1.00 0.00 H new ATOM 1848 N LEU A 120 12.751 -6.522 -0.159 1.00 0.00 N ATOM 1849 CA LEU A 120 12.994 -6.631 1.275 1.00 0.00 C ATOM 1850 C LEU A 120 12.410 -7.926 1.830 1.00 0.00 C ATOM 1851 O LEU A 120 11.579 -8.569 1.189 1.00 0.00 O ATOM 1852 CB LEU A 120 12.391 -5.431 2.008 1.00 0.00 C ATOM 1853 CG LEU A 120 10.864 -5.354 2.024 1.00 0.00 C ATOM 1854 CD1 LEU A 120 10.299 -6.193 3.159 1.00 0.00 C ATOM 1855 CD2 LEU A 120 10.405 -3.908 2.147 1.00 0.00 C ATOM 0 H LEU A 120 11.773 -6.625 -0.430 1.00 0.00 H new ATOM 0 HA LEU A 120 14.072 -6.642 1.435 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.745 -5.445 3.039 1.00 0.00 H new ATOM 0 HB3 LEU A 120 12.776 -4.520 1.550 1.00 0.00 H new ATOM 0 HG LEU A 120 10.489 -5.755 1.082 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.211 -6.126 3.154 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.599 -7.233 3.027 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.681 -5.823 4.110 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.316 -3.872 2.157 1.00 0.00 H new ATOM 0 HD22 LEU A 120 10.791 -3.481 3.073 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.780 -3.334 1.299 1.00 0.00 H new ATOM 1867 N ASN A 121 12.849 -8.303 3.027 1.00 0.00 N ATOM 1868 CA ASN A 121 12.368 -9.521 3.669 1.00 0.00 C ATOM 1869 C ASN A 121 11.174 -9.225 4.571 1.00 0.00 C ATOM 1870 O ASN A 121 10.973 -8.088 5.001 1.00 0.00 O ATOM 1871 CB ASN A 121 13.489 -10.169 4.484 1.00 0.00 C ATOM 1872 CG ASN A 121 14.527 -10.841 3.606 1.00 0.00 C ATOM 1873 OD1 ASN A 121 15.091 -10.220 2.705 1.00 0.00 O ATOM 1874 ND2 ASN A 121 14.784 -12.118 3.866 1.00 0.00 N ATOM 0 H ASN A 121 13.537 -7.783 3.572 1.00 0.00 H new ATOM 0 HA ASN A 121 12.049 -10.212 2.889 1.00 0.00 H new ATOM 0 HB2 ASN A 121 13.973 -9.410 5.099 1.00 0.00 H new ATOM 0 HB3 ASN A 121 13.061 -10.905 5.165 1.00 0.00 H new ATOM 0 HD21 ASN A 121 15.473 -12.623 3.309 1.00 0.00 H new ATOM 0 HD22 ASN A 121 14.292 -12.593 4.623 1.00 0.00 H new ATOM 1881 N LEU A 122 10.384 -10.255 4.855 1.00 0.00 N ATOM 1882 CA LEU A 122 9.210 -10.107 5.707 1.00 0.00 C ATOM 1883 C LEU A 122 9.394 -10.855 7.023 1.00 0.00 C ATOM 1884 O LEU A 122 10.174 -11.804 7.105 1.00 0.00 O ATOM 1885 CB LEU A 122 7.963 -10.621 4.984 1.00 0.00 C ATOM 1886 CG LEU A 122 7.855 -10.271 3.500 1.00 0.00 C ATOM 1887 CD1 LEU A 122 6.629 -10.926 2.884 1.00 0.00 C ATOM 1888 CD2 LEU A 122 7.808 -8.762 3.310 1.00 0.00 C ATOM 0 H LEU A 122 10.536 -11.202 4.507 1.00 0.00 H new ATOM 0 HA LEU A 122 9.083 -9.047 5.928 1.00 0.00 H new ATOM 0 HB2 LEU A 122 7.931 -11.706 5.084 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.084 -10.228 5.494 1.00 0.00 H new ATOM 0 HG LEU A 122 8.740 -10.654 2.991 1.00 0.00 H new ATOM 0 HD11 LEU A 122 6.569 -10.665 1.827 1.00 0.00 H new ATOM 0 HD12 LEU A 122 6.704 -12.009 2.987 1.00 0.00 H new ATOM 0 HD13 LEU A 122 5.733 -10.575 3.396 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.731 -8.531 2.247 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.942 -8.356 3.833 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.717 -8.316 3.713 1.00 0.00 H new ATOM 1900 N TRP A 123 8.669 -10.424 8.049 1.00 0.00 N ATOM 1901 CA TRP A 123 8.751 -11.055 9.361 1.00 0.00 C ATOM 1902 C TRP A 123 7.794 -12.238 9.457 1.00 0.00 C ATOM 1903 O TRP A 123 6.746 -12.272 8.813 1.00 0.00 O ATOM 1904 CB TRP A 123 8.436 -10.038 10.460 1.00 0.00 C ATOM 1905 CG TRP A 123 9.264 -8.792 10.371 1.00 0.00 C ATOM 1906 CD1 TRP A 123 9.143 -7.791 9.450 1.00 0.00 C ATOM 1907 CD2 TRP A 123 10.342 -8.417 11.235 1.00 0.00 C ATOM 1908 NE1 TRP A 123 10.080 -6.816 9.689 1.00 0.00 N ATOM 1909 CE2 TRP A 123 10.828 -7.175 10.779 1.00 0.00 C ATOM 1910 CE3 TRP A 123 10.943 -9.007 12.350 1.00 0.00 C ATOM 1911 CZ2 TRP A 123 11.886 -6.517 11.401 1.00 0.00 C ATOM 1912 