USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1104 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 63 CYS SG : rot -63:sc= -1.88 USER MOD Set 1.2: A 68 LYS NZ :NH3+ -109:sc= -3.42! (180deg=-7.97!) USER MOD Set 2.1: A 58 LYS NZ :NH3+ -124:sc= -1.56 (180deg=-3.19!) USER MOD Set 2.2: A 61 GLN : amide:sc= -0.0889 K(o=-1.7,f=-4.8) USER MOD Set 3.1: A 10 MET CE :methyl -118:sc= -1.64! (180deg=-2.57) USER MOD Set 3.2: A 51 HIS : no HD1:sc= -0.203 K(o=-1.8,f=-2.4) USER MOD Set 4.1: A 24 ASN : amide:sc= -0.0183 K(o=0.045,f=-0.55) USER MOD Set 4.2: A 64 LYS NZ :NH3+ -169:sc= 0.063 (180deg=0) USER MOD Set 5.1: A 22 SER OG : rot 180:sc= 0.0166 USER MOD Set 5.2: A 34 LYS NZ :NH3+ -125:sc= -3.58 (180deg=-4.88!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 75:sc= 0.528 USER MOD Single : A 17 ASN : amide:sc= -1.69 K(o=-1.7,f=-0.47) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -149:sc=-0.00544 (180deg=-0.869) USER MOD Single : A 35 MET CE :methyl 179:sc= -2.45 (180deg=-2.46) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.398 X(o=-0.4,f=0) USER MOD Single : A 39 THR OG1 : rot 84:sc= 0.169 USER MOD Single : A 40 LYS NZ :NH3+ 169:sc=-0.00533 (180deg=-0.149) USER MOD Single : A 44 LYS NZ :NH3+ -163:sc= -0.0291 (180deg=-0.261) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 30:sc=-0.00377 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot -6:sc= 1.12 USER MOD Single : A 73 TYR OH : rot 180:sc= -0.966 USER MOD Single : A 77 SER OG : rot 75:sc= 0.092 USER MOD Single : A 81 GLN : amide:sc= -2.35 K(o=-2.4,f=-0.94) USER MOD Single : A 82 SER OG : rot 115:sc= 1.14 USER MOD Single : A 84 HIS : no HD1:sc= -1.03 K(o=-1,f=-0.17) USER MOD Single : A 85 GLN : amide:sc= -4.79! C(o=-4.8!,f=-3.1!) USER MOD Single : A 98 SER OG : rot -14:sc= 0.22 USER MOD Single : A 99 ASN : amide:sc= -1.06 K(o=-1.1,f=-1.6) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 160:sc= -0.195 USER MOD Single : A 106 GLN : amide:sc= -0.327 K(o=-0.33,f=-1.4) USER MOD Single : A 107 ASN : amide:sc= -0.521 K(o=-0.52,f=-1.5) USER MOD Single : A 109 TYR OH : rot -148:sc= 1.07 USER MOD Single : A 111 CYS SG : rot -65:sc= 1.15 USER MOD Single : A 116 LYS NZ :NH3+ -136:sc= 0.871 (180deg=-1.35!) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -129:sc= -0.109 (180deg=-0.612) USER MOD Single : A 124 ASN : amide:sc= 0.281 X(o=0.28,f=0) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=-0.0081) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 ASN : amide:sc= 0.207 X(o=0.21,f=0) USER MOD Single : A 130 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= 0.395 K(o=0.39,f=-0.22) USER MOD Single : A 143 MET CE :methyl -161:sc= -3.44 (180deg=-5.82) USER MOD ----------------------------------------------------------------- ATOM 92 N MET A 10 -17.077 11.729 2.393 1.00 0.00 N ATOM 93 CA MET A 10 -15.895 11.006 1.937 1.00 0.00 C ATOM 94 C MET A 10 -16.290 9.763 1.147 1.00 0.00 C ATOM 95 O MET A 10 -15.966 8.641 1.535 1.00 0.00 O ATOM 96 CB MET A 10 -15.021 10.611 3.129 1.00 0.00 C ATOM 97 CG MET A 10 -14.491 11.799 3.915 1.00 0.00 C ATOM 98 SD MET A 10 -13.458 11.306 5.307 1.00 0.00 S ATOM 99 CE MET A 10 -12.013 10.682 4.453 1.00 0.00 C ATOM 0 HA MET A 10 -15.326 11.666 1.282 1.00 0.00 H new ATOM 0 HB2 MET A 10 -15.599 9.973 3.797 1.00 0.00 H new ATOM 0 HB3 MET A 10 -14.179 10.018 2.771 1.00 0.00 H new ATOM 0 HG2 MET A 10 -13.915 12.442 3.250 1.00 0.00 H new ATOM 0 HG3 MET A 10 -15.330 12.390 4.282 1.00 0.00 H new ATOM 0 HE1 MET A 10 -11.882 9.625 4.684 1.00 0.00 H new ATOM 0 HE2 MET A 10 -12.144 10.805 3.378 1.00 0.00 H new ATOM 0 HE3 MET A 10 -11.132 11.236 4.777 1.00 0.00 H new ATOM 109 N GLU A 11 -16.992 9.970 0.037 1.00 0.00 N ATOM 110 CA GLU A 11 -17.432 8.865 -0.806 1.00 0.00 C ATOM 111 C GLU A 11 -16.271 8.313 -1.628 1.00 0.00 C ATOM 112 O GLU A 11 -16.130 7.101 -1.788 1.00 0.00 O ATOM 113 CB GLU A 11 -18.559 9.320 -1.735 1.00 0.00 C ATOM 114 CG GLU A 11 -19.074 8.222 -2.650 1.00 0.00 C ATOM 115 CD GLU A 11 -19.796 8.767 -3.867 1.00 0.00 C ATOM 116 OE1 GLU A 11 -19.112 9.134 -4.846 1.00 0.00 O ATOM 117 OE2 GLU A 11 -21.043 8.826 -3.841 1.00 0.00 O ATOM 0 H GLU A 11 -17.268 10.893 -0.299 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.805 8.072 -0.157 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -19.386 9.697 -1.132 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -18.203 10.152 -2.344 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.238 7.603 -2.975 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.750 7.575 -2.091 1.00 0.00 H new ATOM 124 N ALA A 12 -15.442 9.212 -2.148 1.00 0.00 N ATOM 125 CA ALA A 12 -14.293 8.817 -2.953 1.00 0.00 C ATOM 126 C ALA A 12 -13.403 7.838 -2.195 1.00 0.00 C ATOM 127 O ALA A 12 -12.999 6.806 -2.732 1.00 0.00 O ATOM 128 CB ALA A 12 -13.495 10.043 -3.372 1.00 0.00 C ATOM 0 H ALA A 12 -15.545 10.219 -2.026 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.662 8.315 -3.847 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.640 9.733 -3.973 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.129 10.707 -3.959 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.143 10.569 -2.484 1.00 0.00 H new ATOM 134 N VAL A 13 -13.099 8.168 -0.943 1.00 0.00 N ATOM 135 CA VAL A 13 -12.256 7.318 -0.111 1.00 0.00 C ATOM 136 C VAL A 13 -12.860 5.926 0.040 1.00 0.00 C ATOM 137 O VAL A 13 -12.322 4.945 -0.474 1.00 0.00 O ATOM 138 CB VAL A 13 -12.049 7.930 1.287 1.00 0.00 C ATOM 139 CG1 VAL A 13 -11.302 6.959 2.189 1.00 0.00 C ATOM 140 CG2 VAL A 13 -11.306 9.253 1.184 1.00 0.00 C ATOM 0 H VAL A 13 -13.424 9.018 -0.483 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.291 7.240 -0.612 1.00 0.00 H new ATOM 0 HB VAL A 13 -13.027 8.122 1.730 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -11.165 7.408 3.173 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -11.877 6.038 2.288 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.328 6.734 1.754 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -11.168 9.672 2.181 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.333 9.089 0.722 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -11.884 9.948 0.575 1.00 0.00 H new ATOM 150 N LYS A 14 -13.981 5.847 0.748 1.00 0.00 N ATOM 151 CA LYS A 14 -14.660 4.575 0.967 1.00 0.00 C ATOM 152 C LYS A 14 -14.512 3.664 -0.247 1.00 0.00 C ATOM 153 O LYS A 14 -14.262 2.466 -0.111 1.00 0.00 O ATOM 154 CB LYS A 14 -16.143 4.810 1.264 1.00 0.00 C ATOM 155 CG LYS A 14 -16.388 5.684 2.481 1.00 0.00 C ATOM 156 CD LYS A 14 -17.718 6.413 2.386 1.00 0.00 C ATOM 157 CE LYS A 14 -17.811 7.539 3.404 1.00 0.00 C ATOM 158 NZ LYS A 14 -18.352 7.064 4.708 1.00 0.00 N ATOM 0 H LYS A 14 -14.439 6.649 1.180 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.197 4.087 1.824 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -16.610 5.273 0.395 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.632 3.847 1.414 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.373 5.069 3.381 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.580 6.410 2.577 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -17.841 6.818 1.382 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -18.533 5.707 2.547 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.823 7.973 3.557 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -18.450 8.331 3.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -18.400 7.861 5.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -19.305 6.673 4.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -17.729 6.326 5.094 1.00 0.00 H new ATOM 172 N THR A 15 -14.668 4.239 -1.436 1.00 0.00 N ATOM 173 CA THR A 15 -14.551 3.478 -2.674 1.00 0.00 C ATOM 174 C THR A 15 -13.169 2.848 -2.804 1.00 0.00 C ATOM 175 O THR A 15 -13.044 1.653 -3.073 1.00 0.00 O ATOM 176 CB THR A 15 -14.816 4.365 -3.905 1.00 0.00 C ATOM 177 OG1 THR A 15 -16.129 4.932 -3.827 1.00 0.00 O ATOM 178 CG2 THR A 15 -14.682 3.562 -5.190 1.00 0.00 C ATOM 0 H THR A 15 -14.876 5.229 -1.567 1.00 0.00 H new ATOM 0 HA THR A 15 -15.304 2.691 -2.633 1.00 0.00 H new ATOM 0 HB THR A 15 -14.075 5.164 -3.915 1.00 0.00 H new ATOM 0 HG1 THR A 15 -16.134 5.657 -3.167 1.00 0.00 H new ATOM 0 HG21 THR A 15 -14.874 4.210 -6.045 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.673 3.155 -5.261 1.00 0.00 H new ATOM 0 HG23 THR A 15 -15.403 2.745 -5.185 1.00 0.00 H new ATOM 186 N PHE A 16 -12.134 3.658 -2.611 1.00 0.00 N ATOM 187 CA PHE A 16 -10.760 3.180 -2.707 1.00 0.00 C ATOM 188 C PHE A 16 -10.441 2.210 -1.572 1.00 0.00 C ATOM 189 O PHE A 16 -9.711 1.238 -1.759 1.00 0.00 O ATOM 190 CB PHE A 16 -9.784 4.357 -2.676 1.00 0.00 C ATOM 191 CG PHE A 16 -8.346 3.941 -2.549 1.00 0.00 C ATOM 192 CD1 PHE A 16 -7.805 3.637 -1.311 1.00 0.00 C ATOM 193 CD2 PHE A 16 -7.535 3.855 -3.670 1.00 0.00 C ATOM 194 CE1 PHE A 16 -6.483 3.253 -1.191 1.00 0.00 C ATOM 195 CE2 PHE A 16 -6.212 3.471 -3.556 1.00 0.00 C ATOM 196 CZ PHE A 16 -5.685 3.171 -2.315 1.00 0.00 C ATOM 0 H PHE A 16 -12.221 4.649 -2.387 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.651 2.652 -3.654 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.905 4.943 -3.587 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -10.040 5.009 -1.841 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -8.424 3.701 -0.428 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -7.941 4.090 -4.643 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -6.074 3.017 -0.219 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.591 3.406 -4.437 1.00 0.00 H new ATOM 0 HZ PHE A 16 -4.651 2.873 -2.224 1.00 0.00 H new ATOM 206 N ASN A 17 -10.994 2.484 -0.395 1.00 0.00 N ATOM 207 CA ASN A 17 -10.769 1.637 0.771 1.00 0.00 C ATOM 208 C ASN A 17 -11.186 0.197 0.486 1.00 0.00 C ATOM 209 O ASN A 17 -10.774 -0.729 1.185 1.00 0.00 O ATOM 210 CB ASN A 17 -11.543 2.176 1.976 1.00 0.00 C ATOM 211 CG ASN A 17 -10.721 3.142 2.806 1.00 0.00 C ATOM 212 OD1 ASN A 17 -10.507 2.927 3.999 1.00 0.00 O ATOM 213 ND2 ASN A 17 -10.256 4.215 2.177 1.00 0.00 N ATOM 0 H ASN A 17 -11.601 3.286 -0.223 1.00 0.00 H new ATOM 0 HA ASN A 17 -9.703 1.649 0.998 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -12.447 2.677 1.629 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -11.861 1.343 2.602 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.697 4.901 2.684 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -10.458 4.353 1.187 1.00 0.00 H new ATOM 220 N SER A 18 -12.005 0.017 -0.544 1.00 0.00 N ATOM 221 CA SER A 18 -12.481 -1.309 -0.920 1.00 0.00 C ATOM 222 C SER A 18 -11.566 -1.939 -1.966 1.00 0.00 C ATOM 223 O SER A 18 -11.257 -3.128 -1.900 1.00 0.00 O ATOM 224 CB SER A 18 -13.910 -1.228 -1.459 1.00 0.00 C ATOM 225 OG SER A 18 -14.846 -1.082 -0.404 1.00 0.00 O ATOM 0 H SER A 18 -12.353 0.773 -1.134 1.00 0.00 H new ATOM 0 HA SER A 18 -12.472 -1.937 -0.029 1.00 0.00 H new ATOM 0 HB2 SER A 18 -13.996 -0.385 -2.145 1.00 0.00 H new ATOM 0 HB3 SER A 18 -14.138 -2.128 -2.030 1.00 0.00 H new ATOM 0 HG SER A 18 -15.752 -1.031 -0.775 1.00 0.00 H new ATOM 231 N GLU A 19 -11.137 -1.131 -2.931 1.00 0.00 N ATOM 232 CA GLU A 19 -10.258 -1.609 -3.991 1.00 0.00 C ATOM 233 C GLU A 19 -8.864 -1.912 -3.448 1.00 0.00 C ATOM 234 O GLU A 19 -8.229 -2.889 -3.847 1.00 0.00 O ATOM 235 CB GLU A 19 -10.166 -0.572 -5.113 1.00 0.00 C ATOM 236 CG GLU A 19 -11.513 -0.015 -5.539 1.00 0.00 C ATOM 237 CD GLU A 19 -12.409 -1.067 -6.163 1.00 0.00 C ATOM 238 OE1 GLU A 19 -11.901 -1.875 -6.969 1.00 0.00 O ATOM 239 OE2 GLU A 19 -13.617 -1.083 -5.846 1.00 0.00 O ATOM 0 H GLU A 19 -11.384 -0.144 -3.000 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.681 -2.531 -4.391 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.530 0.250 -4.785 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -9.680 -1.026 -5.977 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -12.014 0.416 -4.672 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -11.358 0.794 -6.253 1.00 0.00 H new ATOM 246 N LEU A 20 -8.395 -1.067 -2.537 1.00 0.00 N ATOM 247 CA LEU A 20 -7.076 -1.244 -1.938 1.00 0.00 C ATOM 248 C LEU A 20 -6.960 -2.609 -1.269 1.00 0.00 C ATOM 249 O LEU A 20 -6.048 -3.382 -1.566 1.00 0.00 O ATOM 250 CB LEU A 20 -6.806 -0.138 -0.916 1.00 0.00 C ATOM 251 CG LEU A 20 -5.406 -0.117 -0.303 1.00 0.00 C ATOM 252 CD1 LEU A 20 -5.252 -1.238 0.713 1.00 0.00 C ATOM 253 CD2 LEU A 20 -4.346 -0.230 -1.390 1.00 0.00 C ATOM 0 H LEU A 20 -8.907 -0.253 -2.197 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.333 -1.186 -2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -6.985 0.824 -1.396 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -7.533 -0.232 -0.109 1.00 0.00 H new ATOM 0 HG LEU A 20 -5.269 0.834 0.212 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -4.249 -1.208 1.139 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -5.988 -1.113 1.507 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.409 -2.198 0.222 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -3.355 -0.213 -0.935 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -4.480 -1.165 -1.933 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -4.442 0.608 -2.081 1.00 0.00 H new ATOM 265 N TYR A 21 -7.890 -2.901 -0.367 1.00 0.00 N ATOM 266 CA TYR A 21 -7.892 -4.174 0.345 1.00 0.00 C ATOM 267 C TYR A 21 -8.426 -5.294 -0.543 1.00 0.00 C ATOM 268 O TYR A 21 -8.038 -6.453 -0.400 1.00 0.00 O ATOM 269 CB TYR A 21 -8.736 -4.070 1.616 1.00 0.00 C ATOM 270 CG TYR A 21 -8.065 -3.293 2.726 1.00 0.00 C ATOM 271 CD1 TYR A 21 -8.087 -1.903 2.740 1.00 0.00 C ATOM 272 CD2 TYR A 21 -7.408 -3.947 3.761 1.00 0.00 C ATOM 273 CE1 TYR A 21 -7.475 -1.189 3.751 1.00 0.00 C ATOM 274 CE2 TYR A 21 -6.794 -3.241 4.777 1.00 0.00 C ATOM 275 CZ TYR A 21 -6.831 -1.862 4.768 1.00 0.00 C ATOM 276 OH TYR A 21 -6.219 -1.155 5.778 1.00 0.00 O ATOM 0 H TYR A 21 -8.652 -2.274 -0.111 1.00 0.00 H new ATOM 0 HA TYR A 21 -6.863 -4.410 0.618 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -9.686 -3.594 1.373 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -8.965 -5.074 1.973 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.592 -1.372 1.946 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -7.377 -5.027 3.771 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -7.500 -0.109 3.745 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.288 -3.766 5.574 1.00 0.00 H new ATOM 0 HH TYR A 21 -5.813 -1.779 6.415 1.00 0.00 H new ATOM 286 N SER A 22 -9.319 -4.937 -1.461 1.00 0.00 N ATOM 287 CA SER A 22 -9.910 -5.911 -2.372 1.00 0.00 C ATOM 288 C SER A 22 -8.842 -6.843 -2.938 1.00 0.00 C ATOM 289 O SER A 22 -9.141 -7.954 -3.379 1.00 0.00 O ATOM 290 CB SER A 22 -10.637 -5.198 -3.513 1.00 0.00 C ATOM 291 OG SER A 22 -10.796 -6.055 -4.631 1.00 0.00 O ATOM 0 H SER A 22 -9.649 -3.981 -1.594 1.00 0.00 H new ATOM 0 HA SER A 22 -10.628 -6.508 -1.810 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.614 -4.858 -3.170 1.00 0.00 H new ATOM 0 HB3 SER A 22 -10.076 -4.311 -3.808 1.00 0.00 H new ATOM 0 HG SER A 22 -11.265 -5.576 -5.346 1.00 0.00 H new ATOM 297 N LEU A 23 -7.596 -6.383 -2.922 1.00 0.00 N ATOM 298 CA LEU A 23 -6.482 -7.174 -3.434 1.00 0.00 C ATOM 299 C LEU A 23 -6.517 -8.591 -2.870 1.00 0.00 C ATOM 300 O LEU A 23 -6.113 -9.544 -3.535 1.00 0.00 O ATOM 301 CB LEU A 23 -5.152 -6.506 -3.081 1.00 0.00 C ATOM 302 CG LEU A 23 -4.682 -5.405 -4.033 1.00 0.00 C ATOM 303 CD1 LEU A 23 -3.324 -4.872 -3.603 1.00 0.00 C ATOM 304 CD2 LEU A 23 -4.625 -5.924 -5.462 1.00 0.00 C ATOM 0 H LEU A 23 -7.331 -5.467 -2.560 1.00 0.00 H new ATOM 0 HA LEU A 23 -6.577 -7.231 -4.518 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.235 -6.083 -2.080 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.381 -7.276 -3.039 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.400 -4.586 -3.994 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.005 -4.090 -4.292 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.397 -4.461 -2.596 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.595 -5.683 -3.613 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.289 -5.127 -6.125 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.929 -6.761 -5.518 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.617 -6.257 -5.768 1.00 0.00 H new ATOM 316 N ASN A 24 -7.005 -8.722 -1.641 1.00 0.00 N ATOM 317 CA ASN A 24 -7.094 -10.024 -0.988 1.00 0.00 C ATOM 318 C ASN A 24 -7.808 -11.033 -1.883 1.00 0.00 C ATOM 319 O ASN A 24 -7.482 -12.220 -1.880 1.00 0.00 O ATOM 320 CB ASN A 24 -7.830 -9.898 0.347 1.00 0.00 C ATOM 321 CG ASN A 24 -6.896 -9.566 1.494 1.00 0.00 C ATOM 322 OD1 ASN A 24 -6.795 -10.317 2.465 1.00 0.00 O ATOM 323 ND2 ASN A 24 -6.206 -8.437 1.386 1.00 0.00 N ATOM 0 H ASN A 24 -7.345 -7.943 -1.077 1.00 0.00 H new ATOM 0 HA ASN A 24 -6.081 -10.382 -0.804 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.592 -9.123 0.267 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -8.348 -10.833 0.563 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.560 -8.161 2.126 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -6.322 -7.845 0.563 1.00 0.00 H new ATOM 330 N ASP A 25 -8.781 -10.552 -2.648 1.00 0.00 N ATOM 331 CA ASP A 25 -9.541 -11.411 -3.549 1.00 0.00 C ATOM 332 C ASP A 25 -8.636 -12.006 -4.624 1.00 0.00 C ATOM 333 O ASP A 25 -8.819 -13.150 -5.040 1.00 0.00 O ATOM 334 CB ASP A 25 -10.678 -10.623 -4.202 1.00 0.00 C ATOM 335 CG ASP A 25 -11.750 -10.224 -3.208 1.00 0.00 C ATOM 336 OD1 ASP A 25 -11.402 -9.934 -2.043 1.00 0.00 O ATOM 337 OD2 ASP A 25 -12.937 -10.200 -3.594 1.00 0.00 O ATOM 0 H ASP A 25 -9.062 -9.572 -2.663 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.964 -12.226 -2.963 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -10.272 -9.728 -4.673 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -11.126 -11.225 -4.993 1.00 0.00 H new ATOM 342 N TYR A 26 -7.660 -11.222 -5.068 1.00 0.00 N ATOM 343 CA TYR A 26 -6.728 -11.670 -6.097 1.00 0.00 C ATOM 344 C TYR A 26 -5.366 -11.996 -5.493 1.00 0.00 C ATOM 345 O TYR A 26 -4.878 -11.288 -4.612 1.00 0.00 O ATOM 346 CB TYR A 26 -6.576 -10.599 -7.178 1.00 0.00 C ATOM 347 CG TYR A 26 -7.876 -9.919 -7.544 1.00 0.00 C ATOM 348 CD1 TYR A 26 -8.410 -8.919 -6.740 1.00 0.00 C ATOM 349 CD2 TYR A 26 -8.570 -10.276 -8.693 1.00 0.00 C ATOM 350 CE1 TYR A 26 -9.597 -8.295 -7.070 1.00 0.00 C ATOM 351 CE2 TYR A 26 -9.758 -9.657 -9.032 1.00 0.00 C ATOM 352 CZ TYR A 26 -10.267 -8.667 -8.217 1.00 0.00 C ATOM 353 OH TYR A 26 -11.450 -8.048 -8.550 1.00 0.00 O ATOM 0 H TYR A 26 -7.493 -10.273 -4.732 1.00 0.00 H new ATOM 0 HA TYR A 26 -7.132 -12.577 -6.548 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.866 -9.846 -6.835 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -6.150 -11.055 -8.072 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -7.888 -8.625 -5.842 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -8.174 -11.051 -9.333 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.998 -7.520 -6.434 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -10.285 -9.946 -9.929 1.00 0.00 H new ATOM 0 HH TYR A 26 -11.792 -8.426 -9.387 1.00 0.00 H new ATOM 363 N LYS A 27 -4.755 -13.074 -5.974 1.00 0.00 N ATOM 364 CA LYS A 27 -3.448 -13.496 -5.485 1.00 0.00 C ATOM 365 C LYS A 27 -2.352 -13.132 -6.482 1.00 0.00 C ATOM 366 O LYS A 27 -2.494 -13.312 -7.691 1.00 0.00 O ATOM 367 CB LYS A 27 -3.439 -15.004 -5.229 1.00 0.00 C ATOM 368 CG LYS A 27 -4.558 -15.472 -4.315 1.00 0.00 C ATOM 369 CD LYS A 27 -5.801 -15.849 -5.103 1.00 0.00 C ATOM 370 CE LYS A 27 -5.787 -17.319 -5.496 1.00 0.00 C ATOM 371 NZ LYS A 27 -7.075 -17.739 -6.116 1.00 0.00 N ATOM 0 H LYS A 27 -5.145 -13.672 -6.703 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.252 -12.974 -4.548 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -3.517 -15.526 -6.182 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.481 -15.284 -4.790 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.220 -16.330 -3.735 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -4.802 -14.683 -3.604 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -6.689 -15.639 -4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -5.866 -15.232 -5.999 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -4.971 -17.500 -6.195 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -5.592 -17.929 -4.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.026 -18.746 -6.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -7.851 -17.590 -5.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -7.249 -17.174 -6.972 1.00 0.00 H new ATOM 385 N PRO A 28 -1.230 -12.610 -5.964 1.00 0.00 N ATOM 386 CA PRO A 28 -0.086 -12.213 -6.791 1.00 0.00 C ATOM 387 C PRO A 28 0.303 -13.291 -7.797 1.00 0.00 C ATOM 388 O PRO A 28 0.384 -14.476 -7.474 1.00 0.00 O ATOM 389 CB PRO A 28 1.034 -12.004 -5.770 1.00 0.00 C ATOM 390 CG PRO A 28 0.332 -11.666 -4.501 1.00 0.00 C ATOM 391 CD PRO A 28 -0.991 -12.368 -4.531 1.00 0.00 C ATOM 0 HA PRO A 28 -0.303 -11.330 -7.391 1.00 0.00 H new ATOM 0 HB2 PRO A 28 1.641 -12.902 -5.659 1.00 0.00 H new ATOM 0 HB3 PRO A 28 1.705 -11.202 -6.077 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.918 -11.985 -3.639 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.195 -10.588 -4.412 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.961 -13.301 -3.968 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.779 -11.755 -4.092 1.00 0.00 H new ATOM 399 N PRO A 29 0.552 -12.872 -9.047 1.00 0.00 N ATOM 400 CA PRO A 29 0.459 -11.464 -9.444 1.00 0.00 C ATOM 401 C PRO A 29 -0.980 -10.960 -9.457 1.00 0.00 C ATOM 402 O PRO A 29 -1.925 -11.748 -9.409 1.00 0.00 O ATOM 403 CB PRO A 29 1.041 -11.455 -10.860 1.00 0.00 C ATOM 404 CG PRO A 29 0.825 -12.840 -11.367 1.00 0.00 C ATOM 405 CD PRO A 29 0.943 -13.742 -10.170 1.00 0.00 C ATOM 0 HA PRO A 29 0.984 -10.809 -8.749 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.539 -10.720 -11.490 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.100 -11.197 -10.851 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -0.156 -12.936 -11.833 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.565 -13.098 -12.125 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.287 -14.609 -10.254 1.00 0.00 H new ATOM 0 HD3 PRO A 29 1.958 -14.120 -10.051 1.00 0.00 H new ATOM 413 N ILE A 30 -1.140 -9.642 -9.521 1.00 0.00 N ATOM 414 CA ILE A 30 -2.464 -9.034 -9.542 1.00 0.00 C ATOM 415 C ILE A 30 -2.856 -8.619 -10.956 1.00 0.00 C ATOM 416 O ILE A 30 -2.081 -7.976 -11.663 1.00 0.00 O ATOM 417 CB ILE A 30 -2.532 -7.802 -8.620 1.00 0.00 C ATOM 418 CG1 ILE A 30 -2.200 -8.196 -7.180 1.00 0.00 C ATOM 419 CG2 ILE A 30 -3.909 -7.159 -8.695 1.00 0.00 C ATOM 420 CD1 ILE A 30 -3.194 -9.162 -6.573 1.00 0.00 C ATOM 0 H ILE A 30 -0.369 -8.975 -9.559 1.00 0.00 H new ATOM 0 HA ILE A 30 -3.163 -9.788 -9.180 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.794 -7.074 -8.957 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.207 -8.645 -7.155 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -2.159 -7.296 -6.566 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.941 -6.290 -8.038 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.109 -6.847 -9.720 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -4.664 -7.879 -8.381 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -2.895 -9.397 -5.551 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.185 -8.708 -6.566 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.219 -10.078 -7.164 1.00 0.00 H new ATOM 432 N SER A 31 -4.067 -8.990 -11.361 1.00 0.00 N ATOM 433 CA SER A 31 -4.563 -8.658 -12.691 1.00 0.00 C ATOM 434 C SER A 31 -4.310 -7.188 -13.014 1.00 0.00 C ATOM 435 O SER A 31 -4.732 -6.297 -12.277 1.00 0.00 O ATOM 436 CB SER A 31 -6.058 -8.965 -12.793 1.00 0.00 C ATOM 437 OG SER A 31 -6.418 -9.315 -14.118 1.00 0.00 O ATOM 0 H SER A 31 -4.722 -9.521 -10.787 1.00 0.00 H new ATOM 0 HA SER A 31 -4.024 -9.269 -13.415 1.00 0.00 H new ATOM 0 HB2 SER A 31 -6.312 -9.781 -12.116 1.00 0.00 H new ATOM 0 HB3 SER A 31 -6.633 -8.096 -12.474 1.00 0.00 H new ATOM 0 HG SER A 31 -7.378 -9.508 -14.156 1.00 0.00 H new ATOM 443 N LYS A 32 -3.619 -6.943 -14.122 1.00 0.00 N ATOM 444 CA LYS A 32 -3.310 -5.582 -14.546 1.00 0.00 C ATOM 445 C LYS A 32 -4.518 -4.669 -14.367 1.00 0.00 C ATOM 446 O LYS A 32 -4.394 -3.552 -13.866 1.00 0.00 O ATOM 447 CB LYS A 32 -2.862 -5.572 -16.009 1.00 0.00 C ATOM 448 CG LYS A 32 -2.513 -4.187 -16.528 1.00 0.00 C ATOM 449 CD LYS A 32 -2.018 -4.239 -17.964 1.00 0.00 C ATOM 450 CE LYS A 32 -3.172 -4.178 -18.954 1.00 0.00 C ATOM 451 NZ LYS A 32 -3.691 -5.534 -19.285 1.00 0.00 N ATOM 0 H LYS A 32 -3.262 -7.669 -14.743 1.00 0.00 H new ATOM 0 HA LYS A 32 -2.499 -5.208 -13.921 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -1.994 -6.222 -16.119 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -3.656 -5.993 -16.626 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -3.390 -3.543 -16.467 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -1.746 -3.742 -15.894 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -1.337 -3.407 -18.146 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -1.450 -5.156 -18.121 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -3.977 -3.573 -18.537 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.841 -3.683 -19.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -4.054 -5.538 -20.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.923 -6.230 -19.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -4.459 -5.782 -18.629 1.00 0.00 H new ATOM 465 N ALA A 33 -5.686 -5.152 -14.777 1.00 0.00 N ATOM 466 CA ALA A 33 -6.917 -4.380 -14.658 1.00 0.00 C ATOM 467 C ALA A 33 -7.150 -3.937 -13.218 1.00 0.00 C ATOM 468 O ALA A 33 -7.611 -2.824 -12.967 1.00 0.00 O ATOM 469 CB ALA A 33 -8.100 -5.194 -15.161 1.00 0.00 C ATOM 0 H ALA A 33 -5.806 -6.075 -15.195 1.00 0.00 H new ATOM 0 HA ALA A 33 -6.818 -3.486 -15.273 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.013 -4.606 -15.067 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -7.943 -5.455 -16.208 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -8.193 -6.105 -14.570 1.00 0.00 H new ATOM 475 N LYS A 34 -6.829 -4.816 -12.274 1.00 0.00 N ATOM 476 CA LYS A 34 -7.002 -4.516 -10.858 1.00 0.00 C ATOM 477 C LYS A 34 -6.248 -3.247 -10.474 1.00 0.00 C ATOM 478 O LYS A 34 -6.851 -2.257 -10.062 1.00 0.00 O ATOM 479 CB LYS A 34 -6.515 -5.689 -10.004 1.00 0.00 C ATOM 480 CG LYS A 34 -6.618 -5.437 -8.510 1.00 0.00 C ATOM 481 CD LYS A 34 -8.065 -5.383 -8.051 1.00 0.00 C ATOM 482 CE LYS A 34 -8.222 -4.536 -6.797 1.00 0.00 C ATOM 483 NZ LYS A 34 -7.835 -5.286 -5.570 1.00 0.00 N ATOM 0 H LYS A 34 -6.447 -5.742 -12.465 1.00 0.00 H new ATOM 0 HA LYS A 34 -8.064 -4.356 -10.674 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.096 -6.576 -10.255 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -5.477 -5.905 -10.257 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.094 -6.226 -7.970 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.122 -4.498 -8.264 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.685 -4.973 -8.848 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.424 -6.394 -7.856 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.607 -3.640 -6.884 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -9.257 -4.205 -6.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -8.622 -5.269 -4.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.615 -6.271 -5.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.998 -4.842 -5.142 1.00 0.00 H new ATOM 497 N MET A 35 -4.927 -3.284 -10.614 1.00 0.00 N ATOM 498 CA MET A 35 -4.092 -2.135 -10.284 1.00 0.00 C ATOM 499 C MET A 35 -4.705 -0.845 -10.820 1.00 0.00 C ATOM 500 O MET A 35 -4.545 0.224 -10.230 1.00 0.00 O ATOM 501 CB MET A 35 -2.684 -2.320 -10.855 1.00 0.00 C ATOM 502 CG MET A 35 -1.798 -3.217 -10.006 1.00 0.00 C ATOM 503 SD MET A 35 -1.270 -2.425 -8.475 1.00 0.00 S ATOM 504 CE MET A 35 -0.868 -3.855 -7.475 1.00 0.00 C ATOM 0 H MET A 35 -4.412 -4.096 -10.953 1.00 0.00 H new ATOM 0 HA MET A 35 -4.030 -2.063 -9.198 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.760 -2.741 -11.857 1.00 0.00 H new ATOM 0 HB3 MET A 35 -2.210 -1.344 -10.955 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.337 -4.134 -9.769 1.00 0.00 H new ATOM 0 HG3 MET A 35 -0.919 -3.504 -10.583 1.00 0.00 H new ATOM 0 HE1 MET A 35 -0.507 -3.527 -6.500 1.00 0.00 H new ATOM 0 HE2 MET A 35 -1.759 -4.470 -7.345 1.00 0.00 H new ATOM 0 HE3 MET A 35 -0.093 -4.439 -7.971 1.00 0.00 H new ATOM 514 N THR A 36 -5.408 -0.951 -11.944 1.00 0.00 N ATOM 515 CA THR A 36 -6.043 0.206 -12.560 1.00 0.00 C ATOM 516 C THR A 36 -7.299 0.615 -11.798 1.00 0.00 C ATOM 517 O THR A 36 -7.549 1.801 -11.589 1.00 0.00 O ATOM 518 CB THR A 36 -6.416 -0.073 -14.029 1.00 0.00 C ATOM 519 OG1 THR A 36 -5.230 -0.288 -14.802 1.00 0.00 O ATOM 520 CG2 THR A 36 -7.208 1.086 -14.616 1.00 0.00 C ATOM 0 H THR A 36 -5.551 -1.827 -12.446 1.00 0.00 H new ATOM 0 HA THR A 36 -5.319 1.020 -12.525 1.00 0.00 H new ATOM 0 HB THR A 36 -7.037 -0.968 -14.060 1.00 0.00 H new ATOM 0 HG1 THR A 36 -5.475 -0.466 -15.734 1.00 0.00 H new ATOM 0 HG21 THR A 36 -7.460 0.866 -15.653 1.00 0.00 H new ATOM 0 HG22 THR A 36 -8.124 1.228 -14.043 1.00 0.00 H new ATOM 0 HG23 THR A 36 -6.608 1.995 -14.573 1.00 0.00 H new ATOM 528 N GLN A 37 -8.084 -0.376 -11.386 1.00 0.00 N ATOM 529 CA GLN A 37 -9.314 -0.117 -10.647 1.00 0.00 C ATOM 530 C GLN A 37 -9.024 0.639 -9.355 1.00 0.00 C ATOM 531 O GLN A 37 -9.764 1.548 -8.977 1.00 0.00 O ATOM 532 CB GLN A 37 -10.030 -1.432 -10.333 1.00 0.00 C ATOM 533 CG GLN A 37 -10.421 -2.223 -11.571 1.00 0.00 C ATOM 534 CD GLN A 37 -11.750 -1.782 -12.150 1.00 0.00 C ATOM 535 OE1 GLN A 37 -12.759 -2.476 -12.020 1.00 0.00 O ATOM 536 NE2 GLN A 37 -11.759 -0.621 -12.795 1.00 0.00 N ATOM 0 H GLN A 37 -7.890 -1.364 -11.551 1.00 0.00 H new ATOM 0 HA GLN A 37 -9.960 0.501 -11.270 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -9.383 -2.048 -9.708 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -10.926 -1.218 -9.751 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -9.645 -2.113 -12.328 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -10.472 -3.282 -11.319 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -10.900 -0.078 -12.879 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -12.625 -0.273 -13.206 1.00 0.00 H new ATOM 545 N ILE A 38 -7.944 0.257 -8.681 1.00 0.00 N ATOM 546 CA ILE A 38 -7.556 0.900 -7.432 1.00 0.00 C ATOM 547 C ILE A 38 -7.062 2.322 -7.676 1.00 0.00 C ATOM 548 O ILE A 38 -7.557 3.276 -7.075 1.00 0.00 O ATOM 549 CB ILE A 38 -6.457 0.103 -6.706 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.743 -1.397 -6.791 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.351 0.547 -5.255 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.847 -2.235 -5.906 1.00 0.00 C ATOM 0 H ILE A 38 -7.322 -0.495 -8.979 1.00 0.00 H new ATOM 0 HA ILE A 38 -8.446 0.930 -6.803 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.503 0.299 -7.196 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.782 -1.576 -6.516 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.626 -1.723 -7.825 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.570 -0.026 -4.755 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.104 1.608 -5.216 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.303 0.377 -4.752 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -6.107 -3.288 -6.018 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.807 -2.085 -6.195 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.981 -1.937 -4.866 1.00 0.00 H new ATOM 564 N THR A 39 -6.081 2.458 -8.564 1.00 0.00 N ATOM 565 CA THR A 39 -5.519 3.763 -8.888 1.00 0.00 C ATOM 566 C THR A 39 -6.617 4.766 -9.223 1.00 0.00 C ATOM 567 O THR A 39 -6.585 5.911 -8.771 1.00 0.00 O ATOM 568 CB THR A 39 -4.542 3.674 -10.075 1.00 0.00 C ATOM 569 OG1 THR A 39 -3.411 2.870 -9.719 1.00 0.00 O ATOM 570 CG2 THR A 39 -4.073 5.059 -10.495 1.00 0.00 C ATOM 0 H THR A 39 -5.660 1.680 -9.071 1.00 0.00 H new ATOM 0 HA THR A 39 -4.977 4.102 -8.005 1.00 0.00 H new ATOM 0 HB THR A 39 -5.065 3.215 -10.914 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.628 1.924 -9.851 1.00 0.00 H new ATOM 0 HG21 THR A 39 -3.384 4.971 -11.335 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.933 5.660 -10.793 1.00 0.00 H new ATOM 0 HG23 THR A 39 -3.566 5.541 -9.659 1.00 0.00 H new ATOM 578 N LYS A 40 -7.589 4.330 -10.017 1.00 0.00 N ATOM 579 CA LYS A 40 -8.699 5.189 -10.411 1.00 0.00 C ATOM 580 C LYS A 40 -9.459 5.692 -9.188 1.00 0.00 C ATOM 581 O LYS A 40 -9.836 6.861 -9.117 1.00 0.00 O ATOM 582 CB LYS A 40 -9.651 4.433 -11.341 1.00 0.00 C ATOM 583 CG LYS A 40 -9.069 4.162 -12.718 1.00 0.00 C ATOM 584 CD LYS A 40 -9.672 2.916 -13.344 1.00 0.00 C ATOM 585 CE LYS A 40 -11.176 3.057 -13.526 1.00 0.00 C ATOM 586 NZ LYS A 40 -11.520 4.160 -14.465 1.00 0.00 N ATOM 0 H LYS A 40 -7.630 3.386 -10.401 1.00 0.00 H new ATOM 0 HA LYS A 40 -8.289 6.049 -10.941 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.922 3.484 -10.877 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -10.571 5.008 -11.451 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.250 5.020 -13.366 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.988 4.044 -12.640 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.203 2.729 -14.310 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.460 2.052 -12.714 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.586 2.119 -13.901 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.643 3.244 -12.