USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1062 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 101 SER OG : rot 180:sc= 0.0163 USER MOD Set 1.2: A 102 MET CE :methyl 162:sc= -0.399 (180deg=-1.21) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.164 K(o=-0.16,f=-1.8) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.63 K(o=-0.63,f=-4) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot -170:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -1.28 K(o=-1.3,f=-3.7!) USER MOD Single : A 74 ASN : amide:sc= 0.92 K(o=0.92,f=0) USER MOD Single : A 79 GLN : amide:sc= 0.15 X(o=0.15,f=0) USER MOD Single : A 86 THR OG1 : rot -128:sc= 0.283 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc= -0.887 X(o=-0.89,f=-1.3) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 115 SER OG : rot 45:sc= 1.1 USER MOD Single : A 116 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.0318 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 HIS : no HE2:sc=0.000935 K(o=0.00094,f=-1.4) USER MOD Single : A 133 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.1) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 33:sc= 0.0165 USER MOD Single : A 157 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 158 HIS : no HE2:sc= -2.21! C(o=-2.2!,f=-2.2!) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 138 N SER A 24 16.061 4.103 -7.642 1.00 0.00 N ATOM 139 CA SER A 24 15.084 5.186 -7.455 1.00 0.00 C ATOM 140 C SER A 24 15.682 6.415 -6.738 1.00 0.00 C ATOM 141 O SER A 24 16.744 6.346 -6.103 1.00 0.00 O ATOM 142 CB SER A 24 13.851 4.673 -6.689 1.00 0.00 C ATOM 143 OG SER A 24 14.167 4.345 -5.343 1.00 0.00 O ATOM 0 HA SER A 24 14.785 5.512 -8.451 1.00 0.00 H new ATOM 0 HB2 SER A 24 13.071 5.434 -6.704 1.00 0.00 H new ATOM 0 HB3 SER A 24 13.449 3.794 -7.193 1.00 0.00 H new ATOM 0 HG SER A 24 13.361 4.025 -4.887 1.00 0.00 H new ATOM 149 N GLY A 25 14.977 7.551 -6.810 1.00 0.00 N ATOM 150 CA GLY A 25 15.309 8.782 -6.083 1.00 0.00 C ATOM 151 C GLY A 25 14.712 10.031 -6.731 1.00 0.00 C ATOM 152 O GLY A 25 14.718 10.162 -7.954 1.00 0.00 O ATOM 0 H GLY A 25 14.142 7.641 -7.388 1.00 0.00 H new ATOM 0 HA2 GLY A 25 14.948 8.702 -5.058 1.00 0.00 H new ATOM 0 HA3 GLY A 25 16.393 8.887 -6.032 1.00 0.00 H new ATOM 156 N VAL A 26 14.220 10.959 -5.908 1.00 0.00 N ATOM 157 CA VAL A 26 13.624 12.228 -6.367 1.00 0.00 C ATOM 158 C VAL A 26 14.684 13.144 -6.993 1.00 0.00 C ATOM 159 O VAL A 26 15.747 13.373 -6.418 1.00 0.00 O ATOM 160 CB VAL A 26 12.841 12.970 -5.256 1.00 0.00 C ATOM 161 CG1 VAL A 26 11.552 12.211 -4.906 1.00 0.00 C ATOM 162 CG2 VAL A 26 13.655 13.217 -3.973 1.00 0.00 C ATOM 0 H VAL A 26 14.221 10.856 -4.893 1.00 0.00 H new ATOM 0 HA VAL A 26 12.896 11.961 -7.133 1.00 0.00 H new ATOM 0 HB VAL A 26 12.605 13.950 -5.671 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.015 12.747 -4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 26 10.922 12.136 -5.792 1.00 0.00 H new ATOM 0 HG13 VAL A 26 11.803 11.211 -4.553 1.00 0.00 H new ATOM 0 HG21 VAL A 26 13.036 13.741 -3.245 1.00 0.00 H new ATOM 0 HG22 VAL A 26 13.976 12.262 -3.556 1.00 0.00 H new ATOM 0 HG23 VAL A 26 14.530 13.823 -4.208 1.00 0.00 H new ATOM 172 N ASP A 27 14.381 13.679 -8.179 1.00 0.00 N ATOM 173 CA ASP A 27 15.297 14.528 -8.961 1.00 0.00 C ATOM 174 C ASP A 27 15.346 15.993 -8.468 1.00 0.00 C ATOM 175 O ASP A 27 16.249 16.746 -8.837 1.00 0.00 O ATOM 176 CB ASP A 27 14.877 14.437 -10.438 1.00 0.00 C ATOM 177 CG ASP A 27 15.891 15.090 -11.393 1.00 0.00 C ATOM 178 OD1 ASP A 27 15.527 16.076 -12.078 1.00 0.00 O ATOM 179 OD2 ASP A 27 17.037 14.587 -11.488 1.00 0.00 O1- ATOM 0 H ASP A 27 13.479 13.535 -8.634 1.00 0.00 H new ATOM 0 HA ASP A 27 16.315 14.160 -8.830 1.00 0.00 H new ATOM 0 HB2 ASP A 27 14.752 13.389 -10.711 1.00 0.00 H new ATOM 0 HB3 ASP A 27 13.906 14.917 -10.564 1.00 0.00 H new ATOM 184 N LEU A 28 14.386 16.388 -7.617 1.00 0.00 N ATOM 185 CA LEU A 28 14.187 17.768 -7.134 1.00 0.00 C ATOM 186 C LEU A 28 13.582 17.893 -5.718 1.00 0.00 C ATOM 187 O LEU A 28 13.416 19.009 -5.225 1.00 0.00 O ATOM 188 CB LEU A 28 13.342 18.530 -8.178 1.00 0.00 C ATOM 189 CG LEU A 28 11.923 17.945 -8.397 1.00 0.00 C ATOM 190 CD1 LEU A 28 10.833 18.938 -7.977 1.00 0.00 C ATOM 191 CD2 LEU A 28 11.722 17.542 -9.863 1.00 0.00 C ATOM 0 H LEU A 28 13.703 15.735 -7.232 1.00 0.00 H new ATOM 0 HA LEU A 28 15.177 18.212 -7.027 1.00 0.00 H new ATOM 0 HB2 LEU A 28 13.250 19.570 -7.865 1.00 0.00 H new ATOM 0 HB3 LEU A 28 13.874 18.530 -9.130 1.00 0.00 H new ATOM 0 HG LEU A 28 11.838 17.059 -7.768 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.852 18.494 -8.145 1.00 0.00 H new ATOM 0 HD12 LEU A 28 10.947 19.178 -6.920 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.924 19.850 -8.568 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.720 17.134 -9.994 1.00 0.00 H new ATOM 0 HD22 LEU A 28 11.844 18.417 -10.501 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.459 16.788 -10.137 1.00 0.00 H new ATOM 203 N GLY A 29 13.237 16.776 -5.062 1.00 0.00 N ATOM 204 CA GLY A 29 12.678 16.736 -3.696 1.00 0.00 C ATOM 205 C GLY A 29 11.165 16.491 -3.614 1.00 0.00 C ATOM 206 O GLY A 29 10.685 16.087 -2.554 1.00 0.00 O ATOM 0 H GLY A 29 13.340 15.849 -5.475 1.00 0.00 H new ATOM 0 HA2 GLY A 29 13.187 15.952 -3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.904 17.680 -3.201 1.00 0.00 H new ATOM 210 N THR A 30 10.421 16.696 -4.714 1.00 0.00 N ATOM 211 CA THR A 30 8.954 16.518 -4.789 1.00 0.00 C ATOM 212 C THR A 30 8.470 16.093 -6.186 1.00 0.00 C ATOM 213 O THR A 30 7.367 16.413 -6.620 1.00 0.00 O ATOM 214 CB THR A 30 8.243 17.736 -4.166 1.00 0.00 C ATOM 215 OG1 THR A 30 6.923 17.378 -3.821 1.00 0.00 O ATOM 216 CG2 THR A 30 8.237 19.000 -5.031 1.00 0.00 C ATOM 0 H THR A 30 10.829 16.997 -5.599 1.00 0.00 H new ATOM 0 HA THR A 30 8.663 15.663 -4.178 1.00 0.00 H new ATOM 0 HB THR A 30 8.826 18.002 -3.284 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.468 18.150 -3.423 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.714 19.798 -4.505 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.263 19.309 -5.231 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.730 18.794 -5.973 1.00 0.00 H new ATOM 224 N GLU A 31 9.296 15.332 -6.913 1.00 0.00 N ATOM 225 CA GLU A 31 8.972 14.818 -8.259 1.00 0.00 C ATOM 226 C GLU A 31 7.753 13.867 -8.244 1.00 0.00 C ATOM 227 O GLU A 31 7.031 13.737 -9.231 1.00 0.00 O ATOM 228 CB GLU A 31 10.232 14.155 -8.847 1.00 0.00 C ATOM 229 CG GLU A 31 10.270 14.085 -10.384 1.00 0.00 C ATOM 230 CD GLU A 31 9.617 12.830 -10.990 1.00 0.00 C ATOM 231 OE1 GLU A 31 8.869 12.959 -11.989 1.00 0.00 O ATOM 232 OE2 GLU A 31 9.922 11.703 -10.533 1.00 0.00 O1- ATOM 0 H GLU A 31 10.219 15.050 -6.584 1.00 0.00 H new ATOM 0 HA GLU A 31 8.676 15.648 -8.901 1.00 0.00 H new ATOM 0 HB2 GLU A 31 11.108 14.703 -8.501 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.311 13.143 -8.450 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.771 14.967 -10.786 1.00 0.00 H new ATOM 0 HG3 GLU A 31 11.309 14.130 -10.710 1.00 0.00 H new ATOM 239 N ASN A 32 7.454 13.272 -7.084 1.00 0.00 N ATOM 240 CA ASN A 32 6.217 12.540 -6.799 1.00 0.00 C ATOM 241 C ASN A 32 4.928 13.377 -6.971 1.00 0.00 C ATOM 242 O ASN A 32 3.892 12.814 -7.320 1.00 0.00 O ATOM 243 CB ASN A 32 6.307 11.971 -5.370 1.00 0.00 C ATOM 244 CG ASN A 32 6.665 13.026 -4.323 1.00 0.00 C ATOM 245 OD1 ASN A 32 7.833 13.321 -4.104 1.00 0.00 O ATOM 246 ND2 ASN A 32 5.692 13.649 -3.684 1.00 0.00 N ATOM 0 H ASN A 32 8.092 13.288 -6.288 1.00 0.00 H new ATOM 0 HA ASN A 32 6.135 11.742 -7.537 1.00 0.00 H new ATOM 0 HB2 ASN A 32 5.352 11.516 -5.106 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.055 11.178 -5.348 1.00 0.00 H new ATOM 0 HD21 ASN A 32 5.912 14.378 -3.006 1.00 0.00 H new ATOM 0 HD22 ASN A 32 4.720 13.401 -3.869 1.00 0.00 H new ATOM 253 N LEU A 33 4.962 14.699 -6.745 1.00 0.00 N ATOM 254 CA LEU A 33 3.772 15.567 -6.742 1.00 0.00 C ATOM 255 C LEU A 33 3.102 15.678 -8.121 1.00 0.00 C ATOM 256 O LEU A 33 1.895 15.907 -8.197 1.00 0.00 O ATOM 257 CB LEU A 33 4.198 16.958 -6.229 1.00 0.00 C ATOM 258 CG LEU A 33 3.037 17.890 -5.822 1.00 0.00 C ATOM 259 CD1 LEU A 33 2.424 17.469 -4.476 1.00 0.00 C ATOM 260 CD2 LEU A 33 3.542 19.336 -5.727 1.00 0.00 C ATOM 0 H LEU A 33 5.828 15.203 -6.556 1.00 0.00 H new ATOM 0 HA LEU A 33 3.023 15.122 -6.087 1.00 0.00 H new ATOM 0 HB2 LEU A 33 4.855 16.825 -5.370 1.00 0.00 H new ATOM 0 HB3 LEU A 33 4.784 17.451 -7.005 1.00 0.00 H new ATOM 0 HG LEU A 33 2.263 17.817 -6.586 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.609 18.146 -4.219 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.040 16.452 -4.554 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.188 17.510 -3.700 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.719 19.991 -5.439 1.00 0.00 H new ATOM 0 HD22 LEU A 33 4.333 19.397 -4.979 1.00 0.00 H new ATOM 0 HD23 LEU A 33 3.933 19.649 -6.695 1.00 0.00 H new ATOM 272 N TYR A 34 3.861 15.468 -9.202 1.00 0.00 N ATOM 273 CA TYR A 34 3.443 15.636 -10.605 1.00 0.00 C ATOM 274 C TYR A 34 2.143 14.881 -10.969 1.00 0.00 C ATOM 275 O TYR A 34 1.409 15.312 -11.861 1.00 0.00 O ATOM 276 CB TYR A 34 4.586 15.145 -11.514 1.00 0.00 C ATOM 277 CG TYR A 34 5.789 16.054 -11.741 1.00 0.00 C ATOM 278 CD1 TYR A 34 6.454 16.705 -10.678 1.00 0.00 C ATOM 279 CD2 TYR A 34 6.302 16.180 -13.050 1.00 0.00 C ATOM 280 CE1 TYR A 34 7.610 17.472 -10.922 1.00 0.00 C ATOM 281 CE2 TYR A 34 7.460 16.940 -13.300 1.00 0.00 C ATOM 282 CZ TYR A 34 8.121 17.587 -12.233 1.00 0.00 C ATOM 283 OH TYR A 34 9.251 18.314 -12.463 1.00 0.00 O ATOM 0 H TYR A 34 4.831 15.161 -9.122 1.00 0.00 H new ATOM 0 HA TYR A 34 3.230 16.695 -10.751 1.00 0.00 H new ATOM 0 HB2 TYR A 34 4.955 14.206 -11.101 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.157 14.917 -12.490 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.073 16.614 -9.671 1.00 0.00 H new ATOM 0 HD2 TYR A 34 5.800 15.687 -13.870 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.107 17.973 -10.104 1.00 0.00 H new ATOM 0 HE2 TYR A 34 7.842 17.028 -14.306 1.00 0.00 H new ATOM 0 HH TYR A 34 9.467 18.290 -13.419 1.00 0.00 H new ATOM 293 N PHE A 35 1.848 13.777 -10.268 1.00 0.00 N ATOM 294 CA PHE A 35 0.599 13.010 -10.373 1.00 0.00 C ATOM 295 C PHE A 35 0.115 12.555 -8.977 1.00 0.00 C ATOM 296 O PHE A 35 -0.441 11.470 -8.826 1.00 0.00 O ATOM 297 CB PHE A 35 0.792 11.858 -11.386 1.00 0.00 C ATOM 298 CG PHE A 35 -0.384 11.520 -12.293 1.00 0.00 C ATOM 299 CD1 PHE A 35 -0.131 11.184 -13.639 1.00 0.00 C ATOM 300 CD2 PHE A 35 -1.713 11.500 -11.819 1.00 0.00 C ATOM 301 CE1 PHE A 35 -1.188 10.842 -14.501 1.00 0.00 C ATOM 302 CE2 PHE A 35 -2.770 11.156 -12.681 1.00 0.00 C ATOM 303 CZ PHE A 35 -2.509 10.828 -14.023 1.00 0.00 C ATOM 0 H PHE A 35 2.496 13.380 -9.588 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.204 13.638 -10.760 1.00 0.00 H new ATOM 0 HB2 PHE A 35 1.645 12.104 -12.018 1.00 0.00 H new ATOM 0 HB3 PHE A 35 1.057 10.960 -10.828 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.883 11.189 -14.011 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.920 11.750 -10.789 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -0.984 10.590 -15.531 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.785 11.144 -12.311 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.322 10.566 -14.684 1.00 0.00 H new ATOM 313 N GLN A 36 0.349 13.369 -7.941 1.00 0.00 N ATOM 314 CA GLN A 36 -0.148 13.158 -6.571 1.00 0.00 C ATOM 315 C GLN A 36 0.394 11.843 -5.956 1.00 0.00 C ATOM 316 O GLN A 36 1.481 11.374 -6.297 1.00 0.00 O ATOM 317 CB GLN A 36 -1.699 13.235 -6.548 1.00 0.00 C ATOM 318 CG GLN A 36 -2.334 14.382 -7.359 1.00 0.00 C ATOM 319 CD GLN A 36 -1.750 15.761 -7.043 1.00 0.00 C ATOM 320 OE1 GLN A 36 -1.503 16.122 -5.899 1.00 0.00 O ATOM 321 NE2 GLN A 36 -1.486 16.578 -8.043 1.00 0.00 N ATOM 0 H GLN A 36 0.906 14.219 -8.033 1.00 0.00 H new ATOM 0 HA GLN A 36 0.232 13.959 -5.937 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -2.095 12.291 -6.922 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -2.022 13.328 -5.511 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -2.204 14.178 -8.422 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -3.407 14.400 -7.167 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -1.686 16.292 -9.002 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -1.082 17.496 -7.858 1.00 0.00 H new ATOM 330 N SER A 37 -0.375 11.195 -5.075 1.00 0.00 N ATOM 331 CA SER A 37 -0.067 9.850 -4.559 1.00 0.00 C ATOM 332 C SER A 37 0.113 8.808 -5.681 1.00 0.00 C ATOM 333 O SER A 37 0.903 7.869 -5.545 1.00 0.00 O ATOM 334 CB SER A 37 -1.203 9.407 -3.635 1.00 0.00 C ATOM 335 OG SER A 37 -0.840 8.276 -2.862 1.00 0.00 O ATOM 0 H SER A 37 -1.236 11.589 -4.695 1.00 0.00 H new ATOM 0 HA SER A 37 0.879 9.909 -4.022 1.00 0.00 H new ATOM 0 HB2 SER A 37 -1.474 10.229 -2.972 1.00 0.00 H new ATOM 0 HB3 SER A 37 -2.086 9.173 -4.230 1.00 0.00 H new ATOM 0 HG SER A 37 -1.589 8.022 -2.283 1.00 0.00 H new ATOM 341 N MET A 38 -0.560 9.004 -6.826 1.00 0.00 N ATOM 342 CA MET A 38 -0.459 8.127 -7.995 1.00 0.00 C ATOM 343 C MET A 38 0.975 8.086 -8.534 1.00 0.00 C ATOM 344 O MET A 38 1.489 6.992 -8.743 1.00 0.00 O ATOM 345 CB MET A 38 -1.472 8.546 -9.078 1.00 0.00 C ATOM 346 CG MET A 38 -2.035 7.353 -9.856 1.00 0.00 C ATOM 347 SD MET A 38 -3.130 6.283 -8.884 1.00 0.00 S ATOM 348 CE MET A 38 -3.998 5.448 -10.234 1.00 0.00 C ATOM 0 H MET A 38 -1.198 9.788 -6.964 1.00 0.00 H new ATOM 0 HA MET A 38 -0.711 7.112 -7.687 1.00 0.00 H new ATOM 0 HB2 MET A 38 -2.293 9.089 -8.610 1.00 0.00 H new ATOM 0 HB3 MET A 38 -0.990 9.233 -9.774 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.583 7.724 -10.722 1.00 0.00 H new ATOM 0 HG3 MET A 38 -1.205 6.757 -10.235 1.00 0.00 H new ATOM 0 HE1 MET A 38 -4.720 4.744 -9.821 1.00 0.00 H new ATOM 0 HE2 MET A 38 -4.519 6.186 -10.844 1.00 0.00 H new ATOM 0 HE3 MET A 38 -3.279 4.910 -10.851 1.00 0.00 H new ATOM 358 N ARG A 39 1.679 9.223 -8.669 1.00 0.00 N ATOM 359 CA ARG A 39 3.122 9.173 -8.964 1.00 0.00 C ATOM 360 C ARG A 39 3.938 8.729 -7.752 1.00 0.00 C ATOM 361 O ARG A 39 4.875 7.962 -7.943 1.00 0.00 O ATOM 362 CB ARG A 39 3.702 10.479 -9.539 1.00 0.00 C ATOM 363 CG ARG A 39 4.113 10.321 -11.017 1.00 0.00 C ATOM 364 CD ARG A 39 5.242 11.289 -11.409 1.00 0.00 C ATOM 365 NE ARG A 39 5.128 11.795 -12.791 1.00 0.00 N ATOM 366 CZ ARG A 39 5.156 11.106 -13.928 1.00 0.00 C ATOM 367 NH1 ARG A 39 5.230 9.792 -13.962 1.00 0.00 N1+ ATOM 368 NH2 ARG A 39 5.104 11.751 -15.074 1.00 0.00 N ATOM 0 H ARG A 39 1.288 10.161 -8.582 1.00 0.00 H new ATOM 0 HA ARG A 39 3.209 8.424 -9.751 1.00 0.00 H new ATOM 0 HB2 ARG A 39 2.963 11.275 -9.450 1.00 0.00 H new ATOM 0 HB3 ARG A 39 4.568 10.782 -8.951 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.437 9.296 -11.195 1.00 0.00 H new ATOM 0 HG3 ARG A 39 3.247 10.497 -11.655 1.00 0.00 H new ATOM 0 HD2 ARG A 39 5.242 12.133 -10.720 1.00 0.00 H new ATOM 0 HD3 ARG A 39 6.201 10.783 -11.293 1.00 0.00 H new ATOM 0 HE ARG A 39 5.013 12.804 -12.886 1.00 0.00 H new ATOM 0 HH11 ARG A 39 5.268 9.261 -13.092 1.00 0.00 H new ATOM 0 HH12 ARG A 39 5.249 9.305 -14.858 1.00 0.00 H new ATOM 0 HH21 ARG A 39 5.043 12.769 -15.084 1.00 0.00 H new ATOM 0 HH22 ARG A 39 5.125 11.233 -15.952 1.00 0.00 H new ATOM 382 N ALA A 40 3.609 9.140 -6.522 1.00 0.00 N ATOM 383 CA ALA A 40 4.367 8.723 -5.332 1.00 0.00 C ATOM 384 C ALA A 40 4.554 7.193 -5.270 1.00 0.00 C ATOM 385 O ALA A 40 5.675 6.715 -5.101 1.00 0.00 O ATOM 386 CB ALA A 40 3.681 9.269 -4.071 1.00 0.00 C ATOM 0 H ALA A 40 2.824 9.760 -6.323 1.00 0.00 H new ATOM 0 HA ALA A 40 5.370 9.144 -5.395 1.00 0.00 H new ATOM 0 HB1 ALA A 40 4.242 8.960 -3.189 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.648 10.358 -4.117 1.00 0.00 H new ATOM 0 HB3 ALA A 40 2.666 8.877 -4.011 1.00 0.00 H new ATOM 392 N GLN A 41 3.483 6.431 -5.501 1.00 0.00 N ATOM 393 CA GLN A 