USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=24 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 118 THR OG1 : rot 161:sc= 0.669 USER MOD Set 1.2: A 122 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 101 SER OG : rot -130:sc= 0.17 USER MOD Set 2.2: A 102 MET CE :methyl 150:sc= -0.244 (180deg=-1.56) USER MOD Set 3.1: A 47 GLN : amide:sc= -0.609 K(o=-0.41,f=0.79) USER MOD Set 3.2: A 52 GLN : amide:sc= 0.201 K(o=-0.41,f=0.094) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -38:sc= 0.168 USER MOD Single : A 32 ASN : amide:sc= -0.176 X(o=-0.18,f=-0.42) 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= -1.53 K(o=-1.5,f=-3.5) USER MOD Single : A 59 THR OG1 : rot 162:sc= 0.763 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= -0.204 K(o=-0.2,f=-1.2) USER MOD Single : A 74 ASN : amide:sc= 0.867 K(o=0.87,f=0) USER MOD Single : A 79 GLN : amide:sc= 0.52 K(o=0.52,f=-0.006) USER MOD Single : A 86 THR OG1 : rot -129:sc= 0.532 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc= -1.35 X(o=-1.4,f=-1.5) 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) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl -166:sc=-0.00161 (180deg=-0.315) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.00271 USER MOD Single : A 124 HIS : no HE2:sc= -0.798 K(o=-0.8,f=-2.2) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HE2:sc= 0.0497 K(o=0.05,f=-0.5) 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 -26:sc= 0.0497 USER MOD Single : A 156 SER OG : rot -150:sc= -0.143 USER MOD Single : A 157 HIS : no HD1:sc=-0.00845 X(o=-0.0084,f=0) USER MOD Single : A 158 HIS : no HD1:sc= -2.33! C(o=-2.3!,f=-2!) USER MOD Single : A 160 THR OG1 : rot 180:sc= -0.0355 USER MOD ----------------------------------------------------------------- ATOM 138 N SER A 24 15.311 4.657 -6.690 1.00 0.00 N ATOM 139 CA SER A 24 14.239 4.081 -5.859 1.00 0.00 C ATOM 140 C SER A 24 13.052 5.049 -5.727 1.00 0.00 C ATOM 141 O SER A 24 12.021 4.833 -6.364 1.00 0.00 O ATOM 142 CB SER A 24 14.820 3.673 -4.495 1.00 0.00 C ATOM 143 OG SER A 24 13.835 3.062 -3.677 1.00 0.00 O ATOM 0 HA SER A 24 13.845 3.187 -6.343 1.00 0.00 H new ATOM 0 HB2 SER A 24 15.651 2.984 -4.643 1.00 0.00 H new ATOM 0 HB3 SER A 24 15.221 4.552 -3.990 1.00 0.00 H new ATOM 0 HG SER A 24 14.233 2.812 -2.817 1.00 0.00 H new ATOM 149 N GLY A 25 13.198 6.137 -4.955 1.00 0.00 N ATOM 150 CA GLY A 25 12.198 7.209 -4.832 1.00 0.00 C ATOM 151 C GLY A 25 12.365 8.306 -5.891 1.00 0.00 C ATOM 152 O GLY A 25 13.055 8.118 -6.893 1.00 0.00 O ATOM 0 H GLY A 25 14.030 6.299 -4.388 1.00 0.00 H new ATOM 0 HA2 GLY A 25 11.200 6.779 -4.916 1.00 0.00 H new ATOM 0 HA3 GLY A 25 12.271 7.655 -3.840 1.00 0.00 H new ATOM 156 N VAL A 26 11.733 9.460 -5.658 1.00 0.00 N ATOM 157 CA VAL A 26 11.786 10.632 -6.560 1.00 0.00 C ATOM 158 C VAL A 26 13.229 11.120 -6.784 1.00 0.00 C ATOM 159 O VAL A 26 13.996 11.282 -5.835 1.00 0.00 O ATOM 160 CB VAL A 26 10.887 11.803 -6.085 1.00 0.00 C ATOM 161 CG1 VAL A 26 9.400 11.412 -6.121 1.00 0.00 C ATOM 162 CG2 VAL A 26 11.222 12.322 -4.674 1.00 0.00 C ATOM 0 H VAL A 26 11.160 9.616 -4.828 1.00 0.00 H new ATOM 0 HA VAL A 26 11.388 10.285 -7.514 1.00 0.00 H new ATOM 0 HB VAL A 26 11.091 12.610 -6.789 1.00 0.00 H new ATOM 0 HG11 VAL A 26 8.794 12.253 -5.783 1.00 0.00 H new ATOM 0 HG12 VAL A 26 9.118 11.148 -7.140 1.00 0.00 H new ATOM 0 HG13 VAL A 26 9.233 10.557 -5.466 1.00 0.00 H new ATOM 0 HG21 VAL A 26 10.548 13.140 -4.418 1.00 0.00 H new ATOM 0 HG22 VAL A 26 11.104 11.514 -3.952 1.00 0.00 H new ATOM 0 HG23 VAL A 26 12.251 12.680 -4.653 1.00 0.00 H new ATOM 172 N ASP A 27 13.601 11.356 -8.047 1.00 0.00 N ATOM 173 CA ASP A 27 14.966 11.754 -8.444 1.00 0.00 C ATOM 174 C ASP A 27 15.177 13.283 -8.441 1.00 0.00 C ATOM 175 O ASP A 27 16.297 13.765 -8.262 1.00 0.00 O ATOM 176 CB ASP A 27 15.249 11.161 -9.834 1.00 0.00 C ATOM 177 CG ASP A 27 16.687 11.426 -10.313 1.00 0.00 C ATOM 178 OD1 ASP A 27 17.638 10.930 -9.663 1.00 0.00 O ATOM 179 OD2 ASP A 27 16.860 12.104 -11.354 1.00 0.00 O1- ATOM 0 H ASP A 27 12.959 11.276 -8.835 1.00 0.00 H new ATOM 0 HA ASP A 27 15.668 11.364 -7.707 1.00 0.00 H new ATOM 0 HB2 ASP A 27 15.072 10.086 -9.808 1.00 0.00 H new ATOM 0 HB3 ASP A 27 14.547 11.583 -10.554 1.00 0.00 H new ATOM 184 N LEU A 28 14.085 14.036 -8.608 1.00 0.00 N ATOM 185 CA LEU A 28 14.038 15.508 -8.682 1.00 0.00 C ATOM 186 C LEU A 28 13.168 16.163 -7.589 1.00 0.00 C ATOM 187 O LEU A 28 12.945 17.373 -7.616 1.00 0.00 O ATOM 188 CB LEU A 28 13.583 15.927 -10.096 1.00 0.00 C ATOM 189 CG LEU A 28 12.272 15.260 -10.573 1.00 0.00 C ATOM 190 CD1 LEU A 28 11.281 16.266 -11.163 1.00 0.00 C ATOM 191 CD2 LEU A 28 12.560 14.177 -11.619 1.00 0.00 C ATOM 0 H LEU A 28 13.159 13.618 -8.701 1.00 0.00 H new ATOM 0 HA LEU A 28 15.046 15.876 -8.490 1.00 0.00 H new ATOM 0 HB2 LEU A 28 13.453 17.009 -10.116 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.376 15.688 -10.805 1.00 0.00 H new ATOM 0 HG LEU A 28 11.819 14.814 -9.687 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.379 15.744 -11.482 1.00 0.00 H new ATOM 0 HD12 LEU A 28 11.023 17.008 -10.408 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.734 16.763 -12.020 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.623 13.722 -11.939 1.00 0.00 H new ATOM 0 HD22 LEU A 28 13.058 14.625 -12.479 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.204 13.413 -11.184 1.00 0.00 H new ATOM 203 N GLY A 29 12.636 15.380 -6.644 1.00 0.00 N ATOM 204 CA GLY A 29 11.846 15.859 -5.494 1.00 0.00 C ATOM 205 C GLY A 29 10.376 16.152 -5.811 1.00 0.00 C ATOM 206 O GLY A 29 9.496 15.699 -5.081 1.00 0.00 O ATOM 0 H GLY A 29 12.744 14.366 -6.654 1.00 0.00 H new ATOM 0 HA2 GLY A 29 11.892 15.112 -4.702 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.308 16.766 -5.104 1.00 0.00 H new ATOM 210 N THR A 30 10.107 16.884 -6.902 1.00 0.00 N ATOM 211 CA THR A 30 8.762 17.328 -7.332 1.00 0.00 C ATOM 212 C THR A 30 8.086 16.387 -8.347 1.00 0.00 C ATOM 213 O THR A 30 7.005 16.685 -8.847 1.00 0.00 O ATOM 214 CB THR A 30 8.839 18.802 -7.778 1.00 0.00 C ATOM 215 OG1 THR A 30 7.556 19.385 -7.786 1.00 0.00 O ATOM 216 CG2 THR A 30 9.491 19.030 -9.144 1.00 0.00 C ATOM 0 H THR A 30 10.843 17.197 -7.536 1.00 0.00 H new ATOM 0 HA THR A 30 8.087 17.269 -6.478 1.00 0.00 H new ATOM 0 HB THR A 30 9.486 19.278 -7.041 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.902 18.733 -8.115 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.499 20.096 -9.370 1.00 0.00 H new ATOM 0 HG22 THR A 30 10.514 18.655 -9.126 1.00 0.00 H new ATOM 0 HG23 THR A 30 8.925 18.501 -9.910 1.00 0.00 H new ATOM 224 N GLU A 31 8.671 15.218 -8.634 1.00 0.00 N ATOM 225 CA GLU A 31 8.090 14.239 -9.570 1.00 0.00 C ATOM 226 C GLU A 31 6.701 13.751 -9.111 1.00 0.00 C ATOM 227 O GLU A 31 5.799 13.579 -9.927 1.00 0.00 O ATOM 228 CB GLU A 31 9.053 13.053 -9.748 1.00 0.00 C ATOM 229 CG GLU A 31 8.827 12.304 -11.067 1.00 0.00 C ATOM 230 CD GLU A 31 9.795 11.121 -11.272 1.00 0.00 C ATOM 231 OE1 GLU A 31 10.822 11.015 -10.561 1.00 0.00 O ATOM 232 OE2 GLU A 31 9.523 10.297 -12.176 1.00 0.00 O1- ATOM 0 H GLU A 31 9.558 14.922 -8.227 1.00 0.00 H new ATOM 0 HA GLU A 31 7.949 14.736 -10.530 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.080 13.415 -9.711 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.929 12.361 -8.915 1.00 0.00 H new ATOM 0 HG2 GLU A 31 7.802 11.934 -11.096 1.00 0.00 H new ATOM 0 HG3 GLU A 31 8.937 13.002 -11.897 1.00 0.00 H new ATOM 239 N ASN A 32 6.484 13.602 -7.798 1.00 0.00 N ATOM 240 CA ASN A 32 5.191 13.202 -7.223 1.00 0.00 C ATOM 241 C ASN A 32 4.047 14.221 -7.446 1.00 0.00 C ATOM 242 O ASN A 32 2.884 13.909 -7.194 1.00 0.00 O ATOM 243 CB ASN A 32 5.370 12.865 -5.734 1.00 0.00 C ATOM 244 CG ASN A 32 5.703 14.083 -4.878 1.00 0.00 C ATOM 245 OD1 ASN A 32 4.859 14.925 -4.601 1.00 0.00 O ATOM 246 ND2 ASN A 32 6.944 14.223 -4.452 1.00 0.00 N ATOM 0 H ASN A 32 7.208 13.757 -7.097 1.00 0.00 H new ATOM 0 HA ASN A 32 4.870 12.313 -7.765 1.00 0.00 H new ATOM 0 HB2 ASN A 32 4.455 12.405 -5.360 1.00 0.00 H new ATOM 0 HB3 ASN A 32 6.165 12.126 -5.628 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.202 15.034 -3.890 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.645 13.520 -4.684 1.00 0.00 H new ATOM 253 N LEU A 33 4.338 15.430 -7.939 1.00 0.00 N ATOM 254 CA LEU A 33 3.325 16.436 -8.281 1.00 0.00 C ATOM 255 C LEU A 33 2.687 16.191 -9.669 1.00 0.00 C ATOM 256 O LEU A 33 1.676 16.812 -9.995 1.00 0.00 O ATOM 257 CB LEU A 33 3.963 17.836 -8.120 1.00 0.00 C ATOM 258 CG LEU A 33 3.213 18.748 -7.127 1.00 0.00 C ATOM 259 CD1 LEU A 33 4.087 19.955 -6.760 1.00 0.00 C ATOM 260 CD2 LEU A 33 1.871 19.234 -7.690 1.00 0.00 C ATOM 0 H LEU A 33 5.293 15.741 -8.114 1.00 0.00 H new ATOM 0 HA LEU A 33 2.481 16.361 -7.596 1.00 0.00 H new ATOM 0 HB2 LEU A 33 4.994 17.720 -7.786 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.997 18.324 -9.094 1.00 0.00 H new ATOM 0 HG LEU A 33 3.004 18.156 -6.236 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.550 20.593 -6.059 1.00 0.00 H new ATOM 0 HD12 LEU A 33 5.012 19.608 -6.299 1.00 0.00 H new ATOM 0 HD13 LEU A 33 4.321 20.522 -7.661 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.379 19.873 -6.957 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.044 19.799 -8.606 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.236 18.376 -7.908 1.00 0.00 H new ATOM 272 N TYR A 34 3.224 15.267 -10.479 1.00 0.00 N ATOM 273 CA TYR A 34 2.723 14.955 -11.831 1.00 0.00 C ATOM 274 C TYR A 34 1.474 14.046 -11.834 1.00 0.00 C ATOM 275 O TYR A 34 0.572 14.243 -12.652 1.00 0.00 O ATOM 276 CB TYR A 34 3.848 14.298 -12.654 1.00 0.00 C ATOM 277 CG TYR A 34 4.887 15.245 -13.242 1.00 0.00 C ATOM 278 CD1 TYR A 34 5.624 16.131 -12.427 1.00 0.00 C ATOM 279 CD2 TYR A 34 5.126 15.229 -14.632 1.00 0.00 C ATOM 280 CE1 TYR A 34 6.565 17.011 -12.995 1.00 0.00 C ATOM 281 CE2 TYR A 34 6.073 16.097 -15.206 1.00 0.00 C ATOM 282 CZ TYR A 34 6.791 16.999 -14.390 1.00 0.00 C ATOM 283 OH TYR A 34 7.695 17.850 -14.953 1.00 0.00 O ATOM 0 H TYR A 34 4.032 14.705 -10.211 1.00 0.00 H new ATOM 0 HA TYR A 34 2.416 15.900 -12.279 1.00 0.00 H new ATOM 0 HB2 TYR A 34 4.362 13.576 -12.019 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.393 13.737 -13.471 1.00 0.00 H new ATOM 0 HD1 TYR A 34 5.465 16.134 -11.359 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.577 14.544 -15.261 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.114 17.695 -12.365 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.251 16.074 -16.271 1.00 0.00 H new ATOM 0 HH TYR A 34 7.723 17.704 -15.922 1.00 0.00 H new ATOM 293 N PHE A 35 1.413 13.062 -10.924 1.00 0.00 N ATOM 294 CA PHE A 35 0.303 12.098 -10.786 1.00 0.00 C ATOM 295 C PHE A 35 0.002 11.804 -9.298 1.00 0.00 C ATOM 296 O PHE A 35 -0.398 10.699 -8.940 1.00 0.00 O ATOM 297 CB PHE A 35 0.596 10.829 -11.628 1.00 0.00 C ATOM 298 CG PHE A 35 -0.568 10.253 -12.425 1.00 0.00 C ATOM 299 CD1 PHE A 35 -1.746 9.812 -11.786 1.00 0.00 C ATOM 300 CD2 PHE A 35 -0.445 10.088 -13.820 1.00 0.00 C ATOM 301 CE1 PHE A 35 -2.783 9.221 -12.529 1.00 0.00 C ATOM 302 CE2 PHE A 35 -1.482 9.495 -14.564 1.00 0.00 C ATOM 303 CZ PHE A 35 -2.652 9.060 -13.918 1.00 0.00 C ATOM 0 H PHE A 35 2.155 12.908 -10.242 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.612 12.534 -11.186 1.00 0.00 H new ATOM 0 HB2 PHE A 35 1.403 11.061 -12.323 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.966 10.054 -10.957 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.852 9.929 -10.718 1.00 0.00 H new ATOM 0 HD2 PHE A 35 0.452 10.419 -14.322 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -3.682 8.890 -12.031 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -1.379 9.374 -15.632 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.448 8.603 -14.488 1.00 0.00 H new ATOM 313 N GLN A 36 0.233 12.782 -8.413 1.00 0.00 N ATOM 314 CA GLN A 36 -0.054 12.705 -6.971 1.00 0.00 C ATOM 315 C GLN A 36 0.833 11.644 -6.270 1.00 0.00 C ATOM 316 O GLN A 36 1.853 11.201 -6.804 1.00 0.00 O ATOM 317 CB GLN A 36 -1.576 12.460 -6.773 1.00 0.00 C ATOM 318 CG GLN A 36 -2.212 13.242 -5.608 1.00 0.00 C ATOM 319 CD GLN A 36 -2.833 14.565 -6.071 1.00 0.00 C ATOM 320 OE1 GLN A 36 -4.020 14.657 -6.360 1.00 0.00 O ATOM 321 NE2 GLN A 36 -2.071 15.634 -6.190 1.00 0.00 N ATOM 0 H GLN A 36 0.637 13.677 -8.687 1.00 0.00 H new ATOM 0 HA GLN A 36 0.200 13.651 -6.492 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -2.095 12.724 -7.695 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -1.740 11.395 -6.609 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -2.979 12.628 -5.136 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -1.454 13.443 -4.851 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -1.080 15.582 -5.955 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -2.473 16.513 -6.517 1.00 0.00 H new ATOM 330 N SER A 37 0.428 11.163 -5.089 1.00 0.00 N ATOM 331 CA SER A 37 1.072 10.012 -4.427 1.00 0.00 C ATOM 332 C SER A 37 1.090 8.752 -5.322 1.00 0.00 C ATOM 333 O SER A 37 1.968 7.895 -5.186 1.00 0.00 O ATOM 334 CB SER A 37 0.361 9.734 -3.093 1.00 0.00 C ATOM 335 OG SER A 37 1.149 8.910 -2.247 1.00 0.00 O ATOM 0 H SER A 37 -0.353 11.556 -4.563 1.00 0.00 H new ATOM 0 HA SER A 37 2.115 10.266 -4.239 1.00 0.00 H new ATOM 0 HB2 SER A 37 0.148 10.677 -2.589 1.00 0.00 H new ATOM 0 HB3 SER A 37 -0.597 9.251 -3.284 1.00 0.00 H new ATOM 0 HG SER A 37 0.671 8.752 -1.406 1.00 0.00 H new ATOM 341 N MET A 38 0.189 8.676 -6.316 1.00 0.00 N ATOM 342 CA MET A 38 0.185 7.634 -7.346 1.00 0.00 C ATOM 343 C MET A 38 1.485 7.609 -8.164 1.00 0.00 C ATOM 344 O MET A 38 1.985 6.523 -8.440 1.00 0.00 O ATOM 345 CB MET A 38 -1.057 7.755 -8.250 1.00 0.00 C ATOM 346 CG MET A 38 -1.707 6.383 -8.459 1.00 0.00 C ATOM 347 SD MET A 38 -3.133 6.404 -9.574 1.00 0.00 S ATOM 348 CE MET A 38 -3.678 4.690 -9.353 1.00 0.00 C ATOM 0 H MET A 38 -0.568 9.351 -6.424 1.00 0.00 H new ATOM 0 HA MET A 38 0.132 6.675 -6.830 1.00 0.00 H new ATOM 0 HB2 MET A 38 -1.776 8.439 -7.800 1.00 0.00 H new ATOM 0 HB3 MET A 38 -0.773 8.179 -9.213 1.00 0.00 H new ATOM 0 HG2 MET A 38 -0.960 5.695 -8.855 1.00 0.00 H new ATOM 0 HG3 MET A 38 -2.021 5.990 -7.492 1.00 0.00 H new ATOM 0 HE1 MET A 38 -4.559 4.506 -9.968 1.00 0.00 H new ATOM 0 HE2 MET A 38 -2.878 4.012 -9.653 1.00 0.00 H new ATOM 0 HE3 MET A 38 -3.925 4.519 -8.305 1.00 0.00 H new ATOM 358 N ARG A 39 2.105 8.755 -8.484 1.00 0.00 N ATOM 359 CA ARG A 39 3.440 8.763 -9.113 1.00 0.00 C ATOM 360 C ARG A 39 4.519 8.285 -8.133 1.00 0.00 C ATOM 361 O ARG A 39 5.347 7.455 -8.509 1.00 0.00 O ATOM 362 CB ARG A 39 3.774 10.150 -9.695 1.00 0.00 C ATOM 363 CG ARG A 39 5.175 10.260 -10.333 1.00 0.00 C ATOM 364 CD ARG A 39 5.476 9.234 -11.436 1.00 0.00 C ATOM 365 NE ARG A 39 4.672 9.466 -12.649 1.00 0.00 N ATOM 366 CZ ARG A 39 4.430 8.582 -13.612 1.00 0.00 C ATOM 367 NH1 ARG A 39 4.842 7.332 -13.538 1.00 0.00 N1+ ATOM 368 NH2 ARG A 39 3.766 8.951 -14.685 1.00 0.00 N ATOM 0 H ARG A 39 1.710 9.681 -8.321 1.00 0.00 H new ATOM 0 HA ARG A 39 3.421 8.058 -9.944 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.026 10.404 -10.447 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.692 10.892 -8.901 1.00 0.00 H new ATOM 0 HG2 ARG A 39 5.289 11.261 -10.750 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.923 10.155 -9.547 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.535 9.278 -11.691 1.00 0.00 H new ATOM 0 HD3 ARG A 39 5.280 8.230 -11.059 1.00 0.00 H new ATOM 0 HE ARG A 39 4.262 10.393 -12.760 1.00 0.00 H new ATOM 0 HH11 ARG A 39 5.365 7.015 -12.722 1.00 0.00 H new ATOM 0 HH12 ARG A 39 4.637 6.682 -14.297 1.00 0.00 H new ATOM 0 HH21 ARG A 39 3.438 9.913 -14.776 1.00 0.00 H new ATOM 0 HH22 ARG A 39 3.578 8.276 -15.426 1.00 0.00 H new ATOM 382 N ALA A 40 4.501 8.760 -6.883 1.00 0.00 N ATOM 383 CA ALA A 40 5.484 8.379 -5.861 1.00 0.00 C ATOM 384 C ALA A 40 5.542 6.855 -5.667 1.00 0.00 C ATOM 385 O ALA A 40 6.614 6.262 -5.772 1.00 0.00 O ATOM 386 