USER MOD reduce.3.24.130724 H: found=0, std=0, add=777, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 780 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 127 TYR OH : rot -65:sc= 1.18 USER MOD Set 1.2: A 129 ASN : amide:sc= 0.497 K(o=1.7,f=-0.64) USER MOD Set 2.1: A 37 THR OG1 : rot 130:sc= 0.393 USER MOD Set 2.2: A 69 THR OG1 : rot 30:sc= 0.423 USER MOD Set 3.1: A 12 MET CE :methyl 160:sc= -0.103 (180deg=-0.364) USER MOD Set 3.2: A 68 THR OG1 : rot -71:sc= 1.01 USER MOD Set 4.1: A 16 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 98 THR OG1 : rot 180:sc= -0.213 USER MOD Single : A 13 TYR OH : rot 28:sc= 1.13 USER MOD Single : A 19 GLN : amide:sc= 2.48 K(o=2.5,f=-8!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0114 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -146:sc= 2.37 (180deg=0.711) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.0864 K(o=-0.086,f=-1.2) USER MOD Single : A 38 GLN : amide:sc= -0.139 K(o=-0.14,f=-1.2!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 177:sc= 1.1 (180deg=1.09) USER MOD Single : A 65 THR OG1 : rot -120:sc= -0.397 USER MOD Single : A 67 SER OG : rot 180:sc= 0.00713 USER MOD Single : A 71 LYS NZ :NH3+ -164:sc= 1.18 (180deg=0.595) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0112 USER MOD Single : A 93 MET CE :methyl -173:sc= -0.561 (180deg=-0.586) USER MOD Single : A 94 GLN : amide:sc= -0.0466 X(o=-0.047,f=0) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -0.0809 K(o=-0.081,f=-6.5!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ -139:sc= 1.27 (180deg=0.2) USER MOD Single : A 110 SER OG : rot -83:sc= 0.0198 USER MOD Single : A 125 ASN : amide:sc=-0.00163 X(o=-0.0016,f=-0.0016) USER MOD Single : A 128 TYR OH : rot 120:sc= -0.0118 USER MOD ----------------------------------------------------------------- ATOM 109 N GLY A 10 20.212 5.943 -2.119 1.00 0.00 N ATOM 110 CA GLY A 10 18.851 6.372 -2.345 1.00 0.00 C ATOM 111 C GLY A 10 18.164 6.332 -0.989 1.00 0.00 C ATOM 112 O GLY A 10 18.729 6.812 -0.002 1.00 0.00 O ATOM 0 HA2 GLY A 10 18.824 7.377 -2.766 1.00 0.00 H new ATOM 0 HA3 GLY A 10 18.349 5.716 -3.056 1.00 0.00 H new ATOM 116 N ALA A 11 16.990 5.714 -0.885 1.00 0.00 N ATOM 117 CA ALA A 11 16.185 5.759 0.320 1.00 0.00 C ATOM 118 C ALA A 11 15.565 4.398 0.589 1.00 0.00 C ATOM 119 O ALA A 11 15.192 3.678 -0.334 1.00 0.00 O ATOM 120 CB ALA A 11 15.111 6.839 0.163 1.00 0.00 C ATOM 0 H ALA A 11 16.574 5.168 -1.640 1.00 0.00 H new ATOM 0 HA ALA A 11 16.812 6.009 1.176 1.00 0.00 H new ATOM 0 HB1 ALA A 11 14.501 6.879 1.065 1.00 0.00 H new ATOM 0 HB2 ALA A 11 15.588 7.806 0.004 1.00 0.00 H new ATOM 0 HB3 ALA A 11 14.478 6.601 -0.692 1.00 0.00 H new ATOM 126 N MET A 12 15.429 4.055 1.864 1.00 0.00 N ATOM 127 CA MET A 12 14.410 3.113 2.285 1.00 0.00 C ATOM 128 C MET A 12 13.056 3.730 1.969 1.00 0.00 C ATOM 129 O MET A 12 12.903 4.944 2.117 1.00 0.00 O ATOM 130 CB MET A 12 14.504 2.875 3.794 1.00 0.00 C ATOM 131 CG MET A 12 15.872 2.316 4.183 1.00 0.00 C ATOM 132 SD MET A 12 15.856 1.217 5.616 1.00 0.00 S ATOM 133 CE MET A 12 15.064 -0.237 4.872 1.00 0.00 C ATOM 0 H MET A 12 16.012 4.416 2.619 1.00 0.00 H new ATOM 0 HA MET A 12 14.543 2.162 1.769 1.00 0.00 H new ATOM 0 HB2 MET A 12 14.327 3.811 4.324 1.00 0.00 H new ATOM 0 HB3 MET A 12 13.723 2.181 4.104 1.00 0.00 H new ATOM 0 HG2 MET A 12 16.284 1.775 3.331 1.00 0.00 H new ATOM 0 HG3 MET A 12 16.545 3.149 4.388 1.00 0.00 H new ATOM 0 HE1 MET A 12 15.283 -1.119 5.474 1.00 0.00 H new ATOM 0 HE2 MET A 12 13.986 -0.083 4.832 1.00 0.00 H new ATOM 0 HE3 MET A 12 15.447 -0.383 3.862 1.00 0.00 H new ATOM 143 N TYR A 13 12.080 2.899 1.628 1.00 0.00 N ATOM 144 CA TYR A 13 10.678 3.268 1.622 1.00 0.00 C ATOM 145 C TYR A 13 9.900 2.132 2.281 1.00 0.00 C ATOM 146 O TYR A 13 10.296 0.961 2.179 1.00 0.00 O ATOM 147 CB TYR A 13 10.163 3.525 0.202 1.00 0.00 C ATOM 148 CG TYR A 13 10.884 4.588 -0.605 1.00 0.00 C ATOM 149 CD1 TYR A 13 12.008 4.232 -1.370 1.00 0.00 C ATOM 150 CD2 TYR A 13 10.399 5.910 -0.653 1.00 0.00 C ATOM 151 CE1 TYR A 13 12.647 5.180 -2.184 1.00 0.00 C ATOM 152 CE2 TYR A 13 11.027 6.862 -1.477 1.00 0.00 C ATOM 153 CZ TYR A 13 12.150 6.500 -2.257 1.00 0.00 C ATOM 154 OH TYR A 13 12.754 7.431 -3.049 1.00 0.00 O ATOM 0 H TYR A 13 12.247 1.934 1.344 1.00 0.00 H new ATOM 0 HA TYR A 13 10.542 4.199 2.172 1.00 0.00 H new ATOM 0 HB2 TYR A 13 10.211 2.587 -0.352 1.00 0.00 H new ATOM 0 HB3 TYR A 13 9.111 3.803 0.267 1.00 0.00 H new ATOM 0 HD1 TYR A 13 12.383 3.220 -1.331 1.00 0.00 H new ATOM 0 HD2 TYR A 13 9.544 6.193 -0.057 1.00 0.00 H new ATOM 0 HE1 TYR A 13 13.520 4.900 -2.755 1.00 0.00 H new ATOM 0 HE2 TYR A 13 10.650 7.873 -1.514 1.00 0.00 H new ATOM 0 HH TYR A 13 13.193 6.984 -3.802 1.00 0.00 H new ATOM 164 N GLU A 14 8.802 2.486 2.943 1.00 0.00 N ATOM 165 CA GLU A 14 7.916 1.599 3.678 1.00 0.00 C ATOM 166 C GLU A 14 6.500 2.128 3.475 1.00 0.00 C ATOM 167 O GLU A 14 6.180 3.219 3.952 1.00 0.00 O ATOM 168 CB GLU A 14 8.330 1.593 5.156 1.00 0.00 C ATOM 169 CG GLU A 14 7.306 0.987 6.135 1.00 0.00 C ATOM 170 CD GLU A 14 