41 3.511 4.966 -5.495 1.00 0.00 C ATOM 394 C GLN A 41 4.057 4.342 -6.794 1.00 0.00 C ATOM 395 O GLN A 41 4.816 3.373 -6.720 1.00 0.00 O ATOM 396 CB GLN A 41 2.106 4.464 -5.134 1.00 0.00 C ATOM 397 CG GLN A 41 1.049 4.648 -6.240 1.00 0.00 C ATOM 398 CD GLN A 41 -0.397 4.610 -5.745 1.00 0.00 C ATOM 399 OE1 GLN A 41 -0.694 4.637 -4.562 1.00 0.00 O ATOM 400 NE2 GLN A 41 -1.361 4.514 -6.635 1.00 0.00 N ATOM 0 H GLN A 41 2.561 6.818 -5.700 1.00 0.00 H new ATOM 0 HA GLN A 41 4.226 4.636 -4.741 1.00 0.00 H new ATOM 0 HB2 GLN A 41 2.167 3.405 -4.883 1.00 0.00 H new ATOM 0 HB3 GLN A 41 1.768 4.985 -4.238 1.00 0.00 H new ATOM 0 HG2 GLN A 41 1.225 5.601 -6.738 1.00 0.00 H new ATOM 0 HG3 GLN A 41 1.185 3.867 -6.989 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -1.136 4.490 -7.630 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -2.333 4.464 -6.330 1.00 0.00 H new ATOM 409 N LEU A 42 3.733 4.892 -7.977 1.00 0.00 N ATOM 410 CA LEU A 42 4.270 4.401 -9.257 1.00 0.00 C ATOM 411 C LEU A 42 5.784 4.629 -9.365 1.00 0.00 C ATOM 412 O LEU A 42 6.474 3.801 -9.952 1.00 0.00 O ATOM 413 CB LEU A 42 3.533 5.062 -10.446 1.00 0.00 C ATOM 414 CG LEU A 42 2.273 4.351 -10.999 1.00 0.00 C ATOM 415 CD1 LEU A 42 2.655 3.117 -11.828 1.00 0.00 C ATOM 416 CD2 LEU A 42 1.247 3.904 -9.949 1.00 0.00 C ATOM 0 H LEU A 42 3.096 5.683 -8.072 1.00 0.00 H new ATOM 0 HA LEU A 42 4.098 3.325 -9.293 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.244 6.069 -10.143 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.245 5.167 -11.265 1.00 0.00 H new ATOM 0 HG LEU A 42 1.796 5.121 -11.606 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.751 2.637 -12.204 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.280 3.422 -12.667 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.205 2.414 -11.202 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.407 3.419 -10.445 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.715 3.203 -9.258 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.890 4.773 -9.397 1.00 0.00 H new ATOM 428 N ILE A 43 6.323 5.710 -8.796 1.00 0.00 N ATOM 429 CA ILE A 43 7.765 6.012 -8.806 1.00 0.00 C ATOM 430 C ILE A 43 8.516 5.235 -7.720 1.00 0.00 C ATOM 431 O ILE A 43 9.498 4.575 -8.056 1.00 0.00 O ATOM 432 CB ILE A 43 8.005 7.542 -8.729 1.00 0.00 C ATOM 433 CG1 ILE A 43 7.395 8.311 -9.929 1.00 0.00 C ATOM 434 CG2 ILE A 43 9.506 7.872 -8.624 1.00 0.00 C ATOM 435 CD1 ILE A 43 7.801 7.816 -11.322 1.00 0.00 C ATOM 0 H ILE A 43 5.767 6.412 -8.308 1.00 0.00 H new ATOM 0 HA ILE A 43 8.179 5.672 -9.755 1.00 0.00 H new ATOM 0 HB ILE A 43 7.495 7.873 -7.824 1.00 0.00 H new ATOM 0 HG12 ILE A 43 6.309 8.264 -9.851 1.00 0.00 H new ATOM 0 HG13 ILE A 43 7.675 9.361 -9.842 1.00 0.00 H new ATOM 0 HG21 ILE A 43 9.638 8.953 -8.572 1.00 0.00 H new ATOM 0 HG22 ILE A 43 9.918 7.412 -7.725 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.026 7.485 -9.500 1.00 0.00 H new ATOM 0 HD11 ILE A 43 7.314 8.428 -12.082 1.00 0.00 H new ATOM 0 HD12 ILE A 43 8.883 7.891 -11.434 1.00 0.00 H new ATOM 0 HD13 ILE A 43 7.495 6.777 -11.442 1.00 0.00 H new ATOM 447 N GLU A 44 8.058 5.250 -6.460 1.00 0.00 N ATOM 448 CA GLU A 44 8.757 4.613 -5.326 1.00 0.00 C ATOM 449 C GLU A 44 9.109 3.138 -5.586 1.00 0.00 C ATOM 450 O GLU A 44 10.181 2.680 -5.189 1.00 0.00 O ATOM 451 CB GLU A 44 7.895 4.743 -4.056 1.00 0.00 C ATOM 452 CG GLU A 44 8.486 4.029 -2.830 1.00 0.00 C ATOM 453 CD GLU A 44 7.712 4.360 -1.547 1.00 0.00 C ATOM 454 OE1 GLU A 44 8.353 4.730 -0.534 1.00 0.00 O ATOM 455 OE2 GLU A 44 6.467 4.235 -1.546 1.00 0.00 O1- ATOM 0 H GLU A 44 7.186 5.707 -6.193 1.00 0.00 H new ATOM 0 HA GLU A 44 9.705 5.135 -5.193 1.00 0.00 H new ATOM 0 HB2 GLU A 44 7.766 5.800 -3.822 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.903 4.338 -4.258 1.00 0.00 H new ATOM 0 HG2 GLU A 44 8.471 2.952 -2.995 1.00 0.00 H new ATOM 0 HG3 GLU A 44 9.530 4.319 -2.709 1.00 0.00 H new ATOM 462 N ARG A 45 8.218 2.412 -6.269 1.00 0.00 N ATOM 463 CA ARG A 45 8.401 1.013 -6.668 1.00 0.00 C ATOM 464 C ARG A 45 8.823 0.888 -8.140 1.00 0.00 C ATOM 465 O ARG A 45 9.729 0.118 -8.458 1.00 0.00 O ATOM 466 CB ARG A 45 7.088 0.298 -6.310 1.00 0.00 C ATOM 467 CG ARG A 45 6.935 -1.190 -6.671 1.00 0.00 C ATOM 468 CD ARG A 45 6.745 -1.491 -8.160 1.00 0.00 C ATOM 469 NE ARG A 45 5.769 -0.585 -8.790 1.00 0.00 N ATOM 470 CZ ARG A 45 5.591 -0.432 -10.092 1.00 0.00 C ATOM 471 NH1 ARG A 45 6.315 -1.081 -10.969 1.00 0.00 N1+ ATOM 472 NH2 ARG A 45 4.668 0.377 -10.552 1.00 0.00 N ATOM 0 H ARG A 45 7.321 2.794 -6.569 1.00 0.00 H new ATOM 0 HA ARG A 45 9.225 0.536 -6.138 1.00 0.00 H new ATOM 0 HB2 ARG A 45 6.942 0.394 -5.234 1.00 0.00 H new ATOM 0 HB3 ARG A 45 6.274 0.840 -6.792 1.00 0.00 H new ATOM 0 HG2 ARG A 45 7.818 -1.724 -6.320 1.00 0.00 H new ATOM 0 HG3 ARG A 45 6.082 -1.592 -6.125 1.00 0.00 H new ATOM 0 HD2 ARG A 45 7.703 -1.403 -8.672 1.00 0.00 H new ATOM 0 HD3 ARG A 45 6.412 -2.522 -8.281 1.00 0.00 H new ATOM 0 HE ARG A 45 5.181 -0.029 -8.170 1.00 0.00 H new ATOM 0 HH11 ARG A 45 7.040 -1.726 -10.655 1.00 0.00 H new ATOM 0 HH12 ARG A 45 6.154 -0.942 -11.967 1.00 0.00 H new ATOM 0 HH21 ARG A 45 4.077 0.897 -9.904 1.00 0.00 H new ATOM 0 HH22 ARG A 45 4.541 0.486 -11.558 1.00 0.00 H new ATOM 486 N GLY A 46 8.214 1.632 -9.068 1.00 0.00 N ATOM 487 CA GLY A 46 8.442 1.454 -10.513 1.00 0.00 C ATOM 488 C GLY A 46 9.761 2.025 -11.015 1.00 0.00 C ATOM 489 O GLY A 46 10.278 1.529 -12.012 1.00 0.00 O ATOM 0 H GLY A 46 7.550 2.374 -8.844 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.409 0.390 -10.746 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.625 1.925 -11.059 1.00 0.00 H new ATOM 493 N GLN A 47 10.339 3.009 -10.326 1.00 0.00 N ATOM 494 CA GLN A 47 11.693 3.510 -10.591 1.00 0.00 C ATOM 495 C GLN A 47 12.761 2.746 -9.774 1.00 0.00 C ATOM 496 O GLN A 47 13.954 2.897 -10.028 1.00 0.00 O ATOM 497 CB GLN A 47 11.697 5.025 -10.327 1.00 0.00 C ATOM 498 CG GLN A 47 12.805 5.782 -11.073 1.00 0.00 C ATOM 499 CD GLN A 47 12.716 7.280 -10.787 1.00 0.00 C ATOM 500 OE1 GLN A 47 13.258 7.773 -9.806 1.00 0.00 O ATOM 501 NE2 GLN A 47 12.002 8.046 -11.591 1.00 0.00 N ATOM 0 H GLN A 47 9.875 3.490 -9.555 1.00 0.00 H new ATOM 0 HA GLN A 47 11.964 3.333 -11.632 1.00 0.00 H new ATOM 0 HB2 GLN A 47 10.730 5.437 -10.616 1.00 0.00 H new ATOM 0 HB3 GLN A 47 11.810 5.197 -9.257 1.00 0.00 H new ATOM 0 HG2 GLN A 47 13.781 5.405 -10.767 1.00 0.00 H new ATOM 0 HG3 GLN A 47 12.717 5.605 -12.145 1.00 0.00 H new ATOM 0 HE21 GLN A 47 11.548 7.642 -12.410 1.00 0.00 H new ATOM 0 HE22 GLN A 47 11.905 9.042 -11.393 1.00 0.00 H new ATOM 510 N LEU A 48 12.342 1.904 -8.815 1.00 0.00 N ATOM 511 CA LEU A 48 13.198 0.964 -8.077 1.00 0.00 C ATOM 512 C LEU A 48 13.365 -0.365 -8.842 1.00 0.00 C ATOM 513 O LEU A 48 14.435 -0.971 -8.827 1.00 0.00 O ATOM 514 CB LEU A 48 12.563 0.749 -6.688 1.00 0.00 C ATOM 515 CG LEU A 48 13.443 0.023 -5.653 1.00 0.00 C ATOM 516 CD1 LEU A 48 14.540 0.940 -5.097 1.00 0.00 C ATOM 517 CD2 LEU A 48 12.568 -0.456 -4.484 1.00 0.00 C ATOM 0 H LEU A 48 11.366 1.858 -8.523 1.00 0.00 H new ATOM 0 HA LEU A 48 14.202 1.374 -7.967 1.00 0.00 H new ATOM 0 HB2 LEU A 48 12.285 1.722 -6.282 1.00 0.00 H new ATOM 0 HB3 LEU A 48 11.641 0.181 -6.815 1.00 0.00 H new ATOM 0 HG LEU A 48 13.917 -0.820 -6.155 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.139 0.391 -4.370 1.00 0.00 H new ATOM 0 HD12 LEU A 48 15.179 1.279 -5.912 1.00 0.00 H new ATOM 0 HD13 LEU A 48 14.082 1.802 -4.613 1.00 0.00 H new ATOM 0 HD21 LEU A 48 13.190 -0.970 -3.751 1.00 0.00 H new ATOM 0 HD22 LEU A 48 12.087 0.402 -4.014 1.00 0.00 H new ATOM 0 HD23 LEU A 48 11.806 -1.140 -4.857 1.00 0.00 H new ATOM 529 N ILE A 49 12.313 -0.826 -9.531 1.00 0.00 N ATOM 530 CA ILE A 49 12.353 -2.025 -10.395 1.00 0.00 C ATOM 531 C ILE A 49 12.944 -1.718 -11.782 1.00 0.00 C ATOM 532 O ILE A 49 13.753 -2.501 -12.282 1.00 0.00 O ATOM 533 CB ILE A 49 10.943 -2.664 -10.478 1.00 0.00 C ATOM 534 CG1 ILE A 49 10.535 -3.197 -9.083 1.00 0.00 C ATOM 535 CG2 ILE A 49 10.896 -3.790 -11.529 1.00 0.00 C ATOM 536 CD1 ILE A 49 9.171 -3.895 -9.051 1.00 0.00 C ATOM 0 H ILE A 49 11.398 -0.376 -9.508 1.00 0.00 H new ATOM 0 HA ILE A 49 13.026 -2.754 -9.944 1.00 0.00 H new ATOM 0 HB ILE A 49 10.233 -1.899 -10.793 1.00 0.00 H new ATOM 0 HG12 ILE A 49 11.296 -3.896 -8.737 1.00 0.00 H new ATOM 0 HG13 ILE A 49 10.522 -2.365 -8.378 1.00 0.00 H new ATOM 0 HG21 ILE A 49 9.893 -4.216 -11.561 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.149 -3.384 -12.508 1.00 0.00 H new ATOM 0 HG23 ILE A 49 11.612 -4.567 -11.262 1.00 0.00 H new ATOM 0 HD11 ILE A 49 8.962 -4.238 -8.038 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.397 -3.195 -9.364 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.183 -4.749 -9.728 1.00 0.00 H new ATOM 548 N ALA A 50 12.552 -0.596 -12.398 1.00 0.00 N ATOM 549 CA ALA A 50 12.962 -0.170 -13.742 1.00 0.00 C ATOM 550 C ALA A 50 12.654 1.328 -13.943 1.00 0.00 C ATOM 551 O ALA A 50 13.295 2.159 -13.305 1.00 0.00 O ATOM 552 CB ALA A 50 12.339 -1.104 -14.799 1.00 0.00 C ATOM 0 H ALA A 50 11.915 0.067 -11.956 1.00 0.00 H new ATOM 0 HA ALA A 50 14.041 -0.262 -13.864 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.646 -0.783 -15.794 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.677 -2.126 -14.626 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.252 -1.064 -14.725 1.00 0.00 H new ATOM 558 N GLU A 51 11.680 1.680 -14.794 1.00 0.00 N ATOM 559 CA GLU A 51 11.291 3.061 -15.112 1.00 0.00 C ATOM 560 C GLU A 51 9.816 3.119 -15.578 1.00 0.00 C ATOM 561 O GLU A 51 9.520 3.156 -16.772 1.00 0.00 O ATOM 562 CB GLU A 51 12.296 3.673 -16.124 1.00 0.00 C ATOM 563 CG GLU A 51 13.256 4.692 -15.489 1.00 0.00 C ATOM 564 CD GLU A 51 14.474 4.958 -16.388 1.00 0.00 C ATOM 565 OE1 GLU A 51 14.306 5.523 -17.495 1.00 0.00 O ATOM 566 OE2 GLU A 51 15.614 4.618 -15.989 1.00 0.00 O1- ATOM 0 H GLU A 51 11.123 0.989 -15.296 1.00 0.00 H new ATOM 0 HA GLU A 51 11.340 3.679 -14.216 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.878 2.871 -16.578 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.742 4.158 -16.927 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.726 5.627 -15.307 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.592 4.322 -14.520 1.00 0.00 H new ATOM 573 N GLN A 52 8.884 3.116 -14.611 1.00 0.00 N ATOM 574 CA GLN A 52 7.448 3.440 -14.784 1.00 0.00 C ATOM 575 C GLN A 52 6.700 2.445 -15.706 1.00 0.00 C ATOM 576 O GLN A 52 5.980 2.855 -16.622 1.00 0.00 O ATOM 577 CB GLN A 52 7.266 4.909 -15.240 1.00 0.00 C ATOM 578 CG GLN A 52 7.805 5.960 -14.253 1.00 0.00 C ATOM 579 CD GLN A 52 8.935 6.805 -14.844 1.00 0.00 C ATOM 580 OE1 GLN A 52 8.719 7.731 -15.616 1.00 0.00 O ATOM 581 NE2 GLN A 52 10.181 6.523 -14.517 1.00 0.00 N ATOM 0 H GLN A 52 9.114 2.879 -13.646 1.00 0.00 H new ATOM 0 HA GLN A 52 6.981 3.329 -13.805 1.00 0.00 H new ATOM 0 HB2 GLN A 52 7.765 5.042 -16.200 1.00 0.00 H new ATOM 0 HB3 GLN A 52 6.205 5.095 -15.404 1.00 0.00 H new ATOM 0 HG2 GLN A 52 6.990 6.615 -13.946 1.00 0.00 H new ATOM 0 HG3 GLN A 52 8.165 5.458 -13.355 1.00 0.00 H new ATOM 0 HE21 GLN A 52 10.379 5.755 -13.875 1.00 0.00 H new ATOM 0 HE22 GLN A 52 10.947 7.073 -14.906 1.00 0.00 H new ATOM 590 N LEU A 53 6.881 1.132 -15.492 1.00 0.00 N ATOM 591 CA LEU A 53 6.473 0.097 -16.463 1.00 0.00 C ATOM 592 C LEU A 53 5.883 -1.185 -15.849 1.00 0.00 C ATOM 593 O LEU A 53 4.825 -1.639 -16.288 1.00 0.00 O ATOM 594 CB LEU A 53 7.694 -0.194 -17.367 1.00 0.00 C ATOM 595 CG LEU A 53 7.459 0.271 -18.817 1.00 0.00 C ATOM 596 CD1 LEU A 53 8.805 0.465 -19.527 1.00 0.00 C ATOM 597 CD2 LEU A 53 6.581 -0.741 -19.569 1.00 0.00 C ATOM 0 H LEU A 53 7.312 0.757 -14.647 1.00 0.00 H new ATOM 0 HA LEU A 53 5.637 0.489 -17.042 1.00 0.00 H new ATOM 0 HB2 LEU A 53 8.573 0.308 -16.963 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.906 -1.263 -17.358 1.00 0.00 H new ATOM 0 HG LEU A 53 6.934 1.226 -18.804 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.632 0.794 -20.552 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.390 1.218 -18.998 1.00 0.00 H new ATOM 0 HD13 LEU A 53 9.351 -0.478 -19.536 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.424 -0.398 -20.592 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.076 -1.712 -19.584 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.618 -0.832 -19.066 1.00 0.00 H new ATOM 609 N ALA A 54 6.534 -1.765 -14.835 1.00 0.00 N ATOM 610 CA ALA A 54 6.026 -2.919 -14.077 1.00 0.00 C ATOM 611 C ALA A 54 4.723 -2.584 -13.289 1.00 0.00 C ATOM 612 O ALA A 54 4.459 -1.395 -13.060 1.00 0.00 O ATOM 613 CB ALA A 54 7.191 -3.419 -13.197 1.00 0.00 C ATOM 0 H ALA A 54 7.445 -1.442 -14.510 1.00 0.00 H new ATOM 0 HA ALA A 54 5.711 -3.722 -14.743 1.00 0.00 H new ATOM 0 HB1 ALA A 54 6.863 -4.278 -12.613 1.00 0.00 H new ATOM 0 HB2 ALA A 54 8.028 -3.710 -13.832 1.00 0.00 H new ATOM 0 HB3 ALA A 54 7.507 -2.622 -12.524 1.00 0.00 H new ATOM 619 N PRO A 55 3.927 -3.583 -12.842 1.00 0.00 N ATOM 620 CA PRO A 55 2.679 -3.366 -12.097 1.00 0.00 C ATOM 621 C PRO A 55 2.926 -2.770 -10.705 1.00 0.00 C ATOM 622 O PRO A 55 3.929 -3.084 -10.067 1.00 0.00 O ATOM 623 CB PRO A 55 2.017 -4.747 -11.988 1.00 0.00 C ATOM 624 CG PRO A 55 3.201 -5.710 -12.062 1.00 0.00 C ATOM 625 CD PRO A 55 4.129 -5.013 -13.053 1.00 0.00 C ATOM 0 HA PRO A 55 2.045 -2.645 -12.613 1.00 0.00 H new ATOM 0 HB2 PRO A 55 1.467 -4.857 -11.054 1.00 0.00 H new ATOM 0 HB3 PRO A 55 1.308 -4.918 -12.798 1.00 0.00 H new ATOM 0 HG2 PRO A 55 3.674 -5.847 -11.090 1.00 0.00 H new ATOM 0 HG3 PRO A 55 2.900 -6.697 -12.412 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.168 -5.292 -12.879 1.00 0.00 H new ATOM 0 HD3 PRO A 55 3.890 -5.295 -14.078 1.00 0.00 H new ATOM 633 N LEU A 56 1.996 -1.938 -10.212 1.00 0.00 N ATOM 634 CA LEU A 56 2.118 -1.311 -8.887 1.00 0.00 C ATOM 635 C LEU A 56 1.790 -2.250 -7.718 1.00 0.00 C ATOM 636 O LEU A 56 2.402 -2.108 -6.662 1.00 0.00 O ATOM 637 CB LEU A 56 1.351 0.033 -8.815 1.00 0.00 C ATOM 638 CG LEU A 56 -0.182 -0.028 -8.620 1.00 0.00 C ATOM 639 CD1 LEU A 56 -0.749 1.358 -8.282 1.00 0.00 C ATOM 640 CD2 LEU A 56 -0.896 -0.541 -9.875 1.00 0.00 C ATOM 0 H LEU A 56 1.146 -1.683 -10.715 1.00 0.00 H new ATOM 0 HA LEU A 56 3.177 -1.083 -8.763 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.771 0.616 -7.996 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.551 0.584 -9.734 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.359 -0.719 -7.796 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.829 1.287 -8.150 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.294 1.723 -7.361 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.528 2.050 -9.095 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -1.971 -0.569 -9.696 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.684 0.125 -10.712 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.541 -1.544 -10.111 1.00 0.00 H new ATOM 652 N ALA A 57 0.861 -3.199 -7.893 1.00 0.00 N ATOM 653 CA ALA A 57 0.413 -4.093 -6.818 1.00 0.00 C ATOM 654 C ALA A 57 0.984 -5.513 -6.906 1.00 0.00 C ATOM 655 O ALA A 57 1.441 -6.030 -5.893 1.00 0.00 O ATOM 656 CB ALA A 57 -1.121 -4.115 -6.797 1.00 0.00 C ATOM 0 H ALA A 57 0.398 -3.368 -8.786 1.00 0.00 H new ATOM 0 HA ALA A 57 0.802 -3.693 -5.882 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -1.465 -4.776 -6.002 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -1.497 -3.108 -6.619 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -1.493 -4.477 -7.756 1.00 0.00 H new ATOM 662 N ALA A 58 0.972 -6.154 -8.081 1.00 0.00 N ATOM 663 CA ALA A 58 1.248 -7.593 -8.205 1.00 0.00 C ATOM 664 C ALA A 58 2.644 -7.997 -7.685 1.00 0.00 C ATOM 665 O ALA A 58 2.747 -8.856 -6.805 1.00 0.00 O ATOM 666 CB ALA A 58 1.019 -8.007 -9.665 1.00 0.00 C ATOM 0 H ALA A 58 0.772 -5.694 -8.969 1.00 0.00 H new ATOM 0 HA ALA A 58 0.558 -8.137 -7.560 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.219 -9.073 -9.777 