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.530 4.107 -14.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.320 5.075 -14.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.951 4.069 -15.331 1.00 0.00 H new ATOM 600 N ALA A 41 -9.680 4.801 -8.227 1.00 0.00 N ATOM 601 CA ALA A 41 -10.392 5.156 -7.006 1.00 0.00 C ATOM 602 C ALA A 41 -9.589 6.148 -6.171 1.00 0.00 C ATOM 603 O ALA A 41 -10.122 7.155 -5.705 1.00 0.00 O ATOM 604 CB ALA A 41 -10.699 3.907 -6.193 1.00 0.00 C ATOM 0 H ALA A 41 -9.376 3.828 -8.271 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.330 5.634 -7.287 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -11.231 4.186 -5.284 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.319 3.232 -6.783 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.767 3.407 -5.929 1.00 0.00 H new ATOM 610 N ALA A 42 -8.306 5.858 -5.987 1.00 0.00 N ATOM 611 CA ALA A 42 -7.430 6.726 -5.210 1.00 0.00 C ATOM 612 C ALA A 42 -7.394 8.134 -5.793 1.00 0.00 C ATOM 613 O ALA A 42 -7.813 9.094 -5.147 1.00 0.00 O ATOM 614 CB ALA A 42 -6.027 6.141 -5.149 1.00 0.00 C ATOM 0 H ALA A 42 -7.849 5.028 -6.366 1.00 0.00 H new ATOM 0 HA ALA A 42 -7.829 6.791 -4.198 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.383 6.799 -4.566 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -6.063 5.158 -4.679 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.628 6.045 -6.159 1.00 0.00 H new ATOM 620 N ILE A 43 -6.890 8.249 -7.017 1.00 0.00 N ATOM 621 CA ILE A 43 -6.800 9.540 -7.688 1.00 0.00 C ATOM 622 C ILE A 43 -8.119 10.300 -7.596 1.00 0.00 C ATOM 623 O ILE A 43 -8.140 11.531 -7.589 1.00 0.00 O ATOM 624 CB ILE A 43 -6.414 9.379 -9.170 1.00 0.00 C ATOM 625 CG1 ILE A 43 -5.052 8.693 -9.294 1.00 0.00 C ATOM 626 CG2 ILE A 43 -6.395 10.734 -9.862 1.00 0.00 C ATOM 627 CD1 ILE A 43 -3.884 9.612 -9.013 1.00 0.00 C ATOM 0 H ILE A 43 -6.538 7.464 -7.564 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.021 10.107 -7.179 1.00 0.00 H new ATOM 0 HB ILE A 43 -7.161 8.753 -9.659 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.015 7.850 -8.604 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.950 8.286 -10.300 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -6.120 10.604 -10.909 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.384 11.188 -9.800 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.667 11.382 -9.374 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.951 9.058 -9.120 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -3.896 10.442 -9.720 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.962 9.999 -7.997 1.00 0.00 H new ATOM 639 N LYS A 44 -9.219 9.558 -7.525 1.00 0.00 N ATOM 640 CA LYS A 44 -10.543 10.160 -7.431 1.00 0.00 C ATOM 641 C LYS A 44 -10.789 10.718 -6.033 1.00 0.00 C ATOM 642 O LYS A 44 -11.512 11.700 -5.865 1.00 0.00 O ATOM 643 CB LYS A 44 -11.620 9.130 -7.777 1.00 0.00 C ATOM 644 CG LYS A 44 -11.973 9.091 -9.254 1.00 0.00 C ATOM 645 CD LYS A 44 -13.034 10.121 -9.601 1.00 0.00 C ATOM 646 CE LYS A 44 -14.427 9.631 -9.237 1.00 0.00 C ATOM 647 NZ LYS A 44 -14.879 8.530 -10.132 1.00 0.00 N ATOM 0 H LYS A 44 -9.219 8.538 -7.531 1.00 0.00 H new ATOM 0 HA LYS A 44 -10.592 10.982 -8.145 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.279 8.142 -7.467 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.520 9.351 -7.203 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.078 9.275 -9.848 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.331 8.096 -9.517 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -12.825 11.052 -9.074 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.992 10.343 -10.667 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.431 9.284 -8.204 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.131 10.461 -9.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.910 8.418 -10.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -14.631 8.758 -11.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.412 7.643 -9.854 1.00 0.00 H new ATOM 661 N ALA A 45 -10.182 10.087 -5.034 1.00 0.00 N ATOM 662 CA ALA A 45 -10.333 10.522 -3.651 1.00 0.00 C ATOM 663 C ALA A 45 -9.192 11.447 -3.239 1.00 0.00 C ATOM 664 O ALA A 45 -8.990 11.708 -2.053 1.00 0.00 O ATOM 665 CB ALA A 45 -10.401 9.319 -2.723 1.00 0.00 C ATOM 0 H ALA A 45 -9.581 9.272 -5.156 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.266 11.080 -3.572 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.514 9.659 -1.694 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.254 8.697 -2.995 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.484 8.737 -2.814 1.00 0.00 H new ATOM 671 N ILE A 46 -8.449 11.937 -4.225 1.00 0.00 N ATOM 672 CA ILE A 46 -7.329 12.833 -3.965 1.00 0.00 C ATOM 673 C ILE A 46 -7.700 13.891 -2.931 1.00 0.00 C ATOM 674 O ILE A 46 -6.929 14.178 -2.015 1.00 0.00 O ATOM 675 CB ILE A 46 -6.855 13.532 -5.252 1.00 0.00 C ATOM 676 CG1 ILE A 46 -5.395 13.968 -5.115 1.00 0.00 C ATOM 677 CG2 ILE A 46 -7.744 14.728 -5.563 1.00 0.00 C ATOM 678 CD1 ILE A 46 -4.644 13.985 -6.428 1.00 0.00 C ATOM 0 H ILE A 46 -8.602 11.729 -5.212 1.00 0.00 H new ATOM 0 HA ILE A 46 -6.517 12.218 -3.577 1.00 0.00 H new ATOM 0 HB ILE A 46 -6.927 12.825 -6.079 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -5.362 14.964 -4.674 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.887 13.296 -4.424 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -7.396 15.212 -6.476 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -8.772 14.392 -5.699 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -7.701 15.438 -4.737 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.616 14.303 -6.255 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.646 12.985 -6.861 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -5.128 14.679 -7.115 1.00 0.00 H new ATOM 690 N LYS A 47 -8.887 14.468 -3.084 1.00 0.00 N ATOM 691 CA LYS A 47 -9.363 15.493 -2.163 1.00 0.00 C ATOM 692 C LYS A 47 -9.220 15.034 -0.716 1.00 0.00 C ATOM 693 O LYS A 47 -8.886 15.825 0.167 1.00 0.00 O ATOM 694 CB LYS A 47 -10.826 15.833 -2.459 1.00 0.00 C ATOM 695 CG LYS A 47 -11.738 14.619 -2.492 1.00 0.00 C ATOM 696 CD LYS A 47 -12.999 14.890 -3.295 1.00 0.00 C ATOM 697 CE LYS A 47 -13.853 13.639 -3.430 1.00 0.00 C ATOM 698 NZ LYS A 47 -15.154 13.925 -4.096 1.00 0.00 N ATOM 0 H LYS A 47 -9.537 14.243 -3.837 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.752 16.385 -2.304 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -11.189 16.529 -1.703 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -10.884 16.347 -3.419 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -11.204 13.774 -2.926 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.007 14.337 -1.474 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -13.578 15.677 -2.811 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -12.729 15.256 -4.286 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -13.309 12.888 -4.003 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -14.036 13.216 -2.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -15.707 13.047 -4.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -15.685 14.623 -3.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -14.980 14.305 -5.048 1.00 0.00 H new ATOM 712 N PHE A 48 -9.473 13.751 -0.479 1.00 0.00 N ATOM 713 CA PHE A 48 -9.371 13.186 0.861 1.00 0.00 C ATOM 714 C PHE A 48 -8.251 12.152 0.932 1.00 0.00 C ATOM 715 O PHE A 48 -8.196 11.344 1.859 1.00 0.00 O ATOM 716 CB PHE A 48 -10.699 12.545 1.270 1.00 0.00 C ATOM 717 CG PHE A 48 -11.903 13.330 0.833 1.00 0.00 C ATOM 718 CD1 PHE A 48 -11.881 14.716 0.835 1.00 0.00 C ATOM 719 CD2 PHE A 48 -13.056 12.683 0.420 1.00 0.00 C ATOM 720 CE1 PHE A 48 -12.988 15.440 0.434 1.00 0.00 C ATOM 721 CE2 PHE A 48 -14.166 13.402 0.018 1.00 0.00 C ATOM 722 CZ PHE A 48 -14.131 14.782 0.024 1.00 0.00 C ATOM 0 H PHE A 48 -9.750 13.083 -1.198 1.00 0.00 H new ATOM 0 HA PHE A 48 -9.138 13.996 1.553 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -10.755 11.542 0.846 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.721 12.434 2.354 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -10.989 15.236 1.153 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -13.088 11.604 0.412 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -12.959 16.520 0.441 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -15.059 12.885 -0.300 1.00 0.00 H new ATOM 0 HZ PHE A 48 -14.996 15.346 -0.291 1.00 0.00 H new ATOM 732 N TYR A 49 -7.362 12.184 -0.054 1.00 0.00 N ATOM 733 CA TYR A 49 -6.244 11.249 -0.105 1.00 0.00 C ATOM 734 C TYR A 49 -5.663 11.017 1.286 1.00 0.00 C ATOM 735 O TYR A 49 -5.165 9.933 1.591 1.00 0.00 O ATOM 736 CB TYR A 49 -5.156 11.773 -1.044 1.00 0.00 C ATOM 737 CG TYR A 49 -4.114 12.619 -0.350 1.00 0.00 C ATOM 738 CD1 TYR A 49 -4.425 13.887 0.127 1.00 0.00 C ATOM 739 CD2 TYR A 49 -2.817 12.153 -0.172 1.00 0.00 C ATOM 740 CE1 TYR A 49 -3.476 14.664 0.762 1.00 0.00 C ATOM 741 CE2 TYR A 49 -1.862 12.923 0.462 1.00 0.00 C ATOM 742 CZ TYR A 49 -2.196 14.178 0.927 1.00 0.00 C ATOM 743 OH TYR A 49 -1.246 14.948 1.558 1.00 0.00 O ATOM 0 H TYR A 49 -7.393 12.847 -0.829 1.00 0.00 H new ATOM 0 HA TYR A 49 -6.616 10.298 -0.486 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -4.664 10.927 -1.524 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -5.622 12.361 -1.834 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -5.426 14.271 -0.001 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -2.551 11.171 -0.536 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -3.735 15.647 1.127 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -0.859 12.545 0.593 1.00 0.00 H new ATOM 0 HH TYR A 49 -1.681 15.532 2.214 1.00 0.00 H new ATOM 753 N LYS A 50 -5.731 12.043 2.127 1.00 0.00 N ATOM 754 CA LYS A 50 -5.214 11.954 3.487 1.00 0.00 C ATOM 755 C LYS A 50 -5.529 10.593 4.101 1.00 0.00 C ATOM 756 O LYS A 50 -4.829 10.130 5.001 1.00 0.00 O ATOM 757 CB LYS A 50 -5.807 13.066 4.354 1.00 0.00 C ATOM 758 CG LYS A 50 -5.319 14.455 3.980 1.00 0.00 C ATOM 759 CD LYS A 50 -5.992 15.528 4.820 1.00 0.00 C ATOM 760 CE LYS A 50 -5.725 16.919 4.266 1.00 0.00 C ATOM 761 NZ LYS A 50 -6.086 17.984 5.242 1.00 0.00 N ATOM 0 H LYS A 50 -6.140 12.947 1.890 1.00 0.00 H new ATOM 0 HA LYS A 50 -4.131 12.073 3.446 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -6.894 13.038 4.273 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -5.560 12.872 5.398 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -4.239 14.511 4.115 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -5.518 14.640 2.924 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -7.067 15.347 4.850 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -5.630 15.468 5.846 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -4.671 17.009 4.004 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -6.295 17.060 3.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -5.889 18.917 4.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -7.098 17.914 5.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -5.524 17.866 6.109 1.00 0.00 H new ATOM 775 N HIS A 51 -6.587 9.958 3.607 1.00 0.00 N ATOM 776 CA HIS A 51 -6.994 8.649 4.106 1.00 0.00 C ATOM 777 C HIS A 51 -6.406 7.533 3.247 1.00 0.00 C ATOM 778 O HIS A 51 -5.827 6.578 3.764 1.00 0.00 O ATOM 779 CB HIS A 51 -8.519 8.540 4.130 1.00 0.00 C ATOM 780 CG HIS A 51 -9.135 9.031 5.404 1.00 0.00 C ATOM 781 ND1 HIS A 51 -10.044 8.294 6.133 1.00 0.00 N ATOM 782 CD2 HIS A 51 -8.966 10.193 6.078 1.00 0.00 C ATOM 783 CE1 HIS A 51 -10.409 8.982 7.200 1.00 0.00 C ATOM 784 NE2 HIS A 51 -9.769 10.138 7.191 1.00 0.00 N ATOM 0 H HIS A 51 -7.178 10.328 2.862 1.00 0.00 H new ATOM 0 HA HIS A 51 -6.614 8.541 5.122 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -8.929 9.109 3.295 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -8.803 7.499 3.976 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -8.320 11.011 5.794 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -11.112 8.655 7.952 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -9.857 10.870 7.896 1.00 0.00 H new ATOM 792 N VAL A 52 -6.559 7.661 1.933 1.00 0.00 N ATOM 793 CA VAL A 52 -6.043 6.664 1.003 1.00 0.00 C ATOM 794 C VAL A 52 -4.608 6.282 1.347 1.00 0.00 C ATOM 795 O VAL A 52 -4.338 5.159 1.774 1.00 0.00 O ATOM 796 CB VAL A 52 -6.093 7.173 -0.450 1.00 0.00 C ATOM 797 CG1 VAL A 52 -5.152 6.366 -1.331 1.00 0.00 C ATOM 798 CG2 VAL A 52 -7.516 7.119 -0.985 1.00 0.00 C ATOM 0 H VAL A 52 -7.036 8.445 1.489 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.682 5.785 1.095 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.764 8.212 -0.464 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -5.201 6.740 -2.354 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.132 6.462 -0.958 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.447 5.317 -1.314 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.532 7.482 -2.013 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.876 6.091 -0.958 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.161 7.745 -0.368 1.00 0.00 H new ATOM 808 N VAL A 53 -3.689 7.224 1.159 1.00 0.00 N ATOM 809 CA VAL A 53 -2.281 6.988 1.451 1.00 0.00 C ATOM 810 C VAL A 53 -2.116 6.067 2.655 1.00 0.00 C ATOM 811 O VAL A 53 -1.464 5.027 2.568 1.00 0.00 O ATOM 812 CB VAL A 53 -1.534 8.307 1.722 1.00 0.00 C ATOM 813 CG1 VAL A 53 -0.187 8.035 2.373 1.00 0.00 C ATOM 814 CG2 VAL A 53 -1.363 9.097 0.433 1.00 0.00 C ATOM 0 H VAL A 53 -3.895 8.158 0.805 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.852 6.511 0.570 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.129 8.905 2.412 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.326 8.979 2.557 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.338 7.514 3.319 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.419 7.416 1.711 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.833 10.026 0.643 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.790 8.507 -0.282 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.343 9.325 0.013 1.00 0.00 H new ATOM 824 N GLN A 54 -2.712 6.457 3.777 1.00 0.00 N ATOM 825 CA GLN A 54 -2.632 5.665 4.999 1.00 0.00 C ATOM 826 C GLN A 54 -3.068 4.226 4.746 1.00 0.00 C ATOM 827 O GLN A 54 -2.298 3.288 4.951 1.00 0.00 O ATOM 828 CB GLN A 54 -3.499 6.289 6.094 1.00 0.00 C ATOM 829 CG GLN A 54 -3.345 5.617 7.449 1.00 0.00 C ATOM 830 CD GLN A 54 -3.966 6.422 8.573 1.00 0.00 C ATOM 831 OE1 GLN A 54 -5.189 6.534 8.670 1.00 0.00 O ATOM 832 NE2 GLN A 54 -3.126 6.989 9.431 1.00 0.00 N ATOM 0 H GLN A 54 -3.255 7.316 3.865 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.593 5.657 5.329 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.244 7.344 6.190 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -4.545 6.240 5.790 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -3.807 4.630 7.416 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.286 5.466 7.657 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -2.120 6.871 9.313 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -3.487 7.543 10.208 1.00 0.00 H new ATOM 841 N SER A 55 -4.309 4.059 4.299 1.00 0.00 N ATOM 842 CA SER A 55 -4.849 2.734 4.021 1.00 0.00 C ATOM 843 C SER A 55 -3.846 1.890 3.241 1.00 0.00 C ATOM 844 O SER A 55 -3.711 0.689 3.477 1.00 0.00 O ATOM 845 CB SER A 55 -6.157 2.847 3.236 1.00 0.00 C ATOM 846 OG SER A 55 -7.256 3.070 4.103 1.00 0.00 O ATOM 0 H SER A 55 -4.959 4.825 4.122 1.00 0.00 H new ATOM 0 HA SER A 55 -5.047 2.243 4.974 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.084 3.664 2.519 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.321 1.934 2.664 1.00 0.00 H new ATOM 0 HG SER A 55 -8.079 