7.721 1.297 7.574 1.00 0.00 C ATOM 171 OE1 GLU A 14 8.899 1.062 7.923 1.00 0.00 O ATOM 172 OE2 GLU A 14 6.936 1.885 8.352 1.00 0.00 O ATOM 0 H GLU A 14 8.492 3.457 2.981 1.00 0.00 H new ATOM 0 HA GLU A 14 7.969 0.568 3.328 1.00 0.00 H new ATOM 0 HB2 GLU A 14 9.265 1.041 5.250 1.00 0.00 H new ATOM 0 HB3 GLU A 14 8.533 2.619 5.461 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.314 1.394 5.937 1.00 0.00 H new ATOM 0 HG3 GLU A 14 7.243 -0.091 5.989 1.00 0.00 H new ATOM 179 N VAL A 15 5.671 1.403 2.728 1.00 0.00 N ATOM 180 CA VAL A 15 4.247 1.681 2.644 1.00 0.00 C ATOM 181 C VAL A 15 3.566 0.891 3.762 1.00 0.00 C ATOM 182 O VAL A 15 3.938 -0.242 4.083 1.00 0.00 O ATOM 183 CB VAL A 15 3.684 1.428 1.222 1.00 0.00 C ATOM 184 CG1 VAL A 15 3.835 -0.025 0.758 1.00 0.00 C ATOM 185 CG2 VAL A 15 2.205 1.826 1.111 1.00 0.00 C ATOM 0 H VAL A 15 5.971 0.607 2.165 1.00 0.00 H new ATOM 0 HA VAL A 15 4.039 2.740 2.800 1.00 0.00 H new ATOM 0 HB VAL A 15 4.287 2.060 0.570 1.00 0.00 H new ATOM 0 HG11 VAL A 15 3.421 -0.132 -0.244 1.00 0.00 H new ATOM 0 HG12 VAL A 15 4.891 -0.295 0.745 1.00 0.00 H new ATOM 0 HG13 VAL A 15 3.301 -0.683 1.443 1.00 0.00 H new ATOM 0 HG21 VAL A 15 1.851 1.632 0.098 1.00 0.00 H new ATOM 0 HG22 VAL A 15 1.617 1.242 1.819 1.00 0.00 H new ATOM 0 HG23 VAL A 15 2.096 2.887 1.337 1.00 0.00 H new ATOM 195 N THR A 16 2.547 1.497 4.354 1.00 0.00 N ATOM 196 CA THR A 16 1.630 0.846 5.269 1.00 0.00 C ATOM 197 C THR A 16 0.222 1.046 4.719 1.00 0.00 C ATOM 198 O THR A 16 -0.029 1.983 3.955 1.00 0.00 O ATOM 199 CB THR A 16 1.806 1.407 6.698 1.00 0.00 C ATOM 200 OG1 THR A 16 2.256 2.752 6.691 1.00 0.00 O ATOM 201 CG2 THR A 16 2.846 0.602 7.478 1.00 0.00 C ATOM 0 H THR A 16 2.332 2.483 4.205 1.00 0.00 H new ATOM 0 HA THR A 16 1.831 -0.223 5.345 1.00 0.00 H new ATOM 0 HB THR A 16 0.823 1.342 7.165 1.00 0.00 H new ATOM 0 HG1 THR A 16 2.353 3.069 7.613 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.951 1.017 8.480 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.524 -0.437 7.548 1.00 0.00 H new ATOM 0 HG23 THR A 16 3.805 0.651 6.963 1.00 0.00 H new ATOM 209 N ILE A 17 -0.686 0.155 5.103 1.00 0.00 N ATOM 210 CA ILE A 17 -2.112 0.278 4.881 1.00 0.00 C ATOM 211 C ILE A 17 -2.780 -0.179 6.172 1.00 0.00 C ATOM 212 O ILE A 17 -2.286 -1.118 6.802 1.00 0.00 O ATOM 213 CB ILE A 17 -2.514 -0.541 3.632 1.00 0.00 C ATOM 214 CG1 ILE A 17 -3.995 -0.458 3.234 1.00 0.00 C ATOM 215 CG2 ILE A 17 -2.200 -2.030 3.765 1.00 0.00 C ATOM 216 CD1 ILE A 17 -4.480 0.969 3.047 1.00 0.00 C ATOM 0 H ILE A 17 -0.434 -0.702 5.595 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.431 1.298 4.666 1.00 0.00 H new ATOM 0 HB ILE A 17 -1.908 -0.066 2.860 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.148 -1.012 2.308 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.599 -0.944 4.000 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.506 -2.549 2.856 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.129 -2.164 3.916 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.741 -2.441 4.617 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.533 0.962 2.767 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -4.357 1.520 3.979 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -3.899 1.451 2.261 1.00 0.00 H new ATOM 228 N GLU A 18 -3.877 0.468 6.550 1.00 0.00 N ATOM 229 CA GLU A 18 -4.757 0.104 7.655 1.00 0.00 C ATOM 230 C GLU A 18 -6.163 0.112 7.064 1.00 0.00 C ATOM 231 O GLU A 18 -6.763 1.173 6.846 1.00 0.00 O ATOM 232 CB GLU A 18 -4.596 1.087 8.824 1.00 0.00 C ATOM 233 CG GLU A 18 -3.325 0.806 9.644 1.00 0.00 C ATOM 234 CD GLU A 18 -3.483 -0.176 10.807 1.00 0.00 C ATOM 235 OE1 GLU A 18 -4.532 -0.826 10.970 1.00 0.00 O ATOM 236 OE2 GLU A 18 -2.484 -0.333 11.554 1.00 0.00 O ATOM 0 H GLU A 18 -4.194 1.308 6.066 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.523 -0.874 8.075 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.560 2.106 8.438 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -5.468 1.023 9.474 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.559 0.421 8.971 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.955 1.752 10.040 1.00 0.00 H new ATOM 243 N GLN A 19 -6.627 -1.077 6.687 1.00 0.00 N ATOM 244 CA GLN A 19 -7.960 -1.335 6.182 1.00 0.00 C ATOM 245 C GLN A 19 -8.867 -1.508 7.391 1.00 0.00 C ATOM 246 O GLN A 19 -8.588 -2.328 8.271 1.00 0.00 O ATOM 247 CB GLN A 19 -7.991 -2.610 5.323 1.00 0.00 C ATOM 248 CG GLN A 19 -6.901 -2.647 4.247 1.00 0.00 C ATOM 249 CD GLN A 19 -7.254 -3.624 3.133 1.00 0.00 C ATOM 250 OE1 GLN A 19 -8.020 -3.282 2.240 1.00 0.00 O ATOM 251 NE2 GLN A 19 -6.701 -4.822 3.159 1.00 0.00 N ATOM 0 H GLN A 19 -6.054 -1.920 6.730 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.288 -0.509 5.551 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.880 -3.479 5.972 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -8.967 -2.693 4.844 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.766 -1.649 3.829 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -5.951 -2.935 4.698 