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -0.014 -7.801 -9.944 1.00 0.00 H new ATOM 0 HB3 ALA A 58 1.689 -7.442 -10.313 1.00 0.00 H new ATOM 672 N THR A 59 3.706 -7.337 -8.176 1.00 0.00 N ATOM 673 CA THR A 59 5.094 -7.532 -7.708 1.00 0.00 C ATOM 674 C THR A 59 5.269 -7.093 -6.258 1.00 0.00 C ATOM 675 O THR A 59 5.894 -7.799 -5.471 1.00 0.00 O ATOM 676 CB THR A 59 6.090 -6.843 -8.655 1.00 0.00 C ATOM 677 OG1 THR A 59 7.404 -7.153 -8.245 1.00 0.00 O ATOM 678 CG2 THR A 59 5.966 -5.318 -8.695 1.00 0.00 C ATOM 0 H THR A 59 3.627 -6.643 -8.919 1.00 0.00 H new ATOM 0 HA THR A 59 5.311 -8.600 -7.730 1.00 0.00 H new ATOM 0 HB THR A 59 5.860 -7.215 -9.653 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.045 -6.718 -8.845 1.00 0.00 H new ATOM 0 HG21 THR A 59 6.704 -4.911 -9.386 1.00 0.00 H new ATOM 0 HG22 THR A 59 4.965 -5.043 -9.029 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.140 -4.913 -7.698 1.00 0.00 H new ATOM 686 N ALA A 60 4.666 -5.964 -5.877 1.00 0.00 N ATOM 687 CA ALA A 60 4.787 -5.384 -4.544 1.00 0.00 C ATOM 688 C ALA A 60 4.139 -6.252 -3.450 1.00 0.00 C ATOM 689 O ALA A 60 4.672 -6.334 -2.346 1.00 0.00 O ATOM 690 CB ALA A 60 4.200 -3.972 -4.597 1.00 0.00 C ATOM 0 H ALA A 60 4.070 -5.420 -6.501 1.00 0.00 H new ATOM 0 HA ALA A 60 5.839 -5.338 -4.262 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.275 -3.509 -3.613 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.753 -3.375 -5.322 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.153 -4.024 -4.894 1.00 0.00 H new ATOM 696 N LEU A 61 3.030 -6.935 -3.750 1.00 0.00 N ATOM 697 CA LEU A 61 2.365 -7.875 -2.843 1.00 0.00 C ATOM 698 C LEU A 61 3.127 -9.208 -2.809 1.00 0.00 C ATOM 699 O LEU A 61 3.387 -9.726 -1.723 1.00 0.00 O ATOM 700 CB LEU A 61 0.890 -8.008 -3.286 1.00 0.00 C ATOM 701 CG LEU A 61 -0.128 -8.571 -2.269 1.00 0.00 C ATOM 702 CD1 LEU A 61 0.119 -10.036 -1.888 1.00 0.00 C ATOM 703 CD2 LEU A 61 -0.220 -7.713 -0.997 1.00 0.00 C ATOM 0 H LEU A 61 2.559 -6.848 -4.651 1.00 0.00 H new ATOM 0 HA LEU A 61 2.370 -7.511 -1.816 1.00 0.00 H new ATOM 0 HB2 LEU A 61 0.544 -7.021 -3.593 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.864 -8.644 -4.171 1.00 0.00 H new ATOM 0 HG LEU A 61 -1.083 -8.530 -2.794 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.636 -10.358 -1.171 1.00 0.00 H new ATOM 0 HD12 LEU A 61 0.061 -10.659 -2.781 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.108 -10.134 -1.441 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.949 -8.151 -0.315 1.00 0.00 H new ATOM 0 HD22 LEU A 61 0.755 -7.676 -0.512 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -0.532 -6.703 -1.261 1.00 0.00 H new ATOM 715 N ALA A 62 3.575 -9.719 -3.963 1.00 0.00 N ATOM 716 CA ALA A 62 4.387 -10.940 -4.056 1.00 0.00 C ATOM 717 C ALA A 62 5.704 -10.855 -3.253 1.00 0.00 C ATOM 718 O ALA A 62 6.095 -11.835 -2.616 1.00 0.00 O ATOM 719 CB ALA A 62 4.648 -11.233 -5.540 1.00 0.00 C ATOM 0 H ALA A 62 3.382 -9.292 -4.869 1.00 0.00 H new ATOM 0 HA ALA A 62 3.832 -11.761 -3.603 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.250 -12.137 -5.632 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.698 -11.376 -6.055 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.181 -10.395 -5.988 1.00 0.00 H new ATOM 725 N ARG A 63 6.354 -9.681 -3.245 1.00 0.00 N ATOM 726 CA ARG A 63 7.547 -9.369 -2.433 1.00 0.00 C ATOM 727 C ARG A 63 7.215 -8.737 -1.058 1.00 0.00 C ATOM 728 O ARG A 63 8.117 -8.422 -0.283 1.00 0.00 O ATOM 729 CB ARG A 63 8.501 -8.497 -3.273 1.00 0.00 C ATOM 730 CG ARG A 63 8.110 -7.013 -3.259 1.00 0.00 C ATOM 731 CD ARG A 63 8.617 -6.219 -4.465 1.00 0.00 C ATOM 732 NE ARG A 63 10.083 -6.093 -4.465 1.00 0.00 N ATOM 733 CZ ARG A 63 10.868 -6.056 -5.535 1.00 0.00 C ATOM 734 NH1 ARG A 63 10.392 -6.177 -6.758 1.00 0.00 N1+ ATOM 735 NH2 ARG A 63 12.164 -5.893 -5.382 1.00 0.00 N ATOM 0 H ARG A 63 6.056 -8.894 -3.822 1.00 0.00 H new ATOM 0 HA ARG A 63 8.043 -10.306 -2.178 1.00 0.00 H new ATOM 0 HB2 ARG A 63 9.516 -8.605 -2.892 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.506 -8.858 -4.302 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.024 -6.936 -3.218 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.497 -6.556 -2.348 1.00 0.00 H new ATOM 0 HD2 ARG A 63 8.295 -6.710 -5.383 1.00 0.00 H new ATOM 0 HD3 ARG A 63 8.168 -5.226 -4.460 1.00 0.00 H new ATOM 0 HE ARG A 63 10.540 -6.028 -3.555 1.00 0.00 H new ATOM 0 HH11 ARG A 63 9.391 -6.304 -6.905 1.00 0.00 H new ATOM 0 HH12 ARG A 63 11.025 -6.144 -7.557 1.00 0.00 H new ATOM 0 HH21 ARG A 63 12.559 -5.796 -4.447 1.00 0.00 H new ATOM 0 HH22 ARG A 63 12.774 -5.863 -6.199 1.00 0.00 H new ATOM 749 N LYS A 64 5.924 -8.517 -0.766 1.00 0.00 N ATOM 750 CA LYS A 64 5.368 -8.072 0.527 1.00 0.00 C ATOM 751 C LYS A 64 5.845 -6.662 0.978 1.00 0.00 C ATOM 752 O LYS A 64 6.015 -6.392 2.169 1.00 0.00 O ATOM 753 CB LYS A 64 5.608 -9.194 1.563 1.00 0.00 C ATOM 754 CG LYS A 64 4.532 -9.320 2.655 1.00 0.00 C ATOM 755 CD LYS A 64 3.155 -9.840 2.196 1.00 0.00 C ATOM 756 CE LYS A 64 3.240 -11.159 1.409 1.00 0.00 C ATOM 757 NZ LYS A 64 1.957 -11.914 1.434 1.00 0.00 N1+ ATOM 0 H LYS A 64 5.194 -8.652 -1.466 1.00 0.00 H new ATOM 0 HA LYS A 64 4.294 -7.917 0.419 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.679 -10.145 1.035 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.571 -9.023 2.043 1.00 0.00 H new ATOM 0 HG2 LYS A 64 4.908 -9.986 3.432 1.00 0.00 H new ATOM 0 HG3 LYS A 64 4.393 -8.341 3.114 1.00 0.00 H new ATOM 0 HD2 LYS A 64 2.519 -9.985 3.069 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.676 -9.083 1.575 1.00 0.00 H new ATOM 0 HE2 LYS A 64 3.514 -10.946 0.376 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.033 -11.779 1.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.062 -12.795 0.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 1.707 -12.141 2.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.205 -11.334 1.011 1.00 0.00 H new ATOM 771 N ASP A 65 6.090 -5.752 0.030 1.00 0.00 N ATOM 772 CA ASP A 65 6.718 -4.438 0.245 1.00 0.00 C ATOM 773 C ASP A 65 5.716 -3.367 0.731 1.00 0.00 C ATOM 774 O ASP A 65 5.287 -2.481 -0.015 1.00 0.00 O ATOM 775 CB ASP A 65 7.512 -4.010 -1.011 1.00 0.00 C ATOM 776 CG ASP A 65 8.984 -3.709 -0.689 1.00 0.00 C ATOM 777 OD1 ASP A 65 9.874 -4.303 -1.343 1.00 0.00 O ATOM 778 OD2 ASP A 65 9.230 -2.862 0.202 1.00 0.00 O1- ATOM 0 H ASP A 65 5.848 -5.914 -0.948 1.00 0.00 H new ATOM 0 HA ASP A 65 7.432 -4.536 1.063 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.459 -4.801 -1.760 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.049 -3.126 -1.448 1.00 0.00 H new ATOM 783 N THR A 66 5.364 -3.437 2.023 1.00 0.00 N ATOM 784 CA THR A 66 4.429 -2.516 2.711 1.00 0.00 C ATOM 785 C THR A 66 4.800 -1.037 2.554 1.00 0.00 C ATOM 786 O THR A 66 3.913 -0.191 2.612 1.00 0.00 O ATOM 787 CB THR A 66 4.246 -2.919 4.180 1.00 0.00 C ATOM 788 OG1 THR A 66 3.778 -4.249 4.229 1.00 0.00 O ATOM 789 CG2 THR A 66 3.177 -2.091 4.894 1.00 0.00 C ATOM 0 H THR A 66 5.731 -4.158 2.644 1.00 0.00 H new ATOM 0 HA THR A 66 3.466 -2.619 2.212 1.00 0.00 H new ATOM 0 HB THR A 66 5.212 -2.772 4.663 1.00 0.00 H new ATOM 0 HG1 THR A 66 3.507 -4.467 5.145 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.092 -2.421 5.929 1.00 0.00 H new ATOM 0 HG22 THR A 66 3.457 -1.038 4.871 1.00 0.00 H new ATOM 0 HG23 THR A 66 2.219 -2.223 4.392 1.00 0.00 H new ATOM 797 N ALA A 67 6.065 -0.712 2.259 1.00 0.00 N ATOM 798 CA ALA A 67 6.517 0.640 1.915 1.00 0.00 C ATOM 799 C ALA A 67 5.652 1.284 0.817 1.00 0.00 C ATOM 800 O ALA A 67 5.111 2.370 1.024 1.00 0.00 O ATOM 801 CB ALA A 67 7.990 0.561 1.485 1.00 0.00 C ATOM 0 H ALA A 67 6.819 -1.399 2.253 1.00 0.00 H new ATOM 0 HA ALA A 67 6.415 1.281 2.791 1.00 0.00 H new ATOM 0 HB1 ALA A 67 8.347 1.557 1.224 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.588 0.165 2.306 1.00 0.00 H new ATOM 0 HB3 ALA A 67 8.082 -0.095 0.619 1.00 0.00 H new ATOM 807 N VAL A 68 5.471 0.591 -0.311 1.00 0.00 N ATOM 808 CA VAL A 68 4.582 1.021 -1.408 1.00 0.00 C ATOM 809 C VAL A 68 3.155 0.491 -1.225 1.00 0.00 C ATOM 810 O VAL A 68 2.206 1.180 -1.607 1.00 0.00 O ATOM 811 CB VAL A 68 5.159 0.645 -2.795 1.00 0.00 C ATOM 812 CG1 VAL A 68 5.413 -0.863 -2.934 1.00 0.00 C ATOM 813 CG2 VAL A 68 4.253 1.127 -3.940 1.00 0.00 C ATOM 0 H VAL A 68 5.941 -0.295 -0.496 1.00 0.00 H new ATOM 0 HA VAL A 68 4.527 2.109 -1.367 1.00 0.00 H new ATOM 0 HB VAL A 68 6.118 1.158 -2.868 1.00 0.00 H new ATOM 0 HG11 VAL A 68 5.817 -1.074 -3.924 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.127 -1.183 -2.175 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.476 -1.404 -2.802 1.00 0.00 H new ATOM 0 HG21 VAL A 68 4.693 0.844 -4.896 1.00 0.00 H new ATOM 0 HG22 VAL A 68 3.269 0.668 -3.843 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.154 2.211 -3.894 1.00 0.00 H new ATOM 823 N LEU A 69 2.976 -0.686 -0.602 1.00 0.00 N ATOM 824 CA LEU A 69 1.647 -1.258 -0.371 1.00 0.00 C ATOM 825 C LEU A 69 0.771 -0.337 0.495 1.00 0.00 C ATOM 826 O LEU A 69 -0.417 -0.229 0.220 1.00 0.00 O ATOM 827 CB LEU A 69 1.740 -2.707 0.162 1.00 0.00 C ATOM 828 CG LEU A 69 1.208 -3.816 -0.773 1.00 0.00 C ATOM 829 CD1 LEU A 69 -0.278 -3.689 -1.143 1.00 0.00 C ATOM 830 CD2 LEU A 69 2.069 -3.897 -2.035 1.00 0.00 C ATOM 0 H LEU A 69 3.742 -1.259 -0.249 1.00 0.00 H new ATOM 0 HA LEU A 69 1.137 -1.325 -1.332 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.784 -2.922 0.388 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.193 -2.761 1.103 1.00 0.00 H new ATOM 0 HG LEU A 69 1.282 -4.742 -0.203 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.561 -4.511 -1.801 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.883 -3.725 -0.237 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.446 -2.741 -1.654 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.686 -4.682 -2.687 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.037 -2.942 -2.559 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.098 -4.125 -1.759 1.00 0.00 H new ATOM 842 N ASN A 70 1.351 0.430 1.428 1.00 0.00 N ATOM 843 CA ASN A 70 0.674 1.525 2.137 1.00 0.00 C ATOM 844 C ASN A 70 -0.007 2.519 1.178 1.00 0.00 C ATOM 845 O ASN A 70 -1.211 2.758 1.292 1.00 0.00 O ATOM 846 CB ASN A 70 1.683 2.254 3.051 1.00 0.00 C ATOM 847 CG ASN A 70 1.201 3.653 3.456 1.00 0.00 C ATOM 848 OD1 ASN A 70 0.255 3.829 4.203 1.00 0.00 O ATOM 849 ND2 ASN A 70 1.778 4.700 2.903 1.00 0.00 N ATOM 0 H ASN A 70 2.321 0.305 1.717 1.00 0.00 H new ATOM 0 HA ASN A 70 -0.119 1.086 2.743 1.00 0.00 H new ATOM 0 HB2 ASN A 70 1.853 1.658 3.947 1.00 0.00 H new ATOM 0 HB3 ASN A 70 2.640 2.337 2.537 1.00 0.00 H new ATOM 0 HD21 ASN A 70 1.431 5.638 3.103 1.00 0.00 H new ATOM 0 HD22 ASN A 70 2.571 4.573 2.275 1.00 0.00 H new ATOM 856 N ARG A 71 0.749 3.105 0.239 1.00 0.00 N ATOM 857 CA ARG A 71 0.221 4.123 -0.676 1.00 0.00 C ATOM 858 C ARG A 71 -0.822 3.524 -1.624 1.00 0.00 C ATOM 859 O ARG A 71 -1.945 4.025 -1.673 1.00 0.00 O ATOM 860 CB ARG A 71 1.359 4.807 -1.448 1.00 0.00 C ATOM 861 CG ARG A 71 2.082 5.900 -0.637 1.00 0.00 C ATOM 862 CD ARG A 71 3.615 5.839 -0.736 1.00 0.00 C ATOM 863 NE ARG A 71 4.221 5.100 0.387 1.00 0.00 N ATOM 864 CZ ARG A 71 4.568 5.595 1.569 1.00 0.00 C ATOM 865 NH1 ARG A 71 4.304 6.834 1.929 1.00 0.00 N1+ ATOM 866 NH2 ARG A 71 5.166 4.808 2.432 1.00 0.00 N ATOM 0 H ARG A 71 1.735 2.888 0.094 1.00 0.00 H new ATOM 0 HA ARG A 71 -0.280 4.887 -0.081 1.00 0.00 H new ATOM 0 HB2 ARG A 71 2.084 4.053 -1.754 1.00 0.00 H new ATOM 0 HB3 ARG A 71 0.955 5.249 -2.359 1.00 0.00 H new ATOM 0 HG2 ARG A 71 1.744 6.877 -0.982 1.00 0.00 H new ATOM 0 HG3 ARG A 71 1.792 5.813 0.410 1.00 0.00 H new ATOM 0 HD2 ARG A 71 3.897 5.363 -1.675 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.016 6.852 -0.759 1.00 0.00 H new ATOM 0 HE ARG A 71 4.391 4.105 0.240 1.00 0.00 H new ATOM 0 HH11 ARG A 71 3.813 7.458 1.288 1.00 0.00 H new ATOM 0 HH12 ARG A 71 4.591 7.170 2.848 1.00 0.00 H new ATOM 0 HH21 ARG A 71 5.356 3.836 2.189 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.441 5.169 3.346 1.00 0.00 H new ATOM 880 N ILE A 72 -0.520 2.398 -2.290 1.00 0.00 N ATOM 881 CA ILE A 72 -1.496 1.773 -3.209 1.00 0.00 C ATOM 882 C ILE A 72 -2.733 1.273 -2.462 1.00 0.00 C ATOM 883 O ILE A 72 -3.813 1.298 -3.036 1.00 0.00 O ATOM 884 CB ILE A 72 -0.895 0.692 -4.140 1.00 0.00 C ATOM 885 CG1 ILE A 72 -0.774 -0.673 -3.442 1.00 0.00 C ATOM 886 CG2 ILE A 72 0.427 1.168 -4.763 1.00 0.00 C ATOM 887 CD1 ILE A 72 0.021 -1.709 -4.237 1.00 0.00 C ATOM 0 H ILE A 72 0.371 1.907 -2.215 1.00 0.00 H new ATOM 0 HA ILE A 72 -1.812 2.570 -3.882 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.593 0.539 -4.964 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.299 -0.532 -2.471 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.774 -1.063 -3.254 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.825 0.388 -5.412 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.249 2.071 -5.348 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.145 1.384 -3.972 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.061 -2.644 -3.678 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.464 -1.881 -5.198 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.034 -1.342 -4.403 1.00 0.00 H new ATOM 899 N ALA A 73 -2.632 0.898 -1.184 1.00 0.00 N ATOM 900 CA ALA A 73 -3.806 0.588 -0.379 1.00 0.00 C ATOM 901 C ALA A 73 -4.673 1.829 -0.125 1.00 0.00 C ATOM 902 O ALA A 73 -5.870 1.816 -0.394 1.00 0.00 O ATOM 903 CB ALA A 73 -3.385 -0.094 0.923 1.00 0.00 C ATOM 0 H ALA A 73 -1.746 0.803 -0.688 1.00 0.00 H new ATOM 0 HA ALA A 73 -4.430 -0.107 -0.940 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -4.270 -0.321 1.517 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.854 -1.018 0.695 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -2.730 0.571 1.487 1.00 0.00 H new ATOM 909 N ASN A 74 -4.073 2.933 0.321 1.00 0.00 N ATOM 910 CA ASN A 74 -4.796 4.191 0.530 1.00 0.00 C ATOM 911 C ASN A 74 -5.338 4.825 -0.777 1.00 0.00 C ATOM 912 O ASN A 74 -6.188 5.712 -0.703 1.00 0.00 O ATOM 913 CB ASN A 74 -3.910 5.167 1.317 1.00 0.00 C ATOM 914 CG ASN A 74 -3.864 4.828 2.805 1.00 0.00 C ATOM 915 OD1 ASN A 74 -4.676 5.299 3.593 1.00 0.00 O ATOM 916 ND2 ASN A 74 -2.930 4.000 3.239 1.00 0.00 N ATOM 0 H ASN A 74 -3.079 2.982 0.547 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.687 3.961 1.114 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -2.899 5.147 0.910 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -4.286 6.182 1.188 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.886 3.754 4.228 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -2.253 3.607 2.585 1.00 0.00 H new ATOM 923 N GLU A 75 -4.898 4.361 -1.956 1.00 0.00 N ATOM 924 CA GLU A 75 -5.406 4.784 -3.268 1.00 0.00 C ATOM 925 C GLU A 75 -6.332 3.747 -3.921 1.00 0.00 C ATOM 926 O GLU A 75 -7.528 3.987 -4.075 1.00 0.00 O ATOM 927 CB GLU A 75 -4.233 5.089 -4.217 1.00 0.00 C ATOM 928 CG GLU A 75 -3.435 6.333 -3.819 1.00 0.00 C ATOM 929 CD GLU A 75 -4.315 7.581 -3.702 1.00 0.00 C ATOM 930 OE1 GLU A 75 -5.208 7.774 -4.561 1.00 0.00 O ATOM 931 OE2 GLU A 75 -4.085 8.376 -2.764 1.00 0.00 O1- ATOM 0 H GLU A 75 -4.158 3.662 -2.024 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.999 5.682 -3.094 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -3.563 4.230 -4.242 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -4.619 5.222 -5.228 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.938 6.152 -2.866 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.654 6.511 -4.558 1.00 0.00 H new ATOM 938 N ALA A 76 -5.793 2.602 -4.344 1.00 0.00 N ATOM 939 CA ALA A 76 -6.496 1.589 -5.122 1.00 0.00 C ATOM 940 C ALA A 76 -7.379 0.679 -4.254 1.00 0.00 C ATOM 941 O ALA A 76 -8.456 0.307 -4.719 1.00 0.00 O ATOM 942 CB ALA A 76 -5.460 0.786 -5.923 1.00 0.00 C ATOM 0 H ALA A 76 -4.825 2.350 -4.147 1.00 0.00 H new ATOM 0 HA ALA A 76 -7.185 2.086 -5.805 