CB ALA A 40 5.154 9.105 -4.546 1.00 0.00 C ATOM 0 H ALA A 40 3.801 9.423 -6.549 1.00 0.00 H new ATOM 0 HA ALA A 40 6.476 8.683 -6.195 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.881 8.825 -3.784 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.192 10.183 -4.706 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.155 8.822 -4.215 1.00 0.00 H new ATOM 392 N GLN A 41 4.391 6.216 -5.447 1.00 0.00 N ATOM 393 CA GLN A 41 4.296 4.774 -5.198 1.00 0.00 C ATOM 394 C GLN A 41 4.611 3.911 -6.437 1.00 0.00 C ATOM 395 O GLN A 41 5.211 2.846 -6.292 1.00 0.00 O ATOM 396 CB GLN A 41 2.910 4.469 -4.608 1.00 0.00 C ATOM 397 CG GLN A 41 1.781 4.606 -5.643 1.00 0.00 C ATOM 398 CD GLN A 41 0.374 4.645 -5.054 1.00 0.00 C ATOM 399 OE1 GLN A 41 0.148 4.961 -3.898 1.00 0.00 O ATOM 400 NE2 GLN A 41 -0.632 4.295 -5.830 1.00 0.00 N ATOM 0 H GLN A 41 3.488 6.690 -5.436 1.00 0.00 H new ATOM 0 HA GLN A 41 5.068 4.499 -4.479 1.00 0.00 H new ATOM 0 HB2 GLN A 41 2.906 3.457 -4.204 1.00 0.00 H new ATOM 0 HB3 GLN A 41 2.718 5.145 -3.775 1.00 0.00 H new ATOM 0 HG2 GLN A 41 1.944 5.517 -6.219 1.00 0.00 H new ATOM 0 HG3 GLN A 41 1.844 3.772 -6.341 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -0.460 4.028 -6.799 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -1.583 4.291 -5.461 1.00 0.00 H new ATOM 409 N LEU A 42 4.263 4.369 -7.651 1.00 0.00 N ATOM 410 CA LEU A 42 4.619 3.682 -8.900 1.00 0.00 C ATOM 411 C LEU A 42 6.135 3.666 -9.107 1.00 0.00 C ATOM 412 O LEU A 42 6.694 2.634 -9.473 1.00 0.00 O ATOM 413 CB LEU A 42 3.906 4.353 -10.099 1.00 0.00 C ATOM 414 CG LEU A 42 2.617 3.662 -10.598 1.00 0.00 C ATOM 415 CD1 LEU A 42 2.959 2.354 -11.328 1.00 0.00 C ATOM 416 CD2 LEU A 42 1.576 3.385 -9.502 1.00 0.00 C ATOM 0 H LEU A 42 3.727 5.225 -7.792 1.00 0.00 H new ATOM 0 HA LEU A 42 4.284 2.647 -8.831 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.660 5.378 -9.822 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.610 4.407 -10.930 1.00 0.00 H new ATOM 0 HG LEU A 42 2.155 4.374 -11.282 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.041 1.879 -11.673 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.599 2.571 -12.183 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.480 1.682 -10.646 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.705 2.899 -9.942 1.00 0.00 H new ATOM 0 HD22 LEU A 42 2.011 2.734 -8.744 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.273 4.326 -9.042 1.00 0.00 H new ATOM 428 N ILE A 43 6.813 4.787 -8.845 1.00 0.00 N ATOM 429 CA ILE A 43 8.278 4.885 -8.941 1.00 0.00 C ATOM 430 C ILE A 43 8.959 4.087 -7.817 1.00 0.00 C ATOM 431 O ILE A 43 9.812 3.255 -8.124 1.00 0.00 O ATOM 432 CB ILE A 43 8.689 6.376 -9.017 1.00 0.00 C ATOM 433 CG1 ILE A 43 8.144 7.059 -10.297 1.00 0.00 C ATOM 434 CG2 ILE A 43 10.210 6.574 -8.941 1.00 0.00 C ATOM 435 CD1 ILE A 43 8.601 6.468 -11.640 1.00 0.00 C ATOM 0 H ILE A 43 6.363 5.657 -8.559 1.00 0.00 H new ATOM 0 HA ILE A 43 8.632 4.420 -9.861 1.00 0.00 H new ATOM 0 HB ILE A 43 8.240 6.848 -8.143 1.00 0.00 H new ATOM 0 HG12 ILE A 43 7.055 7.026 -10.263 1.00 0.00 H new ATOM 0 HG13 ILE A 43 8.432 8.110 -10.271 1.00 0.00 H new ATOM 0 HG21 ILE A 43 10.442 7.637 -8.999 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.583 6.172 -7.999 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.687 6.053 -9.771 1.00 0.00 H new ATOM 0 HD11 ILE A 43 8.152 7.032 -12.457 1.00 0.00 H new ATOM 0 HD12 ILE A 43 9.687 6.526 -11.712 1.00 0.00 H new ATOM 0 HD13 ILE A 43 8.288 5.426 -11.704 1.00 0.00 H new ATOM 447 N GLU A 44 8.508 4.243 -6.565 1.00 0.00 N ATOM 448 CA GLU A 44 9.018 3.559 -5.361 1.00 0.00 C ATOM 449 C GLU A 44 9.212 2.043 -5.546 1.00 0.00 C ATOM 450 O GLU A 44 10.185 1.491 -5.029 1.00 0.00 O ATOM 451 CB GLU A 44 8.051 3.840 -4.194 1.00 0.00 C ATOM 452 CG GLU A 44 8.361 3.156 -2.852 1.00 0.00 C ATOM 453 CD GLU A 44 9.673 3.612 -2.191 1.00 0.00 C ATOM 454 OE1 GLU A 44 10.293 2.790 -1.475 1.00 0.00 O ATOM 455 OE2 GLU A 44 10.048 4.802 -2.308 1.00 0.00 O1- ATOM 0 H GLU A 44 7.741 4.880 -6.350 1.00 0.00 H new ATOM 0 HA GLU A 44 10.011 3.956 -5.151 1.00 0.00 H new ATOM 0 HB2 GLU A 44 8.025 4.917 -4.027 1.00 0.00 H new ATOM 0 HB3 GLU A 44 7.050 3.541 -4.504 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.537 3.345 -2.164 1.00 0.00 H new ATOM 0 HG3 GLU A 44 8.404 2.078 -3.009 1.00 0.00 H new ATOM 462 N ARG A 45 8.312 1.368 -6.280 1.00 0.00 N ATOM 463 CA ARG A 45 8.435 -0.060 -6.608 1.00 0.00 C ATOM 464 C ARG A 45 8.971 -0.304 -8.028 1.00 0.00 C ATOM 465 O ARG A 45 9.880 -1.117 -8.208 1.00 0.00 O ATOM 466 CB ARG A 45 7.072 -0.733 -6.371 1.00 0.00 C ATOM 467 CG ARG A 45 7.066 -2.270 -6.486 1.00 0.00 C ATOM 468 CD ARG A 45 8.211 -3.001 -5.764 1.00 0.00 C ATOM 469 NE ARG A 45 8.349 -2.612 -4.351 1.00 0.00 N ATOM 470 CZ ARG A 45 9.362 -2.917 -3.548 1.00 0.00 C ATOM 471 NH1 ARG A 45 10.386 -3.641 -3.949 1.00 0.00 N1+ ATOM 472 NH2 ARG A 45 9.349 -2.499 -2.305 1.00 0.00 N ATOM 0 H ARG A 45 7.473 1.802 -6.665 1.00 0.00 H new ATOM 0 HA ARG A 45 9.180 -0.510 -5.952 1.00 0.00 H new ATOM 0 HB2 ARG A 45 6.718 -0.458 -5.377 1.00 0.00 H new ATOM 0 HB3 ARG A 45 6.357 -0.329 -7.087 1.00 0.00 H new ATOM 0 HG2 ARG A 45 6.119 -2.641 -6.094 1.00 0.00 H new ATOM 0 HG3 ARG A 45 7.099 -2.536 -7.542 1.00 0.00 H new ATOM 0 HD2 ARG A 45 8.041 -4.076 -5.823 1.00 0.00 H new ATOM 0 HD3 ARG A 45 9.148 -2.797 -6.283 1.00 0.00 H new ATOM 0 HE ARG A 45 7.594 -2.055 -3.950 1.00 0.00 H new ATOM 0 HH11 ARG A 45 10.420 -3.989 -4.907 1.00 0.00 H new ATOM 0 HH12 ARG A 45 11.145 -3.854 -3.302 1.00 0.00 H new ATOM 0 HH21 ARG A 45 8.565 -1.944 -1.962 1.00 0.00 H new ATOM 0 HH22 ARG A 45 10.123 -2.729 -1.682 1.00 0.00 H new ATOM 486 N GLY A 46 8.456 0.398 -9.042 1.00 0.00 N ATOM 487 CA GLY A 46 8.748 0.130 -10.460 1.00 0.00 C ATOM 488 C GLY A 46 10.139 0.573 -10.914 1.00 0.00 C ATOM 489 O GLY A 46 10.702 -0.033 -11.826 1.00 0.00 O ATOM 0 H GLY A 46 7.816 1.180 -8.903 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.643 -0.939 -10.644 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.001 0.634 -11.074 1.00 0.00 H new ATOM 493 N GLN A 47 10.718 1.598 -10.285 1.00 0.00 N ATOM 494 CA GLN A 47 12.095 2.042 -10.533 1.00 0.00 C ATOM 495 C GLN A 47 13.102 1.317 -9.624 1.00 0.00 C ATOM 496 O GLN A 47 14.250 1.132 -10.021 1.00 0.00 O ATOM 497 CB GLN A 47 12.148 3.571 -10.373 1.00 0.00 C ATOM 498 CG GLN A 47 13.422 4.206 -10.948 1.00 0.00 C ATOM 499 CD GLN A 47 13.363 5.735 -10.894 1.00 0.00 C ATOM 500 OE1 GLN A 47 13.697 6.356 -9.896 1.00 0.00 O ATOM 501 NE2 GLN A 47 12.927 6.406 -11.943 1.00 0.00 N ATOM 0 H GLN A 47 10.237 2.153 -9.577 1.00 0.00 H new ATOM 0 HA GLN A 47 12.388 1.783 -11.550 1.00 0.00 H new ATOM 0 HB2 GLN A 47 11.280 4.010 -10.865 1.00 0.00 H new ATOM 0 HB3 GLN A 47 12.074 3.820 -9.314 1.00 0.00 H new ATOM 0 HG2 GLN A 47 14.289 3.855 -10.388 1.00 0.00 H new ATOM 0 HG3 GLN A 47 13.557 3.883 -11.980 1.00 0.00 H new ATOM 0 HE21 GLN A 47 12.643 5.907 -12.786 1.00 0.00 H new ATOM 0 HE22 GLN A 47 12.874 7.424 -11.911 1.00 0.00 H new ATOM 510 N LEU A 48 12.671 0.835 -8.450 1.00 0.00 N ATOM 511 CA LEU A 48 13.481 -0.034 -7.592 1.00 0.00 C ATOM 512 C LEU A 48 13.676 -1.431 -8.211 1.00 0.00 C ATOM 513 O LEU A 48 14.773 -1.985 -8.134 1.00 0.00 O ATOM 514 CB LEU A 48 12.819 -0.078 -6.203 1.00 0.00 C ATOM 515 CG LEU A 48 13.540 -0.938 -5.146 1.00 0.00 C ATOM 516 CD1 LEU A 48 15.002 -0.526 -4.924 1.00 0.00 C ATOM 517 CD2 LEU A 48 12.778 -0.835 -3.818 1.00 0.00 C ATOM 0 H LEU A 48 11.747 1.039 -8.069 1.00 0.00 H new ATOM 0 HA LEU A 48 14.489 0.369 -7.492 1.00 0.00 H new ATOM 0 HB2 LEU A 48 12.743 0.941 -5.825 1.00 0.00 H new ATOM 0 HB3 LEU A 48 11.802 -0.453 -6.317 1.00 0.00 H new ATOM 0 HG LEU A 48 13.554 -1.962 -5.518 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.451 -1.171 -4.168 1.00 0.00 H new ATOM 0 HD12 LEU A 48 15.554 -0.624 -5.859 1.00 0.00 H new ATOM 0 HD13 LEU A 48 15.041 0.510 -4.587 1.00 0.00 H new ATOM 0 HD21 LEU A 48 13.280 -1.440 -3.063 1.00 0.00 H new ATOM 0 HD22 LEU A 48 12.753 0.205 -3.492 1.00 0.00 H new ATOM 0 HD23 LEU A 48 11.759 -1.197 -3.954 1.00 0.00 H new ATOM 529 N ILE A 49 12.647 -2.000 -8.855 1.00 0.00 N ATOM 530 CA ILE A 49 12.756 -3.282 -9.586 1.00 0.00 C ATOM 531 C ILE A 49 13.574 -3.135 -10.880 1.00 0.00 C ATOM 532 O ILE A 49 14.464 -3.951 -11.131 1.00 0.00 O ATOM 533 CB ILE A 49 11.350 -3.880 -9.848 1.00 0.00 C ATOM 534 CG1 ILE A 49 10.745 -4.365 -8.510 1.00 0.00 C ATOM 535 CG2 ILE A 49 11.402 -5.052 -10.855 1.00 0.00 C ATOM 536 CD1 ILE A 49 9.261 -4.729 -8.602 1.00 0.00 C ATOM 0 H ILE A 49 11.714 -1.589 -8.887 1.00 0.00 H new ATOM 0 HA ILE A 49 13.303 -3.984 -8.957 1.00 0.00 H new ATOM 0 HB ILE A 49 10.725 -3.100 -10.283 1.00 0.00 H new ATOM 0 HG12 ILE A 49 11.303 -5.235 -8.163 1.00 0.00 H new ATOM 0 HG13 ILE A 49 10.873 -3.585 -7.760 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.396 -5.443 -11.011 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.805 -4.699 -11.804 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.041 -5.842 -10.461 1.00 0.00 H new ATOM 0 HD11 ILE A 49 8.906 -5.060 -7.626 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.691 -3.855 -8.918 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.127 -5.531 -9.328 1.00 0.00 H new ATOM 548 N ALA A 50 13.283 -2.116 -11.698 1.00 0.00 N ATOM 549 CA ALA A 50 13.888 -1.925 -13.021 1.00 0.00 C ATOM 550 C ALA A 50 13.911 -0.435 -13.416 1.00 0.00 C ATOM 551 O ALA A 50 14.783 0.296 -12.957 1.00 0.00 O ATOM 552 CB ALA A 50 13.174 -2.852 -14.025 1.00 0.00 C ATOM 0 H ALA A 50 12.610 -1.390 -11.455 1.00 0.00 H new ATOM 0 HA ALA A 50 14.939 -2.212 -13.014 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.612 -2.722 -15.015 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.291 -3.889 -13.709 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.114 -2.601 -14.062 1.00 0.00 H new ATOM 558 N GLU A 51 12.958 0.013 -14.240 1.00 0.00 N ATOM 559 CA GLU A 51 12.708 1.409 -14.630 1.00 0.00 C ATOM 560 C GLU A 51 11.332 1.501 -15.324 1.00 0.00 C ATOM 561 O GLU A 51 11.213 1.263 -16.525 1.00 0.00 O ATOM 562 CB GLU A 51 13.835 2.016 -15.512 1.00 0.00 C ATOM 563 CG GLU A 51 14.970 2.728 -14.738 1.00 0.00 C ATOM 564 CD GLU A 51 15.545 3.958 -15.466 1.00 0.00 C ATOM 565 OE1 GLU A 51 16.749 3.952 -15.834 1.00 0.00 O ATOM 566 OE2 GLU A 51 14.793 4.952 -15.609 1.00 0.00 O1- ATOM 0 H GLU A 51 12.298 -0.628 -14.681 1.00 0.00 H new ATOM 0 HA GLU A 51 12.704 2.012 -13.722 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.272 1.219 -16.113 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.387 2.729 -16.205 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.593 3.038 -13.763 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.775 2.016 -14.557 1.00 0.00 H new ATOM 573 N GLN A 52 10.294 1.845 -14.545 1.00 0.00 N ATOM 574 CA GLN A 52 8.970 2.306 -15.009 1.00 0.00 C ATOM 575 C GLN A 52 8.193 1.256 -15.841 1.00 0.00 C ATOM 576 O GLN A 52 7.654 1.566 -16.908 1.00 0.00 O ATOM 577 CB GLN A 52 9.084 3.679 -15.716 1.00 0.00 C ATOM 578 CG GLN A 52 9.615 4.821 -14.822 1.00 0.00 C ATOM 579 CD GLN A 52 10.979 5.353 -15.274 1.00 0.00 C ATOM 580 OE1 GLN A 52 11.087 6.223 -16.129 1.00 0.00 O ATOM 581 NE2 GLN A 52 12.068 4.848 -14.726 1.00 0.00 N ATOM 0 H GLN A 52 10.355 1.809 -13.527 1.00 0.00 H new ATOM 0 HA GLN A 52 8.356 2.442 -14.119 1.00 0.00 H new ATOM 0 HB2 GLN A 52 9.742 3.575 -16.579 1.00 0.00 H new ATOM 0 HB3 GLN A 52 8.102 3.960 -16.096 1.00 0.00 H new ATOM 0 HG2 GLN A 52 8.895 5.639 -14.822 1.00 0.00 H new ATOM 0 HG3 GLN A 52 9.693 4.464 -13.795 1.00 0.00 H new ATOM 0 HE21 GLN A 52 11.991 4.123 -14.013 1.00 0.00 H new ATOM 0 HE22 GLN A 52 12.987 5.183 -15.016 1.00 0.00 H new ATOM 590 N LEU A 53 8.103 0.012 -15.342 1.00 0.00 N ATOM 591 CA LEU A 53 7.295 -1.058 -15.962 1.00 0.00 C ATOM 592 C LEU A 53 6.657 -2.016 -14.945 1.00 0.00 C ATOM 593 O LEU A 53 5.477 -2.345 -15.082 1.00 0.00 O ATOM 594 CB LEU A 53 8.165 -1.831 -16.977 1.00 0.00 C ATOM 595 CG LEU A 53 7.417 -2.955 -17.732 1.00 0.00 C ATOM 596 CD1 LEU A 53 6.271 -2.417 -18.602 1.00 0.00 C ATOM 597 CD2 LEU A 53 8.397 -3.731 -18.620 1.00 0.00 C ATOM 0 H LEU A 53 8.589 -0.283 -14.495 1.00 0.00 H new ATOM 0 HA LEU A 53 6.460 -0.578 -16.472 1.00 0.00 H new ATOM 0 HB2 LEU A 53 8.567 -1.126 -17.705 1.00 0.00 H new ATOM 0 HB3 LEU A 53 9.015 -2.266 -16.452 1.00 0.00 H new ATOM 0 HG LEU A 53 6.984 -3.611 -16.977 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.779 -3.247 -19.110 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.549 -1.898 -17.972 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.671 -1.724 -19.342 1.00 0.00 H new ATOM 0 HD21 LEU A 53 7.862 -4.521 -19.148 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.849 -3.052 -19.343 1.00 0.00 H new ATOM 0 HD23 LEU A 53 9.178 -4.173 -18.001 1.00 0.00 H new ATOM 609 N ALA A 54 7.418 -2.487 -13.950 1.00 0.00 N ATOM 610 CA ALA A 54 6.952 -3.484 -12.980 1.00 0.00 C ATOM 611 C ALA A 54 5.702 -3.007 -12.194 1.00 0.00 C ATOM 612 O ALA A 54 5.587 -1.805 -11.918 1.00 0.00 O ATOM 613 CB ALA A 54 8.122 -3.851 -12.059 1.00 0.00 C ATOM 0 H ALA A 54 8.380 -2.185 -13.795 1.00 0.00 H new ATOM 0 HA ALA A 54 6.624 -4.377 -13.512 1.00 0.00 H new ATOM 0 HB1 ALA A 54 7.793 -4.592 -11.331 1.00 0.00 H new ATOM 0 HB2 ALA A 54 8.937 -4.263 -12.653 1.00 0.00 H new ATOM 0 HB3 ALA A 54 8.468 -2.959 -11.538 1.00 0.00 H new ATOM 619 N PRO A 55 4.769 -3.920 -11.842 1.00 0.00 N ATOM 620 CA PRO A 55 3.460 -3.571 -11.293 1.00 0.00 C ATOM 621 C PRO A 55 3.559 -2.939 -9.902 1.00 0.00 C ATOM 622 O PRO A 55 4.528 -3.149 -9.173 1.00 0.00 O ATOM 623 CB PRO A 55 2.649 -4.873 -11.271 1.00 0.00 C ATOM 624 CG PRO A 55 3.720 -5.959 -11.193 1.00 0.00 C ATOM 625 CD PRO A 55 4.863 -5.366 -12.012 1.00 0.00 C ATOM 0 HA PRO A 55 2.975 -2.813 -11.908 1.00 0.00 H new ATOM 0 HB2 PRO A 55 1.975 -4.912 -10.415 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.035 -4.978 -12.165 1.00 0.00 H new ATOM 0 HG2 PRO A 55 4.020 -6.158 -10.164 1.00 0.00 H new ATOM 0 HG3 PRO A 55 3.370 -6.903 -11.611 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.827 -5.738 -11.664 1.00 0.00 H new ATOM 0 HD3 PRO A 55 4.775 -5.642 -13.063 1.00 0.00 H new ATOM 633 N LEU A 56 2.531 -2.169 -9.531 1.00 0.00 N ATOM 634 CA LEU A 56 2.484 -1.469 -8.249 1.00 0.00 C ATOM 635 C LEU A 56 2.130 -2.396 -7.076 1.00 0.00 C ATOM 636 O LEU A 56 2.797 -2.329 -6.045 1.00 0.00 O ATOM 637 CB LEU A 56 1.574 -0.225 -8.337 1.00 0.00 C ATOM 638 CG LEU A 56 0.095 -0.438 -8.746 1.00 0.00 C ATOM 639 CD1 LEU A 56 -0.805 0.576 -8.024 1.00 0.00 C ATOM 640 CD2 LEU A 56 -0.110 -0.300 -10.263 1.00 0.00 C ATOM 0 H LEU A 56 1.708 -2.015 -10.114 1.00 0.00 H new ATOM 0 HA LEU A 56 3.492 -1.115 -8.031 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.585 0.267 -7.364 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.022 0.468 -9.050 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.174 -1.454 -8.456 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.842 0.417 -8.319 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.710 0.444 -6.946 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.502 1.588 -8.294 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -1.161 -0.457 -10.504 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.190 0.698 -10.581 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.496 -1.043 -10.781 1.00 0.00 H new ATOM 652 N ALA A 57 1.117 -3.262 -7.223 1.00 0.00 N ATOM 653 CA ALA A 57 0.608 -4.101 -6.132 1.00 0.00 C ATOM 654 C ALA A 57 0.992 -5.578 -6.254 1.00 0.00 C ATOM 655 O ALA A 57 1.399 -6.163 -5.256 1.00 0.00 O ATOM 656 CB ALA A 57 -0.915 -3.932 -6.040 1.00 0.00 C ATOM 0 H ALA A 57 0.626 -3.400 -8.107 1.00 0.00 H new ATOM 0 HA ALA A 57 1.083 -3.760 -5.212 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -1.302 -4.552 -5.231 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -1.154 -2.887 -5.842 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -1.372 -4.236 -6.981 1.00 0.00 H new ATOM 662 N ALA A 58 