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.067 -5.075 3.917 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -6.907 -5.495 2.421 1.00 0.00 H new ATOM 260 N SER A 20 -9.946 -0.736 7.456 1.00 0.00 N ATOM 261 CA SER A 20 -10.924 -0.876 8.517 1.00 0.00 C ATOM 262 C SER A 20 -12.286 -0.444 8.015 1.00 0.00 C ATOM 263 O SER A 20 -12.399 0.156 6.945 1.00 0.00 O ATOM 264 CB SER A 20 -10.445 -0.069 9.722 1.00 0.00 C ATOM 265 OG SER A 20 -11.252 -0.246 10.867 1.00 0.00 O ATOM 0 H SER A 20 -10.162 -0.004 6.780 1.00 0.00 H new ATOM 0 HA SER A 20 -11.025 -1.915 8.830 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.421 -0.356 9.960 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.426 0.989 9.459 1.00 0.00 H new ATOM 0 HG SER A 20 -10.896 0.292 11.604 1.00 0.00 H new ATOM 271 N GLY A 21 -13.308 -0.762 8.804 1.00 0.00 N ATOM 272 CA GLY A 21 -14.678 -0.840 8.340 1.00 0.00 C ATOM 273 C GLY A 21 -14.836 -2.030 7.392 1.00 0.00 C ATOM 274 O GLY A 21 -14.049 -2.976 7.454 1.00 0.00 O ATOM 0 H GLY A 21 -13.200 -0.975 9.796 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.354 -0.947 9.189 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -14.952 0.083 7.829 1.00 0.00 H new ATOM 278 N ASP A 22 -15.856 -2.023 6.534 1.00 0.00 N ATOM 279 CA ASP A 22 -16.249 -3.180 5.716 1.00 0.00 C ATOM 280 C ASP A 22 -15.332 -3.423 4.503 1.00 0.00 C ATOM 281 O ASP A 22 -15.782 -3.562 3.369 1.00 0.00 O ATOM 282 CB ASP A 22 -17.719 -3.059 5.292 1.00 0.00 C ATOM 283 CG ASP A 22 -18.233 -4.368 4.678 1.00 0.00 C ATOM 284 OD1 ASP A 22 -17.887 -5.458 5.197 1.00 0.00 O ATOM 285 OD2 ASP A 22 -19.059 -4.331 3.744 1.00 0.00 O ATOM 0 H ASP A 22 -16.444 -1.203 6.382 1.00 0.00 H new ATOM 0 HA ASP A 22 -16.131 -4.061 6.348 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -18.328 -2.797 6.157 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -17.826 -2.250 4.570 1.00 0.00 H new ATOM 290 N PHE A 23 -14.019 -3.503 4.721 1.00 0.00 N ATOM 291 CA PHE A 23 -13.015 -3.621 3.663 1.00 0.00 C ATOM 292 C PHE A 23 -13.104 -4.919 2.844 1.00 0.00 C ATOM 293 O PHE A 23 -12.379 -5.053 1.858 1.00 0.00 O ATOM 294 CB PHE A 23 -11.609 -3.459 4.268 1.00 0.00 C ATOM 295 CG PHE A 23 -11.190 -4.546 5.249 1.00 0.00 C ATOM 296 CD1 PHE A 23 -10.775 -5.809 4.782 1.00 0.00 C ATOM 297 CD2 PHE A 23 -11.222 -4.304 6.635 1.00 0.00 C ATOM 298 CE1 PHE A 23 -10.430 -6.827 5.690 1.00 0.00 C ATOM 299 CE2 PHE A 23 -10.860 -5.314 7.544 1.00 0.00 C ATOM 300 CZ PHE A 23 -10.468 -6.578 7.072 1.00 0.00 C ATOM 0 H PHE A 23 -13.615 -3.487 5.658 1.00 0.00 H new ATOM 0 HA PHE A 23 -13.221 -2.820 2.953 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -10.884 -3.428 3.455 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -11.560 -2.496 4.776 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -10.721 -5.997 3.720 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -11.527 -3.336 7.003 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.136 -7.800 5.324 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -10.883 -5.118 8.606 1.00 0.00 H new ATOM 0 HZ PHE A 23 -10.197 -7.356 7.770 1.00 0.00 H new ATOM 310 N ARG A 24 -13.935 -5.889 3.244 1.00 0.00 N ATOM 311 CA ARG A 24 -13.998 -7.203 2.609 1.00 0.00 C ATOM 312 C ARG A 24 -14.348 -7.050 1.134 1.00 0.00 C ATOM 313 O ARG A 24 -13.562 -7.440 0.271 1.00 0.00 O ATOM 314 CB ARG A 24 -15.018 -8.131 3.291 1.00 0.00 C ATOM 315 CG ARG A 24 -14.790 -8.391 4.787 1.00 0.00 C ATOM 316 CD ARG A 24 -15.787 -7.582 5.623 1.00 0.00 C ATOM 317 NE ARG A 24 -15.720 -7.905 7.053 1.00 0.00 N ATOM 318 CZ ARG A 24 -16.293 -7.185 8.026 1.00 0.00 C ATOM 319 NH1 ARG A 24 -17.069 -6.144 7.747 1.00 0.00 N ATOM 320 NH2 ARG A 24 -16.083 -7.513 9.293 1.00 0.00 N ATOM 0 H ARG A 24 -14.585 -5.780 4.022 1.00 0.00 H new ATOM 0 HA ARG A 24 -13.015 -7.662 2.713 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -16.012 -7.703 3.163 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.014 -9.089 2.770 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -14.904 -9.454 5.000 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -13.770 -8.119 5.060 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -15.592 -6.519 5.485 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -16.797 -7.770 5.259 1.00 0.00 H new ATOM 0 HE ARG A 24 -15.199 -8.739 7.326 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -17.238 -5.880 6.777 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -17.496 -5.609 8.503 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -15.488 -8.309 9.522 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -16.516 -6.969 10.039 1.00 0.00 H new ATOM 334 N SER A 25 -15.517 -6.476 0.856 1.00 0.00 N ATOM 335 CA SER A 25 -16.175 -6.449 -0.445 1.00 0.00 C ATOM 336 C SER A 25 -15.597 -5.399 -1.395 1.00 0.00 C ATOM 337 O SER A 25 -16.310 -4.905 -2.264 1.00 0.00 O ATOM 338 CB SER A 25 -17.676 -6.246 -0.209 1.00 0.00 C ATOM 339 OG SER A 25 -18.117 -7.220 0.725 1.00 0.00 O ATOM 0 H SER A 25 -16.058 -5.992 1.572 1.00 0.00 H new ATOM 0 HA SER A 25 -15.997 -7.399 -0.949 1.00 0.00 H new ATOM 0 HB2 SER A 25 -17.868 -5.242 