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.968 0.022 -6.512 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.916 1.456 -6.589 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.760 0.309 -5.237 1.00 0.00 H new ATOM 948 N LEU A 77 -6.968 0.357 -3.014 1.00 0.00 N ATOM 949 CA LEU A 77 -7.771 -0.451 -2.072 1.00 0.00 C ATOM 950 C LEU A 77 -8.800 0.405 -1.292 1.00 0.00 C ATOM 951 O LEU A 77 -9.705 -0.123 -0.649 1.00 0.00 O ATOM 952 CB LEU A 77 -6.900 -1.259 -1.090 1.00 0.00 C ATOM 953 CG LEU A 77 -6.025 -2.418 -1.624 1.00 0.00 C ATOM 954 CD1 LEU A 77 -6.865 -3.687 -1.784 1.00 0.00 C ATOM 955 CD2 LEU A 77 -5.267 -2.166 -2.937 1.00 0.00 C ATOM 0 H LEU A 77 -6.068 0.650 -2.634 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.319 -1.160 -2.693 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.238 -0.555 -0.586 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.563 -1.673 -0.330 1.00 0.00 H new ATOM 0 HG LEU A 77 -5.253 -2.522 -0.861 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.237 -4.494 -2.160 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -7.282 -3.972 -0.818 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.676 -3.500 -2.488 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.693 -3.054 -3.202 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -5.979 -1.945 -3.732 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.591 -1.321 -2.810 1.00 0.00 H new ATOM 967 N ASP A 78 -8.682 1.730 -1.351 1.00 0.00 N ATOM 968 CA ASP A 78 -9.633 2.688 -0.778 1.00 0.00 C ATOM 969 C ASP A 78 -10.947 2.760 -1.588 1.00 0.00 C ATOM 970 O ASP A 78 -12.010 3.008 -1.023 1.00 0.00 O ATOM 971 CB ASP A 78 -8.901 4.035 -0.712 1.00 0.00 C ATOM 972 CG ASP A 78 -9.773 5.205 -0.242 1.00 0.00 C ATOM 973 OD1 ASP A 78 -10.220 5.997 -1.105 1.00 0.00 O ATOM 974 OD2 ASP A 78 -9.971 5.338 0.988 1.00 0.00 O1- ATOM 0 H ASP A 78 -7.895 2.185 -1.815 1.00 0.00 H new ATOM 0 HA ASP A 78 -9.948 2.378 0.219 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.049 3.939 -0.039 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -8.503 4.268 -1.700 1.00 0.00 H new ATOM 979 N GLN A 79 -10.882 2.491 -2.896 1.00 0.00 N ATOM 980 CA GLN A 79 -12.002 2.524 -3.848 1.00 0.00 C ATOM 981 C GLN A 79 -13.161 1.548 -3.515 1.00 0.00 C ATOM 982 O GLN A 79 -12.959 0.560 -2.800 1.00 0.00 O ATOM 983 CB GLN A 79 -11.446 2.175 -5.237 1.00 0.00 C ATOM 984 CG GLN A 79 -10.553 3.252 -5.860 1.00 0.00 C ATOM 985 CD GLN A 79 -10.100 2.853 -7.266 1.00 0.00 C ATOM 986 OE1 GLN A 79 -10.403 3.511 -8.255 1.00 0.00 O ATOM 987 NE2 GLN A 79 -9.381 1.758 -7.416 1.00 0.00 N ATOM 0 H GLN A 79 -10.003 2.231 -3.344 1.00 0.00 H new ATOM 0 HA GLN A 79 -12.431 3.525 -3.800 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.876 1.249 -5.163 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -12.282 1.982 -5.910 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -11.096 4.196 -5.905 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -9.681 3.415 -5.227 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -9.122 1.202 -6.601 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -9.083 1.467 -8.347 1.00 0.00 H new ATOM 996 N PRO A 80 -14.373 1.766 -4.078 1.00 0.00 N ATOM 997 CA PRO A 80 -15.543 0.909 -3.850 1.00 0.00 C ATOM 998 C PRO A 80 -15.421 -0.522 -4.399 1.00 0.00 C ATOM 999 O PRO A 80 -16.166 -1.396 -3.962 1.00 0.00 O ATOM 1000 CB PRO A 80 -16.718 1.630 -4.524 1.00 0.00 C ATOM 1001 CG PRO A 80 -16.052 2.490 -5.594 1.00 0.00 C ATOM 1002 CD PRO A 80 -14.759 2.906 -4.904 1.00 0.00 C ATOM 0 HA PRO A 80 -15.668 0.770 -2.776 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -17.424 0.923 -4.961 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -17.276 2.238 -3.812 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -15.864 1.929 -6.510 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -16.664 3.350 -5.866 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -13.984 3.143 -5.633 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -14.908 3.798 -4.296 1.00 0.00 H new ATOM 1010 N ASP A 81 -14.498 -0.798 -5.327 1.00 0.00 N ATOM 1011 CA ASP A 81 -14.342 -2.105 -5.990 1.00 0.00 C ATOM 1012 C ASP A 81 -13.575 -3.152 -5.150 1.00 0.00 C ATOM 1013 O ASP A 81 -13.179 -4.204 -5.652 1.00 0.00 O ATOM 1014 CB ASP A 81 -13.740 -1.895 -7.390 1.00 0.00 C ATOM 1015 CG ASP A 81 -12.255 -1.506 -7.389 1.00 0.00 C ATOM 1016 OD1 ASP A 81 -11.935 -0.420 -6.857 1.00 0.00 O ATOM 1017 OD2 ASP A 81 -11.430 -2.258 -7.957 1.00 0.00 O1- ATOM 0 H ASP A 81 -13.821 -0.105 -5.648 1.00 0.00 H new ATOM 0 HA ASP A 81 -15.334 -2.544 -6.095 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.863 -2.812 -7.966 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.306 -1.118 -7.903 1.00 0.00 H new ATOM 1022 N VAL A 82 -13.365 -2.844 -3.870 1.00 0.00 N ATOM 1023 CA VAL A 82 -12.431 -3.506 -2.942 1.00 0.00 C ATOM 1024 C VAL A 82 -13.179 -4.095 -1.742 1.00 0.00 C ATOM 1025 O VAL A 82 -14.201 -3.546 -1.326 1.00 0.00 O ATOM 1026 CB VAL A 82 -11.396 -2.485 -2.423 1.00 0.00 C ATOM 1027 CG1 VAL A 82 -10.354 -3.178 -1.523 1.00 0.00 C ATOM 1028 CG2 VAL A 82 -10.693 -1.752 -3.581 1.00 0.00 C ATOM 0 H VAL A 82 -13.870 -2.080 -3.420 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.931 -4.309 -3.484 1.00 0.00 H new ATOM 0 HB VAL A 82 -11.936 -1.743 -1.834 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -9.633 -2.442 -1.167 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -10.856 -3.635 -0.671 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.835 -3.948 -2.094 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.972 -1.041 -3.177 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -10.176 -2.477 -4.210 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.434 -1.218 -4.177 1.00 0.00 H new ATOM 1038 N ARG A 83 -12.656 -5.193 -1.172 1.00 0.00 N ATOM 1039 CA ARG A 83 -13.293 -5.892 -0.049 1.00 0.00 C ATOM 1040 C ARG A 83 -12.673 -5.529 1.312 1.00 0.00 C ATOM 1041 O ARG A 83 -13.419 -5.066 2.173 1.00 0.00 O ATOM 1042 CB ARG A 83 -13.359 -7.405 -0.311 1.00 0.00 C ATOM 1043 CG ARG A 83 -13.901 -7.711 -1.724 1.00 0.00 C ATOM 1044 CD ARG A 83 -14.820 -8.932 -1.782 1.00 0.00 C ATOM 1045 NE ARG A 83 -15.466 -9.007 -3.106 1.00 0.00 N ATOM 1046 CZ ARG A 83 -16.533 -9.727 -3.431 1.00 0.00 C ATOM 1047 NH1 ARG A 83 -17.086 -10.573 -2.588 1.00 0.00 N1+ ATOM 1048 NH2 ARG A 83 -17.065 -9.597 -4.627 1.00 0.00 N ATOM 0 H ARG A 83 -11.781 -5.619 -1.478 1.00 0.00 H new ATOM 0 HA ARG A 83 -14.322 -5.539 0.017 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -12.365 -7.838 -0.200 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.998 -7.877 0.435 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -14.445 -6.841 -2.090 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -13.060 -7.869 -2.399 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.246 -9.840 -1.595 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -15.577 -8.866 -1.001 1.00 0.00 H new ATOM 0 HE ARG A 83 -15.049 -8.447 -3.850 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -16.695 -10.690 -1.653 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -17.906 -11.111 -2.869 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -16.658 -8.946 -5.298 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -17.885 -10.147 -4.883 1.00 0.00 H new ATOM 1062 N ALA A 84 -11.348 -5.649 1.501 1.00 0.00 N ATOM 1063 CA ALA A 84 -10.612 -5.248 2.721 1.00 0.00 C ATOM 1064 C ALA A 84 -9.077 -5.402 2.598 1.00 0.00 C ATOM 1065 O ALA A 84 -8.581 -6.254 1.859 1.00 0.00 O ATOM 1066 CB ALA A 84 -11.126 -6.035 3.942 1.00 0.00 C ATOM 0 H ALA A 84 -10.735 -6.041 0.786 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.806 -4.184 2.855 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.575 -5.728 4.831 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -12.187 -5.832 4.085 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.980 -7.102 3.775 1.00 0.00 H new ATOM 1072 N VAL A 85 -8.321 -4.590 3.348 1.00 0.00 N ATOM 1073 CA VAL A 85 -6.847 -4.642 3.426 1.00 0.00 C ATOM 1074 C VAL A 85 -6.336 -3.990 4.726 1.00 0.00 C ATOM 1075 O VAL A 85 -6.977 -3.068 5.240 1.00 0.00 O ATOM 1076 CB VAL A 85 -6.222 -3.992 2.164 1.00 0.00 C ATOM 1077 CG1 VAL A 85 -6.146 -2.464 2.268 1.00 0.00 C ATOM 1078 CG2 VAL A 85 -4.847 -4.560 1.808 1.00 0.00 C ATOM 0 H VAL A 85 -8.723 -3.858 3.934 1.00 0.00 H new ATOM 0 HA VAL A 85 -6.533 -5.686 3.454 1.00 0.00 H new ATOM 0 HB VAL A 85 -6.904 -4.250 1.353 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.701 -2.059 1.359 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -7.150 -2.057 2.393 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -5.533 -2.188 3.126 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.467 -4.062 0.916 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -4.159 -4.394 2.637 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -4.934 -5.630 1.617 1.00 0.00 H new ATOM 1088 N THR A 86 -5.171 -4.429 5.230 1.00 0.00 N ATOM 1089 CA THR A 86 -4.545 -3.969 6.494 1.00 0.00 C ATOM 1090 C THR A 86 -3.064 -4.337 6.515 1.00 0.00 C ATOM 1091 O THR A 86 -2.705 -5.313 5.870 1.00 0.00 O ATOM 1092 CB THR A 86 -5.206 -4.576 7.751 1.00 0.00 C ATOM 1093 OG1 THR A 86 -6.469 -5.140 7.490 1.00 0.00 O ATOM 1094 CG2 THR A 86 -5.397 -3.505 8.825 1.00 0.00 C ATOM 0 H THR A 86 -4.614 -5.140 4.756 1.00 0.00 H new ATOM 0 HA THR A 86 -4.683 -2.888 6.522 1.00 0.00 H new ATOM 0 HB THR A 86 -4.531 -5.363 8.088 1.00 0.00 H new ATOM 0 HG1 THR A 86 -7.127 -4.772 8.116 1.00 0.00 H new ATOM 0 HG21 THR A 86 -5.864 -3.950 9.704 1.00 0.00 H new ATOM 0 HG22 THR A 86 -4.428 -3.089 9.101 1.00 0.00 H new ATOM 0 HG23 THR A 86 -6.036 -2.711 8.438 1.00 0.00 H new ATOM 1102 N PHE A 87 -2.220 -3.607 7.260 1.00 0.00 N ATOM 1103 CA PHE A 87 -0.764 -3.841 7.352 1.00 0.00 C ATOM 1104 C PHE A 87 -0.199 -3.389 8.711 1.00 0.00 C ATOM 1105 O PHE A 87 -0.539 -2.296 9.170 1.00 0.00 O ATOM 1106 CB PHE A 87 -0.017 -3.074 6.241 1.00 0.00 C ATOM 1107 CG PHE A 87 -0.589 -3.157 4.838 1.00 0.00 C ATOM 1108 CD1 PHE A 87 -1.722 -2.394 4.505 1.00 0.00 C ATOM 1109 CD2 PHE A 87 0.003 -3.979 3.862 1.00 0.00 C ATOM 1110 CE1 PHE A 87 -2.279 -2.461 3.224 1.00 0.00 C ATOM 1111 CE2 PHE A 87 -0.566 -4.061 2.580 1.00 0.00 C ATOM 1112 CZ PHE A 87 -1.702 -3.297 2.260 1.00 0.00 C ATOM 0 H PHE A 87 -2.534 -2.820 7.829 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.612 -4.914 7.238 1.00 0.00 H new ATOM 0 HB2 PHE A 87 0.027 -2.023 6.527 1.00 0.00 H new ATOM 0 HB3 PHE A 87 1.010 -3.439 6.210 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.168 -1.748 5.247 1.00 0.00 H new ATOM 0 HD2 PHE A 87 0.892 -4.545 4.097 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -3.150 -1.871 2.979 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -0.129 -4.713 1.838 1.00 0.00 H new ATOM 0 HZ PHE A 87 -2.130 -3.355 1.270 1.00 0.00 H new ATOM 1122 N LEU A 88 0.707 -4.170 9.320 1.00 0.00 N ATOM 1123 CA LEU A 88 1.280 -3.913 10.655 1.00 0.00 C ATOM 1124 C LEU A 88 2.629 -4.630 10.868 1.00 0.00 C ATOM 1125 O LEU A 88 2.866 -5.714 10.336 1.00 0.00 O ATOM 1126 CB LEU A 88 0.219 -4.286 11.715 1.00 0.00 C ATOM 1127 CG LEU A 88 0.634 -4.147 13.199 1.00 0.00 C ATOM 1128 CD1 LEU A 88 -0.466 -3.471 14.027 1.00 0.00 C ATOM 1129 CD2 LEU A 88 0.916 -5.526 13.810 1.00 0.00 C ATOM 0 H LEU A 88 1.072 -5.019 8.889 1.00 0.00 H new ATOM 0 HA LEU A 88 1.521 -2.854 10.752 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -0.660 -3.664 11.549 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.084 -5.319 11.543 1.00 0.00 H new ATOM 0 HG LEU A 88 1.534 -3.532 13.223 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -0.142 -3.389 15.065 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -0.662 -2.476 13.628 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.377 -4.067 13.977 1.00 0.00 H new ATOM 0 HD21 LEU A 88 1.206 -5.409 14.854 1.00 0.00 H new ATOM 0 HD22 LEU A 88 0.018 -6.141 13.750 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.724 -6.009 13.261 1.00 0.00 H new ATOM 1141 N ASP A 89 3.515 -4.019 11.659 1.00 0.00 N ATOM 1142 CA ASP A 89 4.851 -4.523 12.016 1.00 0.00 C ATOM 1143 C ASP A 89 4.940 -5.164 13.425 1.00 0.00 C ATOM 1144 O ASP A 89 3.997 -5.121 14.217 1.00 0.00 O ATOM 1145 CB ASP A 89 5.870 -3.378 11.850 1.00 0.00 C ATOM 1146 CG ASP A 89 5.698 -2.183 12.811 1.00 0.00 C ATOM 1147 OD1 ASP A 89 6.407 -1.173 12.600 1.00 0.00 O ATOM 1148 OD2 ASP A 89 4.914 -2.272 13.785 1.00 0.00 O1- ATOM 0 H ASP A 89 3.314 -3.117 12.090 1.00 0.00 H new ATOM 0 HA ASP A 89 5.082 -5.342 11.335 1.00 0.00 H new ATOM 0 HB2 ASP A 89 6.872 -3.786 11.983 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.810 -3.009 10.826 1.00 0.00 H new ATOM 1153 N ALA A 90 6.111 -5.721 13.774 1.00 0.00 N ATOM 1154 CA ALA A 90 6.392 -6.270 15.112 1.00 0.00 C ATOM 1155 C ALA A 90 6.328 -5.220 16.242 1.00 0.00 C ATOM 1156 O ALA A 90 6.153 -5.581 17.409 1.00 0.00 O ATOM 1157 CB ALA A 90 7.771 -6.944 15.087 1.00 0.00 C ATOM 0 H ALA A 90 6.897 -5.804 13.130 1.00 0.00 H new ATOM 0 HA ALA A 90 5.608 -6.992 15.339 1.00 0.00 H new ATOM 0 HB1 ALA A 90 7.993 -7.355 16.072 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.770 -7.747 14.350 1.00 0.00 H new ATOM 0 HB3 ALA A 90 8.531 -6.209 14.822 1.00 0.00 H new ATOM 1163 N ARG A 91 6.435 -3.929 15.905 1.00 0.00 N ATOM 1164 CA ARG A 91 6.317 -2.798 16.836 1.00 0.00 C ATOM 1165 C ARG A 91 4.854 -2.468 17.204 1.00 0.00 C ATOM 1166 O ARG A 91 4.626 -1.584 18.031 1.00 0.00 O ATOM 1167 CB ARG A 91 7.042 -1.578 16.221 1.00 0.00 C ATOM 1168 CG ARG A 91 7.638 -0.575 17.227 1.00 0.00 C ATOM 1169 CD ARG A 91 9.004 -0.984 17.806 1.00 0.00 C ATOM 1170 NE ARG A 91 8.943 -2.172 18.679 1.00 0.00 N ATOM 1171 CZ ARG A 91 8.468 -2.232 19.919 1.00 0.00 C ATOM 1172 NH1 ARG A 91 7.994 -1.172 20.543 1.00 0.00 N1+ ATOM 1173 NH2 ARG A 91 8.459 -3.382 20.557 1.00 0.00 N ATOM 0 H ARG A 91 6.612 -3.632 14.945 1.00 0.00 H new ATOM 0 HA ARG A 91 6.790 -3.075 17.778 1.00 0.00 H new ATOM 0 HB2 ARG A 91 7.845 -1.942 15.580 1.00 0.00 H new ATOM 0 HB3 ARG A 91 6.339 -1.046 15.580 1.00 0.00 H new ATOM 0 HG2 ARG A 91 7.741 0.393 16.737 1.00 0.00 H new ATOM 0 HG3 ARG A 91 6.934 -0.443 18.049 1.00 0.00 H new ATOM 0 HD2 ARG A 91 9.693 -1.182 16.985 1.00 0.00 H new ATOM 0 HD3 ARG A 91 9.414 -0.148 18.372 1.00 0.00 H new ATOM 0 HE ARG A 91 9.305 -3.042 18.288 1.00 0.00 H new ATOM 0 HH11 ARG A 91 7.983 -0.266 20.074 1.00 0.00 H new ATOM 0 HH12 ARG A 91 7.638 -1.257 21.495 1.00 0.00 H new ATOM 0 HH21 ARG A 91 8.815 -4.221 20.100 1.00 0.00 H new ATOM 0 HH22 ARG A 91 8.096 -3.434 21.509 1.00 0.00 H new ATOM 1187 N GLN A 92 3.873 -3.154 16.599 1.00 0.00 N ATOM 1188 CA GLN A 92 2.424 -2.952 16.772 1.00 0.00 C ATOM 1189 C GLN A 92 1.954 -1.593 16.216 1.00 0.00 C ATOM 1190 O GLN A 92 0.962 -1.033 16.681 1.00 0.00 O ATOM 1191 CB GLN A 92 1.959 -3.229 18.224 1.00 0.00 C ATOM 1192 CG GLN A 92 2.011 -4.720 18.611 1.00 0.00 C ATOM 1193 CD GLN A 92 0.616 -5.289 18.896 1.00 0.00 C ATOM 1194 OE1 GLN A 92 0.217 -5.491 20.037 1.00 0.00 O ATOM 1195 NE2 GLN A 92 -0.195 -5.543 17.887 1.00 0.00 N ATOM 0 H GLN A 92 4.079 -3.905 15.940 1.00 0.00 H new ATOM 0 HA GLN A 92 1.921 -3.703 16.163 1.00 0.00 H new ATOM 0 HB2 GLN A 92 2.585 -2.661 18.912 1.00 0.00 H new ATOM 0 HB3 GLN A 92 0.939 -2.865 18.346 1.00 0.00 H new ATOM 0 HG2 GLN A 92 2.476 -5.288 17.805 1.00 0.00 H new ATOM 0 HG3 GLN A 92 2.640 -4.844 19.493 1.00 0.00 H new ATOM 0 HE21 GLN A 92 0.117 -5.382 16.929 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -1.134 -5.900 18.065 1.00 0.00 H new ATOM 1204 N GLU A 93 2.649 -1.067 15.202 1.00 0.00 N ATOM 1205 CA GLU A 93 2.229 0.090 14.415 1.00 0.00 C ATOM 1206 C GLU A 93 1.493 -0.403 13.161 1.00 0.00 C ATOM 1207 O GLU A 93 2.066 -1.133 12.353 1.00 0.00 O ATOM 1208 CB GLU A 93 3.477 0.934 14.083 1.00 0.00 C ATOM 1209 CG GLU A 93 3.275 2.022 13.016 1.00 0.00 C ATOM 1210 CD GLU A 93 4.531 2.898 12.837 1.00 0.00 C ATOM 1211 OE1 GLU A 93 5.160 3.305 13.844 1.00 