3.140 3.576 1.00 0.00 H new ATOM 852 N VAL A 56 -3.144 2.528 2.310 1.00 0.00 N ATOM 853 CA VAL A 56 -2.151 1.838 1.494 1.00 0.00 C ATOM 854 C VAL A 56 -0.998 1.325 2.349 1.00 0.00 C ATOM 855 O VAL A 56 -0.491 0.226 2.129 1.00 0.00 O ATOM 856 CB VAL A 56 -1.590 2.759 0.394 1.00 0.00 C ATOM 857 CG1 VAL A 56 -0.505 2.045 -0.397 1.00 0.00 C ATOM 858 CG2 VAL A 56 -2.707 3.233 -0.523 1.00 0.00 C ATOM 0 H VAL A 56 -3.244 3.521 2.102 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.657 0.993 1.027 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.144 3.634 0.867 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.120 2.711 -1.170 1.00 0.00 H new ATOM 0 HG12 VAL A 56 0.306 1.760 0.273 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -0.922 1.152 -0.862 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -2.293 3.883 -1.294 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -3.184 2.372 -0.991 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.446 3.785 0.058 1.00 0.00 H new ATOM 868 N GLU A 57 -0.589 2.129 3.326 1.00 0.00 N ATOM 869 CA GLU A 57 0.505 1.756 4.214 1.00 0.00 C ATOM 870 C GLU A 57 0.075 0.649 5.173 1.00 0.00 C ATOM 871 O GLU A 57 0.828 -0.288 5.436 1.00 0.00 O ATOM 872 CB GLU A 57 0.987 2.973 5.006 1.00 0.00 C ATOM 873 CG GLU A 57 1.359 4.159 4.132 1.00 0.00 C ATOM 874 CD GLU A 57 1.869 5.339 4.937 1.00 0.00 C ATOM 875 OE1 GLU A 57 1.312 5.600 6.024 1.00 0.00 O ATOM 876 OE2 GLU A 57 2.823 6.002 4.480 1.00 0.00 O ATOM 0 H GLU A 57 -0.999 3.042 3.522 1.00 0.00 H new ATOM 0 HA GLU A 57 1.325 1.383 3.600 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.205 3.276 5.702 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.852 2.687 5.604 1.00 0.00 H new ATOM 0 HG2 GLU A 57 2.123 3.854 3.418 1.00 0.00 H new ATOM 0 HG3 GLU A 57 0.488 4.467 3.554 1.00 0.00 H new ATOM 883 N LYS A 58 -1.143 0.766 5.693 1.00 0.00 N ATOM 884 CA LYS A 58 -1.676 -0.223 6.622 1.00 0.00 C ATOM 885 C LYS A 58 -1.873 -1.569 5.931 1.00 0.00 C ATOM 886 O LYS A 58 -1.257 -2.566 6.307 1.00 0.00 O ATOM 887 CB LYS A 58 -3.005 0.261 7.206 1.00 0.00 C ATOM 888 CG LYS A 58 -2.960 1.690 7.719 1.00 0.00 C ATOM 889 CD LYS A 58 -1.924 1.854 8.819 1.00 0.00 C ATOM 890 CE LYS A 58 -2.399 1.242 10.128 1.00 0.00 C ATOM 891 NZ LYS A 58 -2.187 -0.232 10.160 1.00 0.00 N ATOM 0 H LYS A 58 -1.779 1.536 5.486 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.955 -0.351 7.430 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.778 0.183 6.442 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.296 -0.400 8.022 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.729 2.366 6.896 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.942 1.973 8.098 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -0.990 1.383 8.514 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.713 2.913 8.967 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -1.866 1.704 10.959 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.458 1.460 10.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.091 -0.709 10.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -1.815 -0.549 9.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -1.507 -0.469 10.910 1.00 0.00 H new ATOM 905 N PHE A 59 -2.732 -1.589 4.917 1.00 0.00 N ATOM 906 CA PHE A 59 -3.008 -2.812 4.173 1.00 0.00 C ATOM 907 C PHE A 59 -1.731 -3.618 3.959 1.00 0.00 C ATOM 908 O PHE A 59 -1.756 -4.849 3.947 1.00 0.00 O ATOM 909 CB PHE A 59 -3.648 -2.480 2.824 1.00 0.00 C ATOM 910 CG PHE A 59 -3.453 -3.550 1.788 1.00 0.00 C ATOM 911 CD1 PHE A 59 -4.359 -4.592 1.671 1.00 0.00 C ATOM 912 CD2 PHE A 59 -2.365 -3.514 0.932 1.00 0.00 C ATOM 913 CE1 PHE A 59 -4.181 -5.579 0.719 1.00 0.00 C ATOM 914 CE2 PHE A 59 -2.182 -4.497 -0.022 1.00 0.00 C ATOM 915 CZ PHE A 59 -3.092 -5.531 -0.129 1.00 0.00 C ATOM 0 H PHE A 59 -3.249 -0.772 4.592 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.703 -3.415 4.758 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -4.716 -2.316 2.968 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.229 -1.545 2.452 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.213 -4.634 2.330 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -1.651 -2.708 1.011 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.893 -6.387 0.639 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.329 -4.457 -0.683 1.00 0.00 H new ATOM 0 HZ PHE A 59 -2.952 -6.300 -0.874 1.00 0.00 H new ATOM 925 N ILE A 60 -0.616 -2.915 3.789 1.00 0.00 N ATOM 926 CA ILE A 60 0.671 -3.565 3.575 1.00 0.00 C ATOM 927 C ILE A 60 1.107 -4.341 4.813 1.00 0.00 C ATOM 928 O ILE A 60 1.619 -5.456 4.709 1.00 0.00 O ATOM 929 CB ILE A 60 1.764 -2.543 3.212 1.00 0.00 C ATOM 930 CG1 ILE A 60 1.581 -2.057 1.773 1.00 0.00 C ATOM 931 CG2 ILE A 60 3.144 -3.154 3.399 1.00 0.00 C ATOM 932 CD1 ILE A 60 2.517 -0.931 1.392 1.00 0.00 C ATOM 0 H ILE A 60 -0.578 -1.896 3.795 1.00 0.00 H new ATOM 0 HA ILE A 60 0.541 -4.257 2.743 1.00 0.00 H new ATOM 0 HB ILE A 60 1.675 -1.686 3.879 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.737 -2.894 1.093 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.552 -1.724 1.638 1.00 0.00 H new ATOM 0 HG21 ILE A 60 3.906 -2.419 3.138 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.271 -3.455 4.439 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.246 -4.027 2.754 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.331 -0.637 0.359 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.346 -0.078 2.048 1.00 0.00 H new ATOM 0 HD13 ILE A 60 3.549 -1.266 1.494 1.00 0.00 H new ATOM 944 N GLN A 61 0.899 -3.745 5.982 1.00 0.00 N ATOM 945 CA GLN A 61 1.270 -4.382 7.241 1.00 0.00 C ATOM 946 C GLN A 61 0.246 -5.440 7.638 1.00 0.00 C ATOM 947 O GLN A 61 0.515 -6.294 8.483 1.00 0.00 O ATOM 948 CB GLN A 61 1.396 -3.335 8.349 1.00 0.00 C ATOM 949 CG GLN A 61 0.058 -2.833 8.867 1.00 0.00 C ATOM 950 CD GLN A 61 0.142 -2.305 10.285 1.00 0.00 C ATOM 951 OE1 GLN A 61 0.457 -1.136 10.507 1.00 0.00 O ATOM 952 NE2 GLN A 61 -0.141 -3.166 11.255 1.00 0.00 N ATOM 0 H GLN A 61 0.476 -2.823 6.084 1.00 0.00 H new ATOM 0 HA GLN A 61 2.234 -4.871 7.102 1.00 0.00 H new ATOM 0 HB2 GLN A 61 1.960 -3.762 9.178 1.00 0.00 H new ATOM 0 HB3 GLN A 61 1.972 -2.489 7.974 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -0.308 -2.044 8.211 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.670 -3.644 8.828 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -0.398 -4.126 11.026 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -0.102 -2.867 12.230 1.00 0.00 H new ATOM 961 N LYS A 62 -0.931 -5.377 7.025 1.00 0.00 N ATOM 962 CA LYS A 62 -1.997 -6.329 7.313 1.00 0.00 C ATOM 963 C LYS A 62 -1.984 -7.480 6.312 1.00 0.00 C ATOM 964 O LYS A 62 -2.389 -8.598 6.632 1.00 0.00 O ATOM 965 CB LYS A 62 -3.357 -5.628 7.283 1.00 0.00 C ATOM 966 CG LYS A 62 -3.362 -4.280 7.983 1.00 0.00 C ATOM 967 CD LYS A 62 -3.496 -4.434 9.488 1.00 0.00 C ATOM 968 CE LYS A 62 -4.954 -4.429 9.922 1.00 0.00 C ATOM 969 NZ LYS A 62 -5.095 -4.230 11.391 1.00 0.00 N ATOM 0 H LYS A 62 -1.171 -4.675 6.325 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.827 -6.736 8.310 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -3.663 -5.491 6.246 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -4.100 -6.274 7.751 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.441 -3.745 7.752 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -4.185 -3.675 7.603 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -3.025 -5.365 9.803 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.964 -3.623 9.986 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -5.487 -3.637 9.396 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.421 -5.372 9.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -6.103 -4.233 11.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -4.608 -4.999 11.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -4.672 -3.319 11.660 1.00 0.00 H new ATOM 983 N CYS A 63 -1.515 -7.199 5.101 1.00 0.00 N ATOM 984 CA CYS A 63 -1.449 -8.212 4.053 1.00 0.00 C ATOM 985 C CYS A 63 -0.463 -9.315 4.425 1.00 0.00 C ATOM 986 O CYS A 63 0.278 -9.198 5.401 1.00 0.00 O ATOM 987 CB CYS A 63 -1.042 -7.574 2.724 1.00 0.00 C ATOM 988 SG CYS A 63 0.742 -7.355 2.526 1.00 0.00 S ATOM 0 H CYS A 63 -1.175 -6.279 4.821 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.439 -8.655 3.947 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.414 -8.193 1.907 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.529 -6.603 2.635 1.00 0.00 H new ATOM 0 HG CYS A 63 1.183 -6.542 3.439 1.00 0.00 H new ATOM 994 N LYS A 64 -0.460 -10.387 3.640 1.00 0.00 N ATOM 995 CA LYS A 64 0.433 -11.513 3.886 1.00 0.00 C ATOM 996 C LYS A 64 1.813 -11.252 3.290 1.00 0.00 C ATOM 997 O LYS A 64 1.978 -10.449 2.371 1.00 0.00 O ATOM 998 CB LYS A 64 -0.154 -12.796 3.294 1.00 0.00 C ATOM 999 CG LYS A 64 -1.471 -13.211 3.928 1.00 0.00 C ATOM 1000 CD LYS A 64 -2.654 -12.555 3.236 1.00 0.00 C ATOM 1001 CE LYS A 64 -3.919 -13.387 3.387 1.00 0.00 C ATOM 1002 NZ LYS A 64 -5.101 -12.714 2.782 1.00 0.00 N ATOM 0 H LYS A 64 -1.066 -10.500 2.828 1.00 0.00 H new ATOM 0 HA LYS A 64 0.537 -11.632 4.964 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.304 -12.657 2.223 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.568 -13.604 3.413 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -1.574 -14.295 3.878 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -1.469 -12.939 4.984 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -2.818 -11.562 3.655 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.429 -12.421 2.178 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -3.773 -14.359 2.915 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.108 -13.572 4.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -5.968 -13.215 3.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.147 -11.729 3.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -5.015 -12.727 1.746 1.00 0.00 H new ATOM 1016 N PRO A 65 2.830 -11.945 3.824 1.00 0.00 N ATOM 1017 CA PRO A 65 4.213 -11.806 3.360 1.00 0.00 C ATOM 1018 C PRO A 65 4.325 -11.881 1.841 1.00 0.00 C ATOM 1019 O PRO A 65 5.332 -11.473 1.263 1.00 0.00 O ATOM 1020 CB PRO A 65 4.926 -12.996 4.007 1.00 0.00 C ATOM 1021 CG PRO A 65 4.123 -13.302 5.224 1.00 0.00 C ATOM 1022 CD PRO A 65 2.707 -12.918 4.923 1.00 0.00 C ATOM 0 HA PRO A 65 4.638 -10.839 3.629 1.00 0.00 H new ATOM 0 HB2 PRO A 65 4.963 -13.851 3.332 1.00 0.00 H new ATOM 0 HB3 PRO A 65 5.956 -12.749 4.264 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.190 -14.361 5.474 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.499 -12.747 6.083 1.00 0.00 H new ATOM 0 HD2 PRO A 65 2.113 -13.783 4.627 1.00 0.00 H new ATOM 0 HD3 PRO A 65 2.219 -12.479 5.793 1.00 0.00 H new ATOM 1030 N GLU A 66 3.284 -12.404 1.200 1.00 0.00 N ATOM 1031 CA GLU A 66 3.267 -12.532 -0.252 1.00 0.00 C ATOM 1032 C GLU A 66 2.684 -11.280 -0.901 1.00 0.00 C ATOM 1033 O GLU A 66 3.010 -10.949 -2.042 1.00 0.00 O ATOM 1034 CB GLU A 66 2.456 -13.760 -0.669 1.00 0.00 C ATOM 1035 CG GLU A 66 0.986 -13.675 -0.294 1.00 0.00 C ATOM 1036 CD GLU A 66 0.361 -15.038 -0.068 1.00 0.00 C ATOM 1037 OE1 GLU A 66 0.164 -15.771 -1.060 1.00 0.00 O ATOM 1038 OE2 GLU A 66 0.069 -15.371 1.099 1.00 0.00 O ATOM 0 H GLU A 66 2.442 -12.746 1.664 1.00 0.00 H new ATOM 0 HA GLU A 66 4.295 -12.652 -0.592 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.540 -13.891 -1.748 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.890 -14.646 -0.205 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.880 -13.076 0.611 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.443 -13.157 -1.084 1.00 0.00 H new ATOM 1045 N TYR A 67 1.819 -10.588 -0.168 1.00 0.00 N ATOM 1046 CA TYR A 67 1.188 -9.375 -0.672 1.00 0.00 C ATOM 1047 C TYR A 67 2.075 -8.158 -0.431 1.00 0.00 C ATOM 1048 O TYR A 67 1.602 -7.021 -0.418 1.00 0.00 O ATOM 1049 CB TYR A 67 -0.173 -9.167 -0.006 1.00 0.00 C ATOM 1050 CG TYR A 67 -1.286 -9.975 -0.636 1.00 0.00 C ATOM 1051 CD1 TYR A 67 -2.014 -9.473 -1.707 1.00 0.00 C ATOM 1052 CD2 TYR A 67 -1.608 -11.240 -0.160 1.00 0.00 C ATOM 1053 CE1 TYR A 67 -3.032 -10.207 -2.285 1.00 0.00 C ATOM 1054 CE2 TYR A 67 -2.623 -11.981 -0.733 1.00 0.00 C ATOM 1055 CZ TYR A 67 -3.332 -11.460 -1.795 1.00 0.00 C ATOM 1056 OH TYR A 67 -4.344 -12.195 -2.369 1.00 0.00 O ATOM 0 H TYR A 67 1.539 -10.847 0.778 1.00 0.00 H new ATOM 0 HA TYR A 67 1.045 -9.491 -1.746 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.096 -9.431 1.049 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.433 -8.109 -0.052 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.780 -8.492 -2.095 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.055 -11.651 0.672 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.590 -9.801 -3.116 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.860 -12.963 -0.351 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.808 -11.647 -3.036 1.00 0.00 H new ATOM 1066 N LYS A 68 3.367 -8.404 -0.240 1.00 0.00 N ATOM 1067 CA LYS A 68 4.324 -7.331 -0.001 1.00 0.00 C ATOM 1068 C LYS A 68 4.731 -6.663 -1.310 1.00 0.00 C ATOM 1069 O LYS A 68 5.183 -5.518 -1.320 1.00 0.00 O ATOM 1070 CB LYS A 68 5.564 -7.875 0.714 1.00 0.00 C ATOM 1071 CG LYS A 68 5.265 -8.480 2.075 1.00 0.00 C ATOM 1072 CD LYS A 68 4.279 -7.630 2.858 1.00 0.00 C ATOM 1073 CE LYS A 68 4.068 -8.173 4.263 1.00 0.00 C ATOM 1074 NZ LYS A 68 2.885 -9.074 4.338 1.00 0.00 N ATOM 0 H LYS A 68 3.775 -9.339 -0.246 1.00 0.00 H new ATOM 0 HA LYS A 68 3.845 -6.585 0.633 1.00 0.00 H new ATOM 0 HB2 LYS A 68 6.033 -8.631 0.085 1.00 0.00 H new ATOM 0 HB3 LYS A 68 6.287 -7.068 0.835 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.860 -9.484 1.947 1.00 0.00 H new ATOM 0 HG3 LYS A 68 6.191 -8.580 2.641 1.00 0.00 H new ATOM 0 HD2 LYS A 68 4.645 -6.605 2.914 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.325 -7.599 2.332 1.00 0.00 H new ATOM 0 HE2 LYS A 68 4.958 -8.716 4.580 1.00 0.00 H new ATOM 0 HE3 LYS A 68 3.937 -7.343 4.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 2.123 -8.603 4.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 2.555 -9.294 3.