CZ3 TRP A 123 11.993 -8.352 12.965 1.00 0.00 C ATOM 1913 CH2 TRP A 123 12.456 -7.118 12.490 1.00 0.00 C ATOM 0 H TRP A 123 8.018 -9.640 7.998 1.00 0.00 H new ATOM 0 HA TRP A 123 9.768 -11.422 9.497 1.00 0.00 H new ATOM 0 HB2 TRP A 123 7.381 -9.769 10.405 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.596 -10.503 11.433 1.00 0.00 H new ATOM 0 HD1 TRP A 123 8.417 -7.769 8.651 1.00 0.00 H new ATOM 0 HE1 TRP A 123 10.200 -5.963 9.143 1.00 0.00 H new ATOM 0 HE3 TRP A 123 10.593 -9.958 12.724 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 12.244 -5.566 11.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 12.465 -8.799 13.827 1.00 0.00 H new ATOM 0 HH2 TRP A 123 13.279 -6.632 12.993 1.00 0.00 H new ATOM 1924 N PRO A 124 8.160 -13.232 10.280 1.00 0.00 N ATOM 1925 CA PRO A 124 7.347 -14.435 10.479 1.00 0.00 C ATOM 1926 C PRO A 124 6.060 -14.144 11.244 1.00 0.00 C ATOM 1927 O PRO A 124 6.030 -13.284 12.124 1.00 0.00 O ATOM 1928 CB PRO A 124 8.261 -15.350 11.298 1.00 0.00 C ATOM 1929 CG PRO A 124 9.188 -14.423 12.006 1.00 0.00 C ATOM 1930 CD PRO A 124 9.397 -13.258 11.079 1.00 0.00 C ATOM 0 HA PRO A 124 7.024 -14.870 9.533 1.00 0.00 H new ATOM 0 HB2 PRO A 124 7.689 -15.953 12.003 1.00 0.00 H new ATOM 0 HB3 PRO A 124 8.807 -16.042 10.656 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.763 -14.095 12.955 1.00 0.00 H new ATOM 0 HG3 PRO A 124 10.134 -14.915 12.233 1.00 0.00 H new ATOM 0 HD2 PRO A 124 9.540 -12.328 11.629 1.00 0.00 H new ATOM 0 HD3 PRO A 124 10.278 -13.396 10.452 1.00 0.00 H new ATOM 1938 N VAL A 125 4.998 -14.868 10.903 1.00 0.00 N ATOM 1939 CA VAL A 125 3.708 -14.688 11.560 1.00 0.00 C ATOM 1940 C VAL A 125 3.738 -15.226 12.986 1.00 0.00 C ATOM 1941 O VAL A 125 4.101 -16.376 13.235 1.00 0.00 O ATOM 1942 CB VAL A 125 2.580 -15.391 10.781 1.00 0.00 C ATOM 1943 CG1 VAL A 125 1.263 -15.281 11.534 1.00 0.00 C ATOM 1944 CG2 VAL A 125 2.455 -14.806 9.382 1.00 0.00 C ATOM 0 H VAL A 125 5.005 -15.584 10.176 1.00 0.00 H new ATOM 0 HA VAL A 125 3.511 -13.616 11.584 1.00 0.00 H new ATOM 0 HB VAL A 125 2.830 -16.448 10.687 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.478 -15.783 10.969 1.00 0.00 H new ATOM 0 HG12 VAL A 125 1.363 -15.751 12.512 1.00 0.00 H new ATOM 0 HG13 VAL A 125 1.003 -14.230 11.661 1.00 0.00 H new ATOM 0 HG21 VAL A 125 1.654 -15.314 8.845 1.00 0.00 H new ATOM 0 HG22 VAL A 125 2.228 -13.742 9.451 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.394 -14.942 8.845 1.00 0.00 H new ATOM 2039 N LEU A 132 -5.267 -11.868 8.904 1.00 0.00 N ATOM 2040 CA LEU A 132 -4.212 -12.254 7.974 1.00 0.00 C ATOM 2041 C LEU A 132 -3.154 -11.160 7.866 1.00 0.00 C ATOM 2042 O LEU A 132 -1.976 -11.391 8.141 1.00 0.00 O ATOM 2043 CB LEU A 132 -4.803 -12.545 6.593 1.00 0.00 C ATOM 2044 CG LEU A 132 -5.859 -13.649 6.534 1.00 0.00 C ATOM 2045 CD1 LEU A 132 -6.745 -13.476 5.311 1.00 0.00 C ATOM 2046 CD2 LEU A 132 -5.197 -15.019 6.526 1.00 0.00 C ATOM 0 HA LEU A 132 -3.737 -13.157 8.357 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -5.245 -11.626 6.208 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -3.988 -12.813 5.920 1.00 0.00 H new ATOM 0 HG LEU A 132 -6.485 -13.575 7.423 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.490 -14.271 5.286 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.247 -12.510 5.359 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -6.134 -13.523 4.410 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -5.963 -15.793 6.484 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -4.547 -15.104 5.655 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -4.606 -15.143 7.433 1.00 0.00 H new ATOM 2058 N LEU A 133 -3.582 -9.968 7.466 1.00 0.00 N ATOM 2059 CA LEU A 133 -2.672 -8.836 7.324 1.00 0.00 C ATOM 2060 C LEU A 133 -2.478 -8.123 8.658 1.00 0.00 C ATOM 2061 O LEU A 133 -3.445 -7.746 9.318 1.00 0.00 O ATOM 2062 CB LEU A 133 -3.207 -7.854 6.281 1.00 0.00 C ATOM 2063 CG LEU A 133 -2.249 -6.742 5.852 1.00 0.00 C ATOM 2064 CD1 LEU A 133 -1.269 -7.255 4.808 1.00 0.00 C ATOM 2065 CD2 LEU A 133 -3.024 -5.547 5.317 1.00 0.00 C ATOM 0 H LEU A 133 -4.553 -9.760 7.234 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.706 -9.217 6.993 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -3.497 -8.419 5.395 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -4.113 -7.394 6.676 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.682 -6.420 6.726 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.595 -6.450 4.515 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.690 -8.079 5.226 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.818 -7.605 3.934 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -2.326 -4.766 5.017 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.617 -5.854 4.456 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.685 -5.164 6.095 1.00 0.00 H new ATOM 2077 N ASN A 134 -1.220 -7.940 9.048 1.00 0.00 N ATOM 2078 CA ASN A 134 -0.899 -7.271 10.304 1.00 0.00 C ATOM 2079 C ASN A 134 -0.408 -5.848 10.051 1.00 0.00 C ATOM 2080 O ASN A 134 0.776 -5.606 9.817 1.00 0.00 O ATOM 2081 CB ASN A 134 0.164 -8.060 11.070 1.00 0.00 C ATOM 2082 CG ASN A 134 0.295 -7.607 12.511 1.00 0.00 C ATOM 2083 OD1 ASN A 134 -0.484 -6.780 12.986 1.00 0.00 O ATOM 2084 ND2 ASN A 134 1.284 -8.147 13.213 1.00 0.00 N ATOM 0 H ASN A 134 -0.407 -8.245 8.513 1.00 0.00 H new ATOM 0 HA ASN A 134 -1.808 -7.223 10.904 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -0.088 -9.120 11.047 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.126 -7.950 10.569 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.422 -7.880 14.188 1.00 0.00 H new ATOM 0 HD22 ASN A 134 1.905 -8.829 12.778 1.00 0.00 H new ATOM 2091 N PRO A 135 -1.339 -4.884 10.100 1.00 0.00 N ATOM 2092 CA PRO A 135 -1.025 -3.469 9.881 1.00 0.00 C ATOM 2093 C PRO A 135 -0.207 -2.873 11.021 1.00 0.00 C ATOM 2094 O PRO A 135 0.406 -1.815 10.871 1.00 0.00 O ATOM 2095 CB PRO A 135 -2.403 -2.807 9.808 1.00 0.00 C ATOM 2096 CG PRO A 135 -3.298 -3.708 10.587 1.00 0.00 C ATOM 2097 CD PRO A 135 -2.770 -5.100 10.374 1.00 0.00 C ATOM 0 HA PRO A 135 -0.418 -3.320 8.988 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.383 -1.804 10.234 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -2.741 -2.709 8.776 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -3.291 -3.446 11.645 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.329 -3.625 10.245 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.921 -5.726 11.254 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.268 -5.596 9.541 1.00 0.00 H new ATOM 2105 N ILE A 136 -0.201 -3.558 12.159 1.00 0.00 N ATOM 2106 CA ILE A 136 0.544 -3.096 13.324 1.00 0.00 C ATOM 2107 C ILE A 136 2.001 -3.542 13.258 1.00 0.00 C ATOM 2108 O ILE A 136 2.875 -2.937 13.876 1.00 0.00 O ATOM 2109 CB ILE A 136 -0.081 -3.614 14.633 1.00 0.00 C ATOM 2110 CG1 ILE A 136 -1.593 -3.381 14.629 1.00 0.00 C ATOM 2111 CG2 ILE A 136 0.563 -2.933 15.832 1.00 0.00 C ATOM 2112 CD1 ILE A 136 -1.981 -1.928 14.799 1.00 0.00 C ATOM 0 H ILE A 136 -0.703 -4.435 12.300 1.00 0.00 H new ATOM 0 HA ILE A 136 0.500 -2.007 13.315 1.00 0.00 H new ATOM 0 HB ILE A 136 0.102 -4.686 14.707 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -2.007 -3.752 13.692 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -2.045 -3.966 15.430 1.00 0.00 H new ATOM 0 HG21 ILE A 136 0.111 -3.309 16.750 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.632 -3.145 15.840 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.408 -1.856 15.766 