0.00 O ATOM 1212 OE2 GLU A 93 4.894 3.202 11.676 1.00 0.00 O1- ATOM 0 H GLU A 93 3.546 -1.448 14.900 1.00 0.00 H new ATOM 0 HA GLU A 93 1.537 0.725 14.968 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.827 1.409 14.999 1.00 0.00 H new ATOM 0 HB3 GLU A 93 4.269 0.264 13.748 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.021 1.554 12.065 1.00 0.00 H new ATOM 0 HG3 GLU A 93 2.431 2.652 13.296 1.00 0.00 H new ATOM 1219 N ARG A 94 0.231 0.015 12.974 1.00 0.00 N ATOM 1220 CA ARG A 94 -0.471 -0.101 11.687 1.00 0.00 C ATOM 1221 C ARG A 94 0.188 0.855 10.691 1.00 0.00 C ATOM 1222 O ARG A 94 0.240 2.062 10.942 1.00 0.00 O ATOM 1223 CB ARG A 94 -1.988 0.192 11.822 1.00 0.00 C ATOM 1224 CG ARG A 94 -2.837 -1.095 11.790 1.00 0.00 C ATOM 1225 CD ARG A 94 -4.177 -1.016 12.542 1.00 0.00 C ATOM 1226 NE ARG A 94 -5.310 -0.509 11.737 1.00 0.00 N ATOM 1227 CZ ARG A 94 -5.970 0.634 11.911 1.00 0.00 C ATOM 1228 NH1 ARG A 94 -5.480 1.623 12.627 1.00 0.00 N1+ ATOM 1229 NH2 ARG A 94 -7.152 0.811 11.356 1.00 0.00 N ATOM 0 H ARG A 94 -0.331 0.442 13.710 1.00 0.00 H new ATOM 0 HA ARG A 94 -0.391 -1.127 11.329 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -2.172 0.723 12.756 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -2.302 0.852 11.013 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -3.037 -1.353 10.750 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -2.249 -1.909 12.213 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -4.429 -2.010 12.913 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -4.052 -0.373 13.413 1.00 0.00 H new ATOM 0 HE ARG A 94 -5.619 -1.099 10.965 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -4.566 1.528 13.070 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -6.014 2.485 12.739 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -7.566 0.070 10.790 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -7.653 1.689 11.493 1.00 0.00 H new ATOM 1243 N LEU A 95 0.677 0.325 9.567 1.00 0.00 N ATOM 1244 CA LEU A 95 1.204 1.139 8.467 1.00 0.00 C ATOM 1245 C LEU A 95 0.065 1.631 7.566 1.00 0.00 C ATOM 1246 O LEU A 95 0.111 2.768 7.104 1.00 0.00 O ATOM 1247 CB LEU A 95 2.275 0.380 7.652 1.00 0.00 C ATOM 1248 CG LEU A 95 3.603 0.149 8.411 1.00 0.00 C ATOM 1249 CD1 LEU A 95 3.569 -1.150 9.227 1.00 0.00 C ATOM 1250 CD2 LEU A 95 4.800 0.082 7.449 1.00 0.00 C ATOM 0 H LEU A 95 0.719 -0.679 9.393 1.00 0.00 H new ATOM 0 HA LEU A 95 1.694 2.009 8.904 1.00 0.00 H new ATOM 0 HB2 LEU A 95 1.869 -0.586 7.350 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.484 0.938 6.739 1.00 0.00 H new ATOM 0 HG LEU A 95 3.720 1.000 9.082 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.519 -1.278 9.746 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.760 -1.100 9.956 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.404 -1.995 8.559 1.00 0.00 H new ATOM 0 HD21 LEU A 95 5.715 -0.081 8.018 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.657 -0.740 6.747 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.877 1.020 6.898 1.00 0.00 H new ATOM 1262 N ALA A 96 -0.967 0.804 7.356 1.00 0.00 N ATOM 1263 CA ALA A 96 -2.094 1.092 6.468 1.00 0.00 C ATOM 1264 C ALA A 96 -3.300 0.178 6.724 1.00 0.00 C ATOM 1265 O ALA A 96 -3.221 -0.814 7.449 1.00 0.00 O ATOM 1266 CB ALA A 96 -1.612 1.008 5.011 1.00 0.00 C ATOM 0 H ALA A 96 -1.041 -0.106 7.811 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.449 2.101 6.676 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.444 1.221 4.340 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -0.818 1.737 4.848 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -1.231 0.006 4.811 1.00 0.00 H new ATOM 1272 N HIS A 97 -4.419 0.527 6.093 1.00 0.00 N ATOM 1273 CA HIS A 97 -5.743 -0.062 6.273 1.00 0.00 C ATOM 1274 C HIS A 97 -6.732 0.578 5.280 1.00 0.00 C ATOM 1275 O HIS A 97 -6.716 1.797 5.094 1.00 0.00 O ATOM 1276 CB HIS A 97 -6.196 0.104 7.736 1.00 0.00 C ATOM 1277 CG HIS A 97 -5.905 1.461 8.332 1.00 0.00 C ATOM 1278 ND1 HIS A 97 -6.590 2.628 8.099 1.00 0.00 N ATOM 1279 CD2 HIS A 97 -4.865 1.769 9.168 1.00 0.00 C ATOM 1280 CE1 HIS A 97 -5.994 3.610 8.796 1.00 0.00 C ATOM 1281 NE2 HIS A 97 -4.934 3.132 9.470 1.00 0.00 N ATOM 0 H HIS A 97 -4.425 1.275 5.400 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.709 -1.131 6.063 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -7.268 -0.082 7.794 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.707 -0.658 8.343 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -4.119 1.077 9.532 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.321 4.639 8.812 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -4.307 3.658 10.079 1.00 0.00 H new ATOM 1289 N ALA A 98 -7.593 -0.230 4.649 1.00 0.00 N ATOM 1290 CA ALA A 98 -8.553 0.199 3.624 1.00 0.00 C ATOM 1291 C ALA A 98 -9.669 -0.847 3.425 1.00 0.00 C ATOM 1292 O ALA A 98 -9.515 -2.022 3.776 1.00 0.00 O ATOM 1293 CB ALA A 98 -7.824 0.571 2.317 1.00 0.00 C ATOM 0 H ALA A 98 -7.642 -1.230 4.843 1.00 0.00 H new ATOM 0 HA ALA A 98 -9.053 1.104 3.970 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.553 0.886 1.571 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.126 1.386 2.509 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -7.277 -0.296 1.946 1.00 0.00 H new ATOM 1299 N GLY A 99 -10.808 -0.401 2.889 1.00 0.00 N ATOM 1300 CA GLY A 99 -12.085 -1.128 2.919 1.00 0.00 C ATOM 1301 C GLY A 99 -13.006 -0.642 4.054 1.00 0.00 C ATOM 1302 O GLY A 99 -12.569 0.146 4.899 1.00 0.00 O ATOM 0 H GLY A 99 -10.872 0.497 2.410 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.594 -1.005 1.963 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.891 -2.194 3.042 1.00 0.00 H new ATOM 1306 N PRO A 100 -14.275 -1.095 4.082 1.00 0.00 N ATOM 1307 CA PRO A 100 -15.333 -0.521 4.914 1.00 0.00 C ATOM 1308 C PRO A 100 -15.154 -0.812 6.411 1.00 0.00 C ATOM 1309 O PRO A 100 -15.510 0.020 7.242 1.00 0.00 O ATOM 1310 CB PRO A 100 -16.633 -1.133 4.375 1.00 0.00 C ATOM 1311 CG PRO A 100 -16.194 -2.479 3.798 1.00 0.00 C ATOM 1312 CD PRO A 100 -14.801 -2.170 3.254 1.00 0.00 C ATOM 0 HA PRO A 100 -15.325 0.567 4.853 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -17.373 -1.259 5.165 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.086 -0.500 3.612 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -16.168 -3.258 4.560 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -16.868 -2.823 3.014 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -14.159 -3.050 3.303 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -14.849 -1.868 2.208 1.00 0.00 H new ATOM 1320 N SER A 101 -14.604 -1.974 6.768 1.00 0.00 N ATOM 1321 CA SER A 101 -14.391 -2.405 8.156 1.00 0.00 C ATOM 1322 C SER A 101 -13.013 -2.008 8.721 1.00 0.00 C ATOM 1323 O SER A 101 -12.887 -1.762 9.923 1.00 0.00 O ATOM 1324 CB SER A 101 -14.559 -3.932 8.203 1.00 0.00 C ATOM 1325 OG SER A 101 -13.829 -4.567 7.155 1.00 0.00 O ATOM 0 H SER A 101 -14.285 -2.661 6.084 1.00 0.00 H new ATOM 0 HA SER A 101 -15.124 -1.898 8.784 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.216 -4.308 9.167 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.616 -4.186 8.119 1.00 0.00 H new ATOM 0 HG SER A 101 -13.953 -5.537 7.211 1.00 0.00 H new ATOM 1331 N MET A 102 -11.976 -1.945 7.874 1.00 0.00 N ATOM 1332 CA MET A 102 -10.572 -1.774 8.292 1.00 0.00 C ATOM 1333 C MET A 102 -10.148 -0.312 8.447 1.00 0.00 C ATOM 1334 O MET A 102 -9.360 0.008 9.341 1.00 0.00 O ATOM 1335 CB MET A 102 -9.651 -2.469 7.279 1.00 0.00 C ATOM 1336 CG MET A 102 -9.880 -3.981 7.185 1.00 0.00 C ATOM 1337 SD MET A 102 -9.546 -4.902 8.707 1.00 0.00 S ATOM 1338 CE MET A 102 -11.193 -4.993 9.453 1.00 0.00 C ATOM 0 H MET A 102 -12.088 -2.012 6.862 1.00 0.00 H new ATOM 0 HA MET A 102 -10.484 -2.228 9.279 1.00 0.00 H new ATOM 0 HB2 MET A 102 -9.804 -2.024 6.296 1.00 0.00 H new ATOM 0 HB3 MET A 102 -8.613 -2.283 7.555 1.00 0.00 H new ATOM 0 HG2 MET A 102 -10.914 -4.159 6.890 1.00 0.00 H new ATOM 0 HG3 MET A 102 -9.249 -4.380 6.391 1.00 0.00 H new ATOM 0 HE1 MET A 102 -11.209 -5.782 10.205 1.00 0.00 H new ATOM 0 HE2 MET A 102 -11.433 -4.039 9.923 1.00 0.00 H new ATOM 0 HE3 MET A 102 -11.930 -5.213 8.681 1.00 0.00 H new ATOM 1348 N LEU A 103 -10.653 0.572 7.582 1.00 0.00 N ATOM 1349 CA LEU A 103 -10.431 2.016 7.637 1.00 0.00 C ATOM 1350 C LEU A 103 -11.668 2.671 8.265 1.00 0.00 C ATOM 1351 O LEU A 103 -12.733 2.710 7.651 1.00 0.00 O ATOM 1352 CB LEU A 103 -10.124 2.497 6.203 1.00 0.00 C ATOM 1353 CG LEU A 103 -10.008 4.015 5.968 1.00 0.00 C ATOM 1354 CD1 LEU A 103 -8.900 4.684 6.791 1.00 0.00 C ATOM 1355 CD2 LEU A 103 -9.752 4.279 4.477 1.00 0.00 C ATOM 0 H LEU A 103 -11.246 0.292 6.801 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.582 2.295 8.261 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.188 2.036 5.887 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -10.905 2.114 5.546 1.00 0.00 H new ATOM 0 HG LEU A 103 -10.951 4.452 6.295 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -8.879 5.752 6.573 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.095 4.535 7.853 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -7.938 4.242 6.533 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -9.669 5.352 4.307 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.825 3.791 4.175 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.580 3.881 3.890 1.00 0.00 H new ATOM 1367 N THR A 104 -11.522 3.203 9.485 1.00 0.00 N ATOM 1368 CA THR A 104 -12.607 3.860 10.240 1.00 0.00 C ATOM 1369 C THR A 104 -13.153 5.085 9.503 1.00 0.00 C ATOM 1370 O THR A 104 -14.357 5.325 9.516 1.00 0.00 O ATOM 1371 CB THR A 104 -12.116 4.229 11.649 1.00 0.00 C ATOM 1372 OG1 THR A 104 -11.442 3.115 12.198 1.00 0.00 O ATOM 1373 CG2 THR A 104 -13.270 4.589 12.586 1.00 0.00 C ATOM 0 H THR A 104 -10.634 3.191 9.987 1.00 0.00 H new ATOM 0 HA THR A 104 -13.433 3.155 10.330 1.00 0.00 H new ATOM 0 HB THR A 104 -11.463 5.097 11.557 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.122 3.337 13.097 1.00 0.00 H new ATOM 0 HG21 THR A 104 -12.875 4.842 13.570 1.00 0.00 H new ATOM 0 HG22 THR A 104 -13.814 5.443 12.182 1.00 0.00 H new ATOM 0 HG23 THR A 104 -13.946 3.738 12.675 1.00 0.00 H new ATOM 1381 N VAL A 105 -12.275 5.814 8.810 1.00 0.00 N ATOM 1382 CA VAL A 105 -12.588 6.982 7.962 1.00 0.00 C ATOM 1383 C VAL A 105 -12.688 6.554 6.480 1.00 0.00 C ATOM 1384 O VAL A 105 -12.053 7.132 5.598 1.00 0.00 O ATOM 1385 CB VAL A 105 -11.579 8.144 8.190 1.00 0.00 C ATOM 1386 CG1 VAL A 105 -12.142 9.484 7.677 1.00 0.00 C ATOM 1387 CG2 VAL A 105 -11.223 8.337 9.679 1.00 0.00 C ATOM 0 H VAL A 105 -11.277 5.601 8.821 1.00 0.00 H new ATOM 0 HA VAL A 105 -13.562 7.375 8.253 1.00 0.00 H new ATOM 0 HB VAL A 105 -10.684 7.861 7.635 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -11.413 10.275 7.851 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -12.347 9.408 6.609 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -13.065 9.718 8.208 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -10.516 9.160 9.780 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -12.128 8.564 10.243 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -10.774 7.423 10.067 1.00 0.00 H new ATOM 1397 N ALA A 106 -13.439 5.478 6.201 1.00 0.00 N ATOM 1398 CA ALA A 106 -13.670 4.969 4.841 1.00 0.00 C ATOM 1399 C ALA A 106 -14.376 6.015 3.946 1.00 0.00 C ATOM 1400 O ALA A 106 -15.138 6.842 4.463 1.00 0.00 O ATOM 1401 CB ALA A 106 -14.475 3.661 4.922 1.00 0.00 C ATOM 0 H ALA A 106 -13.909 4.930 6.922 1.00 0.00 H new ATOM 0 HA ALA A 106 -12.706 4.768 4.373 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -14.650 3.278 3.916 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -13.915 2.924 5.498 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -15.431 3.852 5.409 1.00 0.00 H new ATOM 1407 N PRO A 107 -14.179 5.976 2.611 1.00 0.00 N ATOM 1408 CA PRO A 107 -14.705 6.984 1.693 1.00 0.00 C ATOM 1409 C PRO A 107 -16.190 6.780 1.329 1.00 0.00 C ATOM 1410 O PRO A 107 -16.667 7.393 0.377 1.00 0.00 O ATOM 1411 CB PRO A 107 -13.793 6.909 0.466 1.00 0.00 C ATOM 1412 CG PRO A 107 -13.489 5.421 0.401 1.00 0.00 C ATOM 1413 CD PRO A 107 -13.337 5.040 1.874 1.00 0.00 C ATOM 0 HA PRO A 107 -14.697 7.970 2.157 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -14.290 7.265 -0.436 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -12.890 7.507 0.590 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -14.294 4.865 -0.079 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -12.580 5.219 -0.165 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -13.651 4.011 2.047 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -12.297 5.114 2.193 1.00 0.00 H new ATOM 1421 N ALA A 108 -16.919 5.902 2.037 1.00 0.00 N ATOM 1422 CA ALA A 108 -18.370 5.690 1.904 1.00 0.00 C ATOM 1423 C ALA A 108 -18.816 5.170 0.514 1.00 0.00 C ATOM 1424 O ALA A 108 -19.998 5.251 0.166 1.00 0.00 O ATOM 1425 CB ALA A 108 -19.103 6.969 2.350 1.00 0.00 C ATOM 0 H ALA A 108 -16.499 5.298 2.744 1.00 0.00 H new ATOM 0 HA ALA A 108 -18.654 4.872 2.566 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -20.179 6.823 2.256 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -18.856 7.186 3.389 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -18.793 7.804 1.721 1.00 0.00 H new ATOM 1431 N GLY A 109 -17.877 4.631 -0.277 1.00 0.00 N ATOM 1432 CA GLY A 109 -18.103 4.101 -1.629 1.00 0.00 C ATOM 1433 C GLY A 109 -17.631 5.012 -2.769 1.00 0.00 C ATOM 1434 O GLY A 109 -17.985 4.765 -3.920 1.00 0.00 O ATOM 0 H GLY A 109 -16.904 4.549 0.018 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -17.594 3.141 -1.717 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -19.169 3.909 -1.755 1.00 0.00 H new ATOM 1438 N ASP A 110 -16.840 6.050 -2.482 1.00 0.00 N ATOM 1439 CA ASP A 110 -16.212 6.921 -3.486 1.00 0.00 C ATOM 1440 C ASP A 110 -14.752 6.533 -3.793 1.00 0.00 C ATOM 1441 O ASP A 110 -14.055 5.935 -2.971 1.00 0.00 O ATOM 1442 CB ASP A 110 -16.292 8.386 -3.026 1.00 0.00 C ATOM 1443 CG ASP A 110 -17.696 8.971 -3.246 1.00 0.00 C ATOM 1444 OD1 ASP A 110 -18.533 8.941 -2.313 1.00 0.00 O ATOM 1445 OD2 ASP A 110 -17.954 9.466 -4.369 1.00 0.00 O1- ATOM 0 H ASP A 110 -16.612 6.316 -1.524 1.00 0.00 H new ATOM 0 HA ASP A 110 -16.767 6.792 -4.415 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -16.031 8.451 -1.970 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -15.560 8.980 -3.572 1.00 0.00 H new ATOM 1450 N ALA A 111 -14.291 6.913 -4.990 1.00 0.00 N ATOM 1451 CA ALA A 111 -12.877 6.958 -5.367 1.00 0.00 C ATOM 1452 C ALA A 111 -12.297 8.358 -5.042 1.00 0.00 C ATOM 1453 O ALA A 111 -12.447 8.853 -3.925 1.00 0.00 O ATOM 1454 CB ALA A 111 -12.771 6.529 -6.844 1.00 0.00 C ATOM 0 H ALA A 111 -14.912 7.206 -5.744 1.00 0.00 H new ATOM 0 HA ALA A 111 -12.265 6.262 -4.793 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -11.727 6.552 -7.156 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -13.161 5.518 -6.958 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -13.350 7.213 -7.464 1.00 0.00 H new ATOM 1460 N SER A 112 -11.671 9.033 -6.008 1.00 0.00 N ATOM 1461 CA SER A 112 -10.994 10.330 -5.819 1.00 0.00 C ATOM 1462 C SER A 112 -11.928 11.508 -5.461 1.00 0.00 C ATOM 1463 O SER A 112 -11.449 12.569 -5.060 1.00 0.00 O ATOM 1464 CB SER A 112 -10.214 10.684 -7.096 1.00 0.00 C ATOM 1465 OG SER A 112 -9.362 9.618 -7.501 1.00 0.00 O ATOM 0 H SER A 112 -11.616 8.691 -6.967 1.00 0.00 H new ATOM 0 HA SER A 112 -10.337 10.196 -4.960 1.00 0.00 H new ATOM 0 HB2 SER A 112 -10.914 10.916 -7.898 1.00 0.00 H new ATOM 0 HB3 SER A 112 -9.619 11.581 -6.923 1.00 0.00 H new ATOM 0 HG SER A 112 -8.882 9.874 -8.316 1.00 0.00 H new ATOM 1471 N HIS A 113 -13.253 11.355 -5.591 1.00 0.00 N ATOM 1472 CA HIS A 113 -14.229 12.418 -5.308 1.00 0.00 C ATOM 1473 C HIS A 113 -14.286 12.857 -3.829 1.00 0.00 C ATOM 1474 O HIS A 113 -14.646 14.010 -3.567 1.00 0.00 O ATOM 1475 CB HIS A 113 -15.626 