0.896 -6.186 -7.442 1.00 0.00 N ATOM 663 CA ALA A 58 1.066 -7.636 -7.621 1.00 0.00 C ATOM 664 C ALA A 58 2.411 -8.160 -7.076 1.00 0.00 C ATOM 665 O ALA A 58 2.434 -9.089 -6.265 1.00 0.00 O ATOM 666 CB ALA A 58 0.873 -7.968 -9.111 1.00 0.00 C ATOM 0 H ALA A 58 0.698 -5.687 -8.309 1.00 0.00 H new ATOM 0 HA ALA A 58 0.310 -8.152 -7.029 1.00 0.00 H new ATOM 0 HB1 ALA A 58 0.995 -9.040 -9.264 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -0.127 -7.669 -9.424 1.00 0.00 H new ATOM 0 HB3 ALA A 58 1.614 -7.430 -9.703 1.00 0.00 H new ATOM 672 N THR A 59 3.522 -7.523 -7.474 1.00 0.00 N ATOM 673 CA THR A 59 4.883 -7.864 -7.018 1.00 0.00 C ATOM 674 C THR A 59 5.146 -7.436 -5.576 1.00 0.00 C ATOM 675 O THR A 59 5.829 -8.155 -4.853 1.00 0.00 O ATOM 676 CB THR A 59 5.926 -7.294 -7.987 1.00 0.00 C ATOM 677 OG1 THR A 59 7.188 -7.824 -7.650 1.00 0.00 O ATOM 678 CG2 THR A 59 6.018 -5.769 -7.949 1.00 0.00 C ATOM 0 H THR A 59 3.503 -6.744 -8.132 1.00 0.00 H new ATOM 0 HA THR A 59 4.969 -8.951 -7.022 1.00 0.00 H new ATOM 0 HB THR A 59 5.617 -7.575 -8.994 1.00 0.00 H new ATOM 0 HG1 THR A 59 7.802 -7.712 -8.406 1.00 0.00 H new ATOM 0 HG21 THR A 59 6.774 -5.432 -8.658 1.00 0.00 H new ATOM 0 HG22 THR A 59 5.053 -5.339 -8.217 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.293 -5.446 -6.945 1.00 0.00 H new ATOM 686 N ALA A 60 4.586 -6.304 -5.137 1.00 0.00 N ATOM 687 CA ALA A 60 4.738 -5.783 -3.777 1.00 0.00 C ATOM 688 C ALA A 60 4.033 -6.664 -2.734 1.00 0.00 C ATOM 689 O ALA A 60 4.574 -6.884 -1.651 1.00 0.00 O ATOM 690 CB ALA A 60 4.204 -4.347 -3.746 1.00 0.00 C ATOM 0 H ALA A 60 4.003 -5.713 -5.730 1.00 0.00 H new ATOM 0 HA ALA A 60 5.795 -5.792 -3.510 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.309 -3.941 -2.740 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.771 -3.733 -4.446 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.152 -4.344 -4.031 1.00 0.00 H new ATOM 696 N LEU A 61 2.855 -7.200 -3.066 1.00 0.00 N ATOM 697 CA LEU A 61 2.095 -8.130 -2.229 1.00 0.00 C ATOM 698 C LEU A 61 2.776 -9.506 -2.225 1.00 0.00 C ATOM 699 O LEU A 61 2.959 -10.080 -1.155 1.00 0.00 O ATOM 700 CB LEU A 61 0.636 -8.162 -2.743 1.00 0.00 C ATOM 701 CG LEU A 61 -0.466 -8.623 -1.764 1.00 0.00 C ATOM 702 CD1 LEU A 61 -0.316 -10.075 -1.298 1.00 0.00 C ATOM 703 CD2 LEU A 61 -0.584 -7.696 -0.544 1.00 0.00 C ATOM 0 H LEU A 61 2.391 -6.992 -3.950 1.00 0.00 H new ATOM 0 HA LEU A 61 2.072 -7.805 -1.189 1.00 0.00 H new ATOM 0 HB2 LEU A 61 0.380 -7.159 -3.086 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.603 -8.815 -3.615 1.00 0.00 H new ATOM 0 HG LEU A 61 -1.386 -8.566 -2.345 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.127 -10.323 -0.613 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -0.353 -10.740 -2.161 1.00 0.00 H new ATOM 0 HD13 LEU A 61 0.639 -10.196 -0.788 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -1.372 -8.061 0.115 1.00 0.00 H new ATOM 0 HD22 LEU A 61 0.363 -7.682 -0.005 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -0.827 -6.687 -0.876 1.00 0.00 H new ATOM 715 N ALA A 62 3.241 -9.997 -3.381 1.00 0.00 N ATOM 716 CA ALA A 62 3.966 -11.270 -3.492 1.00 0.00 C ATOM 717 C ALA A 62 5.232 -11.328 -2.611 1.00 0.00 C ATOM 718 O ALA A 62 5.470 -12.346 -1.955 1.00 0.00 O ATOM 719 CB ALA A 62 4.296 -11.514 -4.971 1.00 0.00 C ATOM 0 H ALA A 62 3.124 -9.518 -4.274 1.00 0.00 H new ATOM 0 HA ALA A 62 3.323 -12.065 -3.115 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.835 -12.456 -5.073 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.372 -11.561 -5.547 1.00 0.00 H new ATOM 0 HB3 ALA A 62 4.916 -10.699 -5.345 1.00 0.00 H new ATOM 725 N ARG A 63 6.013 -10.238 -2.552 1.00 0.00 N ATOM 726 CA ARG A 63 7.173 -10.104 -1.650 1.00 0.00 C ATOM 727 C ARG A 63 6.811 -9.620 -0.230 1.00 0.00 C ATOM 728 O ARG A 63 7.632 -9.725 0.680 1.00 0.00 O ATOM 729 CB ARG A 63 8.232 -9.197 -2.300 1.00 0.00 C ATOM 730 CG ARG A 63 7.835 -7.714 -2.298 1.00 0.00 C ATOM 731 CD ARG A 63 8.835 -6.823 -3.038 1.00 0.00 C ATOM 732 NE ARG A 63 8.876 -7.126 -4.481 1.00 0.00 N ATOM 733 CZ ARG A 63 9.960 -7.172 -5.247 1.00 0.00 C ATOM 734 NH1 ARG A 63 11.169 -6.942 -4.775 1.00 0.00 N1+ ATOM 735 NH2 ARG A 63 9.837 -7.449 -6.522 1.00 0.00 N ATOM 0 H ARG A 63 5.857 -9.415 -3.134 1.00 0.00 H new ATOM 0 HA ARG A 63 7.582 -11.104 -1.510 1.00 0.00 H new ATOM 0 HB2 ARG A 63 9.178 -9.315 -1.771 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.399 -9.521 -3.327 1.00 0.00 H new ATOM 0 HG2 ARG A 63 6.853 -7.607 -2.758 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.744 -7.370 -1.268 1.00 0.00 H new ATOM 0 HD2 ARG A 63 8.565 -5.777 -2.894 1.00 0.00 H new ATOM 0 HD3 ARG A 63 9.828 -6.958 -2.610 1.00 0.00 H new ATOM 0 HE ARG A 63 7.984 -7.319 -4.936 1.00 0.00 H new ATOM 0 HH11 ARG A 63 11.297 -6.719 -3.788 1.00 0.00 H new ATOM 0 HH12 ARG A 63 11.976 -6.987 -5.397 1.00 0.00 H new ATOM 0 HH21 ARG A 63 8.914 -7.627 -6.918 1.00 0.00 H new ATOM 0 HH22 ARG A 63 10.664 -7.486 -7.118 1.00 0.00 H new ATOM 749 N LYS A 64 5.599 -9.081 -0.043 1.00 0.00 N ATOM 750 CA LYS A 64 5.018 -8.591 1.222 1.00 0.00 C ATOM 751 C LYS A 64 5.631 -7.250 1.711 1.00 0.00 C ATOM 752 O LYS A 64 5.717 -6.986 2.913 1.00 0.00 O ATOM 753 CB LYS A 64 5.021 -9.732 2.274 1.00 0.00 C ATOM 754 CG LYS A 64 3.769 -9.787 3.171 1.00 0.00 C ATOM 755 CD LYS A 64 2.448 -10.132 2.449 1.00 0.00 C ATOM 756 CE LYS A 64 2.482 -11.395 1.570 1.00 0.00 C ATOM 757 NZ LYS A 64 2.682 -12.647 2.348 1.00 0.00 N1+ ATOM 0 H LYS A 64 4.951 -8.966 -0.823 1.00 0.00 H new ATOM 0 HA LYS A 64 3.977 -8.322 1.044 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.121 -10.685 1.755 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.900 -9.620 2.908 1.00 0.00 H new ATOM 0 HG2 LYS A 64 3.938 -10.525 3.955 1.00 0.00 H new ATOM 0 HG3 LYS A 64 3.653 -8.821 3.662 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.666 -10.253 3.198 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.163 -9.284 1.826 1.00 0.00 H new ATOM 0 HE2 LYS A 64 1.548 -11.467 1.013 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.284 -11.298 0.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.696 -13.460 1.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.586 -12.597 2.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.904 -12.760 3.029 1.00 0.00 H new ATOM 771 N ASP A 65 6.061 -6.383 0.784 1.00 0.00 N ATOM 772 CA ASP A 65 6.705 -5.084 1.057 1.00 0.00 C ATOM 773 C ASP A 65 5.676 -4.006 1.457 1.00 0.00 C ATOM 774 O ASP A 65 5.325 -3.105 0.686 1.00 0.00 O ATOM 775 CB ASP A 65 7.597 -4.642 -0.125 1.00 0.00 C ATOM 776 CG ASP A 65 9.087 -4.975 0.077 1.00 0.00 C ATOM 777 OD1 ASP A 65 9.435 -6.166 0.231 1.00 0.00 O ATOM 778 OD2 ASP A 65 9.908 -4.029 0.041 1.00 0.00 O1- ATOM 0 H ASP A 65 5.968 -6.571 -0.214 1.00 0.00 H new ATOM 0 HA ASP A 65 7.361 -5.214 1.918 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.245 -5.124 -1.037 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.489 -3.567 -0.270 1.00 0.00 H new ATOM 783 N THR A 66 5.238 -4.081 2.721 1.00 0.00 N ATOM 784 CA THR A 66 4.325 -3.127 3.381 1.00 0.00 C ATOM 785 C THR A 66 4.776 -1.667 3.262 1.00 0.00 C ATOM 786 O THR A 66 3.929 -0.784 3.267 1.00 0.00 O ATOM 787 CB THR A 66 4.073 -3.564 4.831 1.00 0.00 C ATOM 788 OG1 THR A 66 3.381 -4.794 4.793 1.00 0.00 O ATOM 789 CG2 THR A 66 3.176 -2.607 5.610 1.00 0.00 C ATOM 0 H THR A 66 5.520 -4.840 3.342 1.00 0.00 H new ATOM 0 HA THR A 66 3.375 -3.155 2.848 1.00 0.00 H new ATOM 0 HB THR A 66 5.046 -3.607 5.321 1.00 0.00 H new ATOM 0 HG1 THR A 66 3.067 -5.021 5.693 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.042 -2.979 6.626 1.00 0.00 H new ATOM 0 HG22 THR A 66 3.639 -1.621 5.643 1.00 0.00 H new ATOM 0 HG23 THR A 66 2.206 -2.536 5.118 1.00 0.00 H new ATOM 797 N ALA A 67 6.069 -1.394 3.049 1.00 0.00 N ATOM 798 CA ALA A 67 6.606 -0.052 2.788 1.00 0.00 C ATOM 799 C ALA A 67 5.896 0.671 1.631 1.00 0.00 C ATOM 800 O ALA A 67 5.521 1.833 1.784 1.00 0.00 O ATOM 801 CB ALA A 67 8.108 -0.175 2.497 1.00 0.00 C ATOM 0 H ALA A 67 6.788 -2.117 3.053 1.00 0.00 H new ATOM 0 HA ALA A 67 6.430 0.556 3.675 1.00 0.00 H new ATOM 0 HB1 ALA A 67 8.523 0.814 2.301 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.611 -0.615 3.358 1.00 0.00 H new ATOM 0 HB3 ALA A 67 8.259 -0.811 1.625 1.00 0.00 H new ATOM 807 N VAL A 68 5.686 -0.007 0.499 1.00 0.00 N ATOM 808 CA VAL A 68 4.931 0.541 -0.648 1.00 0.00 C ATOM 809 C VAL A 68 3.467 0.084 -0.641 1.00 0.00 C ATOM 810 O VAL A 68 2.609 0.829 -1.118 1.00 0.00 O ATOM 811 CB VAL A 68 5.628 0.244 -1.995 1.00 0.00 C ATOM 812 CG1 VAL A 68 5.635 -1.249 -2.352 1.00 0.00 C ATOM 813 CG2 VAL A 68 5.009 1.059 -3.141 1.00 0.00 C ATOM 0 H VAL A 68 6.033 -0.954 0.345 1.00 0.00 H new ATOM 0 HA VAL A 68 4.922 1.625 -0.533 1.00 0.00 H new ATOM 0 HB VAL A 68 6.666 0.550 -1.864 1.00 0.00 H new ATOM 0 HG11 VAL A 68 6.138 -1.392 -3.308 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.162 -1.806 -1.577 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.609 -1.611 -2.424 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.524 0.825 -4.073 1.00 0.00 H new ATOM 0 HG22 VAL A 68 3.953 0.808 -3.237 1.00 0.00 H new ATOM 0 HG23 VAL A 68 5.111 2.123 -2.927 1.00 0.00 H new ATOM 823 N LEU A 69 3.157 -1.079 -0.041 1.00 0.00 N ATOM 824 CA LEU A 69 1.775 -1.530 0.138 1.00 0.00 C ATOM 825 C LEU A 69 0.957 -0.495 0.928 1.00 0.00 C ATOM 826 O LEU A 69 -0.164 -0.188 0.548 1.00 0.00 O ATOM 827 CB LEU A 69 1.726 -2.938 0.772 1.00 0.00 C ATOM 828 CG LEU A 69 0.888 -3.977 -0.003 1.00 0.00 C ATOM 829 CD1 LEU A 69 -0.512 -3.475 -0.390 1.00 0.00 C ATOM 830 CD2 LEU A 69 1.652 -4.451 -1.245 1.00 0.00 C ATOM 0 H LEU A 69 3.855 -1.725 0.329 1.00 0.00 H new ATOM 0 HA LEU A 69 1.310 -1.615 -0.844 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.745 -3.313 0.865 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.325 -2.851 1.782 1.00 0.00 H new ATOM 0 HG LEU A 69 0.730 -4.815 0.676 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.043 -4.258 -0.932 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.068 -3.217 0.511 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.420 -2.594 -1.025 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.051 -5.184 -1.784 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.855 -3.599 -1.895 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.594 -4.907 -0.941 1.00 0.00 H new ATOM 842 N ASN A 70 1.563 0.141 1.935 1.00 0.00 N ATOM 843 CA ASN A 70 1.032 1.289 2.677 1.00 0.00 C ATOM 844 C ASN A 70 0.483 2.400 1.760 1.00 0.00 C ATOM 845 O ASN A 70 -0.676 2.800 1.894 1.00 0.00 O ATOM 846 CB ASN A 70 2.169 1.813 3.576 1.00 0.00 C ATOM 847 CG ASN A 70 1.821 3.092 4.325 1.00 0.00 C ATOM 848 OD1 ASN A 70 1.346 3.053 5.445 1.00 0.00 O ATOM 849 ND2 ASN A 70 2.039 4.258 3.740 1.00 0.00 N ATOM 0 H ASN A 70 2.483 -0.145 2.272 1.00 0.00 H new ATOM 0 HA ASN A 70 0.177 0.969 3.272 1.00 0.00 H new ATOM 0 HB2 ASN A 70 2.434 1.041 4.298 1.00 0.00 H new ATOM 0 HB3 ASN A 70 3.052 1.991 2.962 1.00 0.00 H new ATOM 0 HD21 ASN A 70 1.809 5.124 4.227 1.00 0.00 H new ATOM 0 HD22 ASN A 70 2.437 4.291 2.801 1.00 0.00 H new ATOM 856 N ARG A 71 1.307 2.895 0.824 1.00 0.00 N ATOM 857 CA ARG A 71 0.934 3.981 -0.094 1.00 0.00 C ATOM 858 C ARG A 71 -0.135 3.530 -1.092 1.00 0.00 C ATOM 859 O ARG A 71 -1.202 4.140 -1.151 1.00 0.00 O ATOM 860 CB ARG A 71 2.175 4.519 -0.824 1.00 0.00 C ATOM 861 CG ARG A 71 2.928 5.597 -0.024 1.00 0.00 C ATOM 862 CD ARG A 71 4.445 5.376 0.011 1.00 0.00 C ATOM 863 NE ARG A 71 4.847 4.579 1.184 1.00 0.00 N ATOM 864 CZ ARG A 71 5.081 5.041 2.407 1.00 0.00 C ATOM 865 NH1 ARG A 71 4.930 6.310 2.724 1.00 0.00 N1+ ATOM 866 NH2 ARG A 71 5.464 4.199 3.336 1.00 0.00 N ATOM 0 H ARG A 71 2.257 2.551 0.682 1.00 0.00 H new ATOM 0 HA ARG A 71 0.506 4.788 0.500 1.00 0.00 H new ATOM 0 HB2 ARG A 71 2.853 3.691 -1.034 1.00 0.00 H new ATOM 0 HB3 ARG A 71 1.872 4.934 -1.785 1.00 0.00 H new ATOM 0 HG2 ARG A 71 2.720 6.574 -0.459 1.00 0.00 H new ATOM 0 HG3 ARG A 71 2.547 5.615 0.997 1.00 0.00 H new ATOM 0 HD2 ARG A 71 4.761 4.869 -0.901 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.954 6.340 0.033 1.00 0.00 H new ATOM 0 HE ARG A 71 4.956 3.575 1.043 1.00 0.00 H new ATOM 0 HH11 ARG A 71 4.623 6.979 2.018 1.00 0.00 H new ATOM 0 HH12 ARG A 71 5.120 6.624 3.676 1.00 0.00 H new ATOM 0 HH21 ARG A 71 5.577 3.210 3.113 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.649 4.533 4.282 1.00 0.00 H new ATOM 880 N ILE A 72 0.097 2.426 -1.817 1.00 0.00 N ATOM 881 CA ILE A 72 -0.866 1.939 -2.827 1.00 0.00 C ATOM 882 C ILE A 72 -2.200 1.547 -2.191 1.00 0.00 C ATOM 883 O ILE A 72 -3.238 1.766 -2.806 1.00 0.00 O ATOM 884 CB ILE A 72 -0.296 0.810 -3.721 1.00 0.00 C ATOM 885 CG1 ILE A 72 -0.196 -0.518 -2.953 1.00 0.00 C ATOM 886 CG2 ILE A 72 1.038 1.225 -4.368 1.00 0.00 C ATOM 887 CD1 ILE A 72 0.587 -1.605 -3.687 1.00 0.00 C ATOM 0 H ILE A 72 0.936 1.854 -1.727 1.00 0.00 H new ATOM 0 HA ILE A 72 -1.054 2.779 -3.496 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.997 0.642 -4.538 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.277 -0.333 -1.989 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.202 -0.884 -2.750 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.410 0.410 -4.989 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.883 2.110 -4.985 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.766 1.449 -3.589 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.611 -2.509 -3.079 1.00 0.00 H new ATOM 0 HD12 ILE A 72 0.104 -1.821 -4.640 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.606 -1.261 -3.867 1.00 0.00 H new ATOM 899 N ALA A 73 -2.219 1.058 -0.949 1.00 0.00 N ATOM 900 CA ALA A 73 -3.467 0.745 -0.266 1.00 0.00 C ATOM 901 C ALA A 73 -4.304 1.989 0.059 1.00 0.00 C ATOM 902 O ALA A 73 -5.528 1.941 0.002 1.00 0.00 O ATOM 903 CB ALA A 73 -3.186 -0.088 0.987 1.00 0.00 C ATOM 0 H ALA A 73 -1.381 0.872 -0.399 1.00 0.00 H new ATOM 0 HA ALA A 73 -4.073 0.155 -0.954 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -4.125 -0.317 1.490 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.691 -1.017 0.703 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -2.541 0.475 1.661 1.00 0.00 H new ATOM 909 N ASN A 74 -3.649 3.118 0.329 1.00 0.00 N ATOM 910 CA ASN A 74 -4.297 4.411 0.549 1.00 0.00 C ATOM 911 C ASN A 74 -4.689 5.147 -0.754 1.00 0.00 C ATOM 912 O ASN A 74 -5.264 6.234 -0.676 1.00 0.00 O ATOM 913 CB ASN A 74 -3.385 5.263 1.444 1.00 0.00 C ATOM 914 CG ASN A 74 -3.574 4.908 2.912 1.00 0.00 C ATOM 915 OD1 ASN A 74 -4.395 5.494 3.602 1.00 0.00 O ATOM 916 ND2 ASN A 74 -2.824 3.957 3.432 1.00 0.00 N ATOM 0 H ASN A 74 -2.633 3.160 0.402 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.250 4.233 1.048 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -2.344 5.109 1.160 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -3.604 6.320 1.291 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.927 3.707 4.415 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -2.141 3.471 2.851 1.00 0.00 H new ATOM 923 N GLU A 75 -4.415 4.571 -1.934 1.00 0.00 N ATOM 924 CA GLU A 75 -4.774 5.137 -3.245 1.00 0.00 C ATOM 925 C GLU A 75 -5.631 4.166 -4.081 1.00 0.00 C ATOM 926 O GLU A 75 -6.757 4.494 -4.452 1.00 0.00 O ATOM 927 CB GLU A 75 -3.495 5.488 -4.025 1.00 0.00 C ATOM 928 CG GLU A 75 -2.689 6.659 -3.444 1.00 0.00 C ATOM 929 CD GLU A 75 -3.458 7.988 -3.474 1.00 0.00 C ATOM 930 OE1 GLU A 75 -3.568 8.645 -2.414 1.00 0.00 O ATOM 931 OE2 GLU A 75 -3.915 8.398 -4.566 1.00 0.00 O1- ATOM 0 H GLU A 75 -3.927 3.678 -2.006 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.366 6.034 -3.064 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.855 4.607 -4.061 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -3.767 5.727 -5.053 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.413 6.428 -2.415 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -1.762 6.769 -4.006 1.00 0.00 H new ATOM 938 N ALA A 76 -5.112 2.970 -4.378 1.00 0.00 N ATOM 939 CA ALA A 76 -5.757 1.947 -5.202 1.00 0.00 C ATOM 940 C ALA A 76 -6.694 1.041 -4.390 1.00 0.00 C ATOM 941 O ALA A 76 -7.812 0.782 -4.831 1.00 0.00 O ATOM 942 CB ALA A 76 -4.662 1.127 -5.898 1.00 0.00 C ATOM 0 H ALA A 76 -4.196 2.679 -4.037 1.00 0.00 H new ATOM 0 HA ALA A 76 -6.388 2.440 -5.942 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.122 0.358 -6.518 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.058 1.784 -6.524 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.027 0.656 -5.147 1.00 0.00 H new ATOM 948 N LEU A 77 -6.287 0.596 -3.189 1.00 0.00 N ATOM 949 CA LEU A 77 -7.173 -0.195 -2.311 1.00 0.00 C ATOM 950 C LEU A 77 -8.140 0.716 -1.506 1.00 0.00 C ATOM 951 O LEU A 77 -8.940 0.244 -0.703 1.00 0.00 O ATOM 952 CB LEU A 77 -6.403 -1.220 -1.447 1.00 0.00 C ATOM 953 CG LEU A 77 -5.629 -2.376 -2.150 1.00 0.00 C ATOM 954 CD1 LEU A 77 -5.247 -2.183 -3.629 1.00 0.00 C ATOM 955 CD2 LEU A 77 -4.335 -2.732 -1.399 1.00 0.00 C ATOM 0 H LEU A 77 -5.358 0.768 -2.804 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.806 -0.806 -2.954 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -5.686 -0.666 -0.841 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.118 -1.673 -0.760 1.00 0.00 H new ATOM 0 HG LEU A 77 -6.372 -3.173 -2.123 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.714 -3.065 -3.985 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -6.150 -2.040 -4.222 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.606 -1.307 -3.728 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.823 -3.542 -1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.685 -1.858 -1.360 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.578 -3.049 -0.385 1.00 0.00 H new ATOM 967 N ASP A 78 -8.114 2.026 -1.771 1.00 0.00 N ATOM 968 CA ASP A 78 -9.030 3.050 -1.254 1.00 0.00 C ATOM 969 C ASP A 78 -10.293 3.222 -2.136 1.00 0.00 C ATOM 970 O ASP A 78 -11.192 3.996 -1.808 1.00 0.00 O ATOM 971 CB ASP A 78 -8.211 4.355 -1.168 1.00 0.00 C ATOM 972 CG ASP A 78 -8.745 5.373 -0.160 1.00 0.00 C ATOM 973 OD1 ASP A 78 -8.683 6.587 -0.466 1.00 0.00 O ATOM 974 OD2 ASP A 78 -9.132 4.953 0.954 1.00 0.00 O1- ATOM 0 H ASP A 78 -7.409 2.425 -2.391 1.00 0.00 H new ATOM 0 HA ASP A 78 -9.414 2.757 -0.277 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.183 4.107 -0.905 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -8.185 4.818 -2.154 1.00 0.00 H new ATOM 979 N GLN A 79 -10.350 2.513 -3.271 1.00 0.00 N ATOM 980 CA GLN A 79 -11.385 2.603 -4.311 1.00 0.00 C ATOM 981 C GLN A 79 -12.657 1.777 -3.987 1.00 0.00 C ATOM 982 O GLN A 79 -12.598 0.847 -3.175 1.00 0.00 O ATOM 983 CB GLN A 79 -10.771 2.094 -5.628 1.00 0.00 C ATOM 984 CG GLN A 79 -9.677 3.003 -6.214 1.00 0.00 C ATOM 985 CD GLN A 79 -8.968 2.443 -7.454 1.00 0.00 C ATOM 986 OE1 GLN A 79 -8.045 3.053 -7.979 1.00 0.00 O ATOM 987 NE2 GLN A 79 -9.347 1.302 -7.997 1.00 0.00 N ATOM 0 H GLN A 79 -9.636 1.823 -3.502 1.00 0.00 H new ATOM 0 HA GLN A 79 -11.703 3.643 -4.380 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.350 1.103 -5.459 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -11.566 1.981 -6.365 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.123 3.964 -6.471 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.931 3.194 -5.442 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -10.113 0.770 -7.584 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -8.874 0.952 -8.830 1.00 0.00 H new ATOM 996 N PRO A 80 -13.806 2.048 -4.650 1.00 0.00 N ATOM 997 CA PRO A 80 -15.066 1.340 -4.395 1.00 0.00 C ATOM 998 C PRO A 80 -15.107 -0.118 -4.893 1.00 0.00 C ATOM 999 O PRO A 80 -16.015 -0.852 -4.511 1.00 0.00 O ATOM 1000 CB PRO A 80 -16.153 2.192 -5.063 1.00 0.00 C ATOM 1001 CG PRO A 80 -15.411 2.879 -6.206 1.00 0.00 C ATOM 1002 CD PRO A 80 -14.046 3.150 -5.578 1.00 0.00 C ATOM 0 HA PRO A 80 -15.208 1.234 -3.320 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -16.976 1.578 -5.430 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -16.580 2.916 -4.369 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -15.336 2.241 -7.086 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -15.906 3.798 -6.520 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -13.268 3.196 -6.340 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -14.039 4.108 -5.057 1.00 0.00 H new ATOM 1010 N ASP A 81 -14.148 -0.575 -5.710 1.00 0.00 N ATOM 1011 CA ASP A 81 -14.056 -1.965 -6.197 1.00 0.00 C ATOM 1012 C ASP A 81 -13.376 -2.933 -5.196 1.00 0.00 C ATOM 1013 O ASP A 81 -13.183 -4.112 -5.496 1.00 0.00 O ATOM 1014 CB ASP A 81 -13.356 -1.971 -7.570 1.00 0.00 C ATOM 1015 CG ASP A 81 -11.861 -1.615 -7.497 1.00 0.00 C ATOM 1016 OD1 ASP A 81 -11.550 -0.434 -7.220 1.00 0.00 O ATOM 1017 OD2 ASP A 81 -11.014 -2.506 -7.740 1.00 0.00 O1- ATOM 0 H ASP A 81 -13.398 0.021 -6.060 1.00 0.00 H new ATOM 0 HA ASP A 81 -15.071 -2.348 -6.301 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.465 -2.958 -8.020 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -13.859 -1.263 -8.229 1.00 0.00 H new ATOM 1022 N VAL A 82 -13.006 -2.432 -4.015 1.00 0.00 N ATOM 1023 CA VAL A 82 -12.159 -3.103 -3.007 1.00 0.00 C ATOM 1024 C VAL A 82 -13.000 -3.696 -1.867 1.00 0.00 C ATOM 1025 O VAL A 82 -14.026 -3.127 -1.488 1.00 0.00 O ATOM 1026 CB VAL A 82 -11.123 -2.109 -2.434 1.00 0.00 C ATOM 1027 CG1 VAL A 82 -10.163 -2.803 -1.450 1.00 0.00 C ATOM 1028 CG2 VAL A 82 -10.304 -1.449 -3.560 1.00 0.00 C ATOM 0 H VAL A 82 -13.299 -1.503 -3.714 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.640 -3.923 -3.504 1.00 0.00 H new ATOM 0 HB VAL A 82 -11.683 -1.341 -1.900 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -9.448 -2.076 -1.066 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -10.733 -3.224 -0.622 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.628 -3.601 -1.965 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.584 -0.755 -3.127 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.774 -2.217 -4.123 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.974 -0.907 -4.227 1.00 0.00 H new ATOM 1038 N ARG A 83 -12.552 -4.832 -1.308 1.00 0.00 N ATOM 1039 CA ARG A 83 -13.277 -5.584 -0.273 1.00 0.00 C ATOM 1040 C ARG A 83 -12.814 -5.201 1.149 1.00 0.00 C ATOM 1041 O ARG A 83 -13.653 -4.754 1.931 1.00 0.00 O ATOM 1042 CB ARG A 83 -13.162 -7.101 -0.521 1.00 0.00 C ATOM 1043 CG ARG A 83 -13.459 -7.571 -1.960 1.00 0.00 C ATOM 1044 CD ARG A 83 -14.947 -7.581 -2.322 1.00 0.00 C ATOM 1045 NE ARG A 83 -15.603 -8.810 -1.840 1.00 0.00 N ATOM 1046 CZ ARG A 83 -16.778 -9.279 -2.242 1.00 0.00 C ATOM 1047 NH1 ARG A 83 -17.564 -8.597 -3.050 1.00 0.00 N1+ ATOM 1048 NH2 ARG A 83 -17.182 -10.463 -1.835 1.00 0.00 N ATOM 0 H ARG A 83 -11.663 -5.259 -1.567 1.00 0.00 H new ATOM 0 HA ARG A 83 -14.330 -5.311 -0.341 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -12.153 -7.418 -0.257 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.845 -7.614 0.157 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.931 -6.922 -2.659 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -13.057 -8.576 -2.092 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -15.436 -6.710 -1.887 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -15.062 -7.504 -3.403 1.00 0.00 H new ATOM 0 HE ARG A 83 -15.108 -9.351 -1.131 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -17.276 -7.678 -3.387 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -18.461 -8.988 -3.339 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -16.593 -11.017 -1.213 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -18.084 -10.827 -2.141 1.00 0.00 H new ATOM 1062 N ALA A 84 -11.513 -5.314 1.473 1.00 0.00 N ATOM 1063 CA ALA A 84 -10.893 -4.967 2.773 1.00 0.00 C ATOM 1064 C ALA A 84 -9.374 -5.253 2.825 1.00 0.00 C ATOM 1065 O ALA A 84 -8.939 -6.351 2.482 1.00 0.00 O ATOM 1066 CB ALA A 84 -11.581 -5.734 3.919 1.00 0.00 C ATOM 0 H ALA A 84 -10.828 -5.667 0.805 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.030 -3.892 2.891 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.114 -5.468 4.867 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -12.638 -5.471 3.949 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.478 -6.806 3.752 1.00 0.00 H new ATOM 1072 N VAL A 85 -8.574 -4.309 3.337 1.00 0.00 N ATOM 1073 CA VAL A 85 -7.119 -4.469 3.560 1.00 0.00 C ATOM 1074 C VAL A 85 -6.636 -3.728 4.816 1.00 0.00 C ATOM 1075 O VAL A 85 -7.261 -2.756 5.250 1.00 0.00 O ATOM 1076 CB VAL A 85 -6.277 -4.006 2.347 1.00 0.00 C ATOM 1077 CG1 VAL A 85 -6.558 -4.838 1.084 1.00 0.00 C ATOM 1078 CG2 VAL A 85 -6.479 -2.513 2.047 1.00 0.00 C ATOM 0 H VAL A 85 -8.921 -3.391 3.616 1.00 0.00 H new ATOM 0 HA VAL A 85 -6.970 -5.540 3.701 1.00 0.00 H new ATOM 0 HB VAL A 85 -5.236 -4.166 2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.942 -4.472 0.263 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -6.321 -5.884 1.277 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -7.611 -4.748 0.816 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -5.870 -2.229 1.189 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -7.530 -2.325 1.825 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -6.181 -1.924 2.914 1.00 0.00 H new ATOM 1088 N THR A 86 -5.502 -4.170 5.374 1.00 0.00 N ATOM 1089 CA THR A 86 -4.950 -3.715 6.668 1.00 0.00 C ATOM 1090 C THR A 86 -3.474 -4.079 6.767 1.00 0.00 C ATOM 1091 O THR A 86 -3.080 -5.071 6.163 1.00 0.00 O ATOM 1092 CB THR A 86 -5.689 -4.333 7.873 1.00 0.00 C ATOM 1093 OG1 THR A 86 -6.909 -4.939 7.521 1.00 0.00 O ATOM 1094 CG2 THR A 86 -5.998 -3.254 8.907 1.00 0.00 C ATOM 0 H THR A 86 -4.920 -4.878 4.927 1.00 0.00 H new ATOM 0 HA THR A 86 -5.083 -2.634 6.701 1.00 0.00 H new ATOM 0 HB THR A 86 -5.022 -5.097 8.272 1.00 0.00 H new ATOM 0 HG1 THR A 86 -7.620 -4.607 8.108 1.00 0.00 H new ATOM 0 HG21 THR A 86 -6.520 -3.700 9.754 1.00 0.00 H new ATOM 0 HG22 THR A 86 -5.067 -2.803 9.251 1.00 0.00 H new ATOM 0 HG23 THR A 86 -6.628 -2.487 8.456 1.00 0.00 H new ATOM 1102 N PHE A 87 -2.670 -3.317 7.524 1.00 0.00 N ATOM 1103 CA PHE A 87 -1.213 -3.504 7.649 1.00 0.00 C ATOM 1104 C PHE A 87 -0.700 -3.039 9.031 1.00 0.00 C ATOM 1105 O PHE A 87 -0.909 -1.879 9.397 1.00 0.00 O ATOM 1106 CB PHE A 87 -0.496 -2.722 6.523 1.00 0.00 C ATOM 1107 CG PHE A 87 -1.063 -2.905 5.122 1.00 0.00 C ATOM 1108 CD1 PHE A 87 -0.538 -3.877 4.252 1.00 0.00 C ATOM 1109 CD2 PHE A 87 -2.184 -2.152 4.719 1.00 0.00 C ATOM 1110 CE1 PHE A 87 -1.173 -4.131 3.022 1.00 0.00 C ATOM 1111 CE2 PHE A 87 -2.829 -2.420 3.503 1.00 0.00 C ATOM 1112 CZ PHE A 87 -2.332 -3.424 2.659 1.00 0.00 C ATOM 0 H PHE A 87 -3.020 -2.536 8.079 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.993 -4.568 7.556 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -0.524 -1.661 6.770 1.00 0.00 H new ATOM 0 HB3 PHE A 87 0.553 -3.019 6.511 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.350 -4.427 4.527 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -2.551 -1.359 5.354 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -0.767 -4.875 2.352 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.705 -1.856 3.218 1.00 0.00 H new ATOM 0 HZ PHE A 87 -2.838 -3.653 1.733 1.00 0.00 H new ATOM 1122 N LEU A 88 0.003 -3.906 9.780 1.00 0.00 N ATOM 1123 CA LEU A 88 0.518 -3.636 11.138 1.00 0.00 C ATOM 1124 C LEU A 88 1.863 -4.334 11.411 1.00 0.00 C ATOM 1125 O LEU A 88 2.079 -5.478 11.010 1.00 0.00 O ATOM 1126 CB LEU A 88 -0.562 -4.020 12.172 1.00 0.00 C ATOM 1127 CG LEU A 88 -0.170 -3.874 13.665 1.00 0.00 C ATOM 1128 CD1 LEU A 88 -1.270 -3.195 14.487 1.00 0.00 C ATOM 1129 CD2 LEU A 88 0.103 -5.242 14.297 1.00 0.00 C ATOM 0 H LEU A 88 0.237 -4.842 9.449 1.00 0.00 H new ATOM 0 HA LEU A 88 0.728 -2.570 11.225 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.444 -3.406 11.989 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.852 -5.056 11.995 1.00 0.00 H new ATOM 0 HG LEU A 88 0.729 -3.257 13.680 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -0.951 -3.115 15.526 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.460 -2.199 14.088 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -2.183 -3.788 14.433 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.376 -5.111 15.344 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.793 -5.859 14.230 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.921 -5.731 13.767 1.00 0.00 H new ATOM 1141 N ASP A 89 2.760 -3.644 12.123 1.00 0.00 N ATOM 1142 CA ASP A 89 4.087 -4.140 12.521 1.00 0.00 C ATOM 1143 C ASP A 89 4.125 -4.758 13.940 1.00 0.00 C ATOM 1144 O ASP A 89 3.218 -4.552 14.749 1.00 0.00 O ATOM 1145 CB ASP A 89 5.100 -2.983 12.402 1.00 0.00 C ATOM 1146 CG ASP A 89 6.566 -3.431 12.274 1.00 0.00 C ATOM 1147 OD1 ASP A 89 7.443 -2.539 12.328 1.00 0.00 O ATOM 1148 OD2 ASP A 89 6.828 -4.651 12.143 1.00 0.00 O1- ATOM 0 H ASP A 89 2.579 -2.695 12.450 1.00 0.00 H new ATOM 0 HA ASP A 89 4.348 -4.956 11.847 1.00 0.00 H new ATOM 0 HB2 ASP A 89 4.841 -2.378 11.533 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.004 -2.341 13.278 1.00 0.00 H new ATOM 1153 N ALA A 90 5.223 -5.454 14.268 1.00 0.00 N ATOM 1154 CA ALA A 90 5.515 -6.083 15.568 1.00 0.00 C ATOM 1155 C ALA A 90 5.313 -5.143 16.770 1.00 0.00 C ATOM 1156 O ALA A 90 4.874 -5.563 17.842 1.00 0.00 O ATOM 1157 CB ALA A 90 6.984 -6.540 15.545 1.00 0.00 C ATOM 0 H ALA A 90 5.976 -5.603 13.596 1.00 0.00 H new ATOM 0 HA ALA A 90 4.817 -6.910 15.698 1.00 0.00 H new ATOM 0 HB1 ALA A 90 7.233 -7.011 16.496 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.130 -7.256 14.736 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.631 -5.677 15.387 1.00 0.00 H new ATOM 1163 N ARG A 91 5.604 -3.856 16.559 1.00 0.00 N ATOM 1164 CA ARG A 91 5.500 -2.752 17.519 1.00 0.00 C ATOM 1165 C ARG A 91 4.043 -2.371 17.879 1.00 0.00 C ATOM 1166 O ARG A 91 3.833 -1.397 18.600 1.00 0.00 O ATOM 1167 CB ARG A 91 6.322 -1.595 16.912 1.00 0.00 C ATOM 1168 CG ARG A 91 6.572 -0.391 17.832 1.00 0.00 C ATOM 1169 CD ARG A 91 7.672 0.505 17.249 1.00 0.00 C ATOM 1170 NE ARG A 91 7.747 1.787 17.971 1.00 0.00 N ATOM 1171 CZ ARG A 91 7.102 2.908 17.663 1.00 0.00 C ATOM 1172 NH1 ARG A 91 6.340 3.014 16.593 1.00 0.00 N1+ ATOM 1173 NH2 ARG A 91 7.218 3.958 18.446 1.00 0.00 N ATOM 0 H ARG A 91 5.941 -3.536 15.651 1.00 0.00 H new ATOM 0 HA ARG A 91 5.902 -3.041 18.490 1.00 0.00 H new ATOM 0 HB2 ARG A 91 7.287 -1.990 16.593 1.00 0.00 H new ATOM 0 HB3 ARG A 91 5.810 -1.243 16.017 1.00 0.00 H new ATOM 0 HG2 ARG A 91 5.652 0.182 17.951 1.00 0.00 H new ATOM 0 HG3 ARG A 91 6.863 -0.737 18.824 1.00 0.00 H new ATOM 0 HD2 ARG A 91 8.633 -0.007 17.309 1.00 0.00 H new ATOM 0 HD3 ARG A 91 7.474 0.689 16.193 1.00 0.00 H new ATOM 0 HE ARG A 91 8.355 1.818 18.789 1.00 0.00 H new ATOM 0 HH11 ARG A 91 6.228 2.218 15.966 1.00 0.00 H new ATOM 0 HH12 ARG A 91 5.862 3.892 16.392 1.00 0.00 H new ATOM 0 HH21 ARG A 91 7.800 3.909 19.283 1.00 0.00 H new ATOM 0 HH22 ARG A 91 6.726 4.822 18.217 1.00 0.00 H new ATOM 1187 N GLN A 92 3.038 -3.104 17.370 1.00 0.00 N ATOM 1188 CA GLN A 92 1.595 -2.851 17.543 1.00 0.00 C ATOM 1189 C GLN A 92 1.181 -1.543 16.842 1.00 0.00 C ATOM 1190 O GLN A 92 0.295 -0.832 17.310 1.00 0.00 O ATOM 1191 CB GLN A 92 1.169 -2.924 19.033 1.00 0.00 C ATOM 1192 CG GLN A 92 1.153 -4.361 19.582 1.00 0.00 C ATOM 1193 CD GLN A 92 -0.216 -5.015 19.401 1.00 0.00 C ATOM 1194 OE1 GLN A 92 -0.496 -5.676 18.409 1.00 0.00 O ATOM 1195 NE2 GLN A 92 -1.129 -4.825 20.333 1.00 0.00 N ATOM 0 H GLN A 92 3.217 -3.930 16.799 1.00 0.00 H new ATOM 0 HA GLN A 92 1.043 -3.651 17.050 1.00 0.00 H new ATOM 0 HB2 GLN A 92 1.852 -2.320 19.631 1.00 0.00 H new ATOM 0 HB3 GLN A 92 0.176 -2.487 19.144 1.00 0.00 H new ATOM 0 HG2 GLN A 92 1.911 -4.955 19.072 1.00 0.00 H new ATOM 0 HG3 GLN A 92 1.415 -4.350 20.640 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -0.904 -4.276 21.163 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -2.060 -5.227 20.224 1.00 0.00 H new ATOM 1204 N GLU A 93 1.836 -1.211 15.723 1.00 0.00 N ATOM 1205 CA GLU A 93 1.614 0.012 14.950 1.00 