0.170 1.00 0.00 H new ATOM 0 HB3 SER A 25 -18.224 -6.343 -1.146 1.00 0.00 H new ATOM 0 HG SER A 25 -19.076 -7.104 0.890 1.00 0.00 H new ATOM 345 N PHE A 26 -14.319 -5.050 -1.260 1.00 0.00 N ATOM 346 CA PHE A 26 -13.693 -3.958 -1.984 1.00 0.00 C ATOM 347 C PHE A 26 -12.488 -4.502 -2.734 1.00 0.00 C ATOM 348 O PHE A 26 -11.610 -5.096 -2.117 1.00 0.00 O ATOM 349 CB PHE A 26 -13.326 -2.852 -0.990 1.00 0.00 C ATOM 350 CG PHE A 26 -14.525 -2.020 -0.578 1.00 0.00 C ATOM 351 CD1 PHE A 26 -15.454 -2.531 0.347 1.00 0.00 C ATOM 352 CD2 PHE A 26 -14.746 -0.757 -1.160 1.00 0.00 C ATOM 353 CE1 PHE A 26 -16.618 -1.812 0.654 1.00 0.00 C ATOM 354 CE2 PHE A 26 -15.894 -0.022 -0.826 1.00 0.00 C ATOM 355 CZ PHE A 26 -16.839 -0.556 0.066 1.00 0.00 C ATOM 0 H PHE A 26 -13.680 -5.533 -0.629 1.00 0.00 H new ATOM 0 HA PHE A 26 -14.369 -3.522 -2.719 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -12.876 -3.299 -0.104 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -12.573 -2.202 -1.436 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -15.269 -3.483 0.823 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.032 -0.354 -1.863 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -17.343 -2.223 1.341 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.051 0.956 -1.256 1.00 0.00 H new ATOM 0 HZ PHE A 26 -17.735 -0.001 0.299 1.00 0.00 H new ATOM 365 N ILE A 27 -12.426 -4.337 -4.058 1.00 0.00 N ATOM 366 CA ILE A 27 -11.323 -4.888 -4.848 1.00 0.00 C ATOM 367 C ILE A 27 -10.044 -4.107 -4.529 1.00 0.00 C ATOM 368 O ILE A 27 -9.821 -3.018 -5.062 1.00 0.00 O ATOM 369 CB ILE A 27 -11.613 -4.890 -6.365 1.00 0.00 C ATOM 370 CG1 ILE A 27 -12.992 -5.467 -6.749 1.00 0.00 C ATOM 371 CG2 ILE A 27 -10.461 -5.631 -7.081 1.00 0.00 C ATOM 372 CD1 ILE A 27 -13.121 -6.982 -6.568 1.00 0.00 C ATOM 0 H ILE A 27 -13.123 -3.829 -4.603 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.197 -5.935 -4.571 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.661 -3.852 -6.694 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -13.757 -4.976 -6.148 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.198 -5.220 -7.790 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -10.648 -5.643 -8.155 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -9.520 -5.119 -6.882 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -10.402 -6.655 -6.712 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -14.122 -7.300 -6.862 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.383 -7.487 -7.191 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -12.951 -7.239 -5.523 1.00 0.00 H new ATOM 384 N LYS A 28 -9.204 -4.646 -3.651 1.00 0.00 N ATOM 385 CA LYS A 28 -7.940 -4.036 -3.265 1.00 0.00 C ATOM 386 C LYS A 28 -6.923 -4.225 -4.393 1.00 0.00 C ATOM 387 O LYS A 28 -6.731 -5.353 -4.849 1.00 0.00 O ATOM 388 CB LYS A 28 -7.420 -4.669 -1.961 1.00 0.00 C ATOM 389 CG LYS A 28 -8.436 -4.840 -0.815 1.00 0.00 C ATOM 390 CD LYS A 28 -9.004 -6.265 -0.776 1.00 0.00 C ATOM 391 CE LYS A 28 -10.203 -6.382 0.169 1.00 0.00 C ATOM 392 NZ LYS A 28 -10.741 -7.756 0.182 1.00 0.00 N ATOM 0 H LYS A 28 -9.387 -5.533 -3.181 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.090 -2.970 -3.091 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -7.010 -5.650 -2.200 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.594 -4.060 -1.594 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.955 -4.613 0.136 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -9.250 -4.126 -0.939 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -9.305 -6.563 -1.781 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.224 -6.957 -0.459 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.904 -6.096 1.177 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -10.983 -5.686 -0.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.773 -7.724 0.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -10.517 -8.225 -0.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.313 -8.289 0.966 1.00 0.00 H new ATOM 406 N SER A 29 -6.229 -3.161 -4.799 1.00 0.00 N ATOM 407 CA SER A 29 -5.081 -3.223 -5.691 1.00 0.00 C ATOM 408 C SER A 29 -4.002 -2.273 -5.165 1.00 0.00 C ATOM 409 O SER A 29 -4.325 -1.128 -4.841 1.00 0.00 O ATOM 410 CB SER A 29 -5.515 -2.761 -7.086 1.00 0.00 C ATOM 411 OG SER A 29 -6.467 -3.619 -7.698 1.00 0.00 O ATOM 0 H SER A 29 -6.459 -2.211 -4.507 1.00 0.00 H new ATOM 0 HA SER A 29 -4.694 -4.241 -5.740 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.936 -1.758 -7.013 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.636 -2.692 -7.727 1.00 0.00 H new ATOM 0 HG SER A 29 -6.703 -3.268 -8.582 1.00 0.00 H new ATOM 417 N VAL A 30 -2.738 -2.713 -5.114 1.00 0.00 N ATOM 418 CA VAL A 30 -1.571 -1.847 -4.920 1.00 0.00 C ATOM 419 C VAL A 30 -0.470 -2.309 -5.882 1.00 0.00 C ATOM 420 O VAL A 30 0.051 -3.418 -5.751 1.00 0.00 O ATOM 421 CB VAL A 30 -1.085 -1.831 -3.453 1.00 0.00 C ATOM 422 CG1 VAL A 30 0.170 -0.963 -3.265 1.00 0.00 C ATOM 423 CG2 VAL A 30 -2.151 -1.300 -2.479 1.00 0.00 C ATOM 0 H VAL A 30 -2.495 -3.699 -5.208 