11.979 -5.784 1.00 0.00 C ATOM 1476 CG HIS A 113 -15.867 12.171 -7.261 1.00 0.00 C ATOM 1477 ND1 HIS A 113 -15.860 13.374 -7.935 1.00 0.00 N ATOM 1478 CD2 HIS A 113 -16.230 11.208 -8.166 1.00 0.00 C ATOM 1479 CE1 HIS A 113 -16.197 13.139 -9.215 1.00 0.00 C ATOM 1480 NE2 HIS A 113 -16.432 11.827 -9.409 1.00 0.00 N ATOM 0 H HIS A 113 -13.682 10.482 -5.898 1.00 0.00 H new ATOM 0 HA HIS A 113 -13.889 13.294 -5.861 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -15.767 10.926 -5.539 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -16.379 12.539 -5.229 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -16.341 10.154 -7.958 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -16.269 13.897 -9.981 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -16.702 11.375 -10.283 1.00 0.00 H new ATOM 1488 N LEU A 114 -13.943 11.985 -2.866 1.00 0.00 N ATOM 1489 CA LEU A 114 -13.925 12.355 -1.442 1.00 0.00 C ATOM 1490 C LEU A 114 -12.578 12.960 -1.021 1.00 0.00 C ATOM 1491 O LEU A 114 -12.548 14.034 -0.422 1.00 0.00 O ATOM 1492 CB LEU A 114 -14.312 11.149 -0.556 1.00 0.00 C ATOM 1493 CG LEU A 114 -15.309 11.579 0.542 1.00 0.00 C ATOM 1494 CD1 LEU A 114 -16.736 11.647 -0.026 1.00 0.00 C ATOM 1495 CD2 LEU A 114 -15.295 10.613 1.728 1.00 0.00 C ATOM 0 H LEU A 114 -13.674 11.018 -3.049 1.00 0.00 H new ATOM 0 HA LEU A 114 -14.675 13.133 -1.295 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -14.756 10.366 -1.171 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -13.418 10.726 -0.098 1.00 0.00 H new ATOM 0 HG LEU A 114 -14.998 12.564 0.889 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -17.427 11.951 0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -16.770 12.372 -0.839 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -17.025 10.666 -0.403 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -16.009 10.949 2.480 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -15.570 9.615 1.387 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -14.296 10.586 2.163 1.00 0.00 H new ATOM 1507 N SER A 115 -11.477 12.281 -1.347 1.00 0.00 N ATOM 1508 CA SER A 115 -10.074 12.605 -1.023 1.00 0.00 C ATOM 1509 C SER A 115 -9.123 11.527 -1.583 1.00 0.00 C ATOM 1510 O SER A 115 -9.559 10.427 -1.936 1.00 0.00 O ATOM 1511 CB SER A 115 -9.849 12.742 0.499 1.00 0.00 C ATOM 1512 OG SER A 115 -10.203 14.033 0.976 1.00 0.00 O ATOM 0 H SER A 115 -11.542 11.419 -1.889 1.00 0.00 H new ATOM 0 HA SER A 115 -9.856 13.566 -1.489 1.00 0.00 H new ATOM 0 HB2 SER A 115 -10.438 11.988 1.022 1.00 0.00 H new ATOM 0 HB3 SER A 115 -8.802 12.545 0.730 1.00 0.00 H new ATOM 0 HG SER A 115 -11.060 14.302 0.585 1.00 0.00 H new ATOM 1518 N MET A 116 -7.820 11.834 -1.651 1.00 0.00 N ATOM 1519 CA MET A 116 -6.755 10.879 -2.004 1.00 0.00 C ATOM 1520 C MET A 116 -6.204 10.167 -0.751 1.00 0.00 C ATOM 1521 O MET A 116 -6.338 8.951 -0.644 1.00 0.00 O ATOM 1522 CB MET A 116 -5.674 11.605 -2.839 1.00 0.00 C ATOM 1523 CG MET A 116 -5.669 11.096 -4.286 1.00 0.00 C ATOM 1524 SD MET A 116 -5.017 12.221 -5.543 1.00 0.00 S ATOM 1525 CE MET A 116 -5.156 11.104 -6.965 1.00 0.00 C ATOM 0 H MET A 116 -7.468 12.772 -1.459 1.00 0.00 H new ATOM 0 HA MET A 116 -7.160 10.081 -2.627 1.00 0.00 H new ATOM 0 HB2 MET A 116 -5.860 12.679 -2.827 1.00 0.00 H new ATOM 0 HB3 MET A 116 -4.694 11.446 -2.390 1.00 0.00 H new ATOM 0 HG2 MET A 116 -5.088 10.175 -4.320 1.00 0.00 H new ATOM 0 HG3 MET A 116 -6.692 10.838 -4.559 1.00 0.00 H new ATOM 0 HE1 MET A 116 -4.799 11.611 -7.862 1.00 0.00 H new ATOM 0 HE2 MET A 116 -4.554 10.213 -6.788 1.00 0.00 H new ATOM 0 HE3 MET A 116 -6.198 10.816 -7.101 1.00 0.00 H new ATOM 1535 N SER A 117 -5.659 10.926 0.212 1.00 0.00 N ATOM 1536 CA SER A 117 -5.223 10.494 1.566 1.00 0.00 C ATOM 1537 C SER A 117 -3.807 9.872 1.571 1.00 0.00 C ATOM 1538 O SER A 117 -3.639 8.649 1.553 1.00 0.00 O ATOM 1539 CB SER A 117 -6.244 9.575 2.278 1.00 0.00 C ATOM 1540 OG SER A 117 -7.524 10.194 2.395 1.00 0.00 O ATOM 0 H SER A 117 -5.497 11.922 0.065 1.00 0.00 H new ATOM 0 HA SER A 117 -5.174 11.414 2.149 1.00 0.00 H new ATOM 0 HB2 SER A 117 -6.341 8.642 1.723 1.00 0.00 H new ATOM 0 HB3 SER A 117 -5.872 9.319 3.270 1.00 0.00 H new ATOM 0 HG SER A 117 -8.142 9.583 2.848 1.00 0.00 H new ATOM 1546 N THR A 118 -2.771 10.728 1.622 1.00 0.00 N ATOM 1547 CA THR A 118 -1.349 10.357 1.436 1.00 0.00 C ATOM 1548 C THR A 118 -0.559 10.477 2.748 1.00 0.00 C ATOM 1549 O THR A 118 0.474 11.145 2.801 1.00 0.00 O ATOM 1550 CB THR A 118 -0.713 11.185 0.296 1.00 0.00 C ATOM 1551 OG1 THR A 118 -1.634 11.393 -0.756 1.00 0.00 O ATOM 1552 CG2 THR A 118 0.496 10.469 -0.315 1.00 0.00 C ATOM 0 H THR A 118 -2.899 11.725 1.798 1.00 0.00 H new ATOM 0 HA THR A 118 -1.307 9.308 1.142 1.00 0.00 H new ATOM 0 HB THR A 118 -0.410 12.131 0.744 1.00 0.00 H new ATOM 0 HG1 THR A 118 -1.208 11.921 -1.464 1.00 0.00 H new ATOM 0 HG21 THR A 118 0.917 11.081 -1.113 1.00 0.00 H new ATOM 0 HG22 THR A 118 1.251 10.308 0.455 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.182 9.508 -0.722 1.00 0.00 H new ATOM 1560 N GLU A 119 -1.063 9.876 3.831 1.00 0.00 N ATOM 1561 CA GLU A 119 -0.520 10.027 5.193 1.00 0.00 C ATOM 1562 C GLU A 119 -0.287 8.670 5.888 1.00 0.00 C ATOM 1563 O GLU A 119 -1.052 7.723 5.688 1.00 0.00 O ATOM 1564 CB GLU A 119 -1.482 10.894 6.034 1.00 0.00 C ATOM 1565 CG GLU A 119 -0.760 11.780 7.058 1.00 0.00 C ATOM 1566 CD GLU A 119 -0.244 13.081 6.417 1.00 0.00 C ATOM 1567 OE1 GLU A 119 -1.003 14.080 6.383 1.00 0.00 O ATOM 1568 OE2 GLU A 119 0.918 13.121 5.950 1.00 0.00 O1- ATOM 0 H GLU A 119 -1.874 9.259 3.789 1.00 0.00 H new ATOM 0 HA GLU A 119 0.452 10.514 5.111 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -2.069 11.525 5.367 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.184 10.244 6.557 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.440 12.021 7.875 1.00 0.00 H new ATOM 0 HG3 GLU A 119 0.076 11.230 7.491 1.00 0.00 H new ATOM 1575 N LEU A 120 0.751 8.592 6.735 1.00 0.00 N ATOM 1576 CA LEU A 120 1.140 7.398 7.514 1.00 0.00 C ATOM 1577 C LEU A 120 1.213 7.683 9.036 1.00 0.00 C ATOM 1578 O LEU A 120 1.586 6.820 9.824 1.00 0.00 O ATOM 1579 CB LEU A 120 2.467 6.853 6.922 1.00 0.00 C ATOM 1580 CG LEU A 120 2.552 5.314 6.787 1.00 0.00 C ATOM 1581 CD1 LEU A 120 3.703 4.942 5.839 1.00 0.00 C ATOM 1582 CD2 LEU A 120 2.776 4.576 8.114 1.00 0.00 C ATOM 0 H LEU A 120 1.368 9.386 6.905 1.00 0.00 H new ATOM 0 HA LEU A 120 0.373 6.629 7.426 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.614 7.296 5.937 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.291 7.192 7.550 1.00 0.00 H new ATOM 0 HG LEU A 120 1.582 5.000 6.400 1.00 0.00 H new ATOM 0 HD11 LEU A 120 3.761 3.858 5.745 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.523 5.382 4.858 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.642 5.322 6.240 1.00 0.00 H new ATOM 0 HD21 LEU A 120 2.823 3.503 7.930 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.712 4.909 8.562 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.952 4.791 8.794 1.00 0.00 H new ATOM 1594 N ASP A 121 0.829 8.885 9.482 1.00 0.00 N ATOM 1595 CA ASP A 121 0.820 9.289 10.902 1.00 0.00 C ATOM 1596 C ASP A 121 -0.292 8.616 11.737 1.00 0.00 C ATOM 1597 O ASP A 121 -0.293 8.729 12.966 1.00 0.00 O ATOM 1598 CB ASP A 121 0.708 10.821 10.990 1.00 0.00 C ATOM 1599 CG ASP A 121 2.012 11.517 10.574 1.00 0.00 C ATOM 1600 OD1 ASP A 121 2.139 11.898 9.387 1.00 0.00 O ATOM 1601 OD2 ASP A 121 2.903 11.688 11.441 1.00 0.00 O1- ATOM 0 H ASP A 121 0.508 9.623 8.856 1.00 0.00 H new ATOM 0 HA ASP A 121 1.759 8.947 11.337 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -0.106 11.163 10.350 1.00 0.00 H new ATOM 0 HB3 ASP A 121 0.453 11.108 12.010 1.00 0.00 H new ATOM 1606 N THR A 122 -1.222 7.900 11.086 1.00 0.00 N ATOM 1607 CA THR A 122 -2.339 7.156 11.697 1.00 0.00 C ATOM 1608 C THR A 122 -1.871 5.812 12.292 1.00 0.00 C ATOM 1609 O THR A 122 -2.334 4.725 11.941 1.00 0.00 O ATOM 1610 CB THR A 122 -3.526 7.107 10.717 1.00 0.00 C ATOM 1611 OG1 THR A 122 -4.660 6.558 11.354 1.00 0.00 O ATOM 1612 CG2 THR A 122 -3.258 6.367 9.400 1.00 0.00 C ATOM 0 H THR A 122 -1.217 7.819 10.069 1.00 0.00 H new ATOM 0 HA THR A 122 -2.721 7.681 12.573 1.00 0.00 H new ATOM 0 HB THR A 122 -3.702 8.145 10.434 1.00 0.00 H new ATOM 0 HG1 THR A 122 -5.409 6.533 10.723 1.00 0.00 H new ATOM 0 HG21 THR A 122 -4.155 6.389 8.781 1.00 0.00 H new ATOM 0 HG22 THR A 122 -2.439 6.853 8.870 1.00 0.00 H new ATOM 0 HG23 THR A 122 -2.989 5.332 9.612 1.00 0.00 H new ATOM 1620 N THR A 123 -0.912 5.906 13.220 1.00 0.00 N ATOM 1621 CA THR A 123 -0.368 4.799 14.023 1.00 0.00 C ATOM 1622 C THR A 123 -1.477 4.180 14.875 1.00 0.00 C ATOM 1623 O THR A 123 -2.362 4.879 15.366 1.00 0.00 O ATOM 1624 CB THR A 123 0.801 5.315 14.880 1.00 0.00 C ATOM 1625 OG1 THR A 123 1.812 5.780 14.012 1.00 0.00 O ATOM 1626 CG2 THR A 123 1.450 4.257 15.778 1.00 0.00 C ATOM 0 H THR A 123 -0.471 6.798 13.444 1.00 0.00 H new ATOM 0 HA THR A 123 0.017 4.015 13.370 1.00 0.00 H new ATOM 0 HB THR A 123 0.381 6.085 15.527 1.00 0.00 H new ATOM 0 HG1 THR A 123 2.567 6.115 14.539 1.00 0.00 H new ATOM 0 HG21 THR A 123 2.263 4.710 16.345 1.00 0.00 H new ATOM 0 HG22 THR A 123 0.706 3.858 16.467 1.00 0.00 H new ATOM 0 HG23 THR A 123 1.844 3.449 15.162 1.00 0.00 H new ATOM 1634 N HIS A 124 -1.412 2.863 15.079 1.00 0.00 N ATOM 1635 CA HIS A 124 -2.358 2.098 15.912 1.00 0.00 C ATOM 1636 C HIS A 124 -2.461 2.633 17.358 1.00 0.00 C ATOM 1637 O HIS A 124 -3.535 2.560 17.960 1.00 0.00 O ATOM 1638 CB HIS A 124 -1.920 0.618 15.900 1.00 0.00 C ATOM 1639 CG HIS A 124 -2.451 -0.212 17.043 1.00 0.00 C ATOM 1640 ND1 HIS A 124 -1.682 -0.825 18.004 1.00 0.00 N ATOM 1641 CD2 HIS A 124 -3.762 -0.416 17.382 1.00 0.00 C ATOM 1642 CE1 HIS A 124 -2.508 -1.365 18.916 1.00 0.00 C ATOM 1643 NE2 HIS A 124 -3.791 -1.138 18.582 1.00 0.00 N ATOM 0 H HIS A 124 -0.686 2.280 14.663 1.00 0.00 H new ATOM 0 HA HIS A 124 -3.357 2.207 15.490 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -2.243 0.166 14.962 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -0.831 0.577 15.916 1.00 0.00 H new ATOM 0 HD1 HIS A 124 -0.663 -0.863 18.022 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -4.622 -0.079 16.823 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -2.187 -1.906 19.794 1.00 0.00 H new ATOM 1651 N PHE A 125 -1.358 3.165 17.902 1.00 0.00 N ATOM 1652 CA PHE A 125 -1.239 3.768 19.233 1.00 0.00 C ATOM 1653 C PHE A 125 -1.449 2.707 20.327 1.00 0.00 C ATOM 1654 O PHE A 125 -0.471 2.141 20.822 1.00 0.00 O ATOM 1655 CB PHE A 125 -2.143 5.018 19.342 1.00 0.00 C ATOM 1656 CG PHE A 125 -2.291 5.587 20.741 1.00 0.00 C ATOM 1657 CD1 PHE A 125 -3.543 5.547 21.388 1.00 0.00 C ATOM 1658 CD2 PHE A 125 -1.182 6.147 21.403 1.00 0.00 C ATOM 1659 CE1 PHE A 125 -3.683 6.055 22.691 1.00 0.00 C ATOM 1660 CE2 PHE A 125 -1.324 6.657 22.706 1.00 0.00 C ATOM 1661 CZ PHE A 125 -2.573 6.610 23.351 1.00 0.00 C ATOM 0 H PHE A 125 -0.474 3.186 17.393 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.226 4.138 19.392 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -1.742 5.795 18.691 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.133 4.765 18.963 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -4.398 5.124 20.881 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.222 6.185 20.910 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.643 6.019 23.185 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -0.472 7.086 23.213 1.00 0.00 H new ATOM 0 HZ PHE A 125 -2.679 7.000 24.353 1.00 0.00 H new ATOM 1671 N LEU A 126 -2.708 2.428 20.684 1.00 0.00 N ATOM 1672 CA LEU A 126 -3.138 1.525 21.761 1.00 0.00 C ATOM 1673 C LEU A 126 -4.669 1.307 21.740 1.00 0.00 C ATOM 1674 O LEU A 126 -5.323 1.238 22.785 1.00 0.00 O ATOM 1675 CB LEU A 126 -2.561 2.009 23.122 1.00 0.00 C ATOM 1676 CG LEU A 126 -1.833 0.887 23.891 1.00 0.00 C ATOM 1677 CD1 LEU A 126 -0.994 1.484 25.028 1.00 0.00 C ATOM 1678 CD2 LEU A 126 -2.812 -0.152 24.457 1.00 0.00 C ATOM 0 H LEU A 126 -3.501 2.850 20.201 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.724 0.530 21.598 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.869 2.832 22.947 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.371 2.400 23.738 1.00 0.00 H new ATOM 0 HG LEU A 126 -1.181 0.377 23.182 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -0.485 0.683 25.564 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.255 2.170 24.614 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.645 2.024 25.716 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.256 -0.923 24.990 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -3.504 0.336 25.143 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -3.371 -0.608 23.640 1.00 0.00 H new ATOM 1690 N LEU A 127 -5.261 1.244 20.540 1.00 0.00 N ATOM 1691 CA LEU A 127 -6.703 1.035 20.339 1.00 0.00 C ATOM 1692 C LEU A 127 -7.169 -0.363 20.828 1.00 0.00 C ATOM 1693 O LEU A 127 -6.367 -1.303 20.865 1.00 0.00 O ATOM 1694 CB LEU A 127 -7.048 1.281 18.850 1.00 0.00 C ATOM 1695 CG LEU A 127 -7.614 2.685 18.545 1.00 0.00 C ATOM 1696 CD1 LEU A 127 -6.652 3.831 18.890 1.00 0.00 C ATOM 1697 CD2 LEU A 127 -7.992 2.767 17.059 1.00 0.00 C ATOM 0 H LEU A 127 -4.743 1.338 19.666 1.00 0.00 H new ATOM 0 HA LEU A 127 -7.251 1.753 20.950 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -6.149 1.128 18.252 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -7.774 0.534 18.531 1.00 0.00 H new ATOM 0 HG LEU A 127 -8.488 2.813 19.183 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -7.121 4.785 18.648 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -6.418 3.802 19.954 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -5.734 3.721 18.313 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -8.392 3.757 16.839 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.107 2.590 16.448 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -8.746 2.013 16.833 1.00 0.00 H new ATOM 1709 N PRO A 128 -8.463 -0.526 21.190 1.00 0.00 N ATOM 1710 CA PRO A 128 -9.002 -1.776 21.735 1.00 0.00 C ATOM 1711 C PRO A 128 -9.233 -2.863 20.670 1.00 0.00 C ATOM 1712 O PRO A 128 -9.239 -4.045 21.006 1.00 0.00 O ATOM 1713 CB PRO A 128 -10.317 -1.377 22.412 1.00 0.00 C ATOM 1714 CG PRO A 128 -10.795 -0.187 21.583 1.00 0.00 C ATOM 1715 CD PRO A 128 -9.489 0.512 21.211 1.00 0.00 C ATOM 0 HA PRO A 128 -8.290 -2.228 22.426 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -11.040 -2.193 22.398 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -10.165 -1.104 23.456 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -11.349 -0.506 20.700 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -11.455 0.466 22.155 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -9.571 0.998 20.239 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -9.243 1.288 21.936 1.00 0.00 H new ATOM 1723 N VAL A 129 -9.399 -2.477 19.399 1.00 0.00 N ATOM 1724 CA VAL A 129 -9.457 -3.366 18.226 1.00 0.00 C ATOM 1725 C VAL A 129 -8.556 -2.802 17.124 1.00 0.00 C ATOM 1726 O VAL A 129 -8.400 -1.584 17.011 1.00 0.00 O ATOM 1727 CB VAL A 129 -10.898 -3.565 17.688 1.00 0.00 C ATOM 1728 CG1 VAL A 129 -11.768 -4.337 18.694 1.00 0.00 C ATOM 1729 CG2 VAL A 129 -11.608 -2.253 17.304 1.00 0.00 C ATOM 0 H VAL A 129 -9.501 -1.494 19.146 1.00 0.00 H new ATOM 0 HA VAL A 129 -9.106 -4.349 18.541 1.00 0.00 H new ATOM 0 HB VAL A 129 -10.779 -4.146 16.774 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -12.772 -4.460 18.288 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -11.328 -5.317 18.878 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -11.821 -3.782 19.630 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -12.610 -2.475 16.937 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -11.677 -1.607 18.179 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -11.040 -1.747 16.524 1.00 0.00 H new ATOM 1739 N LEU A 130 -7.969 -3.686 16.313 1.00 0.00 N ATOM 1740 CA LEU