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -3.067 -1.838 14.787 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -1.597 -1.558 15.749 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -1.559 -1.341 13.983 1.00 0.00 H new ATOM 2124 N GLY A 137 2.254 -4.606 12.501 1.00 0.00 N ATOM 2125 CA GLY A 137 3.606 -5.115 12.366 1.00 0.00 C ATOM 2126 C GLY A 137 4.637 -4.007 12.283 1.00 0.00 C ATOM 2127 O GLY A 137 4.338 -2.903 11.826 1.00 0.00 O ATOM 0 H GLY A 137 1.547 -5.124 11.979 1.00 0.00 H new ATOM 0 HA2 GLY A 137 3.836 -5.758 13.216 1.00 0.00 H new ATOM 0 HA3 GLY A 137 3.670 -5.734 11.471 1.00 0.00 H new ATOM 2131 N VAL A 138 5.855 -4.299 12.728 1.00 0.00 N ATOM 2132 CA VAL A 138 6.934 -3.319 12.703 1.00 0.00 C ATOM 2133 C VAL A 138 7.289 -2.928 11.272 1.00 0.00 C ATOM 2134 O VAL A 138 6.920 -3.615 10.319 1.00 0.00 O ATOM 2135 CB VAL A 138 8.196 -3.854 13.405 1.00 0.00 C ATOM 2136 CG1 VAL A 138 7.832 -4.521 14.722 1.00 0.00 C ATOM 2137 CG2 VAL A 138 8.940 -4.822 12.496 1.00 0.00 C ATOM 0 H VAL A 138 6.119 -5.207 13.110 1.00 0.00 H new ATOM 0 HA VAL A 138 6.575 -2.440 13.239 1.00 0.00 H new ATOM 0 HB VAL A 138 8.855 -3.013 13.621 1.00 0.00 H new ATOM 0 HG11 VAL A 138 8.736 -4.893 15.204 1.00 0.00 H new ATOM 0 HG12 VAL A 138 7.345 -3.796 15.375 1.00 0.00 H new ATOM 0 HG13 VAL A 138 7.153 -5.353 14.533 1.00 0.00 H new ATOM 0 HG21 VAL A 138 9.829 -5.191 13.007 1.00 0.00 H new ATOM 0 HG22 VAL A 138 8.290 -5.661 12.248 1.00 0.00 H new ATOM 0 HG23 VAL A 138 9.234 -4.308 11.581 1.00 0.00 H new ATOM 2147 N THR A 139 8.008 -1.820 11.128 1.00 0.00 N ATOM 2148 CA THR A 139 8.413 -1.336 9.814 1.00 0.00 C ATOM 2149 C THR A 139 9.909 -1.530 9.593 1.00 0.00 C ATOM 2150 O THR A 139 10.691 -1.534 10.543 1.00 0.00 O ATOM 2151 CB THR A 139 8.067 0.154 9.632 1.00 0.00 C ATOM 2152 OG1 THR A 139 8.663 0.926 10.680 1.00 0.00 O ATOM 2153 CG2 THR A 139 6.561 0.364 9.634 1.00 0.00 C ATOM 0 H THR A 139 8.322 -1.240 11.906 1.00 0.00 H new ATOM 0 HA THR A 139 7.861 -1.921 9.078 1.00 0.00 H new ATOM 0 HB THR A 139 8.462 0.481 8.670 1.00 0.00 H new ATOM 0 HG1 THR A 139 8.440 1.872 10.557 1.00 0.00 H new ATOM 0 HG21 THR A 139 6.341 1.424 9.504 1.00 0.00 H new ATOM 0 HG22 THR A 139 6.114 -0.202 8.817 1.00 0.00 H new ATOM 0 HG23 THR A 139 6.147 0.021 10.582 1.00 0.00 H new ATOM 2161 N GLY A 140 10.301 -1.690 8.333 1.00 0.00 N ATOM 2162 CA GLY A 140 11.703 -1.881 8.011 1.00 0.00 C ATOM 2163 C GLY A 140 11.990 -3.270 7.476 1.00 0.00 C ATOM 2164 O GLY A 140 11.401 -4.251 7.928 1.00 0.00 O ATOM 0 H GLY A 140 9.673 -1.691 7.529 1.00 0.00 H new ATOM 0 HA2 GLY A 140 12.007 -1.140 7.272 1.00 0.00 H new ATOM 0 HA3 GLY A 140 12.305 -1.707 8.903 1.00 0.00 H new ATOM 2168 N SER A 141 12.898 -3.354 6.508 1.00 0.00 N ATOM 2169 CA SER A 141 13.259 -4.632 5.907 1.00 0.00 C ATOM 2170 C SER A 141 13.889 -5.560 6.941 1.00 0.00 C ATOM 2171 O SER A 141 14.952 -5.268 7.487 1.00 0.00 O ATOM 2172 CB SER A 141 14.226 -4.417 4.741 1.00 0.00 C ATOM 2173 OG SER A 141 15.394 -3.738 5.167 1.00 0.00 O ATOM 0 H SER A 141 13.397 -2.552 6.124 1.00 0.00 H new ATOM 0 HA SER A 141 12.348 -5.099 5.532 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.498 -5.379 4.308 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.733 -3.843 3.957 1.00 0.00 H new ATOM 0 HG SER A 141 15.562 -3.938 6.112 1.00 0.00 H new ATOM 2179 N ASN A 142 13.224 -6.681 7.205 1.00 0.00 N ATOM 2180 CA ASN A 142 13.718 -7.653 8.173 1.00 0.00 C ATOM 2181 C ASN A 142 15.151 -8.065 7.849 1.00 0.00 C ATOM 2182 O ASN A 142 15.478 -8.426 6.718 1.00 0.00 O ATOM 2183 CB ASN A 142 12.813 -8.886 8.196 1.00 0.00 C ATOM 2184 CG ASN A 142 12.851 -9.607 9.530 1.00 0.00 C ATOM 2185 OD1 ASN A 142 12.814 -8.979 10.588 1.00 0.00 O ATOM 2186 ND2 ASN A 142 12.927 -10.932 9.485 1.00 0.00 N ATOM 0 H ASN A 142 12.342 -6.938 6.762 1.00 0.00 H new ATOM 0 HA ASN A 142 13.708 -7.185 9.157 1.00 0.00 H new ATOM 0 HB2 ASN A 142 11.788 -8.585 7.978 1.00 0.00 H new ATOM 0 HB3 ASN A 142 13.119 -9.572 7.406 1.00 0.00 H new ATOM 0 HD21 ASN A 142 12.957 -11.471 10.351 1.00 0.00 H new ATOM 0 HD22 ASN A 142 12.955 -11.411 8.585 1.00 0.00 H new ATOM 2193 N PRO A 143 16.026 -8.011 8.863 1.00 0.00 N ATOM 2194 CA PRO A 143 17.438 -8.376 8.711 1.00 0.00 C ATOM 2195 C PRO A 143 17.629 -9.873 8.496 1.00 0.00 C ATOM 2196 O PRO A 143 18.606 -10.302 7.882 1.00 0.00 O ATOM 2197 CB PRO A 143 18.062 -7.942 10.040 1.00 0.00 C ATOM 2198 CG PRO A 143 16.936 -7.971 11.014 1.00 0.00 C ATOM 2199 CD PRO A 143 15.706 -7.590 10.237 1.00 0.00 C ATOM 0 HA PRO A 143 17.890 -7.904 7.839 1.00 0.00 H new ATOM 0 HB2 PRO A 143 18.863 -8.617 10.341 1.00 0.00 H new ATOM 0 HB3 PRO A 143 18.496 -6.945 9.967 1.00 0.00 H new ATOM 0 HG2 PRO A 143 16.827 -8.962 11.455 1.00 0.00 H new ATOM 0 HG3 PRO A 143 17.111 -7.274 11.834 1.00 0.00 H new ATOM 0 HD2 PRO A 143 14.818 -8.097 10.616 1.00 0.00 H new ATOM 0 HD3 PRO A 143 15.511 -6.519 10.294 1.00 0.00 H new ATOM 2207 N ASN A 144 16.691 -10.665 9.006 1.00 0.00 N ATOM 2208 CA ASN A 144 16.757 -12.115 8.869 1.00 0.00 C ATOM 2209 C ASN A 144 16.963 -12.515 7.411 1.00 0.00 C ATOM 2210 O ASN A 144 16.441 -11.873 6.500 1.00 0.00 O ATOM 2211 CB ASN A 144 15.479 -12.758 9.410 1.00 0.00 C ATOM 2212 CG ASN A 144 15.722 -14.146 9.970 1.00 0.00 C ATOM 2213 OD1 ASN A 144 16.695 -14.810 9.612 1.00 0.00 O ATOM 2214 ND2 ASN A 144 14.836 -14.592 10.853 1.00 0.00 N ATOM 0 H ASN A 144 15.876 -10.327 9.518 1.00 0.00 H new ATOM 0 HA ASN A 144 17.608 -12.471 9.449 1.00 0.00 H new ATOM 0 HB2 ASN A 144 15.058 -12.123 10.190 1.00 0.00 H new ATOM 0 HB3 ASN A 144 14.739 -12.816 8.612 1.00 0.00 H new ATOM 0 HD21 ASN A 144 14.947 -15.519 11.263 1.00 0.00 H new ATOM 0 HD22 ASN A 144 14.044 -14.007 11.121 1.00 0.00 H new ATOM 2221 N LYS A 145 17.727 -13.581 7.199 1.00 0.00 N ATOM 2222 CA LYS A 145 18.002 -14.070 5.853 1.00 0.00 C ATOM 2223 C LYS A 145 17.102 -15.253 5.509 1.00 0.00 C ATOM 2224 O LYS A 145 16.653 -15.392 4.372 1.00 0.00 O ATOM 2225 CB LYS A 145 19.471 -14.481 5.727 1.00 0.00 C ATOM 2226 CG LYS A 145 20.443 -13.417 6.207 1.00 0.00 C ATOM 2227 CD LYS A 145 20.381 -12.172 5.339 1.00 0.00 C ATOM 2228 CE LYS A 145 21.194 -11.034 5.937 1.00 0.00 C ATOM 2229 NZ LYS A 145 21.683 -10.093 4.892 1.00 0.00 N ATOM 0 H LYS A 145 18.167 -14.123 7.942 1.00 0.00 H new ATOM 0 HA LYS A 145 17.795 -13.262 5.151 1.00 0.00 H new ATOM 0 HB2 LYS A 145 19.634 -15.395 6.298 1.00 0.00 H new ATOM 0 HB3 LYS A 145 19.686 -14.714 4.684 1.00 0.00 H new ATOM 0 HG2 LYS A 145 20.214 -13.153 7.240 1.00 0.00 H new ATOM 0 HG3 LYS A 145 21.457 -13.818 6.197 1.00 0.00 H new ATOM 0 HD2 LYS A 145 20.756 -12.403 4.342 1.00 0.00 H new ATOM 0 HD3 LYS A 145 19.343 -11.858 5.225 1.00 0.00 H new ATOM 0 HE2 LYS A 145 20.583 -10.491 6.658 1.00 0.00 H new ATOM 0 HE3 LYS A 145 22.044 -11.443 6.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 22.232 -9.332 5.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 22.287 -10.606 4.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 20.872 -9.683 4.387 1.00 0.00 H new ATOM 2243 N GLU A 146 16.841 -16.100 6.500 1.00 0.00 N ATOM 2244 CA GLU A 146 15.993 -17.269 6.300 1.00 0.00 C ATOM 2245 C GLU A 146 14.518 -16.898 6.419 1.00 0.00 C ATOM 2246 O GLU A 146 13.719 -17.650 6.979 1.00 0.00 O ATOM 2247 CB GLU A 146 16.340 -18.358 7.319 1.00 0.00 C ATOM 2248 CG GLU A 146 16.097 -17.942 8.760 1.00 0.00 C ATOM 2249 CD GLU A 146 16.887 -18.778 9.749 1.00 0.00 C ATOM 2250 OE1 GLU A 146 18.105 -18.953 9.537 1.00 0.00 O ATOM 2251 OE2 GLU A 146 16.287 -19.257 10.734 1.00 0.00 O ATOM 0 H GLU A 146 17.204 -15.999 7.448 1.00 0.00 H new