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 3.150 -9.955 4.824 1.00 0.00 H new ATOM 1088 N VAL A 69 4.568 -7.385 -2.414 1.00 0.00 N ATOM 1089 CA VAL A 69 4.916 -6.862 -3.729 1.00 0.00 C ATOM 1090 C VAL A 69 3.799 -5.984 -4.284 1.00 0.00 C ATOM 1091 O VAL A 69 4.023 -4.854 -4.720 1.00 0.00 O ATOM 1092 CB VAL A 69 5.204 -7.998 -4.728 1.00 0.00 C ATOM 1093 CG1 VAL A 69 4.738 -7.614 -6.124 1.00 0.00 C ATOM 1094 CG2 VAL A 69 6.686 -8.343 -4.727 1.00 0.00 C ATOM 0 H VAL A 69 4.197 -8.335 -2.423 1.00 0.00 H new ATOM 0 HA VAL A 69 5.818 -6.263 -3.602 1.00 0.00 H new ATOM 0 HB VAL A 69 4.647 -8.882 -4.417 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.950 -8.429 -6.816 1.00 0.00 H new ATOM 0 HG12 VAL A 69 3.665 -7.421 -6.109 1.00 0.00 H new ATOM 0 HG13 VAL A 69 5.264 -6.716 -6.449 1.00 0.00 H new ATOM 0 HG21 VAL A 69 6.873 -9.148 -5.438 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.264 -7.464 -5.013 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.984 -8.665 -3.729 1.00 0.00 H new ATOM 1104 N PRO A 70 2.567 -6.513 -4.268 1.00 0.00 N ATOM 1105 CA PRO A 70 1.390 -5.795 -4.766 1.00 0.00 C ATOM 1106 C PRO A 70 1.310 -4.371 -4.225 1.00 0.00 C ATOM 1107 O PRO A 70 1.217 -3.411 -4.989 1.00 0.00 O ATOM 1108 CB PRO A 70 0.218 -6.631 -4.246 1.00 0.00 C ATOM 1109 CG PRO A 70 0.773 -8.004 -4.089 1.00 0.00 C ATOM 1110 CD PRO A 70 2.228 -7.854 -3.764 1.00 0.00 C ATOM 0 HA PRO A 70 1.406 -5.688 -5.851 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -0.155 -6.244 -3.298 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -0.618 -6.619 -4.946 1.00 0.00 H new ATOM 0 HG2 PRO A 70 0.254 -8.541 -3.295 1.00 0.00 H new ATOM 0 HG3 PRO A 70 0.640 -8.581 -5.004 1.00 0.00 H new ATOM 0 HD2 PRO A 70 2.408 -7.935 -2.692 1.00 0.00 H new ATOM 0 HD3 PRO A 70 2.827 -8.626 -4.247 1.00 0.00 H new ATOM 1118 N GLY A 71 1.346 -4.242 -2.902 1.00 0.00 N ATOM 1119 CA GLY A 71 1.276 -2.931 -2.283 1.00 0.00 C ATOM 1120 C GLY A 71 2.160 -1.914 -2.976 1.00 0.00 C ATOM 1121 O GLY A 71 1.694 -0.849 -3.382 1.00 0.00 O ATOM 0 H GLY A 71 1.422 -5.021 -2.248 1.00 0.00 H new ATOM 0 HA2 GLY A 71 0.244 -2.580 -2.298 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.571 -3.011 -1.237 1.00 0.00 H new ATOM 1125 N LEU A 72 3.441 -2.241 -3.112 1.00 0.00 N ATOM 1126 CA LEU A 72 4.394 -1.347 -3.760 1.00 0.00 C ATOM 1127 C LEU A 72 3.842 -0.830 -5.084 1.00 0.00 C ATOM 1128 O LEU A 72 3.892 0.368 -5.364 1.00 0.00 O ATOM 1129 CB LEU A 72 5.722 -2.069 -3.995 1.00 0.00 C ATOM 1130 CG LEU A 72 6.950 -1.175 -4.172 1.00 0.00 C ATOM 1131 CD1 LEU A 72 6.638 -0.019 -5.110 1.00 0.00 C ATOM 1132 CD2 LEU A 72 7.430 -0.656 -2.824 1.00 0.00 C ATOM 0 H LEU A 72 3.843 -3.118 -2.782 1.00 0.00 H new ATOM 0 HA LEU A 72 4.562 -0.496 -3.101 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.903 -2.738 -3.154 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.621 -2.693 -4.883 1.00 0.00 H new ATOM 0 HG LEU A 72 7.748 -1.770 -4.615 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.523 0.606 -5.224 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.342 -0.410 -6.084 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.824 0.576 -4.696 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.304 -0.022 -2.969 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.636 -0.077 -2.353 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.694 -1.497 -2.183 1.00 0.00 H new ATOM 1144 N TYR A 73 3.315 -1.740 -5.895 1.00 0.00 N ATOM 1145 CA TYR A 73 2.754 -1.377 -7.191 1.00 0.00 C ATOM 1146 C TYR A 73 1.639 -0.348 -7.032 1.00 0.00 C ATOM 1147 O TYR A 73 1.579 0.639 -7.765 1.00 0.00 O ATOM 1148 CB TYR A 73 2.219 -2.619 -7.905 1.00 0.00 C ATOM 1149 CG TYR A 73 3.304 -3.556 -8.385 1.00 0.00 C ATOM 1150 CD1 TYR A 73 4.641 -3.308 -8.098 1.00 0.00 C ATOM 1151 CD2 TYR A 73 2.993 -4.689 -9.127 1.00 0.00 C ATOM 1152 CE1 TYR A 73 5.636 -4.160 -8.534 1.00 0.00 C ATOM 1153 CE2 TYR A 73 3.982 -5.548 -9.567 1.00 0.00 C ATOM 1154 CZ TYR A 73 5.301 -5.279 -9.268 1.00 0.00 C ATOM 1155 OH TYR A 73 6.289 -6.132 -9.706 1.00 0.00 O ATOM 0 H TYR A 73 3.264 -2.735 -5.678 1.00 0.00 H new ATOM 0 HA TYR A 73 3.549 -0.935 -7.792 1.00 0.00 H new ATOM 0 HB2 TYR A 73 1.557 -3.160 -7.229 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.617 -2.306 -8.758 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.906 -2.433 -7.523 1.00 0.00 H new ATOM 0 HD2 TYR A 73 1.961 -4.902 -9.364 1.00 0.00 H new ATOM 0 HE1 TYR A 73 6.670 -3.952 -8.302 1.00 0.00 H new ATOM 0 HE2 TYR A 73 3.723 -6.425 -10.142 1.00 0.00 H new ATOM 0 HH TYR A 73 5.885 -6.871 -10.207 1.00 0.00 H new ATOM 1165 N VAL A 74 0.756 -0.586 -6.067 1.00 0.00 N ATOM 1166 CA VAL A 74 -0.358 0.319 -5.809 1.00 0.00 C ATOM 1167 C VAL A 74 0.132 1.749 -5.606 1.00 0.00 C ATOM 1168 O VAL A 74 -0.441 2.695 -6.146 1.00 0.00 O ATOM 1169 CB VAL A 74 -1.160 -0.118 -4.569 1.00 0.00 C ATOM 1170 CG1 VAL A 74 -2.104 0.990 -4.126 1.00 0.00 C ATOM 1171 CG2 VAL A 74 -1.928 -1.399 -4.857 1.00 0.00 C ATOM 0 H VAL A 74 0.791 -1.398 -5.451 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.007 0.281 -6.684 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.461 -0.314 -3.756 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.662 0.663 -3.249 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.528 1.881 -3.878 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.799 1.220 -4.933 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -2.489 -1.694 -3.970 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.618 -1.231 -5.684 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -1.228 -2.191 -5.123 1.00 0.00 H new ATOM 1181 N ILE A 75 1.196 1.898 -4.824 1.00 0.00 N ATOM 1182 CA ILE A 75 1.765 3.212 -4.550 1.00 0.00 C ATOM 1183 C ILE A 75 2.312 3.850 -5.823 1.00 0.00 C ATOM 1184 O ILE A 75 2.127 5.044 -6.060 1.00 0.00 O ATOM 1185 CB ILE A 75 2.892 3.131 -3.504 1.00 0.00 C ATOM 1186 CG1 ILE A 75 2.341 2.636 -2.166 1.00 0.00 C ATOM 1187 CG2 ILE A 75 3.560 4.488 -3.339 1.00 0.00 C ATOM 1188 CD1 ILE A 75 3.411 2.138 -1.219 1.00 0.00 C ATOM 0 H ILE A 75 1.681 1.125 -4.369 1.00 0.00 H new ATOM 0 HA ILE A 75 0.958 3.829 -4.155 1.00 0.00 H new ATOM 0 HB ILE A 75 3.641 2.419 -3.852 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.791 3.446 -1.687 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.628 1.832 -2.351 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.354 4.415 -2.596 1.00 0.00 H new ATOM 0 HG22 ILE A 75 3.983 4.804 -4.293 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.822 5.219 -3.010 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.948 1.803 -0.291 1.00 0.00 H new ATOM 0 HD12 ILE A 75 3.946 1.307 -1.679 1.00 0.00 H new ATOM 0 HD13 ILE A 75 4.111 2.945 -1.004 1.00 0.00 H new ATOM 1200 N ASP A 76 2.984 3.045 -6.639 1.00 0.00 N ATOM 1201 CA ASP A 76 3.556 3.530 -7.890 1.00 0.00 C ATOM 1202 C ASP A 76 2.458 3.950 -8.863 1.00 0.00 C ATOM 1203 O ASP A 76 2.429 5.089 -9.328 1.00 0.00 O ATOM 1204 CB ASP A 76 4.433 2.451 -8.527 1.00 0.00 C ATOM 1205 CG ASP A 76 4.484 2.563 -10.038 1.00 0.00 C ATOM 1206 OD1 ASP A 76 5.150 3.492 -10.542 1.00 0.00 O ATOM 1207 OD2 ASP A 76 3.860 1.722 -10.716 1.00 0.00 O ATOM 0 H ASP A 76 3.146 2.055 -6.457 1.00 0.00 H new ATOM 0 HA ASP A 76 4.171 4.402 -7.666 1.00 0.00 H new ATOM 0 HB2 ASP A 76 5.444 2.525 -8.126 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.052 1.468 -8.251 1.00 0.00 H new ATOM 1212 N SER A 77 1.557 3.021 -9.167 1.00 0.00 N ATOM 1213 CA SER A 77 0.460 3.293 -10.088 1.00 0.00 C ATOM 1214 C SER A 77 -0.268 4.577 -9.702 1.00 0.00 C ATOM 1215 O SER A 77 -0.616 5.388 -10.561 1.00 0.00 O ATOM 1216 CB SER A 77 -0.524 2.121 -10.104 1.00 0.00 C ATOM 1217 OG SER A 77 0.111 0.928 -10.530 1.00 0.00 O ATOM 0 H SER A 77 1.565 2.074 -8.789 1.00 0.00 H new ATOM 0 HA SER A 77 0.880 3.419 -11.086 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.941 1.979 -9.107 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.357 2.351 -10.768 1.00 0.00 H new ATOM 0 HG SER A 77 0.681 0.586 -9.810 1.00 0.00 H new ATOM 1223 N ILE A 78 -0.494 4.755 -8.405 1.00 0.00 N ATOM 1224 CA ILE A 78 -1.178 5.941 -7.905 1.00 0.00 C ATOM 1225 C ILE A 78 -0.328 7.191 -8.102 1.00 0.00 C ATOM 1226 O ILE A 78 -0.648 8.049 -8.925 1.00 0.00 O ATOM 1227 CB ILE A 78 -1.527 5.801 -6.411 1.00 0.00 C ATOM 1228 CG1 ILE A 78 -2.719 4.859 -6.229 1.00 0.00 C ATOM 1229 CG2 ILE A 78 -1.825 7.165 -5.807 1.00 0.00 C ATOM 1230 CD1 ILE A 78 -2.791 4.234 -4.853 1.00 0.00 C ATOM 0 H ILE A 78 -0.213 4.093 -7.681 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.100 6.038 -8.478 1.00 0.00 H new ATOM 0 HB ILE A 78 -0.669 5.375 -5.891 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -3.640 5.411 -6.417 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.664 4.067 -6.976 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -2.070 7.050 -4.751 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -0.950 7.807 -5.909 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.669 7.617 -6.328 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.660 3.579 -4.796 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.887 3.654 -4.669 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -2.878 5.018 -4.101 1.00 0.00 H new ATOM 1242 N VAL A 79 0.758 7.287 -7.342 1.00 0.00 N ATOM 1243 CA VAL A 79 1.657 8.432 -7.435 1.00 0.00 C ATOM 1244 C VAL A 79 1.925 8.803 -8.889 1.00 0.00 C ATOM 1245 O VAL A 79 1.922 9.980 -9.251 1.00 0.00 O ATOM 1246 CB VAL A 79 2.999 8.150 -6.733 1.00 0.00 C ATOM 1247 CG1 VAL A 79 3.955 9.318 -6.919 1.00 0.00 C ATOM 1248 CG2 VAL A 79 2.776 7.863 -5.256 1.00 0.00 C ATOM 0 H VAL A 79 1.037 6.586 -6.655 1.00 0.00 H new ATOM 0 HA VAL A 79 1.162 9.265 -6.936 1.00 0.00 H new ATOM 0 HB VAL A 79 3.449 7.268 -7.188 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.897 9.100 -6.416 1.00 0.00 H new ATOM 0 HG12 VAL A 79 4.138 9.472 -7.982 1.00 0.00 H new ATOM 0 HG13 VAL A 79 3.516 10.219 -6.492 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.734 7.666 -4.775 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.304 8.725 -4.785 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.130 6.992 -5.148 1.00 0.00 H new ATOM 1258 N ARG A 80 2.157 7.791 -9.720 1.00 0.00 N ATOM 1259 CA ARG A 80 2.427 8.012 -11.135 1.00 0.00 C ATOM 1260 C ARG A 80 1.302 8.810 -11.786 1.00 0.00 C ATOM 1261 O ARG A 80 1.549 9.691 -12.609 1.00 0.00 O ATOM 1262 CB ARG A 80 2.602 6.674 -11.857 1.00 0.00 C ATOM 1263 CG ARG A 80 4.025 6.141 -11.814 1.00 0.00 C ATOM 1264 CD ARG A 80 4.284 5.154 -12.943 1.00 0.00 C ATOM 1265 NE ARG A 80 4.163 5.781 -14.256 1.00 0.00 N ATOM 1266 CZ ARG A 80 4.438 5.158 -15.396 1.00 0.00 C ATOM 1267 NH1 ARG A 80 4.847 3.896 -15.384 1.00 0.00 N ATOM 1268 NH2 ARG A 80 4.303 5.795 -16.552 1.00 0.00 N ATOM 0 H ARG A 80 2.163 6.811 -9.437 1.00 0.00 H new ATOM 0 HA ARG A 80 3.350 8.586 -11.218 1.00 0.00 H new ATOM 0 HB2 ARG A 80 1.934 5.939 -11.409 1.00 0.00 H new ATOM 0 HB3 ARG A 80 2.297 6.789 -12.897 1.00 0.00 H new ATOM 0 HG2 ARG A 80 4.728 6.971 -11.886 1.00 0.00 H new ATOM 0 HG3 ARG A 80 4.204 5.654 -10.855 1.00 0.00 H new ATOM 0 HD2 ARG A 80 5.283 4.732 -12.833 1.00 0.00 H new ATOM 0 HD3 ARG A 80 3.578 4.326 -12.870 1.00 0.00 H new ATOM 0 HE ARG A 80 3.850 6.751 -14.300 1.00 0.00 H new ATOM 0 HH11 ARG A 80 4.951 3.402 -14.498 1.00 0.00 H new ATOM 0 HH12 ARG A 80 5.058 3.420 -16.261 1.00 0.00 H new ATOM 0 HH21 ARG A 80 3.988 6.765 -16.566 1.00 0.00 H new ATOM 0 HH22 ARG A 80 4.515 5.315 -17.427 1.00 0.00 H new ATOM 1282 N GLN A 81 0.066 8.494 -11.412 1.00 0.00 N ATOM 1283 CA GLN A 81 -1.097 9.181 -11.961 1.00 0.00 C ATOM 1284 C GLN A 81 -1.203 10.598 -11.408 1.00 0.00 C ATOM 1285 O GLN A 81 -1.052 11.574 -12.143 1.00 0.00 O ATOM 1286 CB GLN A 81 -2.374 8.400 -11.644 1.00 0.00 C ATOM 1287 CG GLN A 81 -2.740 7.376 -12.705 1.00 0.00 C ATOM 1288 CD GLN A 81 -2.671 7.941 -14.110 1.00 0.00 C ATOM 1289 OE1 GLN A 81 -2.276 7.251 -15.050 1.00 0.00 O ATOM 1290 NE2 GLN A 81 -3.057 9.202 -14.261 1.00 0.00 N ATOM 0 H GLN A 81 -0.155 7.767 -10.732 1.00 0.00 H new ATOM 0 HA GLN A 81 -0.975 9.241 -13.043 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -2.251 7.892 -10.688 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.200 9.102 -11.528 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.067 6.522 -12.628 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -3.748 7.006 -12.515 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -3.377 9.737 -13.454 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -3.033 9.636 -15.184 1.00 0.00 H new ATOM 1299 N SER A 82 -1.463 10.704 -10.109 1.00 0.00 N ATOM 1300 CA SER A 82 -1.594 12.002 -9.459 1.00 0.00 C ATOM 1301 C SER A 82 -0.470 12.940 -9.888 1.00 0.00 C ATOM 1302 O SER A 82 -0.708 14.100 -10.223 1.00 0.00 O ATOM 1303 CB SER A 82 -1.584 11.838 -7.938 1.00 0.00 C ATOM 1304 OG SER A 82 -0.603 10.898 -7.533 1.00 0.00 O ATOM 0 H SER A 82 -1.587 9.906 -9.486 1.00 0.00 H new ATOM 0 HA SER A 82 -2.545 12.439 -9.764 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.386 12.801 -7.467 1.00 0.00 H new ATOM 0 HB3 SER A 82 -2.567 11.512 -7.598 1.00 0.00 H new ATOM 0 HG SER A 82 0.089 11.353 -7.009 1.00 0.00 H new ATOM 1310 N ARG A 83 0.757 12.428 -9.874 1.00 0.00 N ATOM 1311 CA ARG A 83 1.919 13.219 -10.260 1.00 0.00 C ATOM 1312 C ARG A 83 1.762 13.759 -11.678 1.00 0.00 C ATOM 1313 O ARG A 83 2.291 14.821 -12.012 1.00 0.00 O ATOM 1314 CB ARG A 83 3.192 12.376 -10.162 1.00 0.00 C ATOM 1315 CG ARG A 83 4.432 13.083 -10.683 1.00 0.00 C ATOM 1316 CD ARG A 83 5.467 12.091 -11.191 1.00 0.00 C ATOM 1317 NE ARG A 83 6.655 12.759 -11.716 1.00 0.00 N ATOM 1318 CZ ARG A 83 6.724 13.285 -12.934 1.00 0.00 C ATOM 1319 NH1 ARG A 83 5.680 13.221 -13.748 1.00 0.00 N ATOM 1320 NH2 ARG A 83 7.841 13.877 -13.339 1.00 0.00 N ATOM 0 H ARG A 83 0.971 11.469 -9.600 1.00 0.00 H new ATOM 0 HA ARG A 83 1.997 14.063 -9.575 1.00 0.00 H new ATOM 0 HB2 ARG A 83 3.354 12.097 -9.121 1.00 0.00 H new ATOM 0 HB3 ARG A 83 3.049 11.451 -10.721 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.153 13.764 -11.488 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.867 13.690 -9.889 1.00 0.00 H new ATOM 0 HD2 ARG A 83 5.756 11.422 -10.381 1.00 0.00 H new ATOM 0 HD3 ARG A 83 5.024 11.473 -11.972 1.00 0.00 H new ATOM 0 HE ARG A 83 7.476 12.825 -11.115 1.00 0.00 H new ATOM 0 HH11 ARG A 83 4.820 12.767 -13.440 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.736 13.626 -14.682 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.646 13.928 -12.715 1.00 0.00 H new ATOM 0 HH22 ARG A 83 7.894 14.281 -14.274 1.00 0.00 H new ATOM 1334 N HIS A 84 1.034 13.022 -12.510 1.00 0.00 N ATOM 1335 CA HIS A 84 0.807 13.426 -13.893 1.00 0.00 C ATOM 1336 C HIS A 84 -0.498 14.206 -14.024 1.00 0.00 C ATOM 1337 O HIS A 84 -0.491 15.398 -14.332 1.00 0.00 O ATOM 1338 CB HIS A 84 0.777 12.201 -14.807 1.00 0.00 C ATOM 1339 CG HIS A 84 0.278 12.496 -16.188 1.00 0.00 C ATOM 1340 ND1 HIS A 84 1.112 12.630 -17.277 1.00 0.00 N ATOM 1341 CD2 HIS A 84 -0.980 12.681 -16.654 1.00 0.00 C ATOM 1342 CE1 HIS A 84 0.390 12.887 -18.353 1.00 0.00 C ATOM 1343 NE2 HIS A 84 -0.883 12.922 -18.002 1.00 0.00 N ATOM 0 H HIS A 84 0.591 12.141 -12.250 1.00 0.00 H new ATOM 0 HA HIS A 84 1.629 14.074 -14.195 1.00 0.00 H new ATOM 0 HB2 HIS A 84 1.782 11.783 -14.874 1.00 0.00 H new ATOM 0 HB3 HIS A 84 0.144 11.437 -14.356 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -1.890 12.646 -16.073 1.00 0.00 H new ATOM 0 HE1 HIS A 84 0.775 13.042 -19.350 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -1.667 13.099 -18.630 1.00 0.00 H new ATOM 1351 N GLN A 85 -1.615 13.525 -13.789 1.00 0.00 N ATOM 1352 CA GLN A 85 -2.927 14.154 -13.883 1.00 0.00 C ATOM 1353 C GLN A 85 -2.899 15.560 -13.293 1.00 0.00 C ATOM 1354 O GLN A 85 -3.177 16.540 -13.984 1.00 0.00 O ATOM 1355 CB GLN A 85 -3.975 13.305 -13.162 1.00 0.00 C ATOM 1356 CG GLN A 85 -4.648 12.278 -14.058 1.00 0.00 C ATOM 1357 CD GLN A 85 -6.075 11.983 -13.639 1.00 0.00 C ATOM 1358 OE1 GLN A 85 -7.010 12.670 -14.052 1.00 0.00 O ATOM 1359 NE2 GLN A 85 -6.250 10.957 -12.814 1.00 0.00 N ATOM 0 H GLN A 85 -1.638 12.538 -13.532 1.00 0.00 H new ATOM 0 HA GLN A 85 -3.193 14.228 -14.937 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -3.501 12.790 -12.326 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -4.736 13.962 -12.742 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -4.643 12.640 -15.086 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -4.070 11.354 -14.042 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -5.446 10.415 -12.497 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -7.188 10.711 -12.498 1.00 0.00 H new ATOM 1449 N ASP A 91 1.117 16.795 -7.061 1.00 0.00 N ATOM 1450 CA ASP A 91 1.002 15.466 -6.473 1.00 0.00 C ATOM 1451 C ASP A 91 0.826 15.553 -4.961 1.00 0.00 C ATOM 1452 O ASP A 91 1.288 16.500 -4.325 1.00 0.00 O ATOM 1453 CB ASP A 91 2.238 14.629 -6.807 1.00 0.00 C ATOM 1454 CG ASP A 91 1.980 13.140 -6.684 1.00 0.00 C ATOM 1455 OD1 ASP A 91 0.860 12.764 -6.282 1.00 0.00 O ATOM 1456 OD2 ASP A 91 2.899 12.351 -6.989 1.00 0.00 O ATOM 0 HA ASP A 91 0.120 14.984 -6.896 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.563 14.856 -7.822 1.00 0.00 H new ATOM 0 HB3 ASP A 91 3.054 14.910 -6.141 1.00 0.00 H new ATOM 1461 N VAL A 92 0.152 14.559 -4.390 1.00 0.00 N ATOM 1462 CA VAL A 92 -0.087 14.524 -2.952 1.00 0.00 C ATOM 1463 C VAL A 92 0.423 13.223 -2.343 1.00 0.00 C ATOM 1464 O VAL A 92 0.894 13.200 -1.205 1.00 0.00 O ATOM 1465 CB VAL A 92 -1.584 14.678 -2.627 1.00 0.00 C ATOM 1466 CG1 VAL A 92 -2.107 16.012 -3.138 1.00 0.00 C ATOM 1467 CG2 VAL A 92 -2.379 13.523 -3.219 1.00 0.00 C ATOM 0 H VAL A 92 -0.238 13.767 -4.902 1.00 0.00 H new ATOM 0 HA VAL A 92 0.458 15.363 -2.520 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.707 14.657 -1.544 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.167 16.103 -2.899 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.557 16.824 -2.663 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.973 16.066 -4.218 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -3.435 13.648 -2.980 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.251 13.510 -4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.021 12.582 -2.800 1.00 0.00 H new ATOM 1477 N PHE A 93 0.326 12.140 -3.107 1.00 0.00 N ATOM 1478 CA PHE A 93 0.776 10.833 -2.642 1.00 0.00 C ATOM 1479 C PHE A 93 2.299 10.740 -2.674 1.00 0.00 C ATOM 1480 O PHE A 93 2.905 10.028 -1.874 1.00 0.00 O ATOM 1481 CB PHE A 93 0.168 9.724 -3.503 1.00 0.00 C ATOM 1482 CG PHE A 93 -1.331 9.775 -3.574 1.00 0.00 C ATOM 1483 CD1 PHE A 93 -1.968 10.630 -4.459 1.00 0.00 C ATOM 1484 CD2 PHE A 93 -2.104 