A 130 -7.060 -3.326 15.223 1.00 0.00 C ATOM 1741 C LEU A 130 -7.157 -4.340 14.075 1.00 0.00 C ATOM 1742 O LEU A 130 -7.069 -5.552 14.291 1.00 0.00 O ATOM 1743 CB LEU A 130 -5.621 -3.121 15.756 1.00 0.00 C ATOM 1744 CG LEU A 130 -4.772 -4.384 16.032 1.00 0.00 C ATOM 1745 CD1 LEU A 130 -3.316 -3.994 16.312 1.00 0.00 C ATOM 1746 CD2 LEU A 130 -5.292 -5.244 17.193 1.00 0.00 C ATOM 0 H LEU A 130 -8.116 -4.692 16.398 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.364 -2.368 14.801 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -5.081 -2.504 15.037 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -5.684 -2.550 16.682 1.00 0.00 H new ATOM 0 HG LEU A 130 -4.846 -4.991 15.129 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -2.729 -4.892 16.505 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -2.907 -3.472 15.447 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -3.276 -3.340 17.183 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -4.643 -6.110 17.323 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -5.297 -4.654 18.109 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -6.305 -5.580 16.972 1.00 0.00 H new ATOM 1758 N GLY A 131 -7.367 -3.843 12.851 1.00 0.00 N ATOM 1759 CA GLY A 131 -7.559 -4.683 11.664 1.00 0.00 C ATOM 1760 C GLY A 131 -8.663 -5.727 11.868 1.00 0.00 C ATOM 1761 O GLY A 131 -9.694 -5.443 12.484 1.00 0.00 O ATOM 0 H GLY A 131 -7.409 -2.843 12.655 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -7.810 -4.052 10.811 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -6.624 -5.188 11.423 1.00 0.00 H new ATOM 1765 N ARG A 132 -8.415 -6.951 11.384 1.00 0.00 N ATOM 1766 CA ARG A 132 -9.266 -8.127 11.636 1.00 0.00 C ATOM 1767 C ARG A 132 -8.872 -8.909 12.903 1.00 0.00 C ATOM 1768 O ARG A 132 -9.578 -9.846 13.268 1.00 0.00 O ATOM 1769 CB ARG A 132 -9.251 -9.064 10.410 1.00 0.00 C ATOM 1770 CG ARG A 132 -9.772 -8.356 9.150 1.00 0.00 C ATOM 1771 CD ARG A 132 -10.035 -9.290 7.969 1.00 0.00 C ATOM 1772 NE ARG A 132 -11.181 -10.184 8.192 1.00 0.00 N ATOM 1773 CZ ARG A 132 -11.715 -10.987 7.277 1.00 0.00 C ATOM 1774 NH1 ARG A 132 -11.249 -11.059 6.047 1.00 0.00 N1+ ATOM 1775 NH2 ARG A 132 -12.747 -11.737 7.599 1.00 0.00 N ATOM 0 H ARG A 132 -7.606 -7.158 10.798 1.00 0.00 H new ATOM 0 HA ARG A 132 -10.274 -7.748 11.807 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -8.235 -9.419 10.235 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -9.864 -9.942 10.615 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -10.695 -7.832 9.397 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -9.048 -7.600 8.846 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -10.214 -8.694 7.074 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -9.144 -9.889 7.781 1.00 0.00 H new ATOM 0 HE ARG A 132 -11.599 -10.188 9.122 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -10.452 -10.486 5.769 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -11.685 -11.687 5.372 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -13.130 -11.699 8.544 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -13.164 -12.356 6.904 1.00 0.00 H new ATOM 1789 N HIS A 133 -7.728 -8.586 13.524 1.00 0.00 N ATOM 1790 CA HIS A 133 -7.115 -9.258 14.690 1.00 0.00 C ATOM 1791 C HIS A 133 -7.055 -10.812 14.620 1.00 0.00 C ATOM 1792 O HIS A 133 -7.007 -11.492 15.647 1.00 0.00 O ATOM 1793 CB HIS A 133 -7.712 -8.691 15.996 1.00 0.00 C ATOM 1794 CG HIS A 133 -9.191 -8.915 16.193 1.00 0.00 C ATOM 1795 ND1 HIS A 133 -9.794 -10.093 16.570 1.00 0.00 N ATOM 1796 CD2 HIS A 133 -10.184 -7.984 16.039 1.00 0.00 C ATOM 1797 CE1 HIS A 133 -11.120 -9.879 16.634 1.00 0.00 C ATOM 1798 NE2 HIS A 133 -11.411 -8.601 16.323 1.00 0.00 N ATOM 0 H HIS A 133 -7.165 -7.796 13.207 1.00 0.00 H new ATOM 0 HA HIS A 133 -6.053 -9.012 14.673 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -7.181 -9.134 16.838 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -7.519 -7.619 16.026 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -10.046 -6.953 15.749 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -11.851 -10.629 16.898 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -12.335 -8.170 16.299 1.00 0.00 H new ATOM 1806 N HIS A 134 -7.072 -11.387 13.410 1.00 0.00 N ATOM 1807 CA HIS A 134 -7.257 -12.828 13.157 1.00 0.00 C ATOM 1808 C HIS A 134 -6.844 -13.233 11.711 1.00 0.00 C ATOM 1809 O HIS A 134 -7.320 -14.233 11.174 1.00 0.00 O ATOM 1810 CB HIS A 134 -8.729 -13.197 13.473 1.00 0.00 C ATOM 1811 CG HIS A 134 -8.939 -14.543 14.132 1.00 0.00 C ATOM 1812 ND1 HIS A 134 -9.872 -14.811 15.111 1.00 0.00 N ATOM 1813 CD2 HIS A 134 -8.273 -15.717 13.888 1.00 0.00 C ATOM 1814 CE1 HIS A 134 -9.767 -16.107 15.451 1.00 0.00 C ATOM 1815 NE2 HIS A 134 -8.800 -16.707 14.730 1.00 0.00 N ATOM 0 H HIS A 134 -6.954 -10.848 12.552 1.00 0.00 H new ATOM 0 HA HIS A 134 -6.595 -13.395 13.812 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -9.147 -12.426 14.121 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -9.298 -13.175 12.543 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -7.478 -15.855 13.170 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -10.373 -16.599 16.198 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -8.510 -17.683 14.785 1.00 0.00 H new ATOM 1823 N SER A 135 -6.011 -12.432 11.029 1.00 0.00 N ATOM 1824 CA SER A 135 -5.740 -12.586 9.583 1.00 0.00 C ATOM 1825 C SER A 135 -4.875 -13.819 9.259 1.00 0.00 C ATOM 1826 O SER A 135 -5.208 -14.580 8.346 1.00 0.00 O ATOM 1827 CB SER A 135 -5.084 -11.300 9.051 1.00 0.00 C ATOM 1828 OG SER A 135 -4.929 -11.317 7.639 1.00 0.00 O ATOM 0 H SER A 135 -5.504 -11.659 11.460 1.00 0.00 H new ATOM 0 HA SER A 135 -6.694 -12.752 9.083 1.00 0.00 H new ATOM 0 HB2 SER A 135 -5.690 -10.441 9.337 1.00 0.00 H new ATOM 0 HB3 SER A 135 -4.108 -11.172 9.520 1.00 0.00 H new ATOM 0 HG SER A 135 -4.510 -10.481 7.346 1.00 0.00 H new ATOM 1834 N LEU A 136 -3.774 -14.013 10.007 1.00 0.00 N ATOM 1835 CA LEU A 136 -2.843 -15.159 9.984 1.00 0.00 C ATOM 1836 C LEU A 136 -2.006 -15.241 8.692 1.00 0.00 C ATOM 1837 O LEU A 136 -0.777 -15.201 8.748 1.00 0.00 O ATOM 1838 CB LEU A 136 -3.622 -16.454 10.326 1.00 0.00 C ATOM 1839 CG LEU A 136 -2.747 -17.661 10.732 1.00 0.00 C ATOM 1840 CD1 LEU A 136 -3.573 -18.627 11.596 1.00 0.00 C ATOM 1841 CD2 LEU A 136 -2.200 -18.438 9.523 1.00 0.00 C ATOM 0 H LEU A 136 -3.489 -13.319 10.698 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.086 -15.014 10.755 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -4.315 -16.238 11.139 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -4.223 -16.736 9.462 1.00 0.00 H new ATOM 0 HG LEU A 136 -1.897 -17.260 11.285 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -2.955 -19.478 11.882 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -3.917 -18.110 12.492 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -4.434 -18.978 11.027 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -1.593 -19.274 9.872 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -3.031 -18.816 8.927 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -1.587 -17.775 8.912 1.00 0.00 H new ATOM 1853 N SER A 137 -2.648 -15.332 7.532 1.00 0.00 N ATOM 1854 CA SER A 137 -2.027 -15.484 6.205 1.00 0.00 C ATOM 1855 C SER A 137 -1.527 -14.142 5.627 1.00 0.00 C ATOM 1856 O SER A 137 -2.018 -13.659 4.602 1.00 0.00 O ATOM 1857 CB SER A 137 -3.005 -16.186 5.246 1.00 0.00 C ATOM 1858 OG SER A 137 -3.328 -17.495 5.704 1.00 0.00 O ATOM 0 H SER A 137 -3.666 -15.301 7.481 1.00 0.00 H new ATOM 0 HA SER A 137 -1.141 -16.108 6.322 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.916 -15.595 5.155 1.00 0.00 H new ATOM 0 HB3 SER A 137 -2.563 -16.245 4.251 1.00 0.00 H new ATOM 0 HG SER A 137 -3.952 -17.916 5.077 1.00 0.00 H new ATOM 1864 N GLY A 138 -0.555 -13.522 6.309 1.00 0.00 N ATOM 1865 CA GLY A 138 0.056 -12.235 5.948 1.00 0.00 C ATOM 1866 C GLY A 138 1.574 -12.304 5.795 1.00 0.00 C ATOM 1867 O GLY A 138 2.119 -13.292 5.303 1.00 0.00 O ATOM 0 H GLY A 138 -0.157 -13.918 7.160 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -0.380 -11.884 5.013 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -0.191 -11.497 6.711 1.00 0.00 H new ATOM 1871 N ALA A 139 2.270 -11.244 6.222 1.00 0.00 N ATOM 1872 CA ALA A 139 3.731 -11.181 6.305 1.00 0.00 C ATOM 1873 C ALA A 139 4.261 -12.024 7.486 1.00 0.00 C ATOM 1874 O ALA A 139 4.683 -11.498 8.518 1.00 0.00 O ATOM 1875 CB ALA A 139 4.169 -9.712 6.377 1.00 0.00 C ATOM 0 H ALA A 139 1.818 -10.382 6.528 1.00 0.00 H new ATOM 0 HA ALA A 139 4.169 -11.619 5.408 1.00 0.00 H new ATOM 0 HB1 ALA A 139 5.256 -9.659 6.439 1.00 0.00 H new ATOM 0 HB2 ALA A 139 3.830 -9.187 5.484 1.00 0.00 H new ATOM 0 HB3 ALA A 139 3.732 -9.245 7.260 1.00 0.00 H new ATOM 1881 N THR A 140 4.229 -13.351 7.306 1.00 0.00 N ATOM 1882 CA THR A 140 4.884 -14.349 8.171 1.00 0.00 C ATOM 1883 C THR A 140 6.416 -14.319 8.027 1.00 0.00 C ATOM 1884 O THR A 140 7.143 -14.726 8.933 1.00 0.00 O ATOM 1885 CB THR A 140 4.265 -15.727 7.883 1.00 0.00 C ATOM 1886 OG1 THR A 140 4.701 -16.647 8.857 1.00 0.00 O ATOM 1887 CG2 THR A 140 4.592 -16.279 6.490 1.00 0.00 C ATOM 0 H THR A 140 3.729 -13.778 6.526 1.00 0.00 H new ATOM 0 HA THR A 140 4.705 -14.108 9.219 1.00 0.00 H new ATOM 0 HB THR A 140 3.184 -15.591 7.918 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.307 -17.526 8.677 1.00 0.00 H new ATOM 0 HG21 THR A 140 4.119 -17.253 6.364 1.00 0.00 H new ATOM 0 HG22 THR A 140 4.218 -15.593 5.730 1.00 0.00 H new ATOM 0 HG23 THR A 140 5.672 -16.383 6.384 1.00 0.00 H new ATOM 1895 N GLU A 141 6.904 -13.777 6.907 1.00 0.00 N ATOM 1896 CA GLU A 141 8.315 -13.493 6.620 1.00 0.00 C ATOM 1897 C GLU A 141 8.891 -12.367 7.518 1.00 0.00 C ATOM 1898 O GLU A 141 8.126 -11.544 8.035 1.00 0.00 O ATOM 1899 CB GLU A 141 8.439 -13.094 5.137 1.00 0.00 C ATOM 1900 CG GLU A 141 8.124 -14.220 4.139 1.00 0.00 C ATOM 1901 CD GLU A 141 9.276 -15.231 4.017 1.00 0.00 C ATOM 1902 OE1 GLU A 141 9.419 -16.107 4.902 1.00 0.00 O ATOM 1903 OE2 GLU A 141 10.037 -15.167 3.023 1.00 0.00 O1- ATOM 0 H GLU A 141 6.294 -13.510 6.135 1.00 0.00 H new ATOM 0 HA GLU A 141 8.894 -14.392 6.834 1.00 0.00 H new ATOM 0 HB2 GLU A 141 7.768 -12.257 4.943 1.00 0.00 H new ATOM 0 HB3 GLU A 141 9.453 -12.739 4.954 1.00 0.00 H new ATOM 0 HG2 GLU A 141 7.219 -14.740 4.455 1.00 0.00 H new ATOM 0 HG3 GLU A 141 7.918 -13.788 3.160 1.00 0.00 H new ATOM 1910 N PRO A 142 10.229 -12.303 7.699 1.00 0.00 N ATOM 1911 CA PRO A 142 10.899 -11.312 8.546 1.00 0.00 C ATOM 1912 C PRO A 142 11.065 -9.941 7.858 1.00 0.00 C ATOM 1913 O PRO A 142 10.577 -9.706 6.751 1.00 0.00 O ATOM 1914 CB PRO A 142 12.245 -11.965 8.898 1.00 0.00 C ATOM 1915 CG PRO A 142 12.574 -12.758 7.637 1.00 0.00 C ATOM 1916 CD PRO A 142 11.203 -13.277 7.214 1.00 0.00 C ATOM 0 HA PRO A 142 10.312 -11.075 9.433 1.00 0.00 H new ATOM 0 HB2 PRO A 142 13.010 -11.221 9.119 1.00 0.00 H new ATOM 0 HB3 PRO A 142 12.165 -12.610 9.773 1.00 0.00 H new ATOM 0 HG2 PRO A 142 13.027 -12.131 6.869 1.00 0.00 H new ATOM 0 HG3 PRO A 142 13.272 -13.570 7.838 1.00 0.00 H new ATOM 0 HD2 PRO A 142 11.144 -13.380 6.131 1.00 0.00 H new ATOM 0 HD3 PRO A 142 11.012 -14.262 7.639 1.00 0.00 H new ATOM 1924 N ASP A 143 11.799 -9.035 8.517 1.00 0.00 N ATOM 1925 CA ASP A 143 12.096 -7.661 8.076 1.00 0.00 C ATOM 1926 C ASP A 143 12.879 -7.570 6.751 1.00 0.00 C ATOM 1927 O ASP A 143 12.958 -6.498 6.150 1.00 0.00 O ATOM 1928 CB ASP A 143 12.871 -6.927 9.185 1.00 0.00 C ATOM 1929 CG ASP A 143 14.273 -7.505 9.443 1.00 0.00 C ATOM 1930 OD1 ASP A 143 15.273 -6.881 9.013 1.00 0.00 O ATOM 1931 OD2 ASP A 143 14.371 -8.564 10.109 1.00 0.00 O1- ATOM 0 H ASP A 143 12.225 -9.249 9.419 1.00 0.00 H new ATOM 0 HA ASP A 143 11.132 -7.189 7.885 1.00 0.00 H new ATOM 0 HB2 ASP A 143 12.965 -5.875 8.916 1.00 0.00 H new ATOM 0 HB3 ASP A 143 12.294 -6.969 10.109 1.00 0.00 H new ATOM 1936 N ASP A 144 13.427 -8.694 6.280 1.00 0.00 N ATOM 1937 CA ASP A 144 14.096 -8.827 4.982 1.00 0.00 C ATOM 1938 C ASP A 144 13.149 -8.546 3.794 1.00 0.00 C ATOM 1939 O ASP A 144 13.612 -8.146 2.724 1.00 0.00 O ATOM 1940 CB ASP A 144 14.698 -10.239 4.894 1.00 0.00 C ATOM 1941 CG ASP A 144 15.669 -10.403 3.710 1.00 0.00 C ATOM 1942 OD1 ASP A 144 16.643 -9.618 3.614 1.00 0.00 O ATOM 1943 OD2 ASP A 144 15.489 -11.353 2.911 1.00 0.00 O1- ATOM 0 H ASP A 144 13.417 -9.566 6.809 1.00 0.00 H new ATOM 0 HA ASP A 144 14.883 -8.077 4.913 1.00 0.00 H new ATOM 0 HB2 ASP A 144 15.224 -10.463 5.822 1.00 0.00 H new ATOM 0 HB3 ASP A 144 13.892 -10.967 4.800 1.00 0.00 H new ATOM 1948 N GLU A 145 11.832 -8.700 3.997 1.00 0.00 N ATOM 1949 CA GLU A 145 10.795 -8.288 3.042 1.00 0.00 C ATOM 1950 C GLU A 145 10.396 -6.818 3.284 1.00 0.00 C ATOM 1951 O GLU A 145 10.690 -5.968 2.441 1.00 0.00 O ATOM 1952 CB GLU A 145 9.575 -9.224 3.113 1.00 0.00 C ATOM 1953 CG GLU A 145 9.881 -10.709 2.872 1.00 0.00 C ATOM 1954 CD GLU A 145 10.480 -11.001 1.485 1.00 0.00 C ATOM 1955 OE1 GLU A 145 9.706 -11.234 0.527 1.00 0.00 O ATOM 1956 OE2 GLU A 145 11.725 -11.047 1.351 1.00 0.00 O1- ATOM 0 H GLU A 145 11.452 -9.122 4.845 1.00 0.00 H new ATOM 0 HA GLU A 145 11.203 -8.364 2.034 1.00 0.00 H new ATOM 0 HB2 GLU A 145 9.112 -9.119 4.094 1.00 0.00 H new ATOM 0 HB3 GLU A 145 8.841 -8.896 2.377 1.00 0.00 H new ATOM 0 HG2 GLU A 145 10.574 -11.057 3.638 1.00 0.00 H new ATOM 0 HG3 GLU A 145 8.962 -11.284 2.989 1.00 0.00 H new ATOM 1963 N ARG A 146 9.782 -6.516 4.446 1.00 0.00 N ATOM 1964 CA ARG A 146 9.470 -5.156 4.940 1.00 0.00 C ATOM 1965 C ARG A 146 8.930 -5.161 6.383 1.00 0.00 C ATOM 1966 O ARG A 146 9.507 -4.502 7.246 1.00 0.00 O ATOM 1967 CB ARG A 146 8.496 -4.402 3.999 1.00 0.00 C ATOM 1968 CG ARG A 146 8.229 -2.942 4.413 1.00 0.00 C ATOM 1969 CD ARG A 146 9.445 -2.019 4.269 1.00 0.00 C ATOM 1970 NE ARG A 146 9.159 -0.693 4.848 1.00 0.00 N ATOM 1971 CZ ARG A 146 9.973 0.357 4.854 1.00 0.00 C ATOM 1972 NH1 ARG A 146 11.149 0.331 4.261 1.00 0.00 N1+ ATOM 1973 NH2 ARG A 146 9.608 1.463 5.464 1.00 0.00 N ATOM 0 H ARG A 146 9.477 -7.242 5.094 1.00 0.00 H new ATOM 0 HA ARG A 146 10.418 -4.618 4.945 1.00 0.00 H new ATOM 0 HB2 ARG A 146 8.902 -4.414 2.988 1.00 0.00 H new ATOM 0 HB3 ARG A 146 7.548 -4.939 3.968 1.00 0.00 H new ATOM 0 HG2 ARG A 146 7.413 -2.547 3.808 1.00 0.00 H new ATOM 0 HG3 ARG A 146 7.894 -2.925 5.450 1.00 0.00 H new ATOM 0 HD2 ARG A 146 10.306 -2.462 4.769 1.00 0.00 H new ATOM 0 HD3 ARG A 146 9.706 -1.914 3.216 1.00 0.00 H new ATOM 0 HE ARG A 146 8.247 -0.570 5.287 1.00 0.00 H new ATOM 0 HH11 ARG A 146 11.458 -0.513 3.779 1.00 0.00 H new ATOM 0 HH12 ARG A 146 11.750 1.155 4.284 1.00 0.00 H new ATOM 0 HH21 ARG A 146 8.702 1.513 5.931 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.230 2.271 5.471 1.00 0.00 H new ATOM 1987 N VAL A 147 7.825 -5.873 6.637 1.00 0.00 N ATOM 1988 CA VAL A 147 7.137 -5.950 7.948 1.00 0.00 C ATOM 1989 C VAL A 147 7.056 -7.397 8.448 1.00 0.00 C ATOM 1990 O VAL A 147 7.139 -8.332 7.654 1.00 0.00 O ATOM 1991 CB VAL A 147 5.721 -5.316 7.935 1.00 0.00 C ATOM 1992 CG1 VAL A 147 5.779 -3.834 7.542 1.00 0.00 C ATOM 1993 CG2 VAL A 147 4.720 -6.049 7.027 1.00 0.00 C ATOM 0 H VAL A 147 7.364 -6.432 5.919 1.00 0.00 H new ATOM 0 HA VAL A 147 7.746 -5.363 8.636 1.00 0.00 H new ATOM 0 HB VAL A 147 5.356 -5.414 8.957 1.00 0.00 H new ATOM 0 HG11 VAL A 147 4.772 -3.418 7.542 1.00 0.00 H new ATOM 0 HG12 VAL A 147 6.396 -3.291 8.259 1.00 0.00 H new ATOM 0 HG13 VAL A 147 6.211 -3.738 6.546 1.00 0.00 H new ATOM 0 HG21 VAL A 147 3.754 -5.547 7.071 1.00 0.00 H new ATOM 0 HG22 VAL A 147 5.087 -6.041 6.001 1.00 0.00 H new ATOM 0 HG23 VAL A 147 4.609 -7.079 7.365 1.00 0.00 H new ATOM 2003 N LEU A 148 6.899 -7.561 9.767 1.00 0.00 N ATOM 2004 CA LEU A 148 6.948 -8.853 10.470 1.00 0.00 C ATOM 2005 C LEU A 148 5.649 -9.203 11.224 1.00 0.00 C ATOM 2006 O LEU A 148 5.534 -10.306 11.761 1.00 0.00 O ATOM 2007 CB LEU A 148 8.101 -8.843 11.498 1.00 0.00 C ATOM 2008 CG LEU A 148 9.456 -8.268 11.039 1.00 0.00 C ATOM 2009 CD1 LEU A 148 9.555 -6.751 11.310 1.00 0.00 C ATOM 2010 CD2 LEU A 148 10.592 -8.986 11.788 1.00 0.00 C ATOM 0 H LEU A 148 6.729 -6.776 10.395 1.00 0.00 H new ATOM 0 HA LEU A 148 7.096 -9.606 9.695 1.00 0.00 H new ATOM 0 HB2 LEU A 148 7.772 -8.275 12.368 1.00 0.00 H new ATOM 0 HB3 LEU A 148 8.265 -9.868 11.830 1.00 0.00 H new ATOM 0 HG LEU A 148 9.541 -8.428 9.964 1.00 0.00 H new ATOM 0 HD11 LEU A 148 10.524 -6.384 10.973 1.00 0.00 H new ATOM 0 HD12 LEU A 148 8.763 -6.233 10.770 1.00 0.00 H new ATOM 0 HD13 LEU A 148 9.448 -6.565 12.379 1.00 0.00 H new ATOM 0 HD21 LEU A 148 11.552 -8.582 11.466 1.00 0.00 H new ATOM 0 HD22 LEU A 148 10.475 -8.832 12.861 1.00 0.00 H new ATOM 0 HD23 LEU A 148 10.555 -10.053 11.568 1.00 0.00 H new ATOM 2022 N GLY A 149 4.708 -8.255 11.333 1.00 0.00 N ATOM 2023 CA GLY A 149 3.514 -8.368 12.176 1.00 0.00 C ATOM 2024 C GLY A 149 2.418 -9.149 11.462 1.00 0.00 C ATOM 2025 O GLY A 149 2.176 -10.311 11.789 1.00 0.00 O ATOM 0 H GLY A 149 4.758 -7.371 10.827 1.00 0.00 H new ATOM 0 HA2 GLY A 149 3.770 -8.865 13.112 1.00 0.00 H new ATOM 0 HA3 GLY A 149 3.149 -7.373 12.433 1.00 0.00 H new ATOM 2029 N TRP A 150 1.802 -8.511 10.462 1.00 0.00 N ATOM 2030 CA TRP A 150 0.822 -9.092 9.536 1.00 0.00 C ATOM 2031 C TRP A 150 0.446 -8.127 8.395 1.00 0.00 C ATOM 2032 O TRP A 150 0.856 -6.968 8.352 1.00 0.00 O ATOM 2033 CB TRP A 150 -0.418 -9.650 10.280 1.00 0.00 C ATOM 2034 CG TRP A 150 -1.071 -8.793 11.326 1.00 0.00 C ATOM 2035 CD1 TRP A 150 -1.117 -9.111 12.639 1.00 0.00 C ATOM 2036 CD2 TRP A 150 -1.798 -7.524 11.201 1.00 0.00 C ATOM 2037 NE1 TRP A 150 -1.822 -8.152 13.333 1.00 0.00 N ATOM 2038 CE2 TRP A 150 -2.259 -7.147 12.500 1.00 0.00 C ATOM 2039 CE3 TRP A 150 -2.112 -6.638 10.144 1.00 0.00 C ATOM 2040 CZ2 TRP A 150 -2.979 -5.970 12.736 1.00 0.00 C ATOM 2041 CZ3 TRP A 150 -2.806 -5.437 10.380 1.00 0.00 C ATOM 2042 CH2 TRP A 150 -3.252 -5.103 11.668 1.00 0.00 C ATOM 0 H TRP A 150 1.982 -7.526 10.266 1.00 0.00 H new ATOM 0 HA TRP A 150 1.307 -9.944 9.059 1.00 0.00 H new ATOM 0 HB2 TRP A 150 -1.172 -9.892 9.532 1.00 0.00 H new ATOM 0 HB3 TRP A 150 -0.126 -10.587 10.754 1.00 0.00 H new ATOM 0 HD1 TRP A 150 -0.667 -9.988 13.080 1.00 0.00 H new ATOM 0 HE1 TRP A 150 -1.998 -8.183 14.337 1.00 0.00 H new ATOM 0 HE3 TRP A 150 -1.813 -6.888 9.