0.00 C ATOM 1206 C GLU A 93 0.946 -0.319 13.611 1.00 0.00 C ATOM 1207 O GLU A 93 1.560 -0.951 12.749 1.00 0.00 O ATOM 1208 CB GLU A 93 2.966 0.719 14.754 1.00 0.00 C ATOM 1209 CG GLU A 93 2.899 1.946 13.835 1.00 0.00 C ATOM 1210 CD GLU A 93 4.172 2.792 13.976 1.00 0.00 C ATOM 1211 OE1 GLU A 93 4.075 3.969 14.394 1.00 0.00 O ATOM 1212 OE2 GLU A 93 5.281 2.276 13.704 1.00 0.00 O1- ATOM 0 H GLU A 93 2.558 -1.807 15.319 1.00 0.00 H new ATOM 0 HA GLU A 93 0.941 0.682 15.485 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.348 1.027 15.727 1.00 0.00 H new ATOM 0 HB3 GLU A 93 3.681 0.007 14.341 1.00 0.00 H new ATOM 0 HG2 GLU A 93 2.780 1.626 12.800 1.00 0.00 H new ATOM 0 HG3 GLU A 93 2.025 2.548 14.085 1.00 0.00 H new ATOM 1219 N ARG A 94 -0.297 0.145 13.425 1.00 0.00 N ATOM 1220 CA ARG A 94 -0.977 0.185 12.125 1.00 0.00 C ATOM 1221 C ARG A 94 -0.277 1.218 11.235 1.00 0.00 C ATOM 1222 O ARG A 94 -0.168 2.388 11.610 1.00 0.00 O ATOM 1223 CB ARG A 94 -2.478 0.524 12.295 1.00 0.00 C ATOM 1224 CG ARG A 94 -3.379 -0.726 12.268 1.00 0.00 C ATOM 1225 CD ARG A 94 -4.666 -0.583 13.095 1.00 0.00 C ATOM 1226 NE ARG A 94 -5.589 0.426 12.548 1.00 0.00 N ATOM 1227 CZ ARG A 94 -6.783 0.741 13.032 1.00 0.00 C ATOM 1228 NH1 ARG A 94 -7.228 0.255 14.171 1.00 0.00 N1+ ATOM 1229 NH2 ARG A 94 -7.553 1.563 12.359 1.00 0.00 N ATOM 0 H ARG A 94 -0.868 0.509 14.188 1.00 0.00 H new ATOM 0 HA ARG A 94 -0.921 -0.797 11.655 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -2.622 1.050 13.239 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -2.784 1.204 11.501 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -3.645 -0.948 11.235 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -2.812 -1.579 12.641 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -5.173 -1.547 13.138 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -4.406 -0.314 14.119 1.00 0.00 H new ATOM 0 HE ARG A 94 -5.280 0.931 11.717 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -6.649 -0.387 14.713 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -8.152 0.520 14.512 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -7.231 1.953 11.473 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -8.473 1.812 12.722 1.00 0.00 H new ATOM 1243 N LEU A 95 0.187 0.783 10.063 1.00 0.00 N ATOM 1244 CA LEU A 95 0.747 1.663 9.030 1.00 0.00 C ATOM 1245 C LEU A 95 -0.374 2.183 8.121 1.00 0.00 C ATOM 1246 O LEU A 95 -0.458 3.381 7.847 1.00 0.00 O ATOM 1247 CB LEU A 95 1.825 0.926 8.205 1.00 0.00 C ATOM 1248 CG LEU A 95 3.021 0.381 9.017 1.00 0.00 C ATOM 1249 CD1 LEU A 95 2.804 -1.092 9.392 1.00 0.00 C ATOM 1250 CD2 LEU A 95 4.322 0.499 8.209 1.00 0.00 C ATOM 0 H LEU A 95 0.186 -0.202 9.799 1.00 0.00 H new ATOM 0 HA LEU A 95 1.224 2.513 9.517 1.00 0.00 H new ATOM 0 HB2 LEU A 95 1.353 0.094 7.682 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.205 1.607 7.443 1.00 0.00 H new ATOM 0 HG LEU A 95 3.098 0.977 9.926 1.00 0.00 H new ATOM 0 HD11 LEU A 95 3.660 -1.452 9.963 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.901 -1.185 9.995 1.00 0.00 H new ATOM 0 HD13 LEU A 95 2.697 -1.687 8.485 1.00 0.00 H new ATOM 0 HD21 LEU A 95 5.153 0.110 8.798 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.231 -0.075 7.287 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.507 1.546 7.968 1.00 0.00 H new ATOM 1262 N ALA A 96 -1.263 1.276 7.703 1.00 0.00 N ATOM 1263 CA ALA A 96 -2.317 1.520 6.725 1.00 0.00 C ATOM 1264 C ALA A 96 -3.505 0.568 6.919 1.00 0.00 C ATOM 1265 O ALA A 96 -3.423 -0.446 7.614 1.00 0.00 O ATOM 1266 CB ALA A 96 -1.710 1.392 5.318 1.00 0.00 C ATOM 0 H ALA A 96 -1.264 0.318 8.052 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.714 2.526 6.861 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.483 1.571 4.571 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -0.912 2.125 5.198 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -1.304 0.389 5.187 1.00 0.00 H new ATOM 1272 N HIS A 97 -4.606 0.899 6.253 1.00 0.00 N ATOM 1273 CA HIS A 97 -5.898 0.220 6.300 1.00 0.00 C ATOM 1274 C HIS A 97 -6.866 0.901 5.323 1.00 0.00 C ATOM 1275 O HIS A 97 -6.896 2.131 5.244 1.00 0.00 O ATOM 1276 CB HIS A 97 -6.451 0.197 7.736 1.00 0.00 C ATOM 1277 CG HIS A 97 -6.262 1.470 8.520 1.00 0.00 C ATOM 1278 ND1 HIS A 97 -6.909 2.665 8.326 1.00 0.00 N ATOM 1279 CD2 HIS A 97 -5.366 1.656 9.535 1.00 0.00 C ATOM 1280 CE1 HIS A 97 -6.435 3.544 9.226 1.00 0.00 C ATOM 1281 NE2 HIS A 97 -5.507 2.963 10.010 1.00 0.00 N ATOM 0 H HIS A 97 -4.622 1.702 5.624 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.776 -0.819 5.993 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -7.516 -0.029 7.694 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.973 -0.619 8.279 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -4.669 0.920 9.906 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.754 4.573 9.309 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -5.009 3.390 10.791 1.00 0.00 H new ATOM 1289 N ALA A 98 -7.646 0.109 4.582 1.00 0.00 N ATOM 1290 CA ALA A 98 -8.532 0.573 3.514 1.00 0.00 C ATOM 1291 C ALA A 98 -9.639 -0.453 3.215 1.00 0.00 C ATOM 1292 O ALA A 98 -9.531 -1.637 3.556 1.00 0.00 O ATOM 1293 CB ALA A 98 -7.696 0.946 2.280 1.00 0.00 C ATOM 0 H ALA A 98 -7.678 -0.902 4.714 1.00 0.00 H new ATOM 0 HA ALA A 98 -9.054 1.473 3.839 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.356 1.292 1.484 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.996 1.740 2.541 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -7.142 0.072 1.938 1.00 0.00 H new ATOM 1299 N GLY A 99 -10.729 0.025 2.613 1.00 0.00 N ATOM 1300 CA GLY A 99 -12.006 -0.693 2.527 1.00 0.00 C ATOM 1301 C GLY A 99 -12.929 -0.379 3.721 1.00 0.00 C ATOM 1302 O GLY A 99 -12.461 0.148 4.737 1.00 0.00 O ATOM 0 H GLY A 99 -10.752 0.940 2.162 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.511 -0.425 1.599 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.816 -1.766 2.488 1.00 0.00 H new ATOM 1306 N PRO A 100 -14.236 -0.689 3.609 1.00 0.00 N ATOM 1307 CA PRO A 100 -15.289 -0.139 4.465 1.00 0.00 C ATOM 1308 C PRO A 100 -15.203 -0.549 5.940 1.00 0.00 C ATOM 1309 O PRO A 100 -15.501 0.270 6.806 1.00 0.00 O ATOM 1310 CB PRO A 100 -16.611 -0.600 3.834 1.00 0.00 C ATOM 1311 CG PRO A 100 -16.226 -1.831 3.014 1.00 0.00 C ATOM 1312 CD PRO A 100 -14.824 -1.474 2.533 1.00 0.00 C ATOM 0 HA PRO A 100 -15.191 0.946 4.504 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -17.352 -0.844 4.595 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.045 0.178 3.205 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -16.230 -2.739 3.617 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -16.911 -1.997 2.183 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -14.237 -2.370 2.334 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -14.860 -0.904 1.605 1.00 0.00 H new ATOM 1320 N SER A 101 -14.802 -1.786 6.254 1.00 0.00 N ATOM 1321 CA SER A 101 -14.724 -2.265 7.647 1.00 0.00 C ATOM 1322 C SER A 101 -13.390 -1.934 8.340 1.00 0.00 C ATOM 1323 O SER A 101 -13.342 -1.847 9.570 1.00 0.00 O ATOM 1324 CB SER A 101 -15.001 -3.779 7.704 1.00 0.00 C ATOM 1325 OG SER A 101 -14.233 -4.533 6.768 1.00 0.00 O ATOM 0 H SER A 101 -14.524 -2.480 5.561 1.00 0.00 H new ATOM 0 HA SER A 101 -15.493 -1.727 8.202 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.791 -4.141 8.710 1.00 0.00 H new ATOM 0 HB3 SER A 101 -16.061 -3.954 7.517 1.00 0.00 H new ATOM 0 HG SER A 101 -14.825 -5.132 6.266 1.00 0.00 H new ATOM 1331 N MET A 102 -12.310 -1.733 7.572 1.00 0.00 N ATOM 1332 CA MET A 102 -10.943 -1.567 8.095 1.00 0.00 C ATOM 1333 C MET A 102 -10.531 -0.098 8.266 1.00 0.00 C ATOM 1334 O MET A 102 -9.784 0.217 9.193 1.00 0.00 O ATOM 1335 CB MET A 102 -9.953 -2.299 7.175 1.00 0.00 C ATOM 1336 CG MET A 102 -10.218 -3.806 7.018 1.00 0.00 C ATOM 1337 SD MET A 102 -9.966 -4.865 8.474 1.00 0.00 S ATOM 1338 CE MET A 102 -11.565 -4.754 9.307 1.00 0.00 C ATOM 0 H MET A 102 -12.360 -1.680 6.555 1.00 0.00 H new ATOM 0 HA MET A 102 -10.925 -2.003 9.094 1.00 0.00 H new ATOM 0 HB2 MET A 102 -9.981 -1.834 6.190 1.00 0.00 H new ATOM 0 HB3 MET A 102 -8.945 -2.160 7.564 1.00 0.00 H new ATOM 0 HG2 MET A 102 -11.248 -3.932 6.686 1.00 0.00 H new ATOM 0 HG3 MET A 102 -9.577 -4.178 6.218 1.00 0.00 H new ATOM 0 HE1 MET A 102 -11.758 -5.680 9.849 1.00 0.00 H new ATOM 0 HE2 MET A 102 -11.553 -3.919 10.008 1.00 0.00 H new ATOM 0 HE3 MET A 102 -12.350 -4.596 8.568 1.00 0.00 H new ATOM 1348 N LEU A 103 -11.011 0.804 7.401 1.00 0.00 N ATOM 1349 CA LEU A 103 -10.759 2.248 7.476 1.00 0.00 C ATOM 1350 C LEU A 103 -12.001 2.960 8.034 1.00 0.00 C ATOM 1351 O LEU A 103 -13.055 2.972 7.399 1.00 0.00 O ATOM 1352 CB LEU A 103 -10.352 2.732 6.068 1.00 0.00 C ATOM 1353 CG LEU A 103 -10.094 4.241 5.871 1.00 0.00 C ATOM 1354 CD1 LEU A 103 -8.983 4.798 6.770 1.00 0.00 C ATOM 1355 CD2 LEU A 103 -9.715 4.505 4.407 1.00 0.00 C ATOM 0 H LEU A 103 -11.600 0.543 6.610 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.943 2.484 8.159 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.447 2.197 5.779 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.135 2.433 5.372 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.018 4.749 6.147 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -8.858 5.863 6.576 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.252 4.648 7.816 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.049 4.279 6.558 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -9.532 5.570 4.265 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.813 3.946 4.158 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.530 4.187 3.757 1.00 0.00 H new ATOM 1367 N THR A 104 -11.865 3.590 9.209 1.00 0.00 N ATOM 1368 CA THR A 104 -12.950 4.301 9.920 1.00 0.00 C ATOM 1369 C THR A 104 -13.563 5.428 9.085 1.00 0.00 C ATOM 1370 O THR A 104 -14.767 5.663 9.151 1.00 0.00 O ATOM 1371 CB THR A 104 -12.412 4.844 11.253 1.00 0.00 C ATOM 1372 OG1 THR A 104 -11.711 3.816 11.922 1.00 0.00 O ATOM 1373 CG2 THR A 104 -13.514 5.351 12.184 1.00 0.00 C ATOM 0 H THR A 104 -10.976 3.623 9.709 1.00 0.00 H new ATOM 0 HA THR A 104 -13.752 3.586 10.106 1.00 0.00 H new ATOM 0 HB THR A 104 -11.765 5.687 11.011 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.364 4.157 12.773 1.00 0.00 H new ATOM 0 HG21 THR A 104 -13.069 5.721 13.107 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.060 6.158 11.696 1.00 0.00 H new ATOM 0 HG23 THR A 104 -14.200 4.536 12.413 1.00 0.00 H new ATOM 1381 N VAL A 105 -12.736 6.090 8.275 1.00 0.00 N ATOM 1382 CA VAL A 105 -13.080 7.210 7.375 1.00 0.00 C ATOM 1383 C VAL A 105 -13.106 6.776 5.892 1.00 0.00 C ATOM 1384 O VAL A 105 -12.670 7.518 5.012 1.00 0.00 O ATOM 1385 CB VAL A 105 -12.146 8.427 7.628 1.00 0.00 C ATOM 1386 CG1 VAL A 105 -12.393 9.023 9.024 1.00 0.00 C ATOM 1387 CG2 VAL A 105 -10.653 8.073 7.494 1.00 0.00 C ATOM 0 H VAL A 105 -11.746 5.850 8.221 1.00 0.00 H new ATOM 0 HA VAL A 105 -14.096 7.529 7.608 1.00 0.00 H new ATOM 0 HB VAL A 105 -12.390 9.159 6.858 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -11.729 9.873 9.179 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -13.429 9.353 9.101 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -12.197 8.266 9.783 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -10.050 8.962 7.681 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -10.396 7.300 8.219 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -10.455 7.706 6.487 1.00 0.00 H new ATOM 1397 N ALA A 106 -13.577 5.552 5.602 1.00 0.00 N ATOM 1398 CA ALA A 106 -13.597 4.970 4.252 1.00 0.00 C ATOM 1399 C ALA A 106 -14.306 5.881 3.213 1.00 0.00 C ATOM 1400 O ALA A 106 -15.498 6.169 3.382 1.00 0.00 O ATOM 1401 CB ALA A 106 -14.250 3.581 4.305 1.00 0.00 C ATOM 0 H ALA A 106 -13.961 4.929 6.313 1.00 0.00 H new ATOM 0 HA ALA A 106 -12.565 4.877 3.915 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -14.266 3.148 3.305 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -13.678 2.935 4.971 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -15.271 3.673 4.677 1.00 0.00 H new ATOM 1407 N PRO A 107 -13.614 6.321 2.138 1.00 0.00 N ATOM 1408 CA PRO A 107 -14.139 7.265 1.152 1.00 0.00 C ATOM 1409 C PRO A 107 -14.974 6.553 0.072 1.00 0.00 C ATOM 1410 O PRO A 107 -14.668 6.601 -1.120 1.00 0.00 O ATOM 1411 CB PRO A 107 -12.897 7.971 0.602 1.00 0.00 C ATOM 1412 CG PRO A 107 -11.845 6.873 0.622 1.00 0.00 C ATOM 1413 CD PRO A 107 -12.199 6.078 1.875 1.00 0.00 C ATOM 0 HA PRO A 107 -14.837 7.984 1.582 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -13.063 8.354 -0.405 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -12.607 8.820 1.222 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -11.891 6.254 -0.274 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -10.836 7.282 0.676 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -12.010 5.015 1.726 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -11.588 6.395 2.720 1.00 0.00 H new ATOM 1421 N ALA A 108 -16.041 5.867 0.491 1.00 0.00 N ATOM 1422 CA ALA A 108 -16.947 5.152 -0.408 1.00 0.00 C ATOM 1423 C ALA A 108 -17.666 6.103 -1.391 1.00 0.00 C ATOM 1424 O ALA A 108 -18.096 7.200 -1.018 1.00 0.00 O ATOM 1425 CB ALA A 108 -17.936 4.342 0.441 1.00 0.00 C ATOM 0 H ALA A 108 -16.302 5.793 1.474 1.00 0.00 H new ATOM 0 HA ALA A 108 -16.369 4.473 -1.035 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -18.620 3.802 -0.214 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -17.388 3.631 1.059 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -18.504 5.017 1.081 1.00 0.00 H new ATOM 1431 N GLY A 109 -17.814 5.660 -2.646 1.00 0.00 N ATOM 1432 CA GLY A 109 -18.485 6.397 -3.730 1.00 0.00 C ATOM 1433 C GLY A 109 -17.551 7.178 -4.664 1.00 0.00 C ATOM 1434 O GLY A 109 -18.022 7.712 -5.668 1.00 0.00 O ATOM 0 H GLY A 109 -17.460 4.752 -2.946 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -19.061 5.690 -4.327 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -19.197 7.094 -3.288 1.00 0.00 H new ATOM 1438 N ASP A 110 -16.245 7.225 -4.379 1.00 0.00 N ATOM 1439 CA ASP A 110 -15.221 7.903 -5.189 1.00 0.00 C ATOM 1440 C ASP A 110 -13.909 7.101 -5.237 1.00 0.00 C ATOM 1441 O ASP A 110 -13.536 6.431 -4.272 1.00 0.00 O ATOM 1442 CB ASP A 110 -14.947 9.313 -4.637 1.00 0.00 C ATOM 1443 CG ASP A 110 -16.025 10.323 -5.058 1.00 0.00 C ATOM 1444 OD1 ASP A 110 -15.954 10.815 -6.210 1.00 0.00 O ATOM 1445 OD2 ASP A 110 -16.917 10.644 -4.237 1.00 0.00 O1- ATOM 0 H ASP A 110 -15.856 6.777 -3.549 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.608 7.979 -6.205 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -14.896 9.271 -3.549 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -13.974 9.656 -4.989 1.00 0.00 H new ATOM 1450 N ALA A 111 -13.205 7.192 -6.370 1.00 0.00 N ATOM 1451 CA ALA A 111 -11.889 6.589 -6.583 1.00 0.00 C ATOM 1452 C ALA A 111 -10.767 7.556 -6.139 1.00 0.00 C ATOM 1453 O ALA A 111 -10.602 7.815 -4.948 1.00 0.00 O ATOM 1454 CB ALA A 111 -11.817 6.115 -8.047 1.00 0.00 C ATOM 0 H ALA A 111 -13.546 7.701 -7.185 1.00 0.00 H new ATOM 0 HA ALA A 111 -11.736 5.709 -5.959 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -10.844 5.660 -8.235 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -12.602 5.382 -8.231 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -11.953 6.967 -8.713 1.00 0.00 H new ATOM 1460 N SER A 112 -9.992 8.108 -7.075 1.00 0.00 N ATOM 1461 CA SER A 112 -8.835 8.974 -6.773 1.00 0.00 C ATOM 1462 C SER A 112 -9.227 10.392 -6.294 1.00 0.00 C ATOM 1463 O SER A 112 -8.436 11.077 -5.645 1.00 0.00 O ATOM 1464 CB SER A 112 -7.950 9.039 -8.028 1.00 0.00 C ATOM 1465 OG SER A 112 -6.666 9.575 -7.751 1.00 0.00 O ATOM 0 H SER A 112 -10.145 7.969 -8.074 1.00 0.00 H new ATOM 0 HA SER A 112 -8.292 8.536 -5.936 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.842 8.038 -8.446 1.00 0.00 H new ATOM 0 HB3 SER A 112 -8.441 9.650 -8.786 1.00 0.00 H new ATOM 0 HG SER A 112 -6.136 9.597 -8.575 1.00 0.00 H new ATOM 1471 