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.848 -0.816 -5.142 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.863 -2.874 -3.228 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.473 -0.983 -2.218 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.978 -1.353 -3.884 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.050 0.063 -3.559 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.754 -1.312 -1.464 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.418 -0.279 -2.753 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.037 -1.933 -2.529 1.00 0.00 H new ATOM 433 N VAL A 31 -0.110 -1.477 -6.862 1.00 0.00 N ATOM 434 CA VAL A 31 1.189 -1.581 -7.529 1.00 0.00 C ATOM 435 C VAL A 31 2.263 -1.142 -6.526 1.00 0.00 C ATOM 436 O VAL A 31 2.100 -0.114 -5.868 1.00 0.00 O ATOM 437 CB VAL A 31 1.183 -0.772 -8.852 1.00 0.00 C ATOM 438 CG1 VAL A 31 1.010 0.734 -8.669 1.00 0.00 C ATOM 439 CG2 VAL A 31 2.428 -0.977 -9.715 1.00 0.00 C ATOM 0 H VAL A 31 -0.701 -0.723 -7.211 1.00 0.00 H new ATOM 0 HA VAL A 31 1.412 -2.605 -7.828 1.00 0.00 H new ATOM 0 HB VAL A 31 0.309 -1.182 -9.358 1.00 0.00 H new ATOM 0 HG11 VAL A 31 1.017 1.222 -9.644 1.00 0.00 H new ATOM 0 HG12 VAL A 31 0.062 0.933 -8.170 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.828 1.123 -8.062 1.00 0.00 H new ATOM 0 HG21 VAL A 31 2.345 -0.377 -10.621 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.312 -0.671 -9.156 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.515 -2.030 -9.984 1.00 0.00 H new ATOM 449 N VAL A 32 3.340 -1.917 -6.396 1.00 0.00 N ATOM 450 CA VAL A 32 4.508 -1.642 -5.565 1.00 0.00 C ATOM 451 C VAL A 32 5.765 -1.876 -6.414 1.00 0.00 C ATOM 452 O VAL A 32 5.778 -2.726 -7.311 1.00 0.00 O ATOM 453 CB VAL A 32 4.420 -2.424 -4.234 1.00 0.00 C ATOM 454 CG1 VAL A 32 3.979 -3.873 -4.423 1.00 0.00 C ATOM 455 CG2 VAL A 32 5.740 -2.445 -3.448 1.00 0.00 C ATOM 0 H VAL A 32 3.423 -2.802 -6.896 1.00 0.00 H new ATOM 0 HA VAL A 32 4.555 -0.602 -5.243 1.00 0.00 H new ATOM 0 HB VAL A 32 3.668 -1.876 -3.667 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.936 -4.370 -3.454 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.993 -3.896 -4.886 1.00 0.00 H new ATOM 0 HG13 VAL A 32 4.693 -4.390 -5.064 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.605 -3.010 -2.526 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.516 -2.915 -4.052 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.037 -1.424 -3.208 1.00 0.00 H new ATOM 465 N VAL A 33 6.798 -1.057 -6.206 1.00 0.00 N ATOM 466 CA VAL A 33 8.006 -1.008 -7.030 1.00 0.00 C ATOM 467 C VAL A 33 9.204 -0.813 -6.092 1.00 0.00 C ATOM 468 O VAL A 33 9.042 -0.331 -4.967 1.00 0.00 O ATOM 469 CB VAL A 33 7.871 0.122 -8.087 1.00 0.00 C ATOM 470 CG1 VAL A 33 9.058 0.165 -9.063 1.00 0.00 C ATOM 471 CG2 VAL A 33 6.588 -0.008 -8.929 1.00 0.00 C ATOM 0 H VAL A 33 6.817 -0.389 -5.435 1.00 0.00 H new ATOM 0 HA VAL A 33 8.154 -1.933 -7.587 1.00 0.00 H new ATOM 0 HB VAL A 33 7.841 1.040 -7.500 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.911 0.973 -9.779 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.980 0.336 -8.507 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.126 -0.784 -9.595 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.543 0.807 -9.652 1.00 0.00 H new ATOM 0 HG22 VAL A 33 6.594 -0.962 -9.457 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.717 0.039 -8.275 1.00 0.00 H new ATOM 481 N ALA A 34 10.411 -1.172 -6.536 1.00 0.00 N ATOM 482 CA ALA A 34 11.659 -0.838 -5.874 1.00 0.00 C ATOM 483 C ALA A 34 12.769 -0.807 -6.909 1.00 0.00 C ATOM 484 O ALA A 34 12.710 -1.538 -7.901 1.00 0.00 O ATOM 485 CB ALA A 34 11.999 -1.885 -4.806 1.00 0.00 C ATOM 0 H ALA A 34 10.543 -1.717 -7.388 1.00 0.00 H new ATOM 0 HA ALA A 34 11.557 0.135 -5.393 1.00 0.00 H new ATOM 0 HB1 ALA A 34 12.938 -1.618 -4.320 1.00 0.00 H new ATOM 0 HB2 ALA A 34 11.203 -1.918 -4.063 1.00 0.00 H new ATOM 0 HB3 ALA A 34 12.099 -2.864 -5.275 1.00 0.00 H new ATOM 491 N ASN A 35 13.813 -0.035 -6.609 1.00 0.00 N ATOM 492 CA ASN A 35 15.003 0.114 -7.431 1.00 0.00 C ATOM 493 C ASN A 35 16.215 -0.369 -6.662 1.00 0.00 C ATOM 494 O ASN A 35 16.707 0.306 -5.762 1.00 0.00 O ATOM 495 CB ASN A 35 15.212 1.565 -7.832 1.00 0.00 C ATOM 496 CG ASN A 35 16.154 1.741 -8.996 1.00 0.00 C ATOM 497 OD1 ASN A 35 17.288 1.261 -8.992 1.00 0.00 O ATOM 498 ND2 ASN A 35 15.658 2.448 -9.992 1.00 0.00 N ATOM 0 H ASN A 35 13.850 0.522 -5.755 1.00 0.00 H new ATOM 0 HA ASN A 35 14.870 -0.481 -8.334 1.00 0.00 H new ATOM 0 HB2 ASN A 35 14.248 2.005 -8.086 1.00 0.00 H new ATOM 0 HB3 ASN A 35 15.599 2.118 -6.976 1.00 0.00 H new ATOM 0 HD21 ASN A 35 16.223 2.625 -10.823 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.709 2.818 -9.932 1.00 0.00 H new ATOM 505 N GLY A 36 16.658 -1.565 -6.982 1.00 0.00 N ATOM 506 CA GLY A 36 17.882 -2.173 -6.516 1.00 0.00 C ATOM 507 C GLY A 36 17.470 -3.291 -5.588 1.00 0.00 C ATOM 508 O GLY A 36 17.377 -4.452 -5.996 1.00 0.00 O ATOM 0 H GLY A 36 16.140 -2.175 -7.614 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.469 -2.556 -7.351 1.00 0.00 H new ATOM 0 HA3 GLY A 36 18.505 -1.445 -5.996 1.00 0.00 H new ATOM 512 N THR A 37 17.152 -2.879 -4.370 1.00 0.00 N ATOM 513 CA THR A 37 16.821 -3.743 -3.252 1.00 0.00 C ATOM 514 C THR A 37 15.455 -4.400 -3.468 1.00 0.00 C ATOM 515 O THR A 37 14.718 -4.076 -4.409 1.00 0.00 O ATOM 516 CB THR A 37 16.926 -2.910 -1.963 1.00 0.00 C ATOM 517 OG1 THR A 37 17.139 -3.670 -0.806 1.00 0.00 O ATOM 518 CG2 THR A 37 15.676 -2.075 -1.712 1.00 0.00 C ATOM 0 H THR A 37 17.117 -1.889 -4.126 1.00 0.00 H new ATOM 0 HA THR A 37 17.521 -4.574 -3.166 1.00 0.00 H new ATOM 0 HB THR A 37 17.795 -2.277 -2.143 1.00 0.00 H new ATOM 0 HG1 THR A 37 17.893 -3.297 -0.304 1.00 0.00 H new ATOM 0 HG21 THR A 37 15.798 -1.505 -0.791 1.00 0.00 H new ATOM 0 HG22 THR A 37 15.523 -1.390 -2.546 1.00 0.00 H new ATOM 0 HG23 THR A 37 14.812 -2.733 -1.620 1.00 0.00 H new ATOM 526 N GLN A 38 15.097 -5.298 -2.556 1.00 0.00 N ATOM 527 CA GLN A 38 13.889 -6.092 -2.628 1.00 0.00 C ATOM 528 C GLN A 38 12.891 -5.670 -1.562 1.00 0.00 C ATOM 529 O GLN A 38 13.168 -4.812 -0.725 1.00 0.00 O ATOM 530 CB GLN A 38 14.276 -7.567 -2.565 1.00 0.00 C ATOM 531 CG GLN A 38 14.804 -8.054 -3.927 1.00 0.00 C ATOM 532 CD GLN A 38 16.027 -8.956 -3.832 1.00 0.00 C ATOM 533 OE1 GLN A 38 16.839 -8.829 -2.919 1.00 0.00 O ATOM 534 NE2 GLN A 38 16.229 -9.828 -4.798 1.00 0.00 N ATOM 0 H GLN A 38 15.658 -5.494 -1.727 1.00 0.00 H new ATOM 0 HA GLN A 38 13.374 -5.925 -3.574 1.00 0.00 H new ATOM 0 HB2 GLN A 38 15.039 -7.715 -1.801 1.00 0.00 H new ATOM 0 HB3 GLN A 38 13.411 -8.162 -2.272 1.00 0.00 H new ATOM 0 HG2 GLN A 38 14.008 -8.592 -4.442 1.00 0.00 H new ATOM 0 HG3 GLN A 38 15.052 -7.187 -4.540 1.00 0.00 H new ATOM 0 HE21 GLN A 38 15.547 -9.923 -5.550 1.00 0.00 H new ATOM 0 HE22 GLN A 38 17.068 -10.408 -4.794 1.00 0.00 H new ATOM 543 N LEU A 39 11.695 -6.244 -1.649 1.00 0.00 N ATOM 544 CA LEU A 39 10.582 -6.000 -0.744 1.00 0.00 C ATOM 545 C LEU A 39 10.517 -7.142 0.256 1.00 0.00 C ATOM 546 O LEU A 39 11.093 -8.211 0.039 1.00 0.00 O ATOM 547 CB LEU A 39 9.271 -5.912 -1.555 1.00 0.00 C ATOM 548 CG LEU A 39 8.748 -4.499 -1.867 1.00 0.00 C ATOM 549 CD1 LEU A 39 7.906 -3.973 -0.713 1.00 0.00 C ATOM 550 CD2 LEU A 39 9.848 -3.492 -2.192 1.00 0.00 C ATOM 0 H LEU A 39 11.468 -6.917 -2.381 1.00 0.00 H new ATOM 0 HA LEU A 39 10.720 -5.060 -0.211 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.418 -6.437 -2.499 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.496 -6.449 -1.009 1.00 0.00 H new ATOM 0 HG LEU A 39 8.139 -4.603 -2.765 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.545 -2.973 -0.952 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.056 -4.636 -0.551 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.513 -3.933 0.192 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.401 -2.520 -2.401 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.525 -3.405 -1.342 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.405 -3.831 -3.066 1.00 0.00 H new ATOM 562 N LYS A 40 9.777 -6.927 1.334 1.00 0.00 N ATOM 563 CA LYS A 40 9.526 -7.936 2.354 1.00 0.00 C ATOM 564 C LYS A 40 8.076 -7.874 2.786 1.00 0.00 C ATOM 565 O LYS A 40 7.623 -6.803 3.211 1.00 0.00 O ATOM 566 CB LYS A 40 10.458 -7.649 3.521 1.00 0.00 C ATOM 567 CG LYS A 40 10.426 -8.725 4.604 1.00 0.00 C ATOM 568 CD LYS A 40 11.388 -8.322 5.723 1.00 0.00 C ATOM 569 CE LYS A 40 11.219 -9.276 6.904 1.00 0.00 C ATOM 570 NZ LYS A 40 11.637 -8.648 8.170 1.00 0.00 N ATOM 0 H LYS A 40 9.327 -6.033 1.528 1.00 0.00 H new ATOM 0 HA LYS A 40 9.713 -8.939 1.971 1.00 0.00 H new ATOM 0 HB2 LYS A 40 11.477 -7.552 3.147 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.188 -6.690 3.964 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.415 -8.836 4.996 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.714 -9.690 4.187 1.00 0.00 H new ATOM 0 HD2 LYS A 40 12.416 -8.351 5.362 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.189 -7.297 6.037 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.176 -9.585 6.977 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.807 -10.177 6.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 11.509 -9.323 8.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.639 -8.375 8.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.058 -7.802 8.345 1.00 0.00 H new ATOM 584 N ASP A 41 7.366 -8.994 2.688 1.00 0.00 N ATOM 585 CA ASP A 41 5.985 -9.053 3.158 1.00 0.00 C ATOM 586 C ASP A 41 5.964 -9.078 4.680 1.00 0.00 C ATOM 587 O ASP A 41 6.613 -9.925 5.293 1.00 0.00 O ATOM 588 CB ASP A 41 5.183 -10.240 2.621 1.00 0.00 C ATOM 589 CG ASP A 41 3.706 -9.845 2.725 1.00 0.00 C ATOM 590 OD1 ASP A 41 3.173 -9.809 3.862 1.00 0.00 O ATOM 591 OD2 ASP A 41 3.126 -9.409 1.716 1.00 0.00 O ATOM 0 H ASP A 41 7.719 -9.865 2.292 1.00 0.00 H new ATOM 0 HA ASP A 41 5.499 -8.158 2.769 1.00 0.00 H new ATOM 0 HB2 ASP A 41 5.455 -10.458 1.588 1.00 0.00 H new ATOM 0 HB3 ASP A 41 5.386 -11.140 3.201 1.00 0.00 H new ATOM 596 N GLY A 42 5.216 -8.172 5.303 1.00 0.00 N ATOM 597 CA GLY A 42 5.075 -8.105 6.747 1.00 0.00 C ATOM 598 C GLY A 