ATOM 0 HA GLU A 146 16.174 -17.650 5.295 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.750 -19.248 7.102 1.00 0.00 H new ATOM 0 HB3 GLU A 146 17.388 -18.634 7.201 1.00 0.00 H new ATOM 0 HG2 GLU A 146 16.365 -16.892 8.881 1.00 0.00 H new ATOM 0 HG3 GLU A 146 15.034 -18.028 8.985 1.00 0.00 H new ATOM 2258 N THR A 147 14.162 -15.733 5.886 1.00 0.00 N ATOM 2259 CA THR A 147 12.784 -15.260 5.933 1.00 0.00 C ATOM 2260 C THR A 147 12.249 -14.986 4.532 1.00 0.00 C ATOM 2261 O THR A 147 13.003 -14.734 3.592 1.00 0.00 O ATOM 2262 CB THR A 147 12.658 -13.979 6.778 1.00 0.00 C ATOM 2263 OG1 THR A 147 13.735 -13.085 6.476 1.00 0.00 O ATOM 2264 CG2 THR A 147 12.667 -14.308 8.263 1.00 0.00 C ATOM 0 H THR A 147 14.809 -15.100 5.417 1.00 0.00 H new ATOM 0 HA THR A 147 12.194 -16.051 6.396 1.00 0.00 H new ATOM 0 HB THR A 147 11.710 -13.500 6.533 1.00 0.00 H new ATOM 0 HG1 THR A 147 13.534 -12.196 6.837 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.577 -13.388 8.840 1.00 0.00 H new ATOM 0 HG22 THR A 147 11.829 -14.965 8.495 1.00 0.00 H new ATOM 0 HG23 THR A 147 13.602 -14.807 8.519 1.00 0.00 H new ATOM 2272 N PRO A 148 10.917 -15.034 4.386 1.00 0.00 N ATOM 2273 CA PRO A 148 10.252 -14.792 3.103 1.00 0.00 C ATOM 2274 C PRO A 148 10.345 -13.334 2.668 1.00 0.00 C ATOM 2275 O PRO A 148 9.949 -12.430 3.405 1.00 0.00 O ATOM 2276 CB PRO A 148 8.796 -15.175 3.380 1.00 0.00 C ATOM 2277 CG PRO A 148 8.628 -14.989 4.848 1.00 0.00 C ATOM 2278 CD PRO A 148 9.957 -15.328 5.464 1.00 0.00 C ATOM 0 HA PRO A 148 10.710 -15.360 2.293 1.00 0.00 H new ATOM 0 HB2 PRO A 148 8.107 -14.543 2.820 1.00 0.00 H new ATOM 0 HB3 PRO A 148 8.595 -16.205 3.086 1.00 0.00 H new ATOM 0 HG2 PRO A 148 8.340 -13.964 5.081 1.00 0.00 H new ATOM 0 HG3 PRO A 148 7.842 -15.637 5.236 1.00 0.00 H new ATOM 0 HD2 PRO A 148 10.153 -14.727 6.352 1.00 0.00 H new ATOM 0 HD3 PRO A 148 10.003 -16.373 5.770 1.00 0.00 H new ATOM 2286 N CYS A 149 10.869 -13.111 1.468 1.00 0.00 N ATOM 2287 CA CYS A 149 11.014 -11.762 0.934 1.00 0.00 C ATOM 2288 C CYS A 149 10.153 -11.573 -0.310 1.00 0.00 C ATOM 2289 O CYS A 149 9.890 -12.524 -1.047 1.00 0.00 O ATOM 2290 CB CYS A 149 12.480 -11.477 0.603 1.00 0.00 C ATOM 2291 SG CYS A 149 12.973 -11.987 -1.060 1.00 0.00 S ATOM 0 H CYS A 149 11.201 -13.848 0.846 1.00 0.00 H new ATOM 0 HA CYS A 149 10.678 -11.059 1.696 1.00 0.00 H new ATOM 0 HB2 CYS A 149 12.665 -10.409 0.714 1.00 0.00 H new ATOM 0 HB3 CYS A 149 13.112 -11.987 1.330 1.00 0.00 H new ATOM 0 HG CYS A 149 14.228 -11.703 -1.247 1.00 0.00 H new ATOM 2297 N LEU A 150 9.714 -10.340 -0.537 1.00 0.00 N ATOM 2298 CA LEU A 150 8.880 -10.026 -1.692 1.00 0.00 C ATOM 2299 C LEU A 150 9.454 -8.850 -2.476 1.00 0.00 C ATOM 2300 O LEU A 150 9.861 -7.844 -1.894 1.00 0.00 O ATOM 2301 CB LEU A 150 7.453 -9.706 -1.244 1.00 0.00 C ATOM 2302 CG LEU A 150 6.458 -10.866 -1.291 1.00 0.00 C ATOM 2303 CD1 LEU A 150 5.176 -10.501 -0.558 1.00 0.00 C ATOM 2304 CD2 LEU A 150 6.158 -11.252 -2.733 1.00 0.00 C ATOM 0 H LEU A 150 9.921 -9.542 0.063 1.00 0.00 H new ATOM 0 HA LEU A 150 8.863 -10.900 -2.344 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.491 -9.327 -0.223 1.00 0.00 H new ATOM 0 HB3 LEU A 150 7.070 -8.899 -1.869 1.00 0.00 H new ATOM 0 HG LEU A 150 6.906 -11.724 -0.791 1.00 0.00 H new ATOM 0 HD11 LEU A 150 4.480 -11.339 -0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 150 5.404 -10.274 0.483 1.00 0.00 H new ATOM 0 HD13 LEU A 150 4.723 -9.628 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 150 5.448 -12.079 -2.748 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.730 -10.397 -3.257 1.00 0.00 H new ATOM 0 HD23 LEU A 150 7.080 -11.556 -3.228 1.00 0.00 H new ATOM 2316 N GLU A 151 9.483 -8.983 -3.798 1.00 0.00 N ATOM 2317 CA GLU A 151 10.006 -7.931 -4.660 