N HIS A 113 -10.459 10.843 -6.564 1.00 0.00 N ATOM 1472 CA HIS A 113 -10.926 12.203 -6.242 1.00 0.00 C ATOM 1473 C HIS A 113 -10.971 12.530 -4.732 1.00 0.00 C ATOM 1474 O HIS A 113 -10.847 13.702 -4.363 1.00 0.00 O ATOM 1475 CB HIS A 113 -12.315 12.423 -6.873 1.00 0.00 C ATOM 1476 CG HIS A 113 -12.267 13.090 -8.225 1.00 0.00 C ATOM 1477 ND1 HIS A 113 -12.830 14.307 -8.543 1.00 0.00 N ATOM 1478 CD2 HIS A 113 -11.641 12.630 -9.354 1.00 0.00 C ATOM 1479 CE1 HIS A 113 -12.551 14.573 -9.830 1.00 0.00 C ATOM 1480 NE2 HIS A 113 -11.825 13.577 -10.373 1.00 0.00 N ATOM 0 H HIS A 113 -11.170 10.269 -7.017 1.00 0.00 H new ATOM 0 HA HIS A 113 -10.188 12.887 -6.662 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -12.817 11.460 -6.970 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -12.919 13.031 -6.199 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -11.100 11.700 -9.444 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -12.865 15.462 -10.356 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -11.479 13.522 -11.331 1.00 0.00 H new ATOM 1488 N LEU A 114 -11.161 11.529 -3.860 1.00 0.00 N ATOM 1489 CA LEU A 114 -11.305 11.736 -2.411 1.00 0.00 C ATOM 1490 C LEU A 114 -9.951 11.785 -1.683 1.00 0.00 C ATOM 1491 O LEU A 114 -9.746 12.672 -0.856 1.00 0.00 O ATOM 1492 CB LEU A 114 -12.252 10.659 -1.836 1.00 0.00 C ATOM 1493 CG LEU A 114 -13.502 11.193 -1.100 1.00 0.00 C ATOM 1494 CD1 LEU A 114 -13.129 11.885 0.217 1.00 0.00 C ATOM 1495 CD2 LEU A 114 -14.361 12.125 -1.968 1.00 0.00 C ATOM 0 H LEU A 114 -11.219 10.550 -4.140 1.00 0.00 H new ATOM 0 HA LEU A 114 -11.750 12.717 -2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -12.580 10.016 -2.653 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -11.686 10.034 -1.146 1.00 0.00 H new ATOM 0 HG LEU A 114 -14.109 10.316 -0.875 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -14.033 12.247 0.706 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -12.623 11.175 0.870 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -12.466 12.725 0.011 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -15.223 12.465 -1.394 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -13.767 12.986 -2.276 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -14.704 11.586 -2.851 1.00 0.00 H new ATOM 1507 N SER A 115 -9.021 10.879 -2.009 1.00 0.00 N ATOM 1508 CA SER A 115 -7.599 10.948 -1.609 1.00 0.00 C ATOM 1509 C SER A 115 -7.397 11.038 -0.074 1.00 0.00 C ATOM 1510 O SER A 115 -6.817 11.996 0.451 1.00 0.00 O ATOM 1511 CB SER A 115 -6.919 12.094 -2.382 1.00 0.00 C ATOM 1512 OG SER A 115 -5.500 11.997 -2.345 1.00 0.00 O ATOM 0 H SER A 115 -9.236 10.056 -2.572 1.00 0.00 H new ATOM 0 HA SER A 115 -7.115 10.010 -1.879 1.00 0.00 H new ATOM 0 HB2 SER A 115 -7.256 12.081 -3.419 1.00 0.00 H new ATOM 0 HB3 SER A 115 -7.228 13.050 -1.958 1.00 0.00 H new ATOM 0 HG SER A 115 -5.108 12.741 -2.848 1.00 0.00 H new ATOM 1518 N MET A 116 -7.926 10.056 0.672 1.00 0.00 N ATOM 1519 CA MET A 116 -7.993 10.092 2.145 1.00 0.00 C ATOM 1520 C MET A 116 -6.603 10.129 2.808 1.00 0.00 C ATOM 1521 O MET A 116 -6.321 11.035 3.592 1.00 0.00 O ATOM 1522 CB MET A 116 -8.833 8.899 2.632 1.00 0.00 C ATOM 1523 CG MET A 116 -9.136 8.933 4.135 1.00 0.00 C ATOM 1524 SD MET A 116 -10.242 10.268 4.678 1.00 0.00 S ATOM 1525 CE MET A 116 -9.052 11.392 5.453 1.00 0.00 C ATOM 0 H MET A 116 -8.323 9.207 0.269 1.00 0.00 H new ATOM 0 HA MET A 116 -8.474 11.022 2.447 1.00 0.00 H new ATOM 0 HB2 MET A 116 -9.773 8.879 2.081 1.00 0.00 H new ATOM 0 HB3 MET A 116 -8.306 7.974 2.397 1.00 0.00 H new ATOM 0 HG2 MET A 116 -9.579 7.979 4.421 1.00 0.00 H new ATOM 0 HG3 MET A 116 -8.194 9.022 4.676 1.00 0.00 H new ATOM 0 HE1 MET A 116 -9.586 12.132 6.050 1.00 0.00 H new ATOM 0 HE2 MET A 116 -8.380 10.824 6.096 1.00 0.00 H new ATOM 0 HE3 MET A 116 -8.473 11.898 4.680 1.00 0.00 H new ATOM 1535 N SER A 117 -5.738 9.167 2.472 1.00 0.00 N ATOM 1536 CA SER A 117 -4.336 9.039 2.927 1.00 0.00 C ATOM 1537 C SER A 117 -4.153 8.647 4.414 1.00 0.00 C ATOM 1538 O SER A 117 -4.990 8.928 5.279 1.00 0.00 O ATOM 1539 CB SER A 117 -3.497 10.297 2.615 1.00 0.00 C ATOM 1540 OG SER A 117 -3.451 10.566 1.222 1.00 0.00 O ATOM 0 H SER A 117 -6.005 8.411 1.841 1.00 0.00 H new ATOM 0 HA SER A 117 -3.965 8.198 2.342 1.00 0.00 H new ATOM 0 HB2 SER A 117 -3.920 11.155 3.137 1.00 0.00 H new ATOM 0 HB3 SER A 117 -2.484 10.161 2.993 1.00 0.00 H new ATOM 0 HG SER A 117 -2.913 11.369 1.062 1.00 0.00 H new ATOM 1546 N THR A 118 -3.000 8.024 4.710 1.00 0.00 N ATOM 1547 CA THR A 118 -2.507 7.710 6.065 1.00 0.00 C ATOM 1548 C THR A 118 -1.637 8.831 6.632 1.00 0.00 C ATOM 1549 O THR A 118 -1.733 9.151 7.817 1.00 0.00 O ATOM 1550 CB THR A 118 -1.773 6.351 6.067 1.00 0.00 C ATOM 1551 OG1 THR A 118 -1.098 6.184 7.290 1.00 0.00 O ATOM 1552 CG2 THR A 118 -0.714 6.153 4.966 1.00 0.00 C ATOM 0 H THR A 118 -2.358 7.712 3.982 1.00 0.00 H new ATOM 0 HA THR A 118 -3.369 7.629 6.727 1.00 0.00 H new ATOM 0 HB THR A 118 -2.567 5.625 5.891 1.00 0.00 H new ATOM 0 HG1 THR A 118 -0.894 5.235 7.424 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.265 5.165 5.066 1.00 0.00 H new ATOM 0 HG22 THR A 118 -1.186 6.240 3.987 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.060 6.914 5.064 1.00 0.00 H new ATOM 1560 N GLU A 119 -0.755 9.400 5.799 1.00 0.00 N ATOM 1561 CA GLU A 119 0.326 10.319 6.195 1.00 0.00 C ATOM 1562 C GLU A 119 1.323 9.664 7.191 1.00 0.00 C ATOM 1563 O GLU A 119 2.166 10.350 7.772 1.00 0.00 O ATOM 1564 CB GLU A 119 -0.281 11.658 6.674 1.00 0.00 C ATOM 1565 CG GLU A 119 0.710 12.834 6.647 1.00 0.00 C ATOM 1566 CD GLU A 119 -0.023 14.178 6.561 1.00 0.00 C ATOM 1567 OE1 GLU A 119 -0.462 14.703 7.611 1.00 0.00 O ATOM 1568 OE2 GLU A 119 -0.146 14.726 5.440 1.00 0.00 O1- ATOM 0 H GLU A 119 -0.774 9.228 4.794 1.00 0.00 H new ATOM 0 HA GLU A 119 0.944 10.547 5.326 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.138 11.903 6.046 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -0.655 11.534 7.690 1.00 0.00 H new ATOM 0 HG2 GLU A 119 1.329 12.812 7.544 1.00 0.00 H new ATOM 0 HG3 GLU A 119 1.381 12.728 5.794 1.00 0.00 H new ATOM 1575 N LEU A 120 1.211 8.337 7.400 1.00 0.00 N ATOM 1576 CA LEU A 120 1.886 7.522 8.424 1.00 0.00 C ATOM 1577 C LEU A 120 1.537 7.964 9.862 1.00 0.00 C ATOM 1578 O LEU A 120 2.246 7.628 10.812 1.00 0.00 O ATOM 1579 CB LEU A 120 3.403 7.412 8.134 1.00 0.00 C ATOM 1580 CG LEU A 120 3.747 6.571 6.887 1.00 0.00 C ATOM 1581 CD1 LEU A 120 5.228 6.761 6.529 1.00 0.00 C ATOM 1582 CD2 LEU A 120 3.476 5.074 7.110 1.00 0.00 C ATOM 0 H LEU A 120 0.601 7.767 6.813 1.00 0.00 H new ATOM 0 HA LEU A 120 1.496 6.506 8.360 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.811 8.415 8.007 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.897 6.975 9.002 1.00 0.00 H new ATOM 0 HG LEU A 120 3.108 6.915 6.074 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.469 6.166 5.648 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.420 7.813 6.320 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.849 6.439 7.365 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.732 4.519 6.207 1.00 0.00 H new ATOM 0 HD22 LEU A 120 4.083 4.714 7.941 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.421 4.926 7.340 1.00 0.00 H new ATOM 1594 N ASP A 121 0.440 8.710 10.032 1.00 0.00 N ATOM 1595 CA ASP A 121 0.018 9.315 11.301 1.00 0.00 C ATOM 1596 C ASP A 121 -1.170 8.591 11.969 1.00 0.00 C ATOM 1597 O ASP A 121 -1.427 8.807 13.156 1.00 0.00 O ATOM 1598 CB ASP A 121 -0.314 10.792 11.036 1.00 0.00 C ATOM 1599 CG ASP A 121 -0.442 11.600 12.338 1.00 0.00 C ATOM 1600 OD1 ASP A 121 -1.551 12.111 12.624 1.00 0.00 O ATOM 1601 OD2 ASP A 121 0.579 11.752 13.052 1.00 0.00 O1- ATOM 0 H ASP A 121 -0.200 8.916 9.265 1.00 0.00 H new ATOM 0 HA ASP A 121 0.839 9.221 12.012 1.00 0.00 H new ATOM 0 HB2 ASP A 121 0.464 11.232 10.412 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -1.247 10.858 10.476 1.00 0.00 H new ATOM 1606 N THR A 122 -1.877 7.706 11.247 1.00 0.00 N ATOM 1607 CA THR A 122 -3.011 6.913 11.764 1.00 0.00 C ATOM 1608 C THR A 122 -2.540 5.667 12.530 1.00 0.00 C ATOM 1609 O THR A 122 -2.975 4.540 12.273 1.00 0.00 O ATOM 1610 CB THR A 122 -4.018 6.589 10.652 1.00 0.00 C ATOM 1611 OG1 THR A 122 -3.361 5.942 9.597 1.00 0.00 O ATOM 1612 CG2 THR A 122 -4.651 7.847 10.056 1.00 0.00 C ATOM 0 H THR A 122 -1.674 7.516 10.266 1.00 0.00 H new ATOM 0 HA THR A 122 -3.540 7.527 12.493 1.00 0.00 H new ATOM 0 HB THR A 122 -4.790 5.968 11.106 1.00 0.00 H new ATOM 0 HG1 THR A 122 -4.005 5.734 8.889 1.00 0.00 H new ATOM 0 HG21 THR A 122 -5.356 7.564 9.274 1.00 0.00 H new ATOM 0 HG22 THR A 122 -5.177 8.395 10.838 1.00 0.00 H new ATOM 0 HG23 THR A 122 -3.872 8.480 9.631 1.00 0.00 H new ATOM 1620 N THR A 123 -1.632 5.890 13.487 1.00 0.00 N ATOM 1621 CA THR A 123 -1.107 4.906 14.444 1.00 0.00 C ATOM 1622 C THR A 123 -2.252 4.264 15.227 1.00 0.00 C ATOM 1623 O THR A 123 -3.276 4.889 15.497 1.00 0.00 O ATOM 1624 CB THR A 123 -0.106 5.596 15.386 1.00 0.00 C ATOM 1625 OG1 THR A 123 0.865 6.268 14.612 1.00 0.00 O ATOM 1626 CG2 THR A 123 0.634 4.646 16.334 1.00 0.00 C ATOM 0 H THR A 123 -1.220 6.813 13.623 1.00 0.00 H new ATOM 0 HA THR A 123 -0.589 4.112 13.906 1.00 0.00 H new ATOM 0 HB THR A 123 -0.698 6.271 16.004 1.00 0.00 H new ATOM 0 HG1 THR A 123 1.506 6.712 15.205 1.00 0.00 H new ATOM 0 HG21 THR A 123 1.318 5.218 16.961 1.00 0.00 H new ATOM 0 HG22 THR A 123 -0.087 4.126 16.965 1.00 0.00 H new ATOM 0 HG23 THR A 123 1.198 3.917 15.752 1.00 0.00 H new ATOM 1634 N HIS A 124 -2.060 3.006 15.612 1.00 0.00 N ATOM 1635 CA HIS A 124 -3.055 2.175 16.302 1.00 0.00 C ATOM 1636 C HIS A 124 -3.556 2.771 17.637 1.00 0.00 C ATOM 1637 O HIS A 124 -4.727 2.593 17.972 1.00 0.00 O ATOM 1638 CB HIS A 124 -2.402 0.796 16.500 1.00 0.00 C ATOM 1639 CG HIS A 124 -3.062 -0.122 17.495 1.00 0.00 C ATOM 1640 ND1 HIS A 124 -2.392 -0.870 18.433 1.00 0.00 N ATOM 1641 CD2 HIS A 124 -4.398 -0.367 17.660 1.00 0.00 C ATOM 1642 CE1 HIS A 124 -3.300 -1.535 19.163 1.00 0.00 C ATOM 1643 NE2 HIS A 124 -4.543 -1.250 18.735 1.00 0.00 N ATOM 0 H HIS A 124 -1.180 2.516 15.449 1.00 0.00 H new ATOM 0 HA HIS A 124 -3.958 2.111 15.695 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -2.374 0.290 15.535 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -1.368 0.949 16.810 1.00 0.00 H new ATOM 0 HD1 HIS A 124 -1.380 -0.912 18.553 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -5.199 0.048 17.066 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -3.066 -2.204 19.978 1.00 0.00 H new ATOM 1651 N PHE A 125 -2.695 3.465 18.398 1.00 0.00 N ATOM 1652 CA PHE A 125 -3.054 4.220 19.614 1.00 0.00 C ATOM 1653 C PHE A 125 -3.601 3.330 20.764 1.00 0.00 C ATOM 1654 O PHE A 125 -4.281 3.814 21.671 1.00 0.00 O ATOM 1655 CB PHE A 125 -3.970 5.400 19.214 1.00 0.00 C ATOM 1656 CG PHE A 125 -4.212 6.453 20.282 1.00 0.00 C ATOM 1657 CD1 PHE A 125 -5.519 6.706 20.743 1.00 0.00 C ATOM 1658 CD2 PHE A 125 -3.135 7.197 20.804 1.00 0.00 C ATOM 1659 CE1 PHE A 125 -5.748 7.686 21.725 1.00 0.00 C ATOM 1660 CE2 PHE A 125 -3.364 8.177 21.788 1.00 0.00 C ATOM 1661 CZ PHE A 125 -4.670 8.421 22.250 1.00 0.00 C ATOM 0 H PHE A 125 -1.700 3.519 18.180 1.00 0.00 H new ATOM 0 HA PHE A 125 -2.148 4.635 20.056 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.537 5.890 18.342 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.934 4.996 18.906 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -6.349 6.145 20.340 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.132 7.015 20.448 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -6.752 7.874 22.076 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.536 8.742 22.189 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.845 9.172 23.007 1.00 0.00 H new ATOM 1671 N LEU A 126 -3.295 2.021 20.732 1.00 0.00 N ATOM 1672 CA LEU A 126 -3.582 1.026 21.783 1.00 0.00 C ATOM 1673 C LEU A 126 -5.094 0.740 21.954 1.00 0.00 C ATOM 1674 O LEU A 126 -5.579 0.498 23.064 1.00 0.00 O ATOM 1675 CB LEU A 126 -2.867 1.425 23.098 1.00 0.00 C ATOM 1676 CG LEU A 126 -2.473 0.210 23.965 1.00 0.00 C ATOM 1677 CD1 LEU A 126 -1.179 -0.442 23.450 1.00 0.00 C ATOM 1678 CD2 LEU A 126 -2.271 0.641 25.422 1.00 0.00 C ATOM 0 H LEU A 126 -2.817 1.606 19.932 1.00 0.00 H new ATOM 0 HA LEU A 126 -3.171 0.068 21.466 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.972 1.999 22.858 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.520 2.080 23.675 1.00 0.00 H new ATOM 0 HG LEU A 126 -3.283 -0.517 23.904 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -0.926 -1.295 24.080 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -1.325 -0.779 22.424 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.368 0.285 23.481 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.994 -0.225 26.023 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.478 1.388 25.474 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -3.197 1.068 25.807 1.00 0.00 H new ATOM 1690 N LEU A 127 -5.853 0.796 20.855 1.00 0.00 N ATOM 1691 CA LEU A 127 -7.298 0.534 20.804 1.00 0.00 C ATOM 1692 C LEU A 127 -7.667 -0.930 21.168 1.00 0.00 C ATOM 1693 O LEU A 127 -6.829 -1.831 21.052 1.00 0.00 O ATOM 1694 CB LEU A 127 -7.807 0.925 19.396 1.00 0.00 C ATOM 1695 CG LEU A 127 -8.429 2.334 19.282 1.00 0.00 C ATOM 1696 CD1 LEU A 127 -7.586 3.461 19.895 1.00 0.00 C ATOM 1697 CD2 LEU A 127 -8.692 2.642 17.801 1.00 0.00 C ATOM 0 H LEU A 127 -5.465 1.034 19.942 1.00 0.00 H new ATOM 0 HA LEU A 127 -7.792 1.140 21.563 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -6.975 0.857 18.696 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -8.550 0.192 19.081 1.00 0.00 H new ATOM 0 HG LEU A 127 -9.351 2.308 19.863 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -8.102 4.412 19.767 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -7.438 3.268 20.958 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -6.618 3.504 19.396 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -9.132 3.635 17.708 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.752 2.608 17.250 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -9.379 1.902 17.392 1.00 0.00 H new ATOM 1709 N PRO A 128 -8.929 -1.191 21.581 1.00 0.00 N ATOM 1710 CA PRO A 128 -9.407 -2.531 21.930 1.00 0.00 C ATOM 1711 C PRO A 128 -9.684 -3.421 20.702 1.00 0.00 C ATOM 1712 O PRO A 128 -9.644 -4.643 20.827 1.00 0.00 O ATOM 1713 CB PRO A 128 -10.678 -2.293 22.754 1.00 0.00 C ATOM 1714 CG PRO A 128 -11.236 -0.992 22.180 1.00 0.00 C ATOM 1715 CD PRO A 128 -9.972 -0.203 21.841 1.00 0.00 C ATOM 0 HA PRO A 128 -8.646 -3.080 22.485 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -11.386 -3.115 22.647 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -10.456 -2.200 23.817 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -11.851 -1.170 21.298 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -11.860 -0.466 22.902 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -10.132 0.432 20.969 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -9.690 0.452 22.665 1.00 0.00 H new ATOM 1723 N VAL A 129 -9.940 -2.831 19.525 1.00 0.00 N ATOM 1724 CA VAL A 129 -10.118 -3.524 18.236 1.00 0.00 C ATOM 1725 C VAL A 129 -9.167 -2.927 17.188 1.00 0.00 C ATOM 1726 O VAL A 129 -8.876 -1.728 17.202 1.00 0.00 O ATOM 1727 CB VAL A 129 -11.587 -3.489 17.735 1.00 0.00 C ATOM 1728 CG1 VAL A 129 -12.528 -4.339 18.650 1.00 0.00 C ATOM 1729 CG2 VAL A 129 -12.132 -2.053 17.547 1.00 0.00 C ATOM 0 H VAL A 129 -10.033 -1.819 19.439 1.00 0.00 H new ATOM 0 HA VAL A 129 -9.872 -4.574 18.392 1.00 0.00 H new ATOM 0 HB VAL A 129 -11.577 -3.945 16.745 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -13.548 -4.291 18.268 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -12.191 -5.376 18.655 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -12.502 -3.944 19.666 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -13.163 -2.098 17.196 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -12.096 -1.523 