8.966 -2.756 1.00 0.00 C ATOM 1485 CE1 PHE A 93 -3.347 10.679 -4.525 1.00 0.00 C ATOM 1486 CE2 PHE A 93 -3.484 9.010 -2.819 1.00 0.00 C ATOM 1487 CZ PHE A 93 -4.107 9.867 -3.705 1.00 0.00 C ATOM 0 H PHE A 93 -0.060 12.142 -4.051 1.00 0.00 H new ATOM 0 HA PHE A 93 0.443 10.707 -1.612 1.00 0.00 H new ATOM 0 HB2 PHE A 93 0.574 9.794 -4.512 1.00 0.00 H new ATOM 0 HB3 PHE A 93 0.472 8.757 -3.103 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -1.380 11.265 -5.105 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -1.622 8.294 -2.061 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.831 11.352 -5.217 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -4.075 8.375 -2.176 1.00 0.00 H new ATOM 0 HZ PHE A 93 -5.185 9.902 -3.757 1.00 0.00 H new ATOM 1497 N ALA A 94 2.911 11.465 -3.605 1.00 0.00 N ATOM 1498 CA ALA A 94 4.362 11.466 -3.741 1.00 0.00 C ATOM 1499 C ALA A 94 5.030 12.045 -2.498 1.00 0.00 C ATOM 1500 O ALA A 94 5.817 11.382 -1.822 1.00 0.00 O ATOM 1501 CB ALA A 94 4.775 12.250 -4.978 1.00 0.00 C ATOM 0 H ALA A 94 2.424 12.059 -4.276 1.00 0.00 H new ATOM 0 HA ALA A 94 4.693 10.433 -3.851 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.861 12.243 -5.067 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.335 11.791 -5.863 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.425 13.279 -4.890 1.00 0.00 H new ATOM 1507 N PRO A 95 4.710 13.310 -2.189 1.00 0.00 N ATOM 1508 CA PRO A 95 5.269 14.005 -1.026 1.00 0.00 C ATOM 1509 C PRO A 95 4.742 13.447 0.292 1.00 0.00 C ATOM 1510 O PRO A 95 5.387 13.574 1.333 1.00 0.00 O ATOM 1511 CB PRO A 95 4.802 15.450 -1.218 1.00 0.00 C ATOM 1512 CG PRO A 95 3.569 15.343 -2.047 1.00 0.00 C ATOM 1513 CD PRO A 95 3.779 14.159 -2.950 1.00 0.00 C ATOM 0 HA PRO A 95 6.352 13.896 -0.968 1.00 0.00 H new ATOM 0 HB2 PRO A 95 4.595 15.930 -0.261 1.00 0.00 H new ATOM 0 HB3 PRO A 95 5.564 16.049 -1.717 1.00 0.00 H new ATOM 0 HG2 PRO A 95 2.688 15.204 -1.420 1.00 0.00 H new ATOM 0 HG3 PRO A 95 3.408 16.252 -2.626 1.00 0.00 H new ATOM 0 HD2 PRO A 95 2.843 13.642 -3.159 1.00 0.00 H new ATOM 0 HD3 PRO A 95 4.200 14.456 -3.911 1.00 0.00 H new ATOM 1521 N ARG A 96 3.567 12.828 0.239 1.00 0.00 N ATOM 1522 CA ARG A 96 2.954 12.250 1.429 1.00 0.00 C ATOM 1523 C ARG A 96 3.577 10.897 1.759 1.00 0.00 C ATOM 1524 O ARG A 96 3.856 10.597 2.921 1.00 0.00 O ATOM 1525 CB ARG A 96 1.446 12.093 1.226 1.00 0.00 C ATOM 1526 CG ARG A 96 0.720 11.553 2.448 1.00 0.00 C ATOM 1527 CD ARG A 96 0.611 12.604 3.541 1.00 0.00 C ATOM 1528 NE ARG A 96 -0.083 12.097 4.722 1.00 0.00 N ATOM 1529 CZ ARG A 96 -0.110 12.732 5.888 1.00 0.00 C ATOM 1530 NH1 ARG A 96 0.513 13.894 6.029 1.00 0.00 N ATOM 1531 NH2 ARG A 96 -0.764 12.206 6.916 1.00 0.00 N ATOM 0 H ARG A 96 3.021 12.714 -0.615 1.00 0.00 H new ATOM 0 HA ARG A 96 3.133 12.927 2.265 1.00 0.00 H new ATOM 0 HB2 ARG A 96 1.021 13.061 0.960 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.269 11.424 0.384 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -0.277 11.219 2.162 1.00 0.00 H new ATOM 0 HG3 ARG A 96 1.250 10.681 2.832 1.00 0.00 H new ATOM 0 HD2 ARG A 96 1.609 12.938 3.823 1.00 0.00 H new ATOM 0 HD3 ARG A 96 0.081 13.475 3.155 1.00 0.00 H new ATOM 0 HE ARG A 96 -0.574 11.206 4.647 1.00 0.00 H new ATOM 0 HH11 ARG A 96 1.015 14.303 5.241 1.00 0.00 H new ATOM 0 HH12 ARG A 96 0.490 14.379 6.926 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -1.246 11.313 6.811 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -0.784 12.694 7.811 1.00 0.00 H new ATOM 1545 N PHE A 97 3.792 10.083 0.731 1.00 0.00 N ATOM 1546 CA PHE A 97 4.380 8.761 0.912 1.00 0.00 C ATOM 1547 C PHE A 97 5.821 8.870 1.401 1.00 0.00 C ATOM 1548 O PHE A 97 6.275 8.062 2.212 1.00 0.00 O ATOM 1549 CB PHE A 97 4.333 7.975 -0.400 1.00 0.00 C ATOM 1550 CG PHE A 97 3.027 7.269 -0.629 1.00 0.00 C ATOM 1551 CD1 PHE A 97 2.444 6.519 0.379 1.00 0.00 C ATOM 1552 CD2 PHE A 97 2.383 7.357 -1.853 1.00 0.00 C ATOM 1553 CE1 PHE A 97 1.243 5.868 0.170 1.00 0.00 C ATOM 1554 CE2 PHE A 97 1.181 6.708 -2.067 1.00 0.00 C ATOM 1555 CZ PHE A 97 0.610 5.964 -1.054 1.00 0.00 C ATOM 0 H PHE A 97 3.568 10.316 -0.236 1.00 0.00 H new ATOM 0 HA PHE A 97 3.798 8.231 1.666 1.00 0.00 H new ATOM 0 HB2 PHE A 97 4.519 8.657 -1.230 1.00 0.00 H new ATOM 0 HB3 PHE A 97 5.139 7.241 -0.404 1.00 0.00 H new ATOM 0 HD1 PHE A 97 2.933 6.442 1.339 1.00 0.00 H new ATOM 0 HD2 PHE A 97 2.825 7.939 -2.648 1.00 0.00 H new ATOM 0 HE1 PHE A 97 0.800 5.284 0.963 1.00 0.00 H new ATOM 0 HE2 PHE A 97 0.689 6.783 -3.026 1.00 0.00 H new ATOM 0 HZ PHE A 97 -0.330 5.458 -1.218 1.00 0.00 H new ATOM 1565 N SER A 98 6.535 9.874 0.902 1.00 0.00 N ATOM 1566 CA SER A 98 7.926 10.086 1.285 1.00 0.00 C ATOM 1567 C SER A 98 8.054 10.263 2.795 1.00 0.00 C ATOM 1568 O SER A 98 9.086 9.944 3.383 1.00 0.00 O ATOM 1569 CB SER A 98 8.493 11.312 0.566 1.00 0.00 C ATOM 1570 OG SER A 98 7.711 12.464 0.829 1.00 0.00 O ATOM 0 H SER A 98 6.174 10.553 0.232 1.00 0.00 H new ATOM 0 HA SER A 98 8.496 9.205 0.991 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.520 11.484 0.889 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.523 11.126 -0.508 1.00 0.00 H new ATOM 0 HG SER A 98 6.855 12.195 1.223 1.00 0.00 H new ATOM 1576 N ASN A 99 6.996 10.775 3.415 1.00 0.00 N ATOM 1577 CA ASN A 99 6.988 10.996 4.857 1.00 0.00 C ATOM 1578 C ASN A 99 7.506 9.767 5.598 1.00 0.00 C ATOM 1579 O ASN A 99 8.580 9.798 6.197 1.00 0.00 O ATOM 1580 CB ASN A 99 5.575 11.336 5.334 1.00 0.00 C ATOM 1581 CG ASN A 99 5.086 12.666 4.794 1.00 0.00 C ATOM 1582 OD1 ASN A 99 5.878 13.494 4.342 1.00 0.00 O ATOM 1583 ND2 ASN A 99 3.776 12.877 4.837 1.00 0.00 N ATOM 0 H ASN A 99 6.133 11.045 2.942 1.00 0.00 H new ATOM 0 HA ASN A 99 7.649 11.835 5.075 1.00 0.00 H new ATOM 0 HB2 ASN A 99 4.890 10.547 5.023 1.00 0.00 H new ATOM 0 HB3 ASN A 99 5.559 11.361 6.424 1.00 0.00 H new ATOM 0 HD21 ASN A 99 3.389 13.753 4.487 1.00 0.00 H new ATOM 0 HD22 ASN A 99 3.157 12.163 5.220 1.00 0.00 H new ATOM 1590 N ASN A 100 6.734 8.686 5.552 1.00 0.00 N ATOM 1591 CA ASN A 100 7.114 7.446 6.219 1.00 0.00 C ATOM 1592 C ASN A 100 7.431 6.356 5.201 1.00 0.00 C ATOM 1593 O ASN A 100 7.452 5.170 5.532 1.00 0.00 O ATOM 1594 CB ASN A 100 5.993 6.980 7.151 1.00 0.00 C ATOM 1595 CG ASN A 100 5.299 8.136 7.845 1.00 0.00 C ATOM 1596 OD1 ASN A 100 4.206 8.544 7.452 1.00 0.00 O ATOM 1597 ND2 ASN A 100 5.934 8.670 8.882 1.00 0.00 N ATOM 0 H ASN A 100 5.842 8.644 5.060 1.00 0.00 H new ATOM 0 HA ASN A 100 8.010 7.639 6.808 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.261 6.412 6.578 1.00 0.00 H new ATOM 0 HB3 ASN A 100 6.405 6.304 7.901 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.517 9.451 9.388 1.00 0.00 H new ATOM 0 HD22 ASN A 100 6.839 8.299 9.172 1.00 0.00 H new ATOM 1604 N ILE A 101 7.676 6.765 3.961 1.00 0.00 N ATOM 1605 CA ILE A 101 7.993 5.823 2.894 1.00 0.00 C ATOM 1606 C ILE A 101 8.822 4.657 3.420 1.00 0.00 C ATOM 1607 O ILE A 101 8.554 3.498 3.101 1.00 0.00 O ATOM 1608 CB ILE A 101 8.761 6.508 1.748 1.00 0.00 C ATOM 1609 CG1 ILE A 101 9.093 5.495 0.651 1.00 0.00 C ATOM 1610 CG2 ILE A 101 10.030 7.160 2.276 1.00 0.00 C ATOM 1611 CD1 ILE A 101 8.025 5.389 -0.416 1.00 0.00 C ATOM 0 H ILE A 101 7.661 7.742 3.670 1.00 0.00 H new ATOM 0 HA ILE A 101 7.044 5.448 2.511 1.00 0.00 H new ATOM 0 HB ILE A 101 8.128 7.285 1.320 1.00 0.00 H new ATOM 0 HG12 ILE A 101 10.037 5.775 0.183 1.00 0.00 H new ATOM 0 HG13 ILE A 101 9.240 4.515 1.105 1.00 0.00 H new ATOM 0 HG21 ILE A 101 10.562 7.640 1.454 1.00 0.00 H new ATOM 0 HG22 ILE A 101 9.770 7.907 3.026 1.00 0.00 H new ATOM 0 HG23 ILE A 101 10.669 6.401 2.727 1.00 0.00 H new ATOM 0 HD11 ILE A 101 8.327 4.653 -1.161 1.00 0.00 H new ATOM 0 HD12 ILE A 101 7.085 5.079 0.040 1.00 0.00 H new ATOM 0 HD13 ILE A 101 7.893 6.358 -0.897 1.00 0.00 H new ATOM 1623 N ILE A 102 9.829 4.970 4.229 1.00 0.00 N ATOM 1624 CA ILE A 102 10.695 3.947 4.802 1.00 0.00 C ATOM 1625 C ILE A 102 9.882 2.886 5.535 1.00 0.00 C ATOM 1626 O ILE A 102 9.947 1.702 5.205 1.00 0.00 O ATOM 1627 CB ILE A 102 11.719 4.558 5.777 1.00 0.00 C ATOM 1628 CG1 ILE A 102 12.532 5.650 5.079 1.00 0.00 C ATOM 1629 CG2 ILE A 102 12.636 3.477 6.327 1.00 0.00 C ATOM 1630 CD1 ILE A 102 13.398 5.131 3.952 1.00 0.00 C ATOM 0 H ILE A 102 10.065 5.924 4.502 1.00 0.00 H new ATOM 0 HA ILE A 102 11.228 3.483 3.972 1.00 0.00 H new ATOM 0 HB ILE A 102 11.181 5.009 6.611 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.850 6.404 4.685 1.00 0.00 H new ATOM 0 HG13 ILE A 102 13.165 6.146 5.814 1.00 0.00 H new ATOM 0 HG21 ILE A 102 13.354 3.924 7.014 1.00 0.00 H new ATOM 0 HG22 ILE A 102 12.043 2.731 6.856 1.00 0.00 H new ATOM 0 HG23 ILE A 102 13.169 3.000 5.505 1.00 0.00 H new ATOM 0 HD11 ILE A 102 13.946 5.959 3.503 1.00 0.00 H new ATOM 0 HD12 ILE A 102 14.104 4.399 4.343 1.00 0.00 H new ATOM 0 HD13 ILE A 102 12.769 4.660 3.197 1.00 0.00 H new ATOM 1642 N SER A 103 9.115 3.319 6.531 1.00 0.00 N ATOM 1643 CA SER A 103 8.290 2.406 7.313 1.00 0.00 C ATOM 1644 C SER A 103 7.378 1.586 6.406 1.00 0.00 C ATOM 1645 O SER A 103 7.116 0.411 6.666 1.00 0.00 O ATOM 1646 CB SER A 103 7.452 3.185 8.329 1.00 0.00 C ATOM 1647 OG SER A 103 7.161 2.391 9.466 1.00 0.00 O ATOM 0 H SER A 103 9.048 4.296 6.815 1.00 0.00 H new ATOM 0 HA SER A 103 8.952 1.724 7.846 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.989 4.082 8.636 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.523 3.513 7.863 1.00 0.00 H new ATOM 0 HG SER A 103 6.626 2.912 10.101 1.00 0.00 H new ATOM 1653 N THR A 104 6.895 2.214 5.338 1.00 0.00 N ATOM 1654 CA THR A 104 6.011 1.545 4.392 1.00 0.00 C ATOM 1655 C THR A 104 6.739 0.426 3.657 1.00 0.00 C ATOM 1656 O THR A 104 6.214 -0.678 3.511 1.00 0.00 O ATOM 1657 CB THR A 104 5.441 2.536 3.360 1.00 0.00 C ATOM 1658 OG1 THR A 104 4.432 3.350 3.968 1.00 0.00 O ATOM 1659 CG2 THR A 104 4.852 1.796 2.168 1.00 0.00 C ATOM 0 H THR A 104 7.102 3.186 5.107 1.00 0.00 H new ATOM 0 HA THR A 104 5.190 1.122 4.971 1.00 0.00 H new ATOM 0 HB THR A 104 6.255 3.169 3.009 1.00 0.00 H new ATOM 0 HG1 THR A 104 4.303 4.163 3.436 1.00 0.00 H new ATOM 0 HG21 THR A 104 4.455 2.516 1.452 1.00 0.00 H new ATOM 0 HG22 THR A 104 5.629 1.200 1.690 1.00 0.00 H new ATOM 0 HG23 THR A 104 4.049 1.141 2.507 1.00 0.00 H new ATOM 1667 N PHE A 105 7.951 0.717 3.196 1.00 0.00 N ATOM 1668 CA PHE A 105 8.751 -0.267 2.475 1.00 0.00 C ATOM 1669 C PHE A 105 9.199 -1.391 3.405 1.00 0.00 C ATOM 1670 O PHE A 105 9.235 -2.556 3.012 1.00 0.00 O ATOM 1671 CB PHE A 105 9.972 0.404 1.842 1.00 0.00 C ATOM 1672 CG PHE A 105 9.723 0.914 0.451 1.00 0.00 C ATOM 1673 CD1 PHE A 105 8.679 1.788 0.197 1.00 0.00 C ATOM 1674 CD2 PHE A 105 10.531 0.517 -0.601 1.00 0.00 C ATOM 1675 CE1 PHE A 105 8.446 2.260 -1.081 1.00 0.00 C ATOM 1676 CE2 PHE A 105 10.304 0.986 -1.882 1.00 0.00 C ATOM 1677 CZ PHE A 105 9.260 1.857 -2.122 1.00 0.00 C ATOM 0 H PHE A 105 8.401 1.626 3.309 1.00 0.00 H new ATOM 0 HA PHE A 105 8.131 -0.697 1.688 1.00 0.00 H new ATOM 0 HB2 PHE A 105 10.288 1.234 2.473 1.00 0.00 H new ATOM 0 HB3 PHE A 105 10.796 -0.309 1.817 1.00 0.00 H new ATOM 0 HD1 PHE A 105 8.039 2.105 1.007 1.00 0.00 H new ATOM 0 HD2 PHE A 105 11.347 -0.166 -0.419 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.629 2.942 -1.265 1.00 0.00 H new ATOM 0 HE2 PHE A 105 10.943 0.671 -2.694 1.00 0.00 H new ATOM 0 HZ PHE A 105 9.080 2.223 -3.122 1.00 0.00 H new ATOM 1687 N GLN A 106 9.539 -1.030 4.638 1.00 0.00 N ATOM 1688 CA GLN A 106 9.986 -2.008 5.623 1.00 0.00 C ATOM 1689 C GLN A 106 9.012 -3.179 5.709 1.00 0.00 C ATOM 1690 O GLN A 106 9.422 -4.332 5.831 1.00 0.00 O ATOM 1691 CB GLN A 106 10.132 -1.349 6.996 1.00 0.00 C ATOM 1692 CG GLN A 106 11.350 -0.447 7.112 1.00 0.00 C ATOM 1693 CD GLN A 106 12.655 -1.212 7.004 1.00 0.00 C ATOM 1694 OE1 GLN A 106 12.681 -2.438 7.118 1.00 0.00 O ATOM 1695 NE2 GLN A 106 13.747 -0.490 6.783 1.00 0.00 N ATOM 0 H GLN A 106 9.514 -0.069 4.978 1.00 0.00 H new ATOM 0 HA GLN A 106 10.956 -2.389 5.305 1.00 0.00 H new ATOM 0 HB2 GLN A 106 9.236 -0.765 7.206 1.00 0.00 H new ATOM 0 HB3 GLN A 106 10.192 -2.126 7.758 1.00 0.00 H new ATOM 0 HG2 GLN A 106 11.312 0.311 6.330 1.00 0.00 H new ATOM 0 HG3 GLN A 106 11.319 0.078 8.067 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.679 0.524 6.695 1.00 0.00 H new ATOM 0 HE22 GLN A 106 14.654 -0.949 6.701 1.00 0.00 H new ATOM 1704 N ASN A 107 7.720 -2.873 5.644 1.00 0.00 N ATOM 1705 CA ASN A 107 6.687 -3.900 5.715 1.00 0.00 C ATOM 1706 C ASN A 107 6.626 -4.701 4.417 1.00 0.00 C ATOM 1707 O ASN A 107 6.093 -5.811 4.384 1.00 0.00 O ATOM 1708 CB ASN A 107 5.325 -3.265 6.000 1.00 0.00 C ATOM 1709 CG ASN A 107 5.345 -2.384 7.234 1.00 0.00 C ATOM 1710 OD1 ASN A 107 6.311 -2.387 7.997 1.00 0.00 O ATOM 1711 ND2 ASN A 107 4.275 -1.624 7.436 1.00 0.00 N ATOM 0 H ASN A 107 7.364 -1.923 5.542 1.00 0.00 H new ATOM 0 HA ASN A 107 6.941 -4.579 6.529 1.00 0.00 H new ATOM 0 HB2 ASN A 107 5.016 -2.673 5.139 1.00 0.00 H new ATOM 0 HB3 ASN A 107 4.581 -4.051 6.130 1.00 0.00 H new ATOM 0 HD21 ASN A 107 4.231 -1.011 8.250 1.00 0.00 H new ATOM 0 HD22 ASN A 107 3.497 -1.653 6.777 1.00 0.00 H new ATOM 1718 N LEU A 108 7.175 -4.131 3.351 1.00 0.00 N ATOM 1719 CA LEU A 108 7.185 -4.791 2.050 1.00 0.00 C ATOM 1720 C LEU A 108 8.447 -5.629 1.873 1.00 0.00 C ATOM 1721 O LEU A 108 8.454 -6.609 1.128 1.00 0.00 O ATOM 1722 CB LEU A 108 7.086 -3.754 0.929 1.00 0.00 C ATOM 1723 CG LEU A 108 5.885 -2.810 0.992 1.00 0.00 C ATOM 1724 CD1 LEU A 108 6.118 -1.591 0.114 1.00 0.00 C ATOM 1725 CD2 LEU A 108 4.614 -3.535 0.575 1.00 0.00 C ATOM 0 H LEU A 108 7.619 -3.213 3.361 1.00 0.00 H new ATOM 0 HA LEU A 108 6.321 -5.454 2.001 1.00 0.00 H new ATOM 0 HB2 LEU A 108 7.996 -3.153 0.936 1.00 0.00 H new ATOM 0 HB3 LEU A 108 7.059 -4.281 -0.025 1.00 0.00 H new ATOM 0 HG LEU A 108 5.766 -2.473 2.022 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.253 -0.931 0.171 1.00 0.00 H new ATOM 0 HD12 LEU A 108 7.005 -1.059 0.459 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.264 -1.909 -0.918 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.770 -2.848 0.626 1.00 0.00 H new ATOM 0 HD22 LEU A 108 4.722 -3.902 -0.446 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.438 -4.376 1.246 1.00 0.00 H new ATOM 1737 N TYR A 109 9.512 -5.238 2.565 1.00 0.00 N ATOM 1738 CA TYR A 109 10.780 -5.953 2.484 1.00 0.00 C ATOM 1739 C TYR A 109 10.777 -7.173 3.400 1.00 0.00 C ATOM 1740 O TYR A 109 11.758 -7.913 3.470 1.00 0.00 O ATOM 1741 CB TYR A 109 11.937 -5.024 2.857 1.00 0.00 C ATOM 1742 CG TYR A 109 12.279 -4.020 1.779 1.00 0.00 C ATOM 1743 CD1 TYR A 109 12.456 -4.419 0.461 1.00 0.00 C ATOM 1744 CD2 TYR A 109 12.423 -2.671 2.080 1.00 0.00 C ATOM 1745 CE1 TYR A 109 12.769 -3.505 -0.526 1.00 0.00 C ATOM 1746 CE2 TYR A 109 12.734 -1.750 1.099 1.00 0.00 C ATOM 1747 CZ TYR A 109 12.907 -2.172 -0.202 1.00 0.00 C ATOM 1748 OH TYR A 109 13.217 -1.257 -1.183 1.00 0.00 O ATOM 0 H TYR A 109 9.522 -4.430 3.188 1.00 0.00 H new ATOM 0 HA TYR A 109 10.912 -6.293 1.457 1.00 0.00 H new ATOM 0 HB2 TYR A 109 11.682 -4.489 3.772 1.00 0.00 H new ATOM 0 HB3 TYR A 109 12.819 -5.626 3.075 1.00 0.00 H new ATOM 0 HD1 TYR A 109 12.347 -5.462 0.203 1.00 0.00 H new ATOM 0 HD2 TYR A 109 12.289 -2.337 3.098 1.00 0.00 H new ATOM 0 HE1 TYR A 109 12.905 -3.833 -1.546 1.00 0.00 H new ATOM 0 HE2 TYR A 109 12.841 -0.705 1.350 1.00 0.00 H new ATOM 0 HH TYR A 109 13.756 -0.535 -0.798 1.00 0.00 H new ATOM 1758 N ARG A 110 9.665 -7.376 4.100 1.00 0.00 N ATOM 1759 CA ARG A 110 9.533 -8.505 5.012 1.00 0.00 C ATOM 1760 C ARG A 110 9.325 -9.806 4.241 1.00 0.00 C ATOM 1761 O ARG A 110 9.415 -10.896 4.808 1.00 0.00 O ATOM 1762 CB ARG A 110 8.365 -8.278 5.974 1.00 0.00 C ATOM 1763 CG ARG A 110 8.277 -6.854 6.499 1.00 0.00 C ATOM 1764 CD ARG A 110 7.490 -6.788 7.799 1.00 0.00 C ATOM 1765 NE ARG A 110 7.905 -7.822 8.743 1.00 0.00 N ATOM 1766 CZ ARG A 110 8.956 -7.705 9.546 1.00 0.00 C ATOM 1767 NH1 ARG A 110 9.696 -6.605 9.519 1.00 0.00 N ATOM 1768 NH2 ARG A 110 9.270 -8.690 10.378 1.00 0.00 N ATOM 0 H ARG A 110 8.843 -6.773 4.053 1.00 0.00 H new ATOM 0 HA ARG A 110 10.457 -8.586 5.585 1.00 0.00 H new ATOM 0 HB2 ARG A 110 7.433 -8.527 5.466 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.461 -8.962 6.817 1.00 0.00 H new ATOM 0 HG2 ARG A 110 9.281 -6.461 6.660 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.802 -6.218 5.752 1.00 0.00 H new ATOM 0 HD2 ARG A 110 7.624 -5.807 8.254 