1.00 0.00 C ATOM 2318 C GLU A 151 8.871 -7.148 -5.315 1.00 0.00 C ATOM 2319 O GLU A 151 8.000 -7.725 -5.967 1.00 0.00 O ATOM 2320 CB GLU A 151 10.916 -8.528 -5.737 1.00 0.00 C ATOM 2321 CG GLU A 151 11.938 -7.545 -6.283 1.00 0.00 C ATOM 2322 CD GLU A 151 13.149 -8.235 -6.880 1.00 0.00 C ATOM 2323 OE1 GLU A 151 13.089 -8.616 -8.068 1.00 0.00 O ATOM 2324 OE2 GLU A 151 14.156 -8.395 -6.159 1.00 0.00 O ATOM 0 H GLU A 151 9.150 -9.809 -4.295 1.00 0.00 H new ATOM 0 HA GLU A 151 10.587 -7.246 -4.042 1.00 0.00 H new ATOM 0 HB2 GLU A 151 11.439 -9.390 -5.322 1.00 0.00 H new ATOM 0 HB3 GLU A 151 10.301 -8.894 -6.559 1.00 0.00 H new ATOM 0 HG2 GLU A 151 11.467 -6.922 -7.044 1.00 0.00 H new ATOM 0 HG3 GLU A 151 12.261 -6.880 -5.482 1.00 0.00 H new ATOM 2331 N LEU A 152 8.888 -5.832 -5.135 1.00 0.00 N ATOM 2332 CA LEU A 152 7.860 -4.969 -5.707 1.00 0.00 C ATOM 2333 C LEU A 152 8.487 -3.831 -6.505 1.00 0.00 C ATOM 2334 O LEU A 152 9.696 -3.610 -6.444 1.00 0.00 O ATOM 2335 CB LEU A 152 6.970 -4.401 -4.600 1.00 0.00 C ATOM 2336 CG LEU A 152 7.640 -3.424 -3.634 1.00 0.00 C ATOM 2337 CD1 LEU A 152 8.815 -4.088 -2.933 1.00 0.00 C ATOM 2338 CD2 LEU A 152 8.095 -2.172 -4.371 1.00 0.00 C ATOM 0 H LEU A 152 9.602 -5.339 -4.598 1.00 0.00 H new ATOM 0 HA LEU A 152 7.251 -5.569 -6.383 1.00 0.00 H new ATOM 0 HB2 LEU A 152 6.123 -3.897 -5.065 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.568 -5.233 -4.022 1.00 0.00 H new ATOM 0 HG LEU A 152 6.910 -3.132 -2.879 1.00 0.00 H new ATOM 0 HD11 LEU A 152 9.280 -3.377 -2.249 1.00 0.00 H new ATOM 0 HD12 LEU A 152 8.462 -4.954 -2.372 1.00 0.00 H new ATOM 0 HD13 LEU A 152 9.546 -4.410 -3.674 1.00 0.00 H new ATOM 0 HD21 LEU A 152 8.570 -1.488 -3.668 1.00 0.00 H new ATOM 0 HD22 LEU A 152 8.809 -2.446 -5.148 1.00 0.00 H new ATOM 0 HD23 LEU A 152 7.233 -1.684 -4.826 1.00 0.00 H new ATOM 2350 N GLU A 153 7.656 -3.110 -7.251 1.00 0.00 N ATOM 2351 CA GLU A 153 8.130 -1.993 -8.060 1.00 0.00 C ATOM 2352 C GLU A 153 7.344 -0.723 -7.749 1.00 0.00 C ATOM 2353 O GLU A 153 6.115 -0.707 -7.822 1.00 0.00 O ATOM 2354 CB GLU A 153 8.013 -2.327 -9.549 1.00 0.00 C ATOM 2355 CG GLU A 153 9.232 -3.040 -10.111 1.00 0.00 C ATOM 2356 CD GLU A 153 9.138 -3.264 -11.607 1.00 0.00 C ATOM 2357 OE1 GLU A 153 8.071 -3.713 -12.075 1.00 0.00 O ATOM 2358 OE2 GLU A 153 10.133 -2.990 -12.311 1.00 0.00 O ATOM 0 H GLU A 153 6.652 -3.279 -7.312 1.00 0.00 H new ATOM 0 HA GLU A 153 9.178 -1.820 -7.815 1.00 0.00 H new ATOM 0 HB2 GLU A 153 7.133 -2.952 -9.704 1.00 0.00 H new ATOM 0 HB3 GLU A 153 7.852 -1.405 -10.108 1.00 0.00 H new ATOM 0 HG2 GLU A 153 10.125 -2.455 -9.890 1.00 0.00 H new ATOM 0 HG3 GLU A 153 9.349 -4.001 -9.610 1.00 0.00 H new ATOM 2365 N PHE A 154 8.061 0.340 -7.401 1.00 0.00 N ATOM 2366 CA PHE A 154 7.431 1.615 -7.077 1.00 0.00 C ATOM 2367 C PHE A 154 7.329 2.501 -8.315 1.00 0.00 C ATOM 2368 O PHE A 154 8.340 2.856 -8.923 1.00 0.00 O ATOM 2369 CB PHE A 154 8.222 2.335 -5.984 1.00 0.00 C ATOM 2370 CG PHE A 154 8.025 1.748 -4.615 1.00 0.00 C ATOM 2371 CD1 PHE A 154 6.783 1.786 -4.003 1.00 0.00 C ATOM 2372 CD2 PHE A 154 9.082 1.158 -3.941 1.00 0.00 C ATOM 2373 CE1 PHE A 154 6.598 1.246 -2.744 1.00 0.00 C ATOM 2374 CE2 PHE A 154 8.903 0.616 -2.683 1.00 0.00 C ATOM 2375 CZ PHE A 154 7.660 0.661 -2.083 1.00 0.00 C ATOM 0 H PHE A 154 9.079 0.344 -7.336 1.00 0.00 H new ATOM 0 HA PHE A 154 6.424 1.413 -6.713 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.282 2.305 -6.234 1.00 0.00 H new ATOM 0 HB3 PHE A 154 7.929 3.385 -5.966 1.00 0.00 H new ATOM 0 HD1 PHE A 154 5.949 2.243 -4.515 1.00 0.00 H new ATOM 0 HD2 PHE A 154 10.057 1.121 -4.404 1.00 0.00 H new ATOM 0 HE1 PHE A 154 5.624 1.282 -2.278 1.00 0.00 H new ATOM 0 HE2 PHE A 154 9.735 0.157 -2.169 1.00 0.00 H new ATOM 0 HZ PHE A 154 7.519 