18.499 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -11.522 -1.525 16.814 1.00 0.00 H new ATOM 1739 N LEU A 130 -8.683 -3.778 16.280 1.00 0.00 N ATOM 1740 CA LEU A 130 -7.680 -3.447 15.269 1.00 0.00 C ATOM 1741 C LEU A 130 -7.721 -4.461 14.120 1.00 0.00 C ATOM 1742 O LEU A 130 -7.611 -5.670 14.345 1.00 0.00 O ATOM 1743 CB LEU A 130 -6.273 -3.302 15.906 1.00 0.00 C ATOM 1744 CG LEU A 130 -5.573 -4.576 16.446 1.00 0.00 C ATOM 1745 CD1 LEU A 130 -4.124 -4.252 16.839 1.00 0.00 C ATOM 1746 CD2 LEU A 130 -6.263 -5.225 17.653 1.00 0.00 C ATOM 0 H LEU A 130 -8.990 -4.749 16.228 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.918 -2.475 14.837 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -5.616 -2.853 15.161 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -6.353 -2.593 16.730 1.00 0.00 H new ATOM 0 HG LEU A 130 -5.623 -5.294 15.628 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -3.640 -5.152 17.217 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -3.583 -3.888 15.966 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -4.120 -3.485 17.614 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -5.703 -6.108 17.961 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -6.300 -4.513 18.477 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -7.277 -5.516 17.379 1.00 0.00 H new ATOM 1758 N GLY A 131 -7.896 -3.969 12.888 1.00 0.00 N ATOM 1759 CA GLY A 131 -7.920 -4.789 11.671 1.00 0.00 C ATOM 1760 C GLY A 131 -8.844 -5.999 11.791 1.00 0.00 C ATOM 1761 O GLY A 131 -10.015 -5.865 12.153 1.00 0.00 O ATOM 0 H GLY A 131 -8.027 -2.974 12.706 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -8.241 -4.174 10.830 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -6.909 -5.130 11.448 1.00 0.00 H new ATOM 1765 N ARG A 132 -8.280 -7.185 11.530 1.00 0.00 N ATOM 1766 CA ARG A 132 -8.918 -8.491 11.770 1.00 0.00 C ATOM 1767 C ARG A 132 -8.313 -9.249 12.970 1.00 0.00 C ATOM 1768 O ARG A 132 -8.478 -10.463 13.083 1.00 0.00 O ATOM 1769 CB ARG A 132 -8.920 -9.319 10.469 1.00 0.00 C ATOM 1770 CG ARG A 132 -9.624 -8.554 9.332 1.00 0.00 C ATOM 1771 CD ARG A 132 -10.455 -9.465 8.419 1.00 0.00 C ATOM 1772 NE ARG A 132 -11.221 -8.675 7.437 1.00 0.00 N ATOM 1773 CZ ARG A 132 -12.287 -7.918 7.684 1.00 0.00 C ATOM 1774 NH1 ARG A 132 -12.860 -7.862 8.869 1.00 0.00 N1+ ATOM 1775 NH2 ARG A 132 -12.799 -7.188 6.721 1.00 0.00 N ATOM 0 H ARG A 132 -7.343 -7.268 11.136 1.00 0.00 H new ATOM 0 HA ARG A 132 -9.954 -8.313 12.058 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -7.895 -9.549 10.178 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -9.424 -10.270 10.639 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -10.273 -7.791 9.763 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -8.876 -8.035 8.733 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -9.797 -10.160 7.898 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -11.138 -10.064 9.022 1.00 0.00 H new ATOM 0 HE ARG A 132 -10.901 -8.713 6.469 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -12.487 -8.413 9.642 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -13.676 -7.267 9.013 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -12.380 -7.204 5.791 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -13.616 -6.605 6.902 1.00 0.00 H new ATOM 1789 N HIS A 133 -7.589 -8.552 13.857 1.00 0.00 N ATOM 1790 CA HIS A 133 -7.091 -9.051 15.155 1.00 0.00 C ATOM 1791 C HIS A 133 -6.040 -10.194 15.038 1.00 0.00 C ATOM 1792 O HIS A 133 -5.815 -10.932 15.997 1.00 0.00 O ATOM 1793 CB HIS A 133 -8.304 -9.409 16.047 1.00 0.00 C ATOM 1794 CG HIS A 133 -8.089 -9.186 17.527 1.00 0.00 C ATOM 1795 ND1 HIS A 133 -8.432 -8.054 18.234 1.00 0.00 N ATOM 1796 CD2 HIS A 133 -7.579 -10.079 18.434 1.00 0.00 C ATOM 1797 CE1 HIS A 133 -8.121 -8.252 19.526 1.00 0.00 C ATOM 1798 NE2 HIS A 133 -7.595 -9.479 19.702 1.00 0.00 N ATOM 0 H HIS A 133 -7.321 -7.583 13.686 1.00 0.00 H new ATOM 0 HA HIS A 133 -6.524 -8.253 15.635 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -9.161 -8.817 15.725 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -8.560 -10.456 15.885 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -7.225 -11.075 18.210 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -8.272 -7.528 20.313 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -7.274 -9.889 20.579 1.00 0.00 H new ATOM 1806 N HIS A 134 -5.423 -10.359 13.857 1.00 0.00 N ATOM 1807 CA HIS A 134 -4.604 -11.505 13.415 1.00 0.00 C ATOM 1808 C HIS A 134 -5.475 -12.771 13.204 1.00 0.00 C ATOM 1809 O HIS A 134 -5.762 -13.517 14.144 1.00 0.00 O ATOM 1810 CB HIS A 134 -3.402 -11.763 14.348 1.00 0.00 C ATOM 1811 CG HIS A 134 -2.350 -12.655 13.725 1.00 0.00 C ATOM 1812 ND1 HIS A 134 -1.139 -12.268 13.184 1.00 0.00 N ATOM 1813 CD2 HIS A 134 -2.426 -14.017 13.589 1.00 0.00 C ATOM 1814 CE1 HIS A 134 -0.515 -13.367 12.730 1.00 0.00 C ATOM 1815 NE2 HIS A 134 -1.261 -14.465 12.956 1.00 0.00 N ATOM 0 H HIS A 134 -5.487 -9.645 13.132 1.00 0.00 H new ATOM 0 HA HIS A 134 -4.178 -11.244 12.446 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -2.948 -10.810 14.619 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -3.758 -12.220 15.271 1.00 0.00 H new ATOM 0 HD1 HIS A 134 -0.781 -11.314 13.138 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -3.246 -14.639 13.915 1.00 0.00 H new ATOM 0 HE1 HIS A 134 0.452 -13.370 12.250 1.00 0.00 H new ATOM 1823 N SER A 135 -5.901 -13.039 11.963 1.00 0.00 N ATOM 1824 CA SER A 135 -6.726 -14.221 11.644 1.00 0.00 C ATOM 1825 C SER A 135 -5.871 -15.494 11.472 1.00 0.00 C ATOM 1826 O SER A 135 -5.993 -16.428 12.273 1.00 0.00 O ATOM 1827 CB SER A 135 -7.593 -13.934 10.408 1.00 0.00 C ATOM 1828 OG SER A 135 -8.474 -15.017 10.144 1.00 0.00 O ATOM 0 H SER A 135 -5.689 -12.452 11.156 1.00 0.00 H new ATOM 0 HA SER A 135 -7.388 -14.417 12.488 1.00 0.00 H new ATOM 0 HB2 SER A 135 -8.169 -13.022 10.566 1.00 0.00 H new ATOM 0 HB3 SER A 135 -6.953 -13.761 9.542 1.00 0.00 H new ATOM 0 HG SER A 135 -9.017 -14.812 9.354 1.00 0.00 H new ATOM 1834 N LEU A 136 -4.974 -15.519 10.469 1.00 0.00 N ATOM 1835 CA LEU A 136 -4.043 -16.624 10.172 1.00 0.00 C ATOM 1836 C LEU A 136 -2.983 -16.209 9.141 1.00 0.00 C ATOM 1837 O LEU A 136 -1.792 -16.197 9.440 1.00 0.00 O ATOM 1838 CB LEU A 136 -4.827 -17.875 9.698 1.00 0.00 C ATOM 1839 CG LEU A 136 -3.943 -19.081 9.306 1.00 0.00 C ATOM 1840 CD1 LEU A 136 -3.083 -19.584 10.476 1.00 0.00 C ATOM 1841 CD2 LEU A 136 -4.830 -20.222 8.792 1.00 0.00 C ATOM 0 H LEU A 136 -4.874 -14.740 9.818 1.00 0.00 H new ATOM 0 HA LEU A 136 -3.514 -16.876 11.091 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -5.507 -18.183 10.492 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -5.442 -17.599 8.841 1.00 0.00 H new ATOM 0 HG LEU A 136 -3.263 -18.746 8.523 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -2.481 -20.431 10.147 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -2.426 -18.783 10.816 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -3.730 -19.895 11.296 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -4.206 -21.072 8.516 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.526 -20.522 9.575 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -5.389 -19.884 7.920 1.00 0.00 H new ATOM 1853 N SER A 137 -3.403 -15.867 7.921 1.00 0.00 N ATOM 1854 CA SER A 137 -2.508 -15.595 6.778 1.00 0.00 C ATOM 1855 C SER A 137 -1.985 -14.138 6.753 1.00 0.00 C ATOM 1856 O SER A 137 -1.843 -13.516 5.696 1.00 0.00 O ATOM 1857 CB SER A 137 -3.211 -16.009 5.472 1.00 0.00 C ATOM 1858 OG SER A 137 -2.275 -16.276 4.435 1.00 0.00 O ATOM 0 H SER A 137 -4.391 -15.768 7.688 1.00 0.00 H new ATOM 0 HA SER A 137 -1.609 -16.201 6.890 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.819 -16.896 5.651 1.00 0.00 H new ATOM 0 HB3 SER A 137 -3.889 -15.216 5.156 1.00 0.00 H new ATOM 0 HG SER A 137 -2.754 -16.537 3.621 1.00 0.00 H new ATOM 1864 N GLY A 138 -1.731 -13.563 7.937 1.00 0.00 N ATOM 1865 CA GLY A 138 -1.282 -12.180 8.125 1.00 0.00 C ATOM 1866 C GLY A 138 0.163 -12.108 8.610 1.00 0.00 C ATOM 1867 O GLY A 138 0.433 -12.440 9.760 1.00 0.00 O ATOM 0 H GLY A 138 -1.837 -14.066 8.818 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -1.376 -11.638 7.184 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -1.931 -11.683 8.846 1.00 0.00 H new ATOM 1871 N ALA A 139 1.069 -11.622 7.749 1.00 0.00 N ATOM 1872 CA ALA A 139 2.511 -11.452 8.009 1.00 0.00 C ATOM 1873 C ALA A 139 3.155 -12.646 8.752 1.00 0.00 C ATOM 1874 O ALA A 139 3.810 -12.485 9.784 1.00 0.00 O ATOM 1875 CB ALA A 139 2.782 -10.102 8.688 1.00 0.00 C ATOM 0 H ALA A 139 0.808 -11.323 6.810 1.00 0.00 H new ATOM 0 HA ALA A 139 3.010 -11.442 7.040 1.00 0.00 H new ATOM 0 HB1 ALA A 139 3.851 -9.995 8.872 1.00 0.00 H new ATOM 0 HB2 ALA A 139 2.443 -9.294 8.040 1.00 0.00 H new ATOM 0 HB3 ALA A 139 2.245 -10.057 9.635 1.00 0.00 H new ATOM 1881 N THR A 140 2.955 -13.860 8.217 1.00 0.00 N ATOM 1882 CA THR A 140 3.573 -15.098 8.731 1.00 0.00 C ATOM 1883 C THR A 140 5.098 -15.131 8.530 1.00 0.00 C ATOM 1884 O THR A 140 5.787 -15.893 9.207 1.00 0.00 O ATOM 1885 CB THR A 140 2.854 -16.320 8.143 1.00 0.00 C ATOM 1886 OG1 THR A 140 3.259 -17.478 8.835 1.00 0.00 O ATOM 1887 CG2 THR A 140 3.088 -16.523 6.643 1.00 0.00 C ATOM 0 H THR A 140 2.354 -14.014 7.407 1.00 0.00 H new ATOM 0 HA THR A 140 3.442 -15.125 9.813 1.00 0.00 H new ATOM 0 HB THR A 140 1.787 -16.134 8.266 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.153 -17.339 9.210 1.00 0.00 H new ATOM 0 HG21 THR A 140 2.546 -17.407 6.306 1.00 0.00 H new ATOM 0 HG22 THR A 140 2.732 -15.649 6.098 1.00 0.00 H new ATOM 0 HG23 THR A 140 4.153 -16.658 6.456 1.00 0.00 H new ATOM 1895 N GLU A 141 5.631 -14.288 7.641 1.00 0.00 N ATOM 1896 CA GLU A 141 7.067 -14.040 7.469 1.00 0.00 C ATOM 1897 C GLU A 141 7.603 -13.065 8.546 1.00 0.00 C ATOM 1898 O GLU A 141 6.837 -12.229 9.043 1.00 0.00 O ATOM 1899 CB GLU A 141 7.331 -13.472 6.062 1.00 0.00 C ATOM 1900 CG GLU A 141 6.862 -14.378 4.912 1.00 0.00 C ATOM 1901 CD GLU A 141 7.459 -15.796 4.977 1.00 0.00 C ATOM 1902 OE1 GLU A 141 6.687 -16.774 5.109 1.00 0.00 O ATOM 1903 OE2 GLU A 141 8.698 -15.948 4.872 1.00 0.00 O1- ATOM 0 H GLU A 141 5.057 -13.741 7.000 1.00 0.00 H new ATOM 0 HA GLU A 141 7.594 -14.987 7.584 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.833 -12.507 5.974 1.00 0.00 H new ATOM 0 HB3 GLU A 141 8.400 -13.290 5.952 1.00 0.00 H new ATOM 0 HG2 GLU A 141 5.774 -14.447 4.932 1.00 0.00 H new ATOM 0 HG3 GLU A 141 7.134 -13.919 3.962 1.00 0.00 H new ATOM 1910 N PRO A 142 8.901 -13.136 8.912 1.00 0.00 N ATOM 1911 CA PRO A 142 9.496 -12.302 9.957 1.00 0.00 C ATOM 1912 C PRO A 142 9.707 -10.842 9.514 1.00 0.00 C ATOM 1913 O PRO A 142 9.455 -10.466 8.369 1.00 0.00 O ATOM 1914 CB PRO A 142 10.818 -13.001 10.312 1.00 0.00 C ATOM 1915 CG PRO A 142 11.224 -13.657 8.996 1.00 0.00 C ATOM 1916 CD PRO A 142 9.881 -14.096 8.420 1.00 0.00 C ATOM 0 HA PRO A 142 8.835 -12.216 10.820 1.00 0.00 H new ATOM 0 HB2 PRO A 142 11.570 -12.291 10.658 1.00 0.00 H new ATOM 0 HB3 PRO A 142 10.685 -13.736 11.105 1.00 0.00 H new ATOM 0 HG2 PRO A 142 11.740 -12.959 8.337 1.00 0.00 H new ATOM 0 HG3 PRO A 142 11.894 -14.502 9.153 1.00 0.00 H new ATOM 0 HD2 PRO A 142 9.907 -14.103 7.330 1.00 0.00 H new ATOM 0 HD3 PRO A 142 9.631 -15.108 8.740 1.00 0.00 H new ATOM 1924 N ASP A 143 10.226 -10.023 10.438 1.00 0.00 N ATOM 1925 CA ASP A 143 10.564 -8.602 10.247 1.00 0.00 C ATOM 1926 C ASP A 143 11.512 -8.343 9.054 1.00 0.00 C ATOM 1927 O ASP A 143 11.497 -7.261 8.468 1.00 0.00 O ATOM 1928 CB ASP A 143 11.203 -8.117 11.560 1.00 0.00 C ATOM 1929 CG ASP A 143 11.555 -6.621 11.550 1.00 0.00 C ATOM 1930 OD1 ASP A 143 10.630 -5.792 11.706 1.00 0.00 O ATOM 1931 OD2 ASP A 143 12.760 -6.287 11.447 1.00 0.00 O1- ATOM 0 H ASP A 143 10.432 -10.346 11.383 1.00 0.00 H new ATOM 0 HA ASP A 143 9.654 -8.053 10.006 1.00 0.00 H new ATOM 0 HB2 ASP A 143 10.518 -8.316 12.384 1.00 0.00 H new ATOM 0 HB3 ASP A 143 12.108 -8.694 11.750 1.00 0.00 H new ATOM 1936 N ASP A 144 12.299 -9.354 8.665 1.00 0.00 N ATOM 1937 CA ASP A 144 13.228 -9.327 7.528 1.00 0.00 C ATOM 1938 C ASP A 144 12.531 -9.116 6.167 1.00 0.00 C ATOM 1939 O ASP A 144 13.144 -8.570 5.248 1.00 0.00 O ATOM 1940 CB ASP A 144 14.023 -10.643 7.528 1.00 0.00 C ATOM 1941 CG ASP A 144 15.189 -10.632 6.522 1.00 0.00 C ATOM 1942 OD1 ASP A 144 15.139 -11.390 5.525 1.00 0.00 O ATOM 1943 OD2 ASP A 144 16.174 -9.891 6.758 1.00 0.00 O1- ATOM 0 H ASP A 144 12.306 -10.249 9.153 1.00 0.00 H new ATOM 0 HA ASP A 144 13.888 -8.469 7.653 1.00 0.00 H new ATOM 0 HB2 ASP A 144 14.414 -10.827 8.529 1.00 0.00 H new ATOM 0 HB3 ASP A 144 13.352 -11.468 7.291 1.00 0.00 H new ATOM 1948 N GLU A 145 11.254 -9.504 6.042 1.00 0.00 N ATOM 1949 CA GLU A 145 10.441 -9.257 4.844 1.00 0.00 C ATOM 1950 C GLU A 145 10.003 -7.783 4.776 1.00 0.00 C ATOM 1951 O GLU A 145 10.331 -7.098 3.806 1.00 0.00 O ATOM 1952 CB GLU A 145 9.232 -10.217 4.800 1.00 0.00 C ATOM 1953 CG GLU A 145 9.271 -11.142 3.577 1.00 0.00 C ATOM 1954 CD GLU A 145 10.527 -12.032 3.527 1.00 0.00 C ATOM 1955 OE1 GLU A 145 11.183 -12.086 2.459 1.00 0.00 O ATOM 1956 OE2 GLU A 145 10.856 -12.696 4.537 1.00 0.00 O1- ATOM 0 H GLU A 145 10.752 -10.003 6.777 1.00 0.00 H new ATOM 0 HA GLU A 145 11.051 -9.456 3.963 1.00 0.00 H new ATOM 0 HB2 GLU A 145 9.215 -10.819 5.708 1.00 0.00 H new ATOM 0 HB3 GLU A 145 8.310 -9.636 4.785 1.00 0.00 H new ATOM 0 HG2 GLU A 145 8.385 -11.776 3.581 1.00 0.00 H new ATOM 0 HG3 GLU A 145 9.226 -10.537 2.671 1.00 0.00 H new ATOM 1963 N ARG A 146 9.330 -7.296 5.834 1.00 0.00 N ATOM 1964 CA ARG A 146 9.035 -5.874 6.107 1.00 0.00 C ATOM 1965 C ARG A 146 8.334 -5.677 7.460 1.00 0.00 C ATOM 1966 O ARG A 146 8.747 -4.822 8.241 1.00 0.00 O ATOM 1967 CB ARG A 146 8.204 -5.206 4.982 1.00 0.00 C ATOM 1968 CG ARG A 146 8.023 -3.691 5.187 1.00 0.00 C ATOM 1969 CD ARG A 146 9.336 -2.903 5.065 1.00 0.00 C ATOM 1970 NE ARG A 146 9.239 -1.596 5.735 1.00 0.00 N ATOM 1971 CZ ARG A 146 10.197 -0.677 5.785 1.00 0.00 C ATOM 1972 NH1 ARG A 146 11.338 -0.819 5.142 1.00 0.00 N1+ ATOM 1973 NH2 ARG A 146 10.013 0.414 6.495 1.00 0.00 N ATOM 0 H ARG A 146 8.958 -7.911 6.558 1.00 0.00 H new ATOM 0 HA ARG A 146 10.006 -5.380 6.144 1.00 0.00 H new ATOM 0 HB2 ARG A 146 8.693 -5.382 4.024 1.00 0.00 H new ATOM 0 HB3 ARG A 146 7.224 -5.680 4.932 1.00 0.00 H new ATOM 0 HG2 ARG A 146 7.311 -3.314 4.453 1.00 0.00 H new ATOM 0 HG3 ARG A 146 7.590 -3.513 6.171 1.00 0.00 H new ATOM 0 HD2 ARG A 146 10.151 -3.479 5.503 1.00 0.00 H new ATOM 0 HD3 ARG A 146 9.579 -2.757 4.012 1.00 0.00 H new ATOM 0 HE ARG A 146 8.359 -1.377 6.202 1.00 0.00 H new ATOM 0 HH11 ARG A 146 11.508 -1.655 4.583 1.00 0.00 H new ATOM 0 HH12 ARG A 146 12.052 -0.093 5.203 1.00 0.00 H new ATOM 0 HH21 ARG A 146 9.139 0.551 7.003 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.744 1.124 6.538 1.00 0.00 H new ATOM 1987 N VAL A 147 7.271 -6.446 7.715 1.00 0.00 N ATOM 1988 CA VAL A 147 6.489 -6.440 8.967 1.00 0.00 C ATOM 1989 C VAL A 147 6.254 -7.871 9.458 1.00 0.00 C ATOM 1990 O VAL A 147 6.175 -8.799 8.654 1.00 0.00 O ATOM 1991 CB VAL A 147 5.127 -5.708 8.842 1.00 0.00 C ATOM 1992 CG1 VAL A 147 5.304 -4.204 8.577 1.00 0.00 C ATOM 1993 CG2 VAL A 147 4.199 -6.307 7.769 1.00 0.00 C ATOM 0 H VAL A 147 6.914 -7.116 7.034 1.00 0.00 H new ATOM 0 HA VAL A 147 7.086 -5.885 9.690 1.00 0.00 H new ATOM 0 HB VAL A 147 4.648 -5.852 9.810 1.00 0.00 H new ATOM 0 HG11 VAL A 147 4.325 -3.731 8.496 1.00 0.00 H new ATOM 0 HG12 VAL A 147 5.859 -3.752 9.400 1.00 0.00 H new ATOM 0 HG13 VAL A 147 5.854 -4.061 7.647 1.00 0.00 H new ATOM 0 HG21 VAL A 147 3.266 -5.744 7.739 1.00 0.00 H new ATOM 0 HG22 VAL A 147 4.686 -6.254 6.796 1.00 0.00 H new ATOM 0 HG23 VAL A 147 3.987 -7.348 8.012 1.00 0.00 H new ATOM 2003 N LEU A 148 6.135 -8.026 10.779 1.00 0.00 N ATOM 2004 CA LEU A 148 5.902 -9.304 11.471 1.00 0.00 C ATOM 2005 C LEU A 148 4.484 -9.413 12.077 1.00 0.00 C ATOM 2006 O LEU A 148 4.049 -10.511 12.423 1.00 0.00 O ATOM 2007 