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.427 -6.898 7.585 1.00 0.00 H new ATOM 0 HE ARG A 110 7.357 -8.681 8.788 1.00 0.00 H new ATOM 0 HH11 ARG A 110 9.458 -5.846 8.880 1.00 0.00 H new ATOM 0 HH12 ARG A 110 10.503 -6.518 10.137 1.00 0.00 H new ATOM 0 HH21 ARG A 110 8.704 -9.538 10.401 1.00 0.00 H new ATOM 0 HH22 ARG A 110 10.078 -8.599 10.994 1.00 0.00 H new ATOM 1782 N CYS A 111 9.047 -9.683 2.948 1.00 0.00 N ATOM 1783 CA CYS A 111 8.825 -10.848 2.100 1.00 0.00 C ATOM 1784 C CYS A 111 10.007 -11.809 2.176 1.00 0.00 C ATOM 1785 O CYS A 111 11.109 -11.446 2.590 1.00 0.00 O ATOM 1786 CB CYS A 111 8.598 -10.414 0.651 1.00 0.00 C ATOM 1787 SG CYS A 111 9.592 -8.992 0.142 1.00 0.00 S ATOM 0 H CYS A 111 8.970 -8.788 2.464 1.00 0.00 H new ATOM 0 HA CYS A 111 7.936 -11.365 2.461 1.00 0.00 H new ATOM 0 HB2 CYS A 111 8.820 -11.254 -0.008 1.00 0.00 H new ATOM 0 HB3 CYS A 111 7.543 -10.174 0.516 1.00 0.00 H new ATOM 0 HG CYS A 111 9.226 -7.943 0.817 1.00 0.00 H new ATOM 1793 N PRO A 112 9.776 -13.066 1.769 1.00 0.00 N ATOM 1794 CA PRO A 112 10.809 -14.106 1.782 1.00 0.00 C ATOM 1795 C PRO A 112 12.117 -13.631 1.159 1.00 0.00 C ATOM 1796 O PRO A 112 13.174 -14.216 1.389 1.00 0.00 O ATOM 1797 CB PRO A 112 10.193 -15.228 0.943 1.00 0.00 C ATOM 1798 CG PRO A 112 8.722 -15.036 1.074 1.00 0.00 C ATOM 1799 CD PRO A 112 8.487 -13.568 1.263 1.00 0.00 C ATOM 0 HA PRO A 112 11.071 -14.408 2.796 1.00 0.00 H new ATOM 0 HB2 PRO A 112 10.509 -15.163 -0.098 1.00 0.00 H new ATOM 0 HB3 PRO A 112 10.498 -16.209 1.308 1.00 0.00 H new ATOM 0 HG2 PRO A 112 8.205 -15.398 0.185 1.00 0.00 H new ATOM 0 HG3 PRO A 112 8.333 -15.601 1.921 1.00 0.00 H new ATOM 0 HD2 PRO A 112 8.209 -13.084 0.327 1.00 0.00 H new ATOM 0 HD3 PRO A 112 7.679 -13.380 1.971 1.00 0.00 H new ATOM 1807 N GLY A 113 12.038 -12.565 0.368 1.00 0.00 N ATOM 1808 CA GLY A 113 13.224 -12.030 -0.276 1.00 0.00 C ATOM 1809 C GLY A 113 13.188 -12.192 -1.783 1.00 0.00 C ATOM 1810 O GLY A 113 13.659 -11.325 -2.519 1.00 0.00 O ATOM 0 H GLY A 113 11.175 -12.063 0.162 1.00 0.00 H new ATOM 0 HA2 GLY A 113 13.322 -10.973 -0.029 1.00 0.00 H new ATOM 0 HA3 GLY A 113 14.107 -12.533 0.119 1.00 0.00 H new ATOM 1814 N ASP A 114 12.630 -13.306 -2.243 1.00 0.00 N ATOM 1815 CA ASP A 114 12.535 -13.580 -3.673 1.00 0.00 C ATOM 1816 C ASP A 114 11.534 -12.643 -4.340 1.00 0.00 C ATOM 1817 O ASP A 114 11.322 -12.705 -5.551 1.00 0.00 O ATOM 1818 CB ASP A 114 12.127 -15.035 -3.909 1.00 0.00 C ATOM 1819 CG ASP A 114 12.775 -15.985 -2.921 1.00 0.00 C ATOM 1820 OD1 ASP A 114 13.920 -15.717 -2.502 1.00 0.00 O ATOM 1821 OD2 ASP A 114 12.135 -16.997 -2.566 1.00 0.00 O ATOM 0 H ASP A 114 12.236 -14.034 -1.647 1.00 0.00 H new ATOM 0 HA ASP A 114 13.516 -13.410 -4.117 1.00 0.00 H new ATOM 0 HB2 ASP A 114 11.043 -15.122 -3.835 1.00 0.00 H new ATOM 0 HB3 ASP A 114 12.402 -15.327 -4.923 1.00 0.00 H new ATOM 1826 N ASP A 115 10.920 -11.776 -3.542 1.00 0.00 N ATOM 1827 CA ASP A 115 9.940 -10.826 -4.056 1.00 0.00 C ATOM 1828 C ASP A 115 10.500 -9.407 -4.042 1.00 0.00 C ATOM 1829 O ASP A 115 9.965 -8.510 -4.694 1.00 0.00 O ATOM 1830 CB ASP A 115 8.655 -10.888 -3.228 1.00 0.00 C ATOM 1831 CG ASP A 115 8.390 -12.275 -2.675 1.00 0.00 C ATOM 1832 OD1 ASP A 115 9.266 -12.805 -1.960 1.00 0.00 O ATOM 1833 OD2 ASP A 115 7.307 -12.829 -2.957 1.00 0.00 O ATOM 0 H ASP A 115 11.083 -11.711 -2.537 1.00 0.00 H new ATOM 0 HA ASP A 115 9.713 -11.098 -5.087 1.00 0.00 H new ATOM 0 HB2 ASP A 115 8.723 -10.178 -2.404 1.00 0.00 H new ATOM 0 HB3 ASP A 115 7.812 -10.579 -3.846 1.00 0.00 H new ATOM 1838 N LYS A 116 11.580 -9.210 -3.294 1.00 0.00 N ATOM 1839 CA LYS A 116 12.214 -7.901 -3.194 1.00 0.00 C ATOM 1840 C LYS A 116 12.394 -7.277 -4.574 1.00 0.00 C ATOM 1841 O LYS A 116 12.213 -6.072 -4.749 1.00 0.00 O ATOM 1842 CB LYS A 116 13.571 -8.020 -2.496 1.00 0.00 C ATOM 1843 CG LYS A 116 13.501 -7.818 -0.992 1.00 0.00 C ATOM 1844 CD LYS A 116 14.656 -8.504 -0.283 1.00 0.00 C ATOM 1845 CE LYS A 116 14.569 -8.326 1.225 1.00 0.00 C ATOM 1846 NZ LYS A 116 15.311 -7.119 1.685 1.00 0.00 N ATOM 0 H LYS A 116 12.035 -9.941 -2.747 1.00 0.00 H new ATOM 0 HA LYS A 116 11.564 -7.255 -2.604 1.00 0.00 H new ATOM 0 HB2 LYS A 116 13.992 -9.004 -2.703 1.00 0.00 H new ATOM 0 HB3 LYS A 116 14.255 -7.285 -2.921 1.00 0.00 H new ATOM 0 HG2 LYS A 116 13.516 -6.752 -0.766 1.00 0.00 H new ATOM 0 HG3 LYS A 116 12.557 -8.211 -0.615 1.00 0.00 H new ATOM 0 HD2 LYS A 116 14.654 -9.567 -0.526 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.600 -8.096 -0.645 1.00 0.00 H new ATOM 0 HE2 LYS A 116 13.523 -8.244 1.521 1.00 0.00 H new ATOM 0 HE3 LYS A 116 14.972 -9.210 1.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 15.863 -7.354 2.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 15.954 -6.799 0.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 14.635 -6.361 1.909 1.00 0.00 H new ATOM 1860 N SER A 117 12.749 -8.105 -5.551 1.00 0.00 N ATOM 1861 CA SER A 117 12.955 -7.633 -6.916 1.00 0.00 C ATOM 1862 C SER A 117 11.803 -6.737 -7.361 1.00 0.00 C ATOM 1863 O SER A 117 12.016 -5.628 -7.850 1.00 0.00 O ATOM 1864 CB SER A 117 13.093 -8.819 -7.872 1.00 0.00 C ATOM 1865 OG SER A 117 14.415 -9.329 -7.865 1.00 0.00 O ATOM 0 H SER A 117 12.900 -9.106 -5.423 1.00 0.00 H new ATOM 0 HA SER A 117 13.875 -7.049 -6.938 1.00 0.00 H new ATOM 0 HB2 SER A 117 12.395 -9.605 -7.584 1.00 0.00 H new ATOM 0 HB3 SER A 117 12.825 -8.509 -8.882 1.00 0.00 H new ATOM 0 HG SER A 117 14.476 -10.087 -8.483 1.00 0.00 H new ATOM 1871 N LYS A 118 10.580 -7.227 -7.188 1.00 0.00 N ATOM 1872 CA LYS A 118 9.392 -6.473 -7.569 1.00 0.00 C ATOM 1873 C LYS A 118 9.282 -5.185 -6.760 1.00 0.00 C ATOM 1874 O LYS A 118 8.567 -4.259 -7.144 1.00 0.00 O ATOM 1875 CB LYS A 118 8.136 -7.324 -7.367 1.00 0.00 C ATOM 1876 CG LYS A 118 7.809 -8.216 -8.552 1.00 0.00 C ATOM 1877 CD LYS A 118 8.532 -9.549 -8.463 1.00 0.00 C ATOM 1878 CE LYS A 118 7.952 -10.564 -9.436 1.00 0.00 C ATOM 1879 NZ LYS A 118 6.528 -10.875 -9.129 1.00 0.00 N ATOM 0 H LYS A 118 10.386 -8.144 -6.786 1.00 0.00 H new ATOM 0 HA LYS A 118 9.481 -6.212 -8.624 1.00 0.00 H new ATOM 0 HB2 LYS A 118 8.267 -7.945 -6.481 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.289 -6.666 -7.173 1.00 0.00 H new ATOM 0 HG2 LYS A 118 6.733 -8.387 -8.594 1.00 0.00 H new ATOM 0 HG3 LYS A 118 8.088 -7.711 -9.477 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.591 -9.404 -8.675 1.00 0.00 H new ATOM 0 HD3 LYS A 118 8.460 -9.936 -7.446 1.00 0.00 H new ATOM 0 HE2 LYS A 118 8.029 -10.178 -10.452 1.00 0.00 H new ATOM 0 HE3 LYS A 118 8.540 -11.481 -9.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 6.402 -11.906 -9.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 6.268 -10.446 -8.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 5.919 -10.490 -9.879 1.00 0.00 H new ATOM 1893 N ILE A 119 9.995 -5.132 -5.640 1.00 0.00 N ATOM 1894 CA ILE A 119 9.979 -3.957 -4.779 1.00 0.00 C ATOM 1895 C ILE A 119 11.090 -2.983 -5.157 1.00 0.00 C ATOM 1896 O ILE A 119 10.912 -1.766 -5.097 1.00 0.00 O ATOM 1897 CB ILE A 119 10.133 -4.343 -3.296 1.00 0.00 C ATOM 1898 CG1 ILE A 119 9.107 -5.413 -2.916 1.00 0.00 C ATOM 1899 CG2 ILE A 119 9.979 -3.115 -2.410 1.00 0.00 C ATOM 1900 CD1 ILE A 119 9.300 -5.966 -1.522 1.00 0.00 C ATOM 0 H ILE A 119 10.591 -5.890 -5.308 1.00 0.00 H new ATOM 0 HA ILE A 119 9.012 -3.475 -4.922 1.00 0.00 H new ATOM 0 HB ILE A 119 11.131 -4.753 -3.144 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.106 -4.989 -2.995 1.00 0.00 H new ATOM 0 HG13 ILE A 119 9.164 -6.231 -3.634 1.00 0.00 H new ATOM 0 HG21 ILE A 119 10.090 -3.404 -1.365 1.00 0.00 H new ATOM 0 HG22 ILE A 119 10.744 -2.382 -2.667 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.992 -2.678 -2.562 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.538 -6.719 -1.321 1.00 0.00 H new ATOM 0 HD12 ILE A 119 10.288 -6.420 -1.444 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.213 -5.159 -0.795 1.00 0.00 H new ATOM 1912 N VAL A 120 12.238 -3.527 -5.548 1.00 0.00 N ATOM 1913 CA VAL A 120 13.379 -2.707 -5.939 1.00 0.00 C ATOM 1914 C VAL A 120 13.244 -2.229 -7.381 1.00 0.00 C ATOM 1915 O VAL A 120 13.892 -1.266 -7.789 1.00 0.00 O ATOM 1916 CB VAL A 120 14.703 -3.479 -5.788 1.00 0.00 C ATOM 1917 CG1 VAL A 120 14.757 -4.189 -4.444 1.00 0.00 C ATOM 1918 CG2 VAL A 120 14.877 -4.468 -6.930 1.00 0.00 C ATOM 0 H VAL A 120 12.403 -4.532 -5.602 1.00 0.00 H new ATOM 0 HA VAL A 120 13.392 -1.844 -5.273 1.00 0.00 H new ATOM 0 HB VAL A 120 15.526 -2.765 -5.828 1.00 0.00 H new ATOM 0 HG11 VAL A 120 15.700 -4.729 -4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 120 14.682 -3.455 -3.642 1.00 0.00 H new ATOM 0 HG13 VAL A 120 13.928 -4.892 -4.371 1.00 0.00 H new ATOM 0 HG21 VAL A 120 15.818 -5.004 -6.807 1.00 0.00 H new ATOM 0 HG22 VAL A 120 14.051 -5.179 -6.925 1.00 0.00 H new ATOM 0 HG23 VAL A 120 14.887 -3.931 -7.878 1.00 0.00 H new ATOM 1928 N ARG A 121 12.396 -2.909 -8.146 1.00 0.00 N ATOM 1929 CA ARG A 121 12.176 -2.554 -9.543 1.00 0.00 C ATOM 1930 C ARG A 121 11.393 -1.249 -9.656 1.00 0.00 C ATOM 1931 O ARG A 121 11.540 -0.507 -10.627 1.00 0.00 O ATOM 1932 CB ARG A 121 11.425 -3.676 -10.264 1.00 0.00 C ATOM 1933 CG ARG A 121 9.929 -3.675 -9.999 1.00 0.00 C ATOM 1934 CD ARG A 121 9.194 -4.603 -10.953 1.00 0.00 C ATOM 1935 NE ARG A 121 7.831 -4.148 -11.218 1.00 0.00 N ATOM 1936 CZ ARG A 121 7.147 -4.474 -12.309 1.00 0.00 C ATOM 1937 NH1 ARG A 121 7.695 -5.253 -13.232 1.00 0.00 N ATOM 1938 NH2 ARG A 121 5.912 -4.020 -12.480 1.00 0.00 N ATOM 0 H ARG A 121 11.851 -3.708 -7.822 1.00 0.00 H new ATOM 0 HA ARG A 121 13.149 -2.416 -10.014 1.00 0.00 H new ATOM 0 HB2 ARG A 121 11.596 -3.585 -11.337 1.00 0.00 H new ATOM 0 HB3 ARG A 121 11.839 -4.636 -9.956 1.00 0.00 H new ATOM 0 HG2 ARG A 121 9.740 -3.984 -8.971 1.00 0.00 H new ATOM 0 HG3 ARG A 121 9.541 -2.662 -10.103 1.00 0.00 H new ATOM 0 HD2 ARG A 121 9.744 -4.667 -11.892 1.00 0.00 H new ATOM 0 HD3 ARG A 121 9.165 -5.608 -10.531 1.00 0.00 H new ATOM 0 HE ARG A 121 7.380 -3.547 -10.528 1.00 0.00 H new ATOM 0 HH11 ARG A 121 8.644 -5.604 -13.105 1.00 0.00 H new ATOM 0 HH12 ARG A 121 7.167 -5.501 -14.069 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.487 -3.420 -11.773 1.00 0.00 H new ATOM 0 HH22 ARG A 121 5.388 -4.271 -13.318 1.00 0.00 H new ATOM 1952 N VAL A 122 10.561 -0.976 -8.656 1.00 0.00 N ATOM 1953 CA VAL A 122 9.755 0.239 -8.643 1.00 0.00 C ATOM 1954 C VAL A 122 10.613 1.464 -8.346 1.00 0.00 C ATOM 1955 O VAL A 122 10.384 2.543 -8.894 1.00 0.00 O ATOM 1956 CB VAL A 122 8.626 0.152 -7.599 1.00 0.00 C ATOM 1957 CG1 VAL A 122 7.657 1.313 -7.762 1.00 0.00 C ATOM 1958 CG2 VAL A 122 7.899 -1.180 -7.710 1.00 0.00 C ATOM 0 H VAL A 122 10.428 -1.580 -7.845 1.00 0.00 H new ATOM 0 HA VAL A 122 9.316 0.338 -9.636 1.00 0.00 H new ATOM 0 HB VAL A 122 9.068 0.216 -6.605 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.866 1.235 -7.016 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.191 2.254 -7.628 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.219 1.284 -8.760 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.105 -1.224 -6.965 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.468 -1.277 -8.706 1.00 0.00 H new ATOM 0 HG23 VAL A 122 8.603 -1.994 -7.538 1.00 0.00 H new ATOM 1968 N LEU A 123 11.603 1.290 -7.477 1.00 0.00 N ATOM 1969 CA LEU A 123 12.497 2.381 -7.108 1.00 0.00 C ATOM 1970 C LEU A 123 13.267 2.889 -8.322 1.00 0.00 C ATOM 1971 O LEU A 123 13.367 4.095 -8.547 1.00 0.00 O ATOM 1972 CB LEU A 123 13.475 1.921 -6.025 1.00 0.00 C ATOM 1973 CG LEU A 123 12.854 1.522 -4.686 1.00 0.00 C ATOM 1974 CD1 LEU A 123 13.937 1.140 -3.688 1.00 0.00 C ATOM 1975 CD2 LEU A 123 11.996 2.653 -4.137 1.00 0.00 C ATOM 0 H LEU A 123 11.806 0.404 -7.015 1.00 0.00 H new ATOM 0 HA LEU A 123 11.891 3.198 -6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 123 14.038 1.071 -6.409 1.00 0.00 H new ATOM 0 HB3 LEU A 123 14.191 2.723 -5.846 1.00 0.00 H new ATOM 0 HG LEU A 123 12.215 0.654 -4.848 1.00 0.00 H new ATOM 0 HD11 LEU A 123 13.476 0.859 -2.741 1.00 0.00 H new ATOM 0 HD12 LEU A 123 14.510 0.298 -4.077 1.00 0.00 H new ATOM 0 HD13 LEU A 123 14.602 1.989 -3.530 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.562 2.351 -3.184 1.00 0.00 H new ATOM 0 HD22 LEU A 123 12.613 3.539 -3.990 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.197 2.880 -4.843 1.00 0.00 H new ATOM 1987 N ASN A 124 13.809 1.960 -9.104 1.00 0.00 N ATOM 1988 CA ASN A 124 14.569 2.314 -10.297 1.00 0.00 C ATOM 1989 C ASN A 124 13.712 3.118 -11.270 1.00 0.00 C ATOM 1990 O ASN A 124 14.207 4.009 -11.961 1.00 0.00 O ATOM 1991 CB ASN A 124 15.094 1.052 -10.985 1.00 0.00 C ATOM 1992 CG ASN A 124 16.398 0.565 -10.383 1.00 0.00 C ATOM 1993 OD1 ASN A 124 17.477 1.027 -10.754 1.00 0.00 O ATOM 1994 ND2 ASN A 124 16.303 -0.373 -9.448 1.00 0.00 N ATOM 0 H ASN A 124 13.736 0.957 -8.933 1.00 0.00 H new ATOM 0 HA ASN A 124 15.413 2.931 -9.990 1.00 0.00 H new ATOM 0 HB2 ASN A 124 14.346 0.263 -10.911 1.00 0.00 H new ATOM 0 HB3 ASN A 124 15.240 1.254 -12.046 1.00 0.00 H new ATOM 0 HD21 ASN A 124 17.146 -0.740 -9.006 1.00 0.00 H new ATOM 0 HD22 ASN A 124 15.387 -0.727 -9.172 1.00 0.00 H new ATOM 2001 N LEU A 125 12.423 2.798 -11.317 1.00 0.00 N ATOM 2002 CA LEU A 125 11.495 3.491 -12.205 1.00 0.00 C ATOM 2003 C LEU A 125 11.151 4.874 -11.660 1.00 0.00 C ATOM 2004 O LEU A 125 11.026 5.836 -12.417 1.00 0.00 O ATOM 2005 CB LEU A 125 10.219 2.668 -12.384 1.00 0.00 C ATOM 2006 CG LEU A 125 10.300 1.512 -13.381 1.00 0.00 C ATOM 2007 CD1 LEU A 125 9.132 0.556 -13.187 1.00 0.00 C ATOM 2008 CD2 LEU A 125 10.328 2.039 -14.808 1.00 0.00 C ATOM 0 H LEU A 125 11.997 2.064 -10.751 1.00 0.00 H new ATOM 0 HA LEU A 125 11.979 3.613 -13.174 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.932 2.264 -11.413 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.420 3.338 -12.700 1.00 0.00 H new ATOM 0 HG LEU A 125 11.225 0.965 -13.199 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.207 -0.260 -13.905 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.157 0.152 -12.175 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.195 1.091 -13.341 1.00 0.00 H new ATOM 0 HD21 LEU A 125 10.386 1.202 -15.504 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.421 2.611 -15.003 1.00 0.00 H new ATOM 0 HD23 LEU A 125 11.198 2.682 -14.941 1.00 0.00 H new ATOM 2020 N TRP A 126 11.000 4.964 -10.344 1.00 0.00 N ATOM 2021 CA TRP A 126 10.671 6.230 -9.698 1.00 0.00 C ATOM 2022 C TRP A 126 11.770 7.261 -9.930 1.00 0.00 C ATOM 2023 O TRP A 126 11.506 8.365 -10.406 1.00 0.00 O ATOM 2024 CB TRP A 126 10.461 6.020 -8.197 1.00 0.00 C ATOM 2025 CG TRP A 126 9.125 5.429 -7.862 1.00 0.00 C ATOM 2026 CD1 TRP A 126 8.073 5.244 -8.713 1.00 0.00 C ATOM 2027 CD2 TRP A 126 8.699 4.947 -6.583 1.00 0.00 C ATOM 2028 NE1 TRP A 126 7.018 4.676 -8.040 1.00 0.00 N ATOM 2029 CE2 TRP A 126 7.377 4.483 -6.733 1.00 0.00 C ATOM 2030 CE3 TRP A 126 9.305 4.859 -5.327 1.00 0.00 C ATOM 2031 CZ2 TRP A 126 6.654 3.942 -5.673 1.00 0.00 C ATOM 2032 CZ3 TRP A 126 8.586 4.323 -4.276 1.00 0.00 C ATOM 2033 CH2 TRP A 126 7.272 3.869 -4.454 1.00 0.00 C ATOM 0 H TRP A 126 11.100 4.177 -9.703 1.00 0.00 H new ATOM 0 HA TRP A 126 9.747 6.605 -10.139 1.00 0.00 H new ATOM 0 HB2 TRP A 126 11.246 5.367 -7.815 1.00 0.00 H new ATOM 0 HB3 TRP A 126 10.566 6.977 -7.685 1.00 0.00 H new ATOM 0 HD1 TRP A 126 8.071 5.506 -9.761 1.00 0.00 H new ATOM 0 HE1 TRP A 126 6.114 4.437 -8.448 1.00 0.00 H new ATOM 0 HE3 TRP A 126 10.318 5.204 -5.180 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 5.641 3.592 -5.808 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 9.044 4.253 -3.301 1.00 0.00 H new ATOM 0 HH2 TRP A 126 6.737 3.454 -3.613 1.00 0.00 H new ATOM 2044 N GLN A 127 13.002 6.893 -9.593 1.00 0.00 N ATOM 2045 CA GLN A 127 14.140 7.788 -9.766 1.00 0.00 C ATOM 2046 C GLN A 127 14.244 8.264 -11.211 1.00 0.00 C ATOM 2047 O GLN A 127 14.807 9.323 -11.488 1.00 0.00 O ATOM 2048 CB GLN A 127 15.435 7.086 -9.353 1.00 0.00 C ATOM 2049 CG GLN A 127 16.477 8.026 -8.769 1.00 0.00 C ATOM 2050 CD GLN A 127 17.839 7.374 -8.631 1.00 0.00 C ATOM 2051 OE1 GLN A 127 18.453 6.977 -9.621 1.00 0.00 O ATOM 2052 NE2 GLN A 127 18.319 7.261 -7.398 1.00 0.00 N ATOM 0 H GLN A 127 13.237 5.982 -9.199 1.00 0.00 H new ATOM 0 HA GLN A 127 13.987 8.658 -9.127 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.202 6.314 -8.619 1.00 0.00 H new ATOM 0 HB3 GLN A 127 15.858 6.582 -10.222 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.563 8.907 -9.405 1.00 0.00 H new ATOM 0 HG3 GLN A 127 16.142 8.370 -7.790 1.00 0.00 H new ATOM 0 HE21 GLN A 127 17.776 7.604 -6.606 1.00 0.00 H new ATOM 0 HE22 GLN A 127 19.231 6.831 -7.243 1.00 0.00 H new ATOM 2061 N LYS A 128 13.698 7.474 -12.129 1.00 0.00 N ATOM 2062 CA LYS A 128 13.728 7.814 -13.547 1.00 0.00 C ATOM 2063 C LYS A 128 12.569 8.738 -13.910 1.00 0.00 C ATOM 2064 O LYS A 128 12.765 9.778 -14.535 1.00 0.00 O ATOM 2065 CB LYS A 128 13.667 6.544 -14.398 1.00 0.00 C ATOM 2066 CG LYS A 128 13.131 6.776 -15.800 1.00 0.00 C ATOM 2067 CD LYS A 128 13.128 5.495 -16.616 1.00 0.00 C ATOM 2068 CE LYS A 128 12.173 5.587 -17.796 1.00 0.00 C ATOM 2069 NZ LYS A 128 11.774 4.241 -18.293 1.00 0.00 N ATOM 0 H LYS A 128 13.229 6.593 -11.917 1.00 0.00 H new ATOM 0 HA LYS A 128 14.663 8.336 -13.750 1.00 0.00 H new ATOM 0 HB2 LYS A 128 14.666 6.115 -14.467 1.00 0.00 H new ATOM 0 HB3 LYS A 128 13.038 5.809 -13.895 1.00 0.00 H new ATOM 0 HG2 LYS A 128 12.118 7.173 -15.742 1.00 0.00 H new ATOM 0 HG3 LYS A 128 13.740 7.527 -16.303 1.00 0.00 H new ATOM 0 HD2 LYS A 128 14.136 5.291 -16.978 1.00 0.00 H new ATOM 0 HD3 LYS A 128 12.842 4.658 -15.979 1.00 0.00 H new ATOM 0 HE2 LYS A 128 11.283 6.143 -17.501 1.00 0.00 H new ATOM 0 HE3 LYS A 128 12.646 6.147 -18.