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 150 -3.321 -5.732 13.732 1.00 0.00 H new ATOM 0 HZ3 TRP A 150 -2.998 -4.763 9.558 1.00 0.00 H new ATOM 0 HH2 TRP A 150 -3.800 -4.187 11.835 1.00 0.00 H new ATOM 2053 N VAL A 151 -0.370 -8.630 7.468 1.00 0.00 N ATOM 2054 CA VAL A 151 -1.017 -7.892 6.376 1.00 0.00 C ATOM 2055 C VAL A 151 -2.186 -8.733 5.869 1.00 0.00 C ATOM 2056 O VAL A 151 -2.045 -9.942 5.698 1.00 0.00 O ATOM 2057 CB VAL A 151 -0.061 -7.428 5.233 1.00 0.00 C ATOM 2058 CG1 VAL A 151 1.117 -8.379 4.997 1.00 0.00 C ATOM 2059 CG2 VAL A 151 -0.742 -7.236 3.863 1.00 0.00 C ATOM 0 H VAL A 151 -0.613 -9.621 7.456 1.00 0.00 H new ATOM 0 HA VAL A 151 -1.377 -6.945 6.778 1.00 0.00 H new ATOM 0 HB VAL A 151 0.285 -6.465 5.609 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.739 -7.994 4.189 1.00 0.00 H new ATOM 0 HG12 VAL A 151 1.711 -8.455 5.908 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.740 -9.365 4.726 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -0.002 -6.913 3.131 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -1.184 -8.179 3.541 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -1.522 -6.480 3.947 1.00 0.00 H new ATOM 2069 N GLU A 152 -3.334 -8.094 5.669 1.00 0.00 N ATOM 2070 CA GLU A 152 -4.539 -8.713 5.119 1.00 0.00 C ATOM 2071 C GLU A 152 -4.700 -8.333 3.642 1.00 0.00 C ATOM 2072 O GLU A 152 -4.222 -7.281 3.217 1.00 0.00 O ATOM 2073 CB GLU A 152 -5.767 -8.278 5.932 1.00 0.00 C ATOM 2074 CG GLU A 152 -6.894 -9.329 5.871 1.00 0.00 C ATOM 2075 CD GLU A 152 -8.228 -8.860 5.272 1.00 0.00 C ATOM 2076 OE1 GLU A 152 -8.514 -7.645 5.223 1.00 0.00 O ATOM 2077 OE2 GLU A 152 -9.035 -9.749 4.918 1.00 0.00 O1- ATOM 0 H GLU A 152 -3.457 -7.106 5.890 1.00 0.00 H new ATOM 0 HA GLU A 152 -4.448 -9.797 5.184 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.477 -8.115 6.970 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -6.137 -7.326 5.551 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -6.538 -10.180 5.290 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -7.081 -9.690 6.882 1.00 0.00 H new ATOM 2084 N LEU A 153 -5.377 -9.178 2.859 1.00 0.00 N ATOM 2085 CA LEU A 153 -5.524 -9.017 1.410 1.00 0.00 C ATOM 2086 C LEU A 153 -6.840 -9.638 0.915 1.00 0.00 C ATOM 2087 O LEU A 153 -6.935 -10.856 0.749 1.00 0.00 O ATOM 2088 CB LEU A 153 -4.279 -9.581 0.675 1.00 0.00 C ATOM 2089 CG LEU A 153 -3.799 -10.991 1.117 1.00 0.00 C ATOM 2090 CD1 LEU A 153 -3.460 -11.870 -0.096 1.00 0.00 C ATOM 2091 CD2 LEU A 153 -2.563 -10.905 2.030 1.00 0.00 C ATOM 0 H LEU A 153 -5.847 -10.008 3.221 1.00 0.00 H new ATOM 0 HA LEU A 153 -5.580 -7.954 1.176 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -4.497 -9.613 -0.392 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -3.455 -8.881 0.811 1.00 0.00 H new ATOM 0 HG LEU A 153 -4.622 -11.442 1.671 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -3.127 -12.850 0.246 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -4.346 -11.985 -0.721 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.666 -11.399 -0.676 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -2.254 -11.909 2.320 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -1.749 -10.416 1.495 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -2.809 -10.329 2.922 1.00 0.00 H new ATOM 2103 N GLU A 154 -7.850 -8.803 0.650 1.00 0.00 N ATOM 2104 CA GLU A 154 -9.118 -9.222 0.049 1.00 0.00 C ATOM 2105 C GLU A 154 -9.600 -8.180 -0.978 1.00 0.00 C ATOM 2106 O GLU A 154 -10.014 -7.069 -0.637 1.00 0.00 O ATOM 2107 CB GLU A 154 -10.165 -9.502 1.145 1.00 0.00 C ATOM 2108 CG GLU A 154 -11.238 -10.470 0.629 1.00 0.00 C ATOM 2109 CD GLU A 154 -12.374 -10.690 1.643 1.00 0.00 C ATOM 2110 OE1 GLU A 154 -13.545 -10.402 1.302 1.00 0.00 O ATOM 2111 OE2 GLU A 154 -12.117 -11.194 2.762 1.00 0.00 O1- ATOM 0 H GLU A 154 -7.808 -7.804 0.850 1.00 0.00 H new ATOM 0 HA GLU A 154 -8.967 -10.155 -0.494 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -9.677 -9.925 2.023 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -10.630 -8.568 1.459 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -11.656 -10.082 -0.300 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -10.775 -11.428 0.394 1.00 0.00 H new ATOM 2118 N LEU A 155 -9.544 -8.557 -2.258 1.00 0.00 N ATOM 2119 CA LEU A 155 -9.797 -7.697 -3.417 1.00 0.00 C ATOM 2120 C LEU A 155 -9.943 -8.523 -4.708 1.00 0.00 C ATOM 2121 O LEU A 155 -9.798 -9.746 -4.714 1.00 0.00 O ATOM 2122 CB LEU A 155 -8.704 -6.601 -3.546 1.00 0.00 C ATOM 2123 CG LEU A 155 -7.274 -7.104 -3.868 1.00 0.00 C ATOM 2124 CD1 LEU A 155 -6.510 -6.041 -4.677 1.00 0.00 C ATOM 2125 CD2 LEU A 155 -6.483 -7.491 -2.606 1.00 0.00 C ATOM 0 H LEU A 155 -9.311 -9.513 -2.527 1.00 0.00 H new ATOM 0 HA LEU A 155 -10.748 -7.189 -3.258 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -9.007 -5.903 -4.327 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -8.669 -6.039 -2.613 1.00 0.00 H new ATOM 0 HG LEU A 155 -7.378 -8.011 -4.464 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -5.506 -6.404 -4.898 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -7.039 -5.844 -5.610 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -6.443 -5.121 -4.097 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -5.489 -7.836 -2.891 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -6.392 -6.623 -1.953 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -7.007 -8.289 -2.079 1.00 0.00 H new ATOM 2137 N SER A 156 -10.197 -7.833 -5.813 1.00 0.00 N ATOM 2138 CA SER A 156 -10.098 -8.338 -7.188 1.00 0.00 C ATOM 2139 C SER A 156 -8.673 -8.800 -7.573 1.00 0.00 C ATOM 2140 O SER A 156 -7.681 -8.366 -6.988 1.00 0.00 O ATOM 2141 CB SER A 156 -10.535 -7.198 -8.123 1.00 0.00 C ATOM 2142 OG SER A 156 -9.919 -5.968 -7.751 1.00 0.00 O ATOM 0 H SER A 156 -10.493 -6.857 -5.779 1.00 0.00 H new ATOM 0 HA SER A 156 -10.735 -9.218 -7.277 1.00 0.00 H new ATOM 0 HB2 SER A 156 -10.271 -7.445 -9.151 1.00 0.00 H new ATOM 0 HB3 SER A 156 -11.619 -7.091 -8.089 1.00 0.00 H new ATOM 0 HG SER A 156 -9.030 -6.147 -7.380 1.00 0.00 H new ATOM 2148 N HIS A 157 -8.531 -9.613 -8.626 1.00 0.00 N ATOM 2149 CA HIS A 157 -7.236 -10.150 -9.092 1.00 0.00 C ATOM 2150 C HIS A 157 -6.298 -9.118 -9.782 1.00 0.00 C ATOM 2151 O HIS A 157 -5.290 -9.503 -10.378 1.00 0.00 O ATOM 2152 CB HIS A 157 -7.507 -11.364 -10.000 1.00 0.00 C ATOM 2153 CG HIS A 157 -8.168 -12.524 -9.296 1.00 0.00 C ATOM 2154 ND1 HIS A 157 -7.595 -13.325 -8.332 1.00 0.00 N ATOM 2155 CD2 HIS A 157 -9.428 -13.011 -9.525 1.00 0.00 C ATOM 2156 CE1 HIS A 157 -8.489 -14.267 -7.987 1.00 0.00 C ATOM 2157 NE2 HIS A 157 -9.629 -14.118 -8.687 1.00 0.00 N ATOM 0 H HIS A 157 -9.321 -9.924 -9.191 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.679 -10.445 -8.203 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -8.139 -11.049 -10.831 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -6.563 -11.702 -10.428 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -10.143 -12.612 -10.229 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -8.317 -15.037 -7.250 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -10.469 -14.693 -8.621 1.00 0.00 H new ATOM 2165 N HIS A 158 -6.618 -7.819 -9.710 1.00 0.00 N ATOM 2166 CA HIS A 158 -5.831 -6.674 -10.200 1.00 0.00 C ATOM 2167 C HIS A 158 -5.828 -6.555 -11.752 1.00 0.00 C ATOM 2168 O HIS A 158 -6.589 -7.239 -12.446 1.00 0.00 O ATOM 2169 CB HIS A 158 -4.429 -6.694 -9.541 1.00 0.00 C ATOM 2170 CG HIS A 158 -3.648 -5.412 -9.670 1.00 0.00 C ATOM 2171 ND1 HIS A 158 -4.043 -4.167 -9.235 1.00 0.00 N ATOM 2172 CD2 HIS A 158 -2.449 -5.256 -10.314 1.00 0.00 C ATOM 2173 CE1 HIS A 158 -3.111 -3.282 -9.624 1.00 0.00 C ATOM 2174 NE2 HIS A 158 -2.113 -3.899 -10.284 1.00 0.00 N ATOM 0 H HIS A 158 -7.492 -7.518 -9.279 1.00 0.00 H new ATOM 0 HA HIS A 158 -6.315 -5.748 -9.890 1.00 0.00 H new ATOM 0 HB2 HIS A 158 -4.545 -6.927 -8.482 1.00 0.00 H new ATOM 0 HB3 HIS A 158 -3.847 -7.503 -9.983 1.00 0.00 H new ATOM 0 HD1 HIS A 158 -4.892 -3.955 -8.711 1.00 0.00 H new ATOM 0 HD2 HIS A 158 -1.865 -6.044 -10.766 1.00 0.00 H new ATOM 0 HE1 HIS A 158 -3.156 -2.220 -9.433 1.00 0.00 H new ATOM 2182 N GLY A 159 -5.010 -5.649 -12.312 1.00 0.00 N ATOM 2183 CA GLY A 159 -4.866 -5.412 -13.759 1.00 0.00 C ATOM 2184 C GLY A 159 -5.760 -4.302 -14.332 1.00 0.00 C ATOM 2185 O GLY A 159 -5.761 -4.109 -15.551 1.00 0.00 O ATOM 0 H GLY A 159 -4.411 -5.041 -11.753 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -3.826 -5.163 -13.968 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -5.084 -6.341 -14.287 1.00 0.00 H new ATOM 2189 N THR A 160 -6.494 -3.570 -13.475 1.00 0.00 N ATOM 2190 CA THR A 160 -7.391 -2.436 -13.815 1.00 0.00 C ATOM 2191 C THR A 160 -8.633 -2.944 -14.578 1.00 0.00 C ATOM 2192 O THR A 160 -8.894 -4.148 -14.599 1.00 0.00 O ATOM 2193 CB THR A 160 -6.644 -1.294 -14.555 1.00 0.00 C ATOM 2194 OG1 THR A 160 -5.276 -1.248 -14.202 1.00 0.00 O ATOM 2195 CG2 THR A 160 -7.182 0.093 -14.179 1.00 0.00 C ATOM 0 H THR A 160 -6.481 -3.758 -12.473 1.00 0.00 H new ATOM 0 HA THR A 160 -7.742 -1.989 -12.885 1.00 0.00 H new ATOM 0 HB THR A 160 -6.792 -1.513 -15.613 1.00 0.00 H new ATOM 0 HG1 THR A 160 -4.837 -0.519 -14.688 1.00 0.00 H new ATOM 0 HG21 THR A 160 -6.627 0.858 -14.722 1.00 0.00 H new ATOM 0 HG22 THR A 160 -8.238 0.156 -14.440 1.00 0.00 H new ATOM 0 HG23 THR A 160 -7.063 0.251 -13.107 1.00 0.00 H new ATOM 2203 N LEU A 161 -9.424 -2.042 -15.180 1.00 0.00 N ATOM 2204 CA LEU A 161 -10.599 -2.344 -16.027 1.00 0.00 C ATOM 2205 C LEU A 161 -11.777 -2.960 -15.229 1.00 0.00 C ATOM 2206 O LEU A 161 -12.606 -3.695 -15.769 1.00 0.00 O ATOM 2207 CB LEU A 161 -10.150 -3.177 -17.262 1.00 0.00 C ATOM 2208 CG LEU A 161 -10.673 -2.711 -18.638 1.00 0.00 C ATOM 2209 CD1 LEU A 161 -12.204 -2.715 -18.747 1.00 0.00 C ATOM 2210 CD2 LEU A 161 -10.122 -1.325 -19.014 1.00 0.00 C ATOM 0 H LEU A 161 -9.259 -1.039 -15.089 1.00 0.00 H new ATOM 0 HA LEU A 161 -11.014 -1.409 -16.404 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -9.060 -3.178 -17.294 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -10.465 -4.209 -17.110 1.00 0.00 H new ATOM 0 HG LEU A 161 -10.302 -3.448 -19.350 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -12.499 -2.376 -19.740 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -12.578 -3.726 -18.582 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -12.624 -2.046 -17.996 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -10.512 -1.031 -19.988 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -10.429 -0.596 -18.265 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -9.034 -1.365 -19.056 1.00 0.00 H new ATOM 2222 N LEU A 162 -11.835 -2.671 -13.924 1.00 0.00 N ATOM 2223 CA LEU A 162 -12.813 -3.200 -12.966 1.00 0.00 C ATOM 2224 C LEU A 162 -14.041 -2.273 -12.882 1.00 0.00 C ATOM 2225 O LEU A 162 -14.999 -2.457 -13.635 1.00 0.00 O ATOM 2226 CB LEU A 162 -12.091 -3.408 -11.615 1.00 0.00 C ATOM 2227 CG LEU A 162 -11.089 -4.584 -11.649 1.00 0.00 C ATOM 2228 CD1 LEU A 162 -9.974 -4.359 -10.623 1.00 0.00 C ATOM 2229 CD2 LEU A 162 -11.800 -5.920 -11.386 1.00 0.00 C ATOM 0 H LEU A 162 -11.171 -2.032 -13.487 1.00 0.00 H new ATOM 0 HA LEU A 162 -13.205 -4.165 -13.287 1.00 0.00 H new ATOM 0 HB2 LEU A 162 -11.563 -2.494 -11.346 1.00 0.00 H new ATOM 0 HB3 LEU A 162 -12.832 -3.589 -10.836 1.00 0.00 H new ATOM 0 HG LEU A 162 -10.647 -4.628 -12.644 1.00 0.00 H new ATOM 0 HD11 LEU A 162 -9.275 -5.194 -10.657 1.00 0.00 H new ATOM 0 HD12 LEU A 162 -9.446 -3.434 -10.856 1.00 0.00 H new ATOM 0 HD13 LEU A 162 -10.407 -4.288 -9.625 1.00 0.00 H new ATOM 0 HD21 LEU A 162 -11.073 -6.731 -11.415 1.00 0.00 H new ATOM 0 HD22 LEU A 162 -12.274 -5.893 -10.405 1.00 0.00 H new ATOM 0 HD23 LEU A 162 -12.559 -6.085 -12.151 1.00 0.00 H new ATOM 2241 N ARG A 163 -13.993 -1.284 -11.980 1.00 0.00 N ATOM 2242 CA ARG A 163 -15.026 -0.285 -11.650 1.00 0.00 C ATOM 2243 C ARG A 163 -14.496 0.687 -10.577 1.00 0.00 C ATOM 2244 O ARG A 163 -13.452 0.430 -9.971 1.00 0.00 O ATOM 2245 CB ARG A 163 -16.371 -0.945 -11.257 1.00 0.00 C ATOM 2246 CG ARG A 163 -16.287 -1.899 -10.053 1.00 0.00 C ATOM 2247 CD ARG A 163 -17.612 -2.641 -9.806 1.00 0.00 C ATOM 2248 NE ARG A 163 -18.069 -2.490 -8.411 1.00 0.00 N ATOM 2249 CZ ARG A 163 -17.696 -3.208 -7.358 1.00 0.00 C ATOM 2250 NH1 ARG A 163 -16.867 -4.228 -7.456 1.00 0.00 N1+ ATOM 2251 NH2 ARG A 163 -18.154 -2.890 -6.167 1.00 0.00 N ATOM 0 H ARG A 163 -13.158 -1.148 -11.411 1.00 0.00 H new ATOM 0 HA ARG A 163 -15.243 0.298 -12.545 1.00 0.00 H new ATOM 0 HB2 ARG A 163 -17.094 -0.161 -11.033 1.00 0.00 H new ATOM 0 HB3 ARG A 163 -16.755 -1.497 -12.115 1.00 0.00 H new ATOM 0 HG2 ARG A 163 -15.492 -2.625 -10.222 1.00 0.00 H new ATOM 0 HG3 ARG A 163 -16.018 -1.333 -9.161 1.00 0.00 H new ATOM 0 HD2 ARG A 163 -18.376 -2.258 -10.483 1.00 0.00 H new ATOM 0 HD3 ARG A 163 -17.485 -3.699 -10.035 1.00 0.00 H new ATOM 0 HE ARG A 163 -18.749 -1.750 -8.236 1.00 0.00 H new ATOM 0 HH11 ARG A 163 -16.487 -4.491 -8.365 1.00 0.00 H new ATOM 0 HH12 ARG A 163 -16.605 -4.754 -6.622 1.00 0.00 H new ATOM 0 HH21 ARG A 163 -18.789 -2.099 -6.059 1.00 0.00 H new ATOM 0 HH22 ARG A 163 -17.874 -3.434 -5.351 1.00 0.00 H new ATOM 2265 N GLY A 164 -15.182 1.812 -10.348 1.00 0.00 N ATOM 2266 CA GLY A 164 -14.777 2.845 -9.378 1.00 0.00 C ATOM 2267 C GLY A 164 -13.586 3.672 -9.873 1.00 0.00 C ATOM 2268 O GLY A 164 -13.715 4.421 -10.848 1.00 0.00 O ATOM 0 H GLY A 164 -16.048 2.037 -10.837 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -15.620 3.507 -9.183 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -14.519 2.370 -8.431 1.00 0.00 H new