CB LEU A 148 7.040 -9.426 12.507 1.00 0.00 C ATOM 2008 CG LEU A 148 6.982 -10.608 13.498 1.00 0.00 C ATOM 2009 CD1 LEU A 148 8.407 -11.020 13.900 1.00 0.00 C ATOM 2010 CD2 LEU A 148 6.219 -10.250 14.792 1.00 0.00 C ATOM 0 H LEU A 148 6.200 -7.238 11.423 1.00 0.00 H new ATOM 0 HA LEU A 148 5.927 -10.145 10.778 1.00 0.00 H new ATOM 0 HB2 LEU A 148 7.983 -9.489 11.964 1.00 0.00 H new ATOM 0 HB3 LEU A 148 7.067 -8.503 13.086 1.00 0.00 H new ATOM 0 HG LEU A 148 6.459 -11.418 12.990 1.00 0.00 H new ATOM 0 HD11 LEU A 148 8.361 -11.855 14.600 1.00 0.00 H new ATOM 0 HD12 LEU A 148 8.963 -11.321 13.012 1.00 0.00 H new ATOM 0 HD13 LEU A 148 8.910 -10.177 14.374 1.00 0.00 H new ATOM 0 HD21 LEU A 148 6.205 -11.113 15.457 1.00 0.00 H new ATOM 0 HD22 LEU A 148 6.716 -9.417 15.289 1.00 0.00 H new ATOM 0 HD23 LEU A 148 5.196 -9.967 14.545 1.00 0.00 H new ATOM 2022 N GLY A 149 3.756 -8.295 12.205 1.00 0.00 N ATOM 2023 CA GLY A 149 2.483 -8.208 12.934 1.00 0.00 C ATOM 2024 C GLY A 149 1.318 -8.870 12.194 1.00 0.00 C ATOM 2025 O GLY A 149 0.866 -9.944 12.598 1.00 0.00 O ATOM 0 H GLY A 149 4.042 -7.406 11.795 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.598 -8.678 13.911 1.00 0.00 H new ATOM 0 HA3 GLY A 149 2.244 -7.159 13.111 1.00 0.00 H new ATOM 2029 N TRP A 150 0.860 -8.237 11.108 1.00 0.00 N ATOM 2030 CA TRP A 150 -0.101 -8.777 10.132 1.00 0.00 C ATOM 2031 C TRP A 150 -0.303 -7.869 8.904 1.00 0.00 C ATOM 2032 O TRP A 150 0.064 -6.695 8.891 1.00 0.00 O ATOM 2033 CB TRP A 150 -1.437 -9.217 10.775 1.00 0.00 C ATOM 2034 CG TRP A 150 -2.082 -8.300 11.767 1.00 0.00 C ATOM 2035 CD1 TRP A 150 -2.149 -8.528 13.097 1.00 0.00 C ATOM 2036 CD2 TRP A 150 -2.746 -7.017 11.557 1.00 0.00 C ATOM 2037 NE1 TRP A 150 -2.865 -7.526 13.714 1.00 0.00 N ATOM 2038 CE2 TRP A 150 -3.244 -6.555 12.814 1.00 0.00 C ATOM 2039 CE3 TRP A 150 -2.942 -6.166 10.446 1.00 0.00 C ATOM 2040 CZ2 TRP A 150 -3.921 -5.339 12.956 1.00 0.00 C ATOM 2041 CZ3 TRP A 150 -3.562 -4.916 10.599 1.00 0.00 C ATOM 2042 CH2 TRP A 150 -4.076 -4.506 11.839 1.00 0.00 C ATOM 0 H TRP A 150 1.161 -7.291 10.872 1.00 0.00 H new ATOM 0 HA TRP A 150 0.363 -9.687 9.751 1.00 0.00 H new ATOM 0 HB2 TRP A 150 -2.151 -9.392 9.971 1.00 0.00 H new ATOM 0 HB3 TRP A 150 -1.270 -10.175 11.267 1.00 0.00 H new ATOM 0 HD1 TRP A 150 -1.706 -9.373 13.603 1.00 0.00 H new ATOM 0 HE1 TRP A 150 -3.086 -7.506 14.710 1.00 0.00 H new ATOM 0 HE3 TRP A 150 -2.611 -6.481 9.468 1.00 0.00 H new ATOM 0 HZ2 TRP A 150 -4.320 -5.045 13.916 1.00 0.00 H new ATOM 0 HZ3 TRP A 150 -3.645 -4.258 9.747 1.00 0.00 H new ATOM 0 HH2 TRP A 150 -4.586 -3.558 11.932 1.00 0.00 H new ATOM 2053 N VAL A 151 -0.934 -8.435 7.873 1.00 0.00 N ATOM 2054 CA VAL A 151 -1.466 -7.745 6.692 1.00 0.00 C ATOM 2055 C VAL A 151 -2.679 -8.526 6.179 1.00 0.00 C ATOM 2056 O VAL A 151 -2.633 -9.753 6.118 1.00 0.00 O ATOM 2057 CB VAL A 151 -0.412 -7.486 5.577 1.00 0.00 C ATOM 2058 CG1 VAL A 151 0.635 -8.599 5.427 1.00 0.00 C ATOM 2059 CG2 VAL A 151 -1.032 -7.269 4.185 1.00 0.00 C ATOM 0 H VAL A 151 -1.097 -9.441 7.836 1.00 0.00 H new ATOM 0 HA VAL A 151 -1.771 -6.744 6.996 1.00 0.00 H new ATOM 0 HB VAL A 151 0.072 -6.573 5.924 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.331 -8.339 4.629 1.00 0.00 H new ATOM 0 HG12 VAL A 151 1.182 -8.712 6.363 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.136 -9.537 5.183 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -0.240 -7.094 3.457 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -1.600 -8.154 3.898 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -1.696 -6.405 4.213 1.00 0.00 H new ATOM 2069 N GLU A 152 -3.754 -7.819 5.829 1.00 0.00 N ATOM 2070 CA GLU A 152 -4.952 -8.381 5.201 1.00 0.00 C ATOM 2071 C GLU A 152 -5.020 -7.986 3.716 1.00 0.00 C ATOM 2072 O GLU A 152 -4.593 -6.896 3.325 1.00 0.00 O ATOM 2073 CB GLU A 152 -6.207 -7.939 5.973 1.00 0.00 C ATOM 2074 CG GLU A 152 -7.501 -8.658 5.554 1.00 0.00 C ATOM 2075 CD GLU A 152 -7.400 -10.191 5.627 1.00 0.00 C ATOM 2076 OE1 GLU A 152 -7.565 -10.754 6.732 1.00 0.00 O ATOM 2077 OE2 GLU A 152 -7.159 -10.822 4.572 1.00 0.00 O1- ATOM 0 H GLU A 152 -3.818 -6.812 5.978 1.00 0.00 H new ATOM 0 HA GLU A 152 -4.903 -9.469 5.242 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -6.041 -8.107 7.037 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -6.342 -6.866 5.837 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -8.317 -8.324 6.195 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -7.756 -8.366 4.535 1.00 0.00 H new ATOM 2084 N LEU A 153 -5.555 -8.896 2.895 1.00 0.00 N ATOM 2085 CA LEU A 153 -5.510 -8.867 1.431 1.00 0.00 C ATOM 2086 C LEU A 153 -6.824 -9.390 0.818 1.00 0.00 C ATOM 2087 O LEU A 153 -6.873 -10.496 0.275 1.00 0.00 O ATOM 2088 CB LEU A 153 -4.258 -9.634 0.938 1.00 0.00 C ATOM 2089 CG LEU A 153 -4.074 -11.069 1.504 1.00 0.00 C ATOM 2090 CD1 LEU A 153 -3.754 -12.077 0.388 1.00 0.00 C ATOM 2091 CD2 LEU A 153 -2.952 -11.109 2.555 1.00 0.00 C ATOM 0 H LEU A 153 -6.055 -9.711 3.251 1.00 0.00 H new ATOM 0 HA LEU A 153 -5.420 -7.836 1.089 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -4.299 -9.696 -0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -3.374 -9.048 1.191 1.00 0.00 H new ATOM 0 HG LEU A 153 -5.018 -11.348 1.973 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -3.632 -13.071 0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -4.571 -12.093 -0.333 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.832 -11.783 -0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -2.845 -12.125 2.934 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -2.014 -10.791 2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -3.200 -10.439 3.378 1.00 0.00 H new ATOM 2103 N GLU A 154 -7.894 -8.593 0.889 1.00 0.00 N ATOM 2104 CA GLU A 154 -9.178 -8.888 0.245 1.00 0.00 C ATOM 2105 C GLU A 154 -9.521 -7.799 -0.788 1.00 0.00 C ATOM 2106 O GLU A 154 -9.804 -6.647 -0.446 1.00 0.00 O ATOM 2107 CB GLU A 154 -10.277 -9.067 1.311 1.00 0.00 C ATOM 2108 CG GLU A 154 -11.366 -10.032 0.826 1.00 0.00 C ATOM 2109 CD GLU A 154 -12.582 -10.089 1.770 1.00 0.00 C ATOM 2110 OE1 GLU A 154 -13.717 -10.225 1.258 1.00 0.00 O ATOM 2111 OE2 GLU A 154 -12.416 -10.024 3.011 1.00 0.00 O1- ATOM 0 H GLU A 154 -7.893 -7.712 1.403 1.00 0.00 H new ATOM 0 HA GLU A 154 -9.107 -9.829 -0.301 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -9.835 -9.446 2.233 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -10.722 -8.100 1.545 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -11.697 -9.728 -0.167 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -10.941 -11.031 0.728 1.00 0.00 H new ATOM 2118 N LEU A 155 -9.514 -8.185 -2.067 1.00 0.00 N ATOM 2119 CA LEU A 155 -9.784 -7.351 -3.244 1.00 0.00 C ATOM 2120 C LEU A 155 -9.920 -8.223 -4.508 1.00 0.00 C ATOM 2121 O LEU A 155 -9.927 -9.453 -4.439 1.00 0.00 O ATOM 2122 CB LEU A 155 -8.740 -6.212 -3.397 1.00 0.00 C ATOM 2123 CG LEU A 155 -7.283 -6.651 -3.680 1.00 0.00 C ATOM 2124 CD1 LEU A 155 -6.615 -5.639 -4.623 1.00 0.00 C ATOM 2125 CD2 LEU A 155 -6.455 -6.756 -2.389 1.00 0.00 C ATOM 0 H LEU A 155 -9.306 -9.150 -2.326 1.00 0.00 H new ATOM 0 HA LEU A 155 -10.742 -6.852 -3.099 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -9.064 -5.558 -4.207 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -8.747 -5.617 -2.484 1.00 0.00 H new ATOM 0 HG LEU A 155 -7.319 -7.638 -4.141 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -5.589 -5.949 -4.822 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -7.169 -5.595 -5.561 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -6.612 -4.654 -4.157 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -5.439 -7.067 -2.633 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -6.429 -5.785 -1.894 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -6.909 -7.490 -1.724 1.00 0.00 H new ATOM 2137 N SER A 156 -10.024 -7.583 -5.667 1.00 0.00 N ATOM 2138 CA SER A 156 -9.953 -8.198 -6.997 1.00 0.00 C ATOM 2139 C SER A 156 -8.543 -8.744 -7.336 1.00 0.00 C ATOM 2140 O SER A 156 -7.576 -8.551 -6.596 1.00 0.00 O ATOM 2141 CB SER A 156 -10.395 -7.129 -8.012 1.00 0.00 C ATOM 2142 OG SER A 156 -9.660 -5.928 -7.802 1.00 0.00 O ATOM 0 H SER A 156 -10.167 -6.574 -5.712 1.00 0.00 H new ATOM 0 HA SER A 156 -10.609 -9.068 -7.029 1.00 0.00 H new ATOM 0 HB2 SER A 156 -10.235 -7.491 -9.028 1.00 0.00 H new ATOM 0 HB3 SER A 156 -11.463 -6.935 -7.908 1.00 0.00 H new ATOM 0 HG SER A 156 -10.208 -5.159 -8.064 1.00 0.00 H new ATOM 2148 N HIS A 157 -8.385 -9.417 -8.482 1.00 0.00 N ATOM 2149 CA HIS A 157 -7.110 -10.034 -8.897 1.00 0.00 C ATOM 2150 C HIS A 157 -6.041 -9.020 -9.392 1.00 0.00 C ATOM 2151 O HIS A 157 -4.958 -9.430 -9.817 1.00 0.00 O ATOM 2152 CB HIS A 157 -7.408 -11.123 -9.949 1.00 0.00 C ATOM 2153 CG HIS A 157 -7.953 -12.422 -9.391 1.00 0.00 C ATOM 2154 ND1 HIS A 157 -7.513 -13.684 -9.728 1.00 0.00 N ATOM 2155 CD2 HIS A 157 -8.959 -12.588 -8.472 1.00 0.00 C ATOM 2156 CE1 HIS A 157 -8.230 -14.582 -9.032 1.00 0.00 C ATOM 2157 NE2 HIS A 157 -9.130 -13.961 -8.247 1.00 0.00 N ATOM 0 H HIS A 157 -9.140 -9.552 -9.155 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.656 -10.482 -8.013 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -8.124 -10.726 -10.668 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -6.491 -11.337 -10.498 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -9.523 -11.796 -8.002 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -8.102 -15.653 -9.094 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -9.800 -14.400 -7.616 1.00 0.00 H new ATOM 2165 N HIS A 158 -6.324 -7.710 -9.346 1.00 0.00 N ATOM 2166 CA HIS A 158 -5.467 -6.607 -9.821 1.00 0.00 C ATOM 2167 C HIS A 158 -5.265 -6.647 -11.365 1.00 0.00 C ATOM 2168 O HIS A 158 -6.002 -7.331 -12.085 1.00 0.00 O ATOM 2169 CB HIS A 158 -4.164 -6.561 -8.986 1.00 0.00 C ATOM 2170 CG HIS A 158 -3.371 -5.277 -9.091 1.00 0.00 C ATOM 2171 ND1 HIS A 158 -3.775 -4.021 -8.690 1.00 0.00 N ATOM 2172 CD2 HIS A 158 -2.114 -5.142 -9.621 1.00 0.00 C ATOM 2173 CE1 HIS A 158 -2.790 -3.154 -8.985 1.00 0.00 C ATOM 2174 NE2 HIS A 158 -1.748 -3.792 -9.551 1.00 0.00 N ATOM 0 H HIS A 158 -7.203 -7.370 -8.956 1.00 0.00 H new ATOM 0 HA HIS A 158 -5.968 -5.653 -9.654 1.00 0.00 H new ATOM 0 HB2 HIS A 158 -4.417 -6.727 -7.939 1.00 0.00 H new ATOM 0 HB3 HIS A 158 -3.525 -7.389 -9.294 1.00 0.00 H new ATOM 0 HD2 HIS A 158 -1.509 -5.941 -10.024 1.00 0.00 H new ATOM 0 HE1 HIS A 158 -2.829 -2.092 -8.794 1.00 0.00 H new ATOM 0 HE2 HIS A 158 -0.871 -3.377 -9.865 1.00 0.00 H new ATOM 2182 N GLY A 159 -4.305 -5.881 -11.903 1.00 0.00 N ATOM 2183 CA GLY A 159 -3.976 -5.836 -13.339 1.00 0.00 C ATOM 2184 C GLY A 159 -4.731 -4.773 -14.152 1.00 0.00 C ATOM 2185 O GLY A 159 -4.584 -4.754 -15.377 1.00 0.00 O ATOM 0 H GLY A 159 -3.722 -5.261 -11.341 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -2.906 -5.658 -13.444 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -4.181 -6.815 -13.773 1.00 0.00 H new ATOM 2189 N THR A 160 -5.509 -3.903 -13.480 1.00 0.00 N ATOM 2190 CA THR A 160 -6.177 -2.687 -14.014 1.00 0.00 C ATOM 2191 C THR A 160 -7.441 -3.048 -14.821 1.00 0.00 C ATOM 2192 O THR A 160 -7.634 -4.209 -15.186 1.00 0.00 O ATOM 2193 CB THR A 160 -5.198 -1.792 -14.815 1.00 0.00 C ATOM 2194 OG1 THR A 160 -3.897 -1.858 -14.259 1.00 0.00 O ATOM 2195 CG2 THR A 160 -5.563 -0.304 -14.757 1.00 0.00 C ATOM 0 H THR A 160 -5.704 -4.033 -12.487 1.00 0.00 H new ATOM 0 HA THR A 160 -6.505 -2.093 -13.161 1.00 0.00 H new ATOM 0 HB THR A 160 -5.251 -2.166 -15.838 1.00 0.00 H new ATOM 0 HG1 THR A 160 -3.291 -1.289 -14.777 1.00 0.00 H new ATOM 0 HG21 THR A 160 -4.841 0.271 -15.337 1.00 0.00 H new ATOM 0 HG22 THR A 160 -6.560 -0.158 -15.172 1.00 0.00 H new ATOM 0 HG23 THR A 160 -5.548 0.034 -13.721 1.00 0.00 H new ATOM 2203 N LEU A 161 -8.327 -2.067 -15.060 1.00 0.00 N ATOM 2204 CA LEU A 161 -9.612 -2.187 -15.788 1.00 0.00 C ATOM 2205 C LEU A 161 -10.607 -3.098 -15.032 1.00 0.00 C ATOM 2206 O LEU A 161 -11.082 -4.115 -15.545 1.00 0.00 O ATOM 2207 CB LEU A 161 -9.405 -2.586 -17.277 1.00 0.00 C ATOM 2208 CG LEU A 161 -8.957 -1.485 -18.263 1.00 0.00 C ATOM 2209 CD1 LEU A 161 -10.034 -0.402 -18.436 1.00 0.00 C ATOM 2210 CD2 LEU A 161 -7.620 -0.829 -17.899 1.00 0.00 C ATOM 0 H LEU A 161 -8.162 -1.114 -14.735 1.00 0.00 H new ATOM 0 HA LEU A 161 -10.073 -1.200 -15.817 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -8.665 -3.386 -17.309 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -10.342 -3.004 -17.645 1.00 0.00 H new ATOM 0 HG LEU A 161 -8.810 -2.005 -19.209 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -9.680 0.354 -19.137 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -10.947 -0.855 -18.821 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -10.239 0.064 -17.472 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -7.375 -0.067 -18.639 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -7.697 -0.367 -16.915 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -6.836 -1.586 -17.884 1.00 0.00 H new ATOM 2222 N LEU A 162 -10.904 -2.726 -13.780 1.00 0.00 N ATOM 2223 CA LEU A 162 -11.680 -3.525 -12.812 1.00 0.00 C ATOM 2224 C LEU A 162 -12.976 -2.829 -12.333 1.00 0.00 C ATOM 2225 O LEU A 162 -13.595 -3.298 -11.375 1.00 0.00 O ATOM 2226 CB LEU A 162 -10.747 -3.877 -11.632 1.00 0.00 C ATOM 2227 CG LEU A 162 -9.484 -4.667 -12.035 1.00 0.00 C ATOM 2228 CD1 LEU A 162 -8.490 -4.722 -10.868 1.00 0.00 C ATOM 2229 CD2 LEU A 162 -9.813 -6.089 -12.513 1.00 0.00 C ATOM 0 H LEU A 162 -10.602 -1.830 -13.396 1.00 0.00 H new ATOM 0 HA LEU A 162 -12.027 -4.432 -13.308 1.00 0.00 H new ATOM 0 HB2 LEU A 162 -10.442 -2.955 -11.138 1.00 0.00 H new ATOM 0 HB3 LEU A 162 -11.308 -4.460 -10.902 1.00 0.00 H new ATOM 0 HG LEU A 162 -9.031 -4.137 -12.873 1.00 0.00 H new ATOM 0 HD11 LEU A 162 -7.605 -5.283 -11.170 1.00 0.00 H new ATOM 0 HD12 LEU A 162 -8.200 -3.709 -10.589 1.00 0.00 H new ATOM 0 HD13 LEU A 162 -8.958 -5.213 -10.015 1.00 0.00 H new ATOM 0 HD21 LEU A 162 -8.892 -6.604 -12.785 1.00 0.00 H new ATOM 0 HD22 LEU A 162 -10.311 -6.636 -11.713 1.00 0.00 H new ATOM 0 HD23 LEU A 162 -10.470 -6.038 -13.381 1.00 0.00 H new ATOM 2241 N ARG A 163 -13.368 -1.718 -12.984 1.00 0.00 N ATOM 2242 CA ARG A 163 -14.516 -0.837 -12.672 1.00 0.00 C ATOM 2243 C ARG A 163 -14.187 0.124 -11.502 1.00 0.00 C ATOM 2244 O ARG A 163 -13.160 -0.021 -10.834 1.00 0.00 O ATOM 2245 CB ARG A 163 -15.801 -1.661 -12.410 1.00 0.00 C ATOM 2246 CG ARG A 163 -17.124 -0.942 -12.741 1.00 0.00 C ATOM 2247 CD ARG A 163 -18.262 -1.315 -11.775 1.00 0.00 C ATOM 2248 NE ARG A 163 -18.324 -0.407 -10.607 1.00 0.00 N ATOM 2249 CZ ARG A 163 -17.780 -0.557 -9.403 1.00 0.00 C ATOM 2250 NH1 ARG A 163 -17.037 -1.592 -9.083 1.00 0.00 N1+ ATOM 2251 NH2 ARG A 163 -17.985 0.355 -8.479 1.00 0.00 N ATOM 0 H ARG A 163 -12.856 -1.386 -13.801 1.00 0.00 H new ATOM 0 HA ARG A 163 -14.710 -0.216 -13.546 1.00 0.00 H new ATOM 0 HB2 ARG A 163 -15.749 -2.579 -12.995 1.00 0.00 H new ATOM 0 HB3 ARG A 163 -15.818 -1.953 -11.360 1.00 0.00 H new ATOM 0 HG2 ARG A 163 -16.965 0.136 -12.709 1.00 0.00 H new ATOM 0 HG3 ARG A 163 -17.422 -1.190 -13.760 1.00 0.00 H new ATOM 0 HD2 ARG A 163 -19.213 -1.285 -12.307 1.00 0.00 H new ATOM 0 HD3 ARG A 163 -18.122 -2.339 -11.430 1.00 0.00 H new ATOM 0 HE ARG A 163 -18.857 0.451 -10.745 1.00 0.00 H new ATOM 0 HH11 ARG A 163 -16.857 -2.323 -9.771 1.00 0.00 H new ATOM 0 HH12 ARG A 163 -16.640 -1.665 -8.146 1.00 0.00 H new ATOM 0 HH21 ARG A 163 -18.559 1.172 -8.687 1.00 0.00 H new ATOM 0 HH22 ARG A 163 -17.570 0.246 -7.554 1.00 0.00 H new ATOM 2265 N GLY A 164 -15.066 1.103 -11.247 1.00 0.00 N ATOM 2266 CA GLY A 164 -14.949 2.102 -10.170 1.00 0.00 C ATOM 2267 C GLY A 164 -14.567 3.485 -10.699 1.00 0.00 C ATOM 2268 O GLY A 164 -13.479 3.663 -11.256 1.00 0.00 O ATOM 0 H GLY A 164 -15.911 1.228 -11.805 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -15.897 2.169 -9.635 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -14.200 1.771 -9.451 1.00 0.00 H new