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 11.123 4.347 -19.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 12.620 3.719 -18.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 11.300 3.716 -17.531 1.00 0.00 H new ATOM 2083 N ASN A 129 11.362 8.350 -13.511 1.00 0.00 N ATOM 2084 CA ASN A 129 10.172 9.144 -13.793 1.00 0.00 C ATOM 2085 C ASN A 129 10.135 10.397 -12.924 1.00 0.00 C ATOM 2086 O ASN A 129 9.181 11.171 -12.974 1.00 0.00 O ATOM 2087 CB ASN A 129 8.910 8.310 -13.561 1.00 0.00 C ATOM 2088 CG ASN A 129 8.557 7.449 -14.758 1.00 0.00 C ATOM 2089 OD1 ASN A 129 7.616 7.745 -15.494 1.00 0.00 O ATOM 2090 ND2 ASN A 129 9.313 6.375 -14.957 1.00 0.00 N ATOM 0 H ASN A 129 11.182 7.491 -12.992 1.00 0.00 H new ATOM 0 HA ASN A 129 10.209 9.450 -14.838 1.00 0.00 H new ATOM 0 HB2 ASN A 129 9.054 7.673 -12.689 1.00 0.00 H new ATOM 0 HB3 ASN A 129 8.075 8.974 -13.336 1.00 0.00 H new ATOM 0 HD21 ASN A 129 9.123 5.757 -15.746 1.00 0.00 H new ATOM 0 HD22 ASN A 129 10.083 6.168 -14.321 1.00 0.00 H new ATOM 2097 N ASN A 130 11.181 10.588 -12.127 1.00 0.00 N ATOM 2098 CA ASN A 130 11.268 11.747 -11.245 1.00 0.00 C ATOM 2099 C ASN A 130 10.139 11.737 -10.220 1.00 0.00 C ATOM 2100 O ASN A 130 9.686 12.789 -9.768 1.00 0.00 O ATOM 2101 CB ASN A 130 11.219 13.040 -12.062 1.00 0.00 C ATOM 2102 CG ASN A 130 12.536 13.339 -12.751 1.00 0.00 C ATOM 2103 OD1 ASN A 130 13.446 12.510 -12.763 1.00 0.00 O ATOM 2104 ND2 ASN A 130 12.644 14.530 -13.330 1.00 0.00 N ATOM 0 H ASN A 130 11.980 9.956 -12.073 1.00 0.00 H new ATOM 0 HA ASN A 130 12.218 11.697 -10.713 1.00 0.00 H new ATOM 0 HB2 ASN A 130 10.430 12.964 -12.810 1.00 0.00 H new ATOM 0 HB3 ASN A 130 10.958 13.871 -11.407 1.00 0.00 H new ATOM 0 HD21 ASN A 130 13.507 14.788 -13.809 1.00 0.00 H new ATOM 0 HD22 ASN A 130 11.864 15.186 -13.296 1.00 0.00 H new ATOM 2111 N VAL A 131 9.689 10.540 -9.855 1.00 0.00 N ATOM 2112 CA VAL A 131 8.614 10.392 -8.881 1.00 0.00 C ATOM 2113 C VAL A 131 9.095 10.734 -7.475 1.00 0.00 C ATOM 2114 O VAL A 131 8.367 11.340 -6.688 1.00 0.00 O ATOM 2115 CB VAL A 131 8.048 8.960 -8.883 1.00 0.00 C ATOM 2116 CG1 VAL A 131 6.811 8.873 -8.003 1.00 0.00 C ATOM 2117 CG2 VAL A 131 7.734 8.514 -10.304 1.00 0.00 C ATOM 0 H VAL A 131 10.052 9.659 -10.219 1.00 0.00 H new ATOM 0 HA VAL A 131 7.826 11.087 -9.172 1.00 0.00 H new ATOM 0 HB VAL A 131 8.803 8.289 -8.474 1.00 0.00 H new ATOM 0 HG11 VAL A 131 6.425 7.854 -8.017 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.071 9.148 -6.981 1.00 0.00 H new ATOM 0 HG13 VAL A 131 6.048 9.555 -8.379 1.00 0.00 H new ATOM 0 HG21 VAL A 131 7.335 7.500 -10.287 1.00 0.00 H new ATOM 0 HG22 VAL A 131 6.997 9.187 -10.742 1.00 0.00 H new ATOM 0 HG23 VAL A 131 8.645 8.535 -10.902 1.00 0.00 H new ATOM 2127 N PHE A 132 10.327 10.343 -7.166 1.00 0.00 N ATOM 2128 CA PHE A 132 10.906 10.608 -5.854 1.00 0.00 C ATOM 2129 C PHE A 132 12.364 11.041 -5.980 1.00 0.00 C ATOM 2130 O PHE A 132 13.070 10.626 -6.900 1.00 0.00 O ATOM 2131 CB PHE A 132 10.807 9.364 -4.968 1.00 0.00 C ATOM 2132 CG PHE A 132 9.393 8.951 -4.672 1.00 0.00 C ATOM 2133 CD1 PHE A 132 8.702 8.125 -5.542 1.00 0.00 C ATOM 2134 CD2 PHE A 132 8.757 9.389 -3.522 1.00 0.00 C ATOM 2135 CE1 PHE A 132 7.401 7.744 -5.272 1.00 0.00 C ATOM 2136 CE2 PHE A 132 7.456 9.011 -3.246 1.00 0.00 C ATOM 2137 CZ PHE A 132 6.778 8.187 -4.122 1.00 0.00 C ATOM 0 H PHE A 132 10.943 9.842 -7.806 1.00 0.00 H new ATOM 0 HA PHE A 132 10.342 11.419 -5.394 1.00 0.00 H new ATOM 0 HB2 PHE A 132 11.324 8.538 -5.456 1.00 0.00 H new ATOM 0 HB3 PHE A 132 11.326 9.554 -4.029 1.00 0.00 H new ATOM 0 HD1 PHE A 132 9.185 7.774 -6.442 1.00 0.00 H new ATOM 0 HD2 PHE A 132 9.283 10.033 -2.833 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.872 7.101 -5.960 1.00 0.00 H new ATOM 0 HE2 PHE A 132 6.971 9.360 -2.346 1.00 0.00 H new ATOM 0 HZ PHE A 132 5.762 7.889 -3.908 1.00 0.00 H new ATOM 2147 N LYS A 133 12.809 11.879 -5.050 1.00 0.00 N ATOM 2148 CA LYS A 133 14.182 12.369 -5.054 1.00 0.00 C ATOM 2149 C LYS A 133 15.162 11.244 -4.738 1.00 0.00 C ATOM 2150 O LYS A 133 14.854 10.339 -3.962 1.00 0.00 O ATOM 2151 CB LYS A 133 14.344 13.502 -4.039 1.00 0.00 C ATOM 2152 CG LYS A 133 14.536 13.017 -2.612 1.00 0.00 C ATOM 2153 CD LYS A 133 14.525 14.172 -1.624 1.00 0.00 C ATOM 2154 CE LYS A 133 13.374 15.128 -1.897 1.00 0.00 C ATOM 2155 NZ LYS A 133 12.976 15.879 -0.674 1.00 0.00 N ATOM 0 H LYS A 133 12.238 12.233 -4.283 1.00 0.00 H new ATOM 0 HA LYS A 133 14.403 12.749 -6.051 1.00 0.00 H new ATOM 0 HB2 LYS A 133 15.199 14.114 -4.324 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.464 14.144 -4.080 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.745 12.311 -2.357 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.481 12.479 -2.534 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.443 13.783 -0.609 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.470 14.712 -1.683 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.663 15.832 -2.677 1.00 0.00 H new ATOM 0 HE3 LYS A 133 12.518 14.568 -2.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 12.189 16.520 -0.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 12.676 15.209 0.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 13.785 16.433 -0.328 1.00 0.00 H new ATOM 2169 N SER A 134 16.345 11.307 -5.342 1.00 0.00 N ATOM 2170 CA SER A 134 17.369 10.293 -5.126 1.00 0.00 C ATOM 2171 C SER A 134 17.703 10.165 -3.642 1.00 0.00 C ATOM 2172 O SER A 134 18.137 9.110 -3.182 1.00 0.00 O ATOM 2173 CB SER A 134 18.633 10.637 -5.917 1.00 0.00 C ATOM 2174 OG SER A 134 18.322 10.943 -7.265 1.00 0.00 O ATOM 0 H SER A 134 16.617 12.051 -5.985 1.00 0.00 H new ATOM 0 HA SER A 134 16.978 9.338 -5.477 1.00 0.00 H new ATOM 0 HB2 SER A 134 19.136 11.486 -5.454 1.00 0.00 H new ATOM 0 HB3 SER A 134 19.328 9.798 -5.882 1.00 0.00 H new ATOM 0 HG SER A 134 19.146 11.161 -7.749 1.00 0.00 H new ATOM 2180 N GLU A 135 17.498 11.249 -2.901 1.00 0.00 N ATOM 2181 CA GLU A 135 17.778 11.260 -1.470 1.00 0.00 C ATOM 2182 C GLU A 135 16.761 10.413 -0.710 1.00 0.00 C ATOM 2183 O GLU A 135 17.018 9.974 0.411 1.00 0.00 O ATOM 2184 CB GLU A 135 17.766 12.693 -0.935 1.00 0.00 C ATOM 2185 CG GLU A 135 17.364 12.794 0.527 1.00 0.00 C ATOM 2186 CD GLU A 135 18.332 12.077 1.448 1.00 0.00 C ATOM 2187 OE1 GLU A 135 19.465 11.786 1.010 1.00 0.00 O ATOM 2188 OE2 GLU A 135 17.956 11.807 2.608 1.00 0.00 O ATOM 0 H GLU A 135 17.139 12.131 -3.268 1.00 0.00 H new ATOM 0 HA GLU A 135 18.769 10.832 -1.317 1.00 0.00 H new ATOM 0 HB2 GLU A 135 18.758 13.127 -1.061 1.00 0.00 H new ATOM 0 HB3 GLU A 135 17.078 13.290 -1.534 1.00 0.00 H new ATOM 0 HG2 GLU A 135 17.307 13.844 0.813 1.00 0.00 H new ATOM 0 HG3 GLU A 135 16.367 12.374 0.656 1.00 0.00 H new ATOM 2195 N ILE A 136 15.607 10.188 -1.329 1.00 0.00 N ATOM 2196 CA ILE A 136 14.552 9.394 -0.713 1.00 0.00 C ATOM 2197 C ILE A 136 14.600 7.948 -1.193 1.00 0.00 C ATOM 2198 O ILE A 136 14.315 7.021 -0.434 1.00 0.00 O ATOM 2199 CB ILE A 136 13.159 9.978 -1.015 1.00 0.00 C ATOM 2200 CG1 ILE A 136 12.931 11.257 -0.207 1.00 0.00 C ATOM 2201 CG2 ILE A 136 12.077 8.952 -0.708 1.00 0.00 C ATOM 2202 CD1 ILE A 136 11.910 12.187 -0.823 1.00 0.00 C ATOM 0 H ILE A 136 15.379 10.545 -2.257 1.00 0.00 H new ATOM 0 HA ILE A 136 14.723 9.422 0.363 1.00 0.00 H new ATOM 0 HB ILE A 136 13.108 10.227 -2.075 1.00 0.00 H new ATOM 0 HG12 ILE A 136 12.606 10.989 0.798 1.00 0.00 H new ATOM 0 HG13 ILE A 136 13.878 11.787 -0.105 1.00 0.00 H new ATOM 0 HG21 ILE A 136 11.098 9.379 -0.926 1.00 0.00 H new ATOM 0 HG22 ILE A 136 12.231 8.065 -1.323 1.00 0.00 H new ATOM 0 HG23 ILE A 136 12.126 8.676 0.345 1.00 0.00 H new ATOM 0 HD11 ILE A 136 11.800 13.072 -0.197 1.00 0.00 H new ATOM 0 HD12 ILE A 136 12.242 12.485 -1.817 1.00 0.00 H new ATOM 0 HD13 ILE A 136 10.951 11.675 -0.899 1.00 0.00 H new ATOM 2214 N ILE A 137 14.965 7.762 -2.457 1.00 0.00 N ATOM 2215 CA ILE A 137 15.053 6.428 -3.038 1.00 0.00 C ATOM 2216 C ILE A 137 16.395 5.778 -2.719 1.00 0.00 C ATOM 2217 O ILE A 137 16.476 4.566 -2.519 1.00 0.00 O ATOM 2218 CB ILE A 137 14.864 6.466 -4.566 1.00 0.00 C ATOM 2219 CG1 ILE A 137 13.584 7.223 -4.925 1.00 0.00 C ATOM 2220 CG2 ILE A 137 14.826 5.053 -5.129 1.00 0.00 C ATOM 2221 CD1 ILE A 137 13.042 6.879 -6.295 1.00 0.00 C ATOM 0 H ILE A 137 15.205 8.518 -3.098 1.00 0.00 H new ATOM 0 HA ILE A 137 14.251 5.837 -2.596 1.00 0.00 H new ATOM 0 HB ILE A 137 15.710 6.991 -5.010 1.00 0.00 H new ATOM 0 HG12 ILE A 137 12.822 7.006 -4.177 1.00 0.00 H new ATOM 0 HG13 ILE A 137 13.780 8.294 -4.879 1.00 0.00 H new ATOM 0 HG21 ILE A 137 14.692 5.095 -6.210 1.00 0.00 H new ATOM 0 HG22 ILE A 137 15.762 4.544 -4.899 1.00 0.00 H new ATOM 0 HG23 ILE A 137 13.996 4.505 -4.682 1.00 0.00 H new ATOM 0 HD11 ILE A 137 12.134 7.453 -6.482 1.00 0.00 H new ATOM 0 HD12 ILE A 137 13.787 7.122 -7.053 1.00 0.00 H new ATOM 0 HD13 ILE A 137 12.814 5.814 -6.339 1.00 0.00 H new ATOM 2233 N GLN A 138 17.445 6.592 -2.671 1.00 0.00 N ATOM 2234 CA GLN A 138 18.783 6.095 -2.375 1.00 0.00 C ATOM 2235 C GLN A 138 18.739 5.029 -1.285 1.00 0.00 C ATOM 2236 O GLN A 138 19.246 3.918 -1.449 1.00 0.00 O ATOM 2237 CB GLN A 138 19.693 7.246 -1.941 1.00 0.00 C ATOM 2238 CG GLN A 138 20.856 6.807 -1.067 1.00 0.00 C ATOM 2239 CD GLN A 138 21.899 6.020 -1.835 1.00 0.00 C ATOM 2240 OE1 GLN A 138 22.830 6.590 -2.404 1.00 0.00 O ATOM 2241 NE2 GLN A 138 21.749 4.700 -1.856 1.00 0.00 N ATOM 0 H GLN A 138 17.395 7.598 -2.833 1.00 0.00 H new ATOM 0 HA GLN A 138 19.185 5.645 -3.283 1.00 0.00 H new ATOM 0 HB2 GLN A 138 20.084 7.743 -2.829 1.00 0.00 H new ATOM 0 HB3 GLN A 138 19.100 7.982 -1.399 1.00 0.00 H new ATOM 0 HG2 GLN A 138 21.324 7.686 -0.623 1.00 0.00 H new ATOM 0 HG3 GLN A 138 20.479 6.198 -0.246 1.00 0.00 H new ATOM 0 HE21 GLN A 138 20.963 4.268 -1.371 1.00 0.00 H new ATOM 0 HE22 GLN A 138 22.420 4.118 -2.357 1.00 0.00 H new ATOM 2250 N PRO A 139 18.121 5.371 -0.146 1.00 0.00 N ATOM 2251 CA PRO A 139 17.996 4.456 0.993 1.00 0.00 C ATOM 2252 C PRO A 139 17.042 3.302 0.707 1.00 0.00 C ATOM 2253 O PRO A 139 17.310 2.156 1.073 1.00 0.00 O ATOM 2254 CB PRO A 139 17.438 5.348 2.105 1.00 0.00 C ATOM 2255 CG PRO A 139 16.726 6.444 1.390 1.00 0.00 C ATOM 2256 CD PRO A 139 17.495 6.678 0.119 1.00 0.00 C ATOM 0 HA PRO A 139 18.946 3.984 1.243 1.00 0.00 H new ATOM 0 HB2 PRO A 139 16.761 4.794 2.755 1.00 0.00 H new ATOM 0 HB3 PRO A 139 18.236 5.740 2.736 1.00 0.00 H new ATOM 0 HG2 PRO A 139 15.694 6.165 1.176 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.692 7.348 1.997 1.00 0.00 H new ATOM 0 HD2 PRO A 139 16.840 6.983 -0.697 1.00 0.00 H new ATOM 0 HD3 PRO A 139 18.241 7.464 0.239 1.00 0.00 H new ATOM 2264 N LEU A 140 15.928 3.609 0.052 1.00 0.00 N ATOM 2265 CA LEU A 140 14.934 2.596 -0.283 1.00 0.00 C ATOM 2266 C LEU A 140 15.547 1.493 -1.139 1.00 0.00 C ATOM 2267 O LEU A 140 15.084 0.352 -1.126 1.00 0.00 O ATOM 2268 CB LEU A 140 13.756 3.234 -1.022 1.00 0.00 C ATOM 2269 CG LEU A 140 12.937 4.252 -0.228 1.00 0.00 C ATOM 2270 CD1 LEU A 140 11.875 4.889 -1.110 1.00 0.00 C ATOM 2271 CD2 LEU A 140 12.299 3.592 0.986 1.00 0.00 C ATOM 0 H LEU A 140 15.690 4.551 -0.258 1.00 0.00 H new ATOM 0 HA LEU A 140 14.576 2.153 0.646 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.138 3.724 -1.918 1.00 0.00 H new ATOM 0 HB3 LEU A 140 13.088 2.439 -1.354 1.00 0.00 H new ATOM 0 HG LEU A 140 13.608 5.037 0.120 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.303 5.610 -0.527 1.00 0.00 H new ATOM 0 HD12 LEU A 140 12.354 5.397 -1.947 1.00 0.00 H new ATOM 0 HD13 LEU A 140 11.206 4.117 -1.489 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.720 4.331 1.540 1.00 0.00 H new ATOM 0 HD22 LEU A 140 11.641 2.787 0.659 1.00 0.00 H new ATOM 0 HD23 LEU A 140 13.078 3.185 1.630 1.00 0.00 H new ATOM 2283 N LEU A 141 16.594 1.839 -1.880 1.00 0.00 N ATOM 2284 CA LEU A 141 17.274 0.878 -2.741 1.00 0.00 C ATOM 2285 C LEU A 141 18.145 -0.068 -1.919 1.00 0.00 C ATOM 2286 O LEU A 141 18.385 -1.208 -2.316 1.00 0.00 O ATOM 2287 CB LEU A 141 18.131 1.607 -3.777 1.00 0.00 C ATOM 2288 CG LEU A 141 17.381 2.196 -4.973 1.00 0.00 C ATOM 2289 CD1 LEU A 141 18.203 3.294 -5.630 1.00 0.00 C ATOM 2290 CD2 LEU A 141 17.043 1.105 -5.979 1.00 0.00 C ATOM 0 H LEU A 141 16.991 2.778 -1.902 1.00 0.00 H new ATOM 0 HA LEU A 141 16.515 0.289 -3.256 1.00 0.00 H new ATOM 0 HB2 LEU A 141 18.665 2.414 -3.275 1.00 0.00 H new ATOM 0 HB3 LEU A 141 18.883 0.912 -4.151 1.00 0.00 H new ATOM 0 HG LEU A 141 16.449 2.634 -4.615 1.00 0.00 H new ATOM 0 HD11 LEU A 141 17.654 3.701 -6.479 1.00 0.00 H new ATOM 0 HD12 LEU A 141 18.394 4.087 -4.907 1.00 0.00 H new ATOM 0 HD13 LEU A 141 19.151 2.882 -5.975 1.00 0.00 H new ATOM 0 HD21 LEU A 141 16.510 1.541 -6.824 1.00 0.00 H new ATOM 0 HD22 LEU A 141 17.963 0.638 -6.332 1.00 0.00 H new ATOM 0 HD23 LEU A 141 16.414 0.353 -5.502 1.00 0.00 H new ATOM 2302 N ASP A 142 18.612 0.413 -0.773 1.00 0.00 N ATOM 2303 CA ASP A 142 19.454 -0.390 0.107 1.00 0.00 C ATOM 2304 C ASP A 142 18.603 -1.262 1.025 1.00 0.00 C ATOM 2305 O ASP A 142 18.878 -2.449 1.199 1.00 0.00 O ATOM 2306 CB ASP A 142 20.365 0.512 0.940 1.00 0.00 C ATOM 2307 CG ASP A 142 21.674 -0.162 1.301 1.00 0.00 C ATOM 2308 OD1 ASP A 142 21.714 -1.410 1.321 1.00 0.00 O ATOM 2309 OD2 ASP A 142 22.659 0.559 1.563 1.00 0.00 O ATOM 0 H ASP A 142 18.422 1.355 -0.431 1.00 0.00 H new ATOM 0 HA ASP A 142 20.070 -1.040 -0.514 1.00 0.00 H new ATOM 0 HB2 ASP A 142 20.572 1.427 0.385 1.00 0.00 H new ATOM 0 HB3 ASP A 142 19.846 0.804 1.853 1.00 0.00 H new ATOM 2314 N MET A 143 17.570 -0.665 1.610 1.00 0.00 N ATOM 2315 CA MET A 143 16.679 -1.388 2.510 1.00 0.00 C ATOM 2316 C MET A 143 16.391 -2.789 1.980 1.00 0.00 C ATOM 2317 O MET A 143 16.302 -3.747 2.748 1.00 0.00 O ATOM 2318 CB MET A 143 15.369 -0.619 2.692 1.00 0.00 C ATOM 2319 CG MET A 143 15.564 0.805 3.186 1.00 0.00 C ATOM 2320 SD MET A 143 14.193 1.379 4.208 1.00 0.00 S ATOM 2321 CE MET A 143 12.793 0.816 3.243 1.00 0.00 C ATOM 0 H MET A 143 17.329 0.317 1.477 1.00 0.00 H new ATOM 0 HA MET A 143 17.175 -1.479 3.476 1.00 0.00 H new ATOM 0 HB2 MET A 143 14.836 -0.595 1.741 1.00 0.00 H new ATOM 0 HB3 MET A 143 14.737 -1.157 3.399 1.00 0.00 H new ATOM 0 HG2 MET A 143 16.489 0.863 3.760 1.00 0.00 H new ATOM 0 HG3 MET A 143 15.677 1.470 2.330 1.00 0.00 H new ATOM 0 HE1 MET A 143 11.900 1.366 3.542 1.00 0.00 H new ATOM 0 HE2 MET A 143 12.988 0.988 2.184 1.00 0.00 H new ATOM 0 HE3 MET A 143 12.638 -0.249 3.414 1.00 0.00 H new ATOM 2331 N ALA A 144 16.245 -2.901 0.664 1.00 0.00 N ATOM 2332 CA ALA A 144 15.969 -4.185 0.032 1.00 0.00 C ATOM 2333 C ALA A 144 17.227 -5.044 -0.039 1.00 0.00 C ATOM 2334 O ALA A 144 17.159 -6.269 0.053 1.00 0.00 O ATOM 2335 CB ALA A 144 15.391 -3.975 -1.360 1.00 0.00 C ATOM 0 H ALA A 144 16.313 -2.117 0.015 1.00 0.00 H new ATOM 0 HA ALA A 144 15.235 -4.712 0.642 1.00 0.00 H new ATOM 0 HB1 ALA A 144 15.190 -4.942 -1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.463 -3.408 -1.287 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.106 -3.424 -1.971 1.00 0.00 H new