0.240 -1.099 1.00 0.00 H new ATOM 2385 N ASP A 155 6.103 2.855 -8.683 1.00 0.00 N ATOM 2386 CA ASP A 155 5.867 3.700 -9.847 1.00 0.00 C ATOM 2387 C ASP A 155 4.805 4.754 -9.549 1.00 0.00 C ATOM 2388 O ASP A 155 3.787 4.462 -8.922 1.00 0.00 O ATOM 2389 CB ASP A 155 5.437 2.849 -11.043 1.00 0.00 C ATOM 2390 CG ASP A 155 5.809 3.484 -12.369 1.00 0.00 C ATOM 2391 OD1 ASP A 155 5.376 4.627 -12.621 1.00 0.00 O ATOM 2392 OD2 ASP A 155 6.533 2.836 -13.155 1.00 0.00 O ATOM 0 H ASP A 155 5.256 2.569 -8.191 1.00 0.00 H new ATOM 0 HA ASP A 155 6.800 4.209 -10.089 1.00 0.00 H new ATOM 0 HB2 ASP A 155 5.902 1.866 -10.971 1.00 0.00 H new ATOM 0 HB3 ASP A 155 4.358 2.695 -11.007 1.00 0.00 H new ATOM 2397 N TRP A 156 5.051 5.978 -10.000 1.00 0.00 N ATOM 2398 CA TRP A 156 4.116 7.076 -9.779 1.00 0.00 C ATOM 2399 C TRP A 156 3.780 7.776 -11.091 1.00 0.00 C ATOM 2400 O TRP A 156 4.362 8.810 -11.421 1.00 0.00 O ATOM 2401 CB TRP A 156 4.702 8.081 -8.786 1.00 0.00 C ATOM 2402 CG TRP A 156 5.366 7.433 -7.608 1.00 0.00 C ATOM 2403 CD1 TRP A 156 6.663 7.012 -7.528 1.00 0.00 C ATOM 2404 CD2 TRP A 156 4.766 7.133 -6.344 1.00 0.00 C ATOM 2405 NE1 TRP A 156 6.904 6.467 -6.290 1.00 0.00 N ATOM 2406 CE2 TRP A 156 5.757 6.530 -5.545 1.00 0.00 C ATOM 2407 CE3 TRP A 156 3.488 7.315 -5.809 1.00 0.00 C ATOM 2408 CZ2 TRP A 156 5.507 6.109 -4.241 1.00 0.00 C ATOM 2409 CZ3 TRP A 156 3.242 6.897 -4.515 1.00 0.00 C ATOM 2410 CH2 TRP A 156 4.247 6.301 -3.743 1.00 0.00 C ATOM 0 H TRP A 156 5.889 6.236 -10.521 1.00 0.00 H new ATOM 0 HA TRP A 156 3.198 6.660 -9.364 1.00 0.00 H new ATOM 0 HB2 TRP A 156 5.427 8.710 -9.302 1.00 0.00 H new ATOM 0 HB3 TRP A 156 3.907 8.736 -8.431 1.00 0.00 H new ATOM 0 HD1 TRP A 156 7.392 7.095 -8.321 1.00 0.00 H new ATOM 0 HE1 TRP A 156 7.793 6.078 -5.977 1.00 0.00 H new ATOM 0 HE3 TRP A 156 2.707 7.774 -6.396 1.00 0.00 H new ATOM 0 HZ2 TRP A 156 6.280 5.648 -3.644 1.00 0.00 H new ATOM 0 HZ3 TRP A 156 2.258 7.032 -4.092 1.00 0.00 H new ATOM 0 HH2 TRP A 156 4.023 5.987 -2.734 1.00 0.00 H new ATOM 2421 N PHE A 157 2.838 7.208 -11.836 1.00 0.00 N ATOM 2422 CA PHE A 157 2.425 7.778 -13.113 1.00 0.00 C ATOM 2423 C PHE A 157 1.349 8.841 -12.911 1.00 0.00 C ATOM 2424 O PHE A 157 1.478 9.968 -13.389 1.00 0.00 O ATOM 2425 CB PHE A 157 1.904 6.679 -14.042 1.00 0.00 C ATOM 2426 CG PHE A 157 0.512 6.222 -13.708 1.00 0.00 C ATOM 2427 CD1 PHE A 157 0.300 5.256 -12.739 1.00 0.00 C ATOM 2428 CD2 PHE A 157 -0.583 6.760 -14.365 1.00 0.00 C ATOM 2429 CE1 PHE A 157 -0.980 4.834 -12.430 1.00 0.00 C ATOM 2430 CE2 PHE A 157 -1.865 6.342 -14.060 1.00 0.00 C ATOM 2431 CZ PHE A 157 -2.063 5.377 -13.092 1.00 0.00 C ATOM 0 H PHE A 157 2.346 6.353 -11.577 1.00 0.00 H new ATOM 0 HA PHE A 157 3.295 8.249 -13.571 1.00 0.00 H new ATOM 0 HB2 PHE A 157 1.922 7.044 -15.069 1.00 0.00 H new ATOM 0 HB3 PHE A 157 2.579 5.825 -13.996 1.00 0.00 H new ATOM 0 HD1 PHE A 157 1.144 4.827 -12.219 1.00 0.00 H new ATOM 0 HD2 PHE A 157 -0.433 7.514 -15.124 1.00 0.00 H new ATOM 0 HE1 PHE A 157 -1.132 4.080 -11.672 1.00 0.00 H new ATOM 0 HE2 PHE A 157 -2.711 6.770 -14.578 1.00 0.00 H new ATOM 0 HZ PHE A 157 -3.063 5.048 -12.853 1.00 0.00 H new ATOM 2441 N SER A 158 0.288 8.474 -12.200 1.00 0.00 N ATOM 2442 CA SER A 158 -0.813 9.394 -11.938 1.00 0.00 C ATOM 2443 C SER A 158 -1.282 10.061 -13.228 1.00 0.00 C ATOM 2444 O SER A 158 -1.801 11.175 -13.208 1.00 0.00 O ATOM 2445 CB SER A 158 -0.386 10.458 -10.926 1.00 0.00 C ATOM 2446 OG SER A 158 0.587 11.327 -11.480 1.00 0.00 O ATOM 0 H SER A 158 0.167 7.546 -11.795 1.00 0.00 H new ATOM 0 HA SER A 158 -1.642 8.821 -11.524 1.00 0.00 H new ATOM 0 HB2 SER A 158 -1.256 11.034 -10.611 1.00 0.00 H new ATOM 0 HB3 SER A 158 0.017 9.976 -10.035 1.00 0.00 H new ATOM 0 HG SER A 158 0.769 11.066 -12.407 1.00 0.00 H new