42 4.193 -9.206 7.347 1.00 0.00 C ATOM 599 O GLY A 42 3.876 -9.100 8.532 1.00 0.00 O ATOM 0 H GLY A 42 4.685 -7.455 4.808 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.065 -8.162 7.200 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.657 -7.135 7.015 1.00 0.00 H new ATOM 603 N ALA A 43 3.733 -10.202 6.583 1.00 0.00 N ATOM 604 CA ALA A 43 3.046 -11.383 7.094 1.00 0.00 C ATOM 605 C ALA A 43 4.070 -12.320 7.728 1.00 0.00 C ATOM 606 O ALA A 43 4.022 -12.573 8.931 1.00 0.00 O ATOM 607 CB ALA A 43 2.298 -12.094 5.959 1.00 0.00 C ATOM 0 H ALA A 43 3.833 -10.205 5.568 1.00 0.00 H new ATOM 0 HA ALA A 43 2.316 -11.084 7.846 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.789 -12.974 6.353 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.564 -11.415 5.525 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.008 -12.400 5.191 1.00 0.00 H new ATOM 613 N THR A 44 5.016 -12.811 6.930 1.00 0.00 N ATOM 614 CA THR A 44 5.952 -13.876 7.303 1.00 0.00 C ATOM 615 C THR A 44 7.397 -13.503 6.972 1.00 0.00 C ATOM 616 O THR A 44 8.305 -14.327 7.080 1.00 0.00 O ATOM 617 CB THR A 44 5.522 -15.227 6.679 1.00 0.00 C ATOM 618 OG1 THR A 44 4.652 -15.074 5.566 1.00 0.00 O ATOM 619 CG2 THR A 44 4.772 -16.050 7.726 1.00 0.00 C ATOM 0 H THR A 44 5.159 -12.471 5.979 1.00 0.00 H new ATOM 0 HA THR A 44 5.916 -13.998 8.386 1.00 0.00 H new ATOM 0 HB THR A 44 6.436 -15.716 6.342 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.415 -15.957 5.212 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.467 -17.002 7.291 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.424 -16.233 8.580 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.889 -15.502 8.055 1.00 0.00 H new ATOM 627 N GLY A 45 7.631 -12.256 6.558 1.00 0.00 N ATOM 628 CA GLY A 45 8.946 -11.819 6.137 1.00 0.00 C ATOM 629 C GLY A 45 9.372 -12.558 4.878 1.00 0.00 C ATOM 630 O GLY A 45 10.550 -12.861 4.727 1.00 0.00 O ATOM 0 H GLY A 45 6.914 -11.532 6.508 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.937 -10.745 5.951 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.668 -11.998 6.934 1.00 0.00 H new ATOM 634 N GLU A 46 8.415 -12.909 4.018 1.00 0.00 N ATOM 635 CA GLU A 46 8.686 -13.530 2.732 1.00 0.00 C ATOM 636 C GLU A 46 9.422 -12.474 1.905 1.00 0.00 C ATOM 637 O GLU A 46 8.976 -11.322 1.834 1.00 0.00 O ATOM 638 CB GLU A 46 7.369 -13.984 2.077 1.00 0.00 C ATOM 639 CG GLU A 46 6.624 -15.073 2.888 1.00 0.00 C ATOM 640 CD GLU A 46 6.577 -16.454 2.216 1.00 0.00 C ATOM 641 OE1 GLU A 46 6.328 -16.548 0.991 1.00 0.00 O ATOM 642 OE2 GLU A 46 6.792 -17.471 2.918 1.00 0.00 O ATOM 0 H GLU A 46 7.422 -12.766 4.202 1.00 0.00 H new ATOM 0 HA GLU A 46 9.298 -14.428 2.821 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.715 -13.120 1.956 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.581 -14.366 1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.104 -15.174 3.861 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.603 -14.737 3.069 1.00 0.00 H new ATOM 649 N SER A 47 10.583 -12.827 1.363 1.00 0.00 N ATOM 650 CA SER A 47 11.492 -11.886 0.733 1.00 0.00 C ATOM 651 C SER A 47 11.130 -11.823 -0.754 1.00 0.00 C ATOM 652 O SER A 47 11.349 -12.762 -1.521 1.00 0.00 O ATOM 653 CB SER A 47 12.949 -12.288 0.995 1.00 0.00 C ATOM 654 OG SER A 47 13.104 -13.106 2.144 1.00 0.00 O ATOM 0 H SER A 47 10.920 -13.789 1.351 1.00 0.00 H new ATOM 0 HA SER A 47 11.391 -10.886 1.154 1.00 0.00 H new ATOM 0 HB2 SER A 47 13.335 -12.818 0.124 1.00 0.00 H new ATOM 0 HB3 SER A 47 13.552 -11.388 1.113 1.00 0.00 H new ATOM 0 HG SER A 47 14.051 -13.332 2.260 1.00 0.00 H new ATOM 660 N LEU A 48 10.477 -10.740 -1.148 1.00 0.00 N ATOM 661 CA LEU A 48 9.783 -10.587 -2.425 1.00 0.00 C ATOM 662 C LEU A 48 10.720 -9.997 -3.482 1.00 0.00 C ATOM 663 O LEU A 48 11.902 -9.782 -3.222 1.00 0.00 O ATOM 664 CB LEU A 48 8.533 -9.710 -2.232 1.00 0.00 C ATOM 665 CG LEU A 48 7.553 -10.198 -1.147 1.00 0.00 C ATOM 666 CD1 LEU A 48 6.385 -9.219 -1.090 1.00 0.00 C ATOM 667 CD2 LEU A 48 7.046 -11.622 -1.406 1.00 0.00 C ATOM 0 H LEU A 48 10.411 -9.906 -0.564 1.00 0.00 H new ATOM 0 HA LEU A 48 9.466 -11.567 -2.781 1.00 0.00 H new ATOM 0 HB2 LEU A 48 8.853 -8.698 -1.982 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.000 -9.650 -3.181 1.00 0.00 H new ATOM 0 HG LEU A 48 8.079 -10.232 -0.193 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.676 -9.543 -0.328 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.756 -8.224 -0.842 1.00 0.00 H new ATOM 0 HD13 LEU A 48 5.888 -9.189 -2.059 1.00 0.00 H new ATOM 0 HD21 LEU A 48 6.360 -11.914 -0.611 1.00 0.00 H new ATOM 0 HD22 LEU A 48 6.527 -11.655 -2.364 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.891 -12.311 -1.427 1.00 0.00 H new ATOM 679 N ALA A 49 10.201 -9.703 -4.675 1.00 0.00 N ATOM 680 CA ALA A 49 10.938 -9.127 -5.787 1.00 0.00 C ATOM 681 C ALA A 49 10.021 -8.119 -6.469 1.00 0.00 C ATOM 682 O ALA A 49 9.017 -8.509 -7.063 1.00 0.00 O ATOM 683 CB ALA A 49 11.354 -10.248 -6.741 1.00 0.00 C ATOM 0 H ALA A 49 9.219 -9.868 -4.896 1.00 0.00 H new ATOM 0 HA ALA A 49 11.844 -8.620 -5.456 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.908 -9.826 -7.579 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.986 -10.961 -6.211 1.00 0.00 H new ATOM 0 HB3 ALA A 49 10.465 -10.757 -7.113 1.00 0.00 H new ATOM 689 N SER A 50 10.302 -6.825 -6.341 1.00 0.00 N ATOM 690 CA SER A 50 9.564 -5.797 -7.057 1.00 0.00 C ATOM 691 C SER A 50 10.087 -5.655 -8.502 1.00 0.00 C ATOM 692 O SER A 50 11.204 -6.094 -8.796 1.00 0.00 O ATOM 693 CB SER A 50 9.693 -4.471 -6.300 1.00 0.00 C ATOM 694 OG SER A 50 8.532 -4.222 -5.537 1.00 0.00 O ATOM 0 H SER A 50 11.044 -6.464 -5.741 1.00 0.00 H new ATOM 0 HA SER A 50 8.513 -6.080 -7.114 1.00 0.00 H new ATOM 0 HB2 SER A 50 10.565 -4.502 -5.647 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.853 -3.656 -7.006 1.00 0.00 H new ATOM 0 HG SER A 50 8.631 -3.373 -5.058 1.00 0.00 H new ATOM 700 N PRO A 51 9.337 -4.982 -9.395 1.00 0.00 N ATOM 701 CA PRO A 51 7.961 -4.529 -9.191 1.00 0.00 C ATOM 702 C PRO A 51 6.981 -5.710 -9.098 1.00 0.00 C ATOM 703 O PRO A 51 7.149 -6.734 -9.771 1.00 0.00 O ATOM 704 CB PRO A 51 7.675 -3.601 -10.375 1.00 0.00 C ATOM 705 CG PRO A 51 8.604 -4.086 -11.475 1.00 0.00 C ATOM 706 CD PRO A 51 9.830 -4.544 -10.695 1.00 0.00 C ATOM 0 HA PRO A 51 7.832 -4.005 -8.244 1.00 0.00 H new ATOM 0 HB2 PRO A 51 6.631 -3.661 -10.683 1.00 0.00 H new ATOM 0 HB3 PRO A 51 7.873 -2.560 -10.120 1.00 0.00 H new ATOM 0 HG2 PRO A 51 8.162 -4.900 -12.050 1.00 0.00 H new ATOM 0 HG3 PRO A 51 8.846 -3.292 -12.181 1.00 0.00 H new ATOM 0 HD2 PRO A 51 10.341 -5.356 -11.212 1.00 0.00 H new ATOM 0 HD3 PRO A 51 10.549 -3.732 -10.587 1.00 0.00 H new ATOM 714 N VAL A 52 5.977 -5.588 -8.227 1.00 0.00 N ATOM 715 CA VAL A 52 4.949 -6.588 -7.954 1.00 0.00 C ATOM 716 C VAL A 52 3.602 -5.926 -7.651 1.00 0.00 C ATOM 717 O VAL A 52 3.541 -4.708 -7.455 1.00 0.00 O ATOM 718 CB VAL A 52 5.479 -7.550 -6.872 1.00 0.00 C ATOM 719 CG1 VAL A 52 5.758 -6.869 -5.533 1.00 0.00 C ATOM 720 CG2 VAL A 52 4.580 -8.768 -6.630 1.00 0.00 C ATOM 0 H VAL A 52 5.855 -4.745 -7.666 1.00 0.00 H new ATOM 0 HA VAL A 52 4.741 -7.197 -8.834 1.00 0.00 H new ATOM 0 HB VAL A 52 6.423 -7.897 -7.292 1.00 0.00 H new ATOM 0 HG11 VAL A 52 6.128 -7.606 -4.820 1.00 0.00 H new ATOM 0 HG12 VAL A 52 6.507 -6.089 -5.670 1.00 0.00 H new ATOM 0 HG13 VAL A 52 4.838 -6.425 -5.152 1.00 0.00 H new ATOM 0 HG21 VAL A 52 5.020 -9.397 -5.856 1.00 0.00 H new ATOM 0 HG22 VAL A 52 3.593 -8.434 -6.309 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.487 -9.341 -7.553 1.00 0.00 H new ATOM 730 N ILE A 53 2.520 -6.704 -7.686 1.00 0.00 N ATOM 731 CA ILE A 53 1.151 -6.279 -7.463 1.00 0.00 C ATOM 732 C ILE A 53 0.627 -7.050 -6.267 1.00 0.00 C ATOM 733 O ILE A 53 0.523 -8.278 -6.291 1.00 0.00 O ATOM 734 CB ILE A 53 0.282 -6.538 -8.716 1.00 0.00 C ATOM 735 CG1 ILE A 53 0.831 -5.855 -9.984 1.00 0.00 C ATOM 736 CG2 ILE A 53 -1.183 -6.122 -8.480 1.00 0.00 C ATOM 737 CD1 ILE A 53 1.071 -4.360 -9.819 1.00 0.00 C ATOM 0 H ILE A 53 2.587 -7.703 -7.882 1.00 0.00 H new ATOM 0 HA ILE A 53 1.111 -5.207 -7.269 1.00 0.00 H new ATOM 0 HB ILE A 53 0.322 -7.614 -8.888 1.00 0.00 H new ATOM 0 HG12 ILE A 53 1.767 -6.335 -10.268 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.130 -6.013 -10.804 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.766 -6.317 -9.380 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -1.595 -6.695 -7.649 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -1.226 -5.059 -8.244 1.00 0.00 H new ATOM 0 HD11 ILE A 53 1.457 -3.948 -10.752 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.133 -3.867 -9.565 1.00 0.00 H new ATOM 0 HD13 ILE A 53 1.795 -4.194 -9.022 1.00 0.00 H new ATOM 749 N LEU A 54 0.271 -6.301 -5.232 1.00 0.00 N ATOM 750 CA LEU A 54 -0.624 -6.784 -4.205 1.00 0.00 C ATOM 751 C LEU A 54 -2.032 -6.820 -4.786 1.00 0.00 C ATOM 752 O LEU A 54 -2.656 -5.771 -4.990 1.00 0.00 O ATOM 753 CB LEU A 54 -0.569 -5.909 -2.955 1.00 0.00 C ATOM 754 CG LEU A 54 0.812 -5.796 -2.297 1.00 0.00 C ATOM 755 CD1 LEU A 54 0.690 -4.856 -1.098 1.00 0.00 C ATOM 756 CD2 LEU A 54 1.343 -7.145 -1.811 1.00 0.00 C ATOM 0 H LEU A 54 0.597 -5.345 -5.087 1.00 0.00 H new ATOM 0 HA LEU A 54 -0.320 -7.784 -3.896 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.912 -4.908 -3.216 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.272 -6.306 -2.222 1.00 0.00 H new ATOM 0 HG LEU A 54 1.512 -5.419 -3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 54 1.661 -4.759 -0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.354 -3.876 -1.437 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.032 -5.262 -0.389 1.00 0.00 H new ATOM 0 HD21 LEU A 54 2.323 -7.007 -1.354 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.655 -7.563 -1.076 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.430 -7.828 -2.656 1.00 0.00 H new ATOM 768 N SER A 55 -2.494 -8.024 -5.099 1.00 0.00 N ATOM 769 CA SER A 55 -3.879 -8.315 -5.430 1.00 0.00 C ATOM 770 C SER A 55 -4.740 -8.346 -4.159 1.00 0.00 C ATOM 771 O SER A 55 -4.233 -8.244 -3.036 1.00 0.00 O ATOM 772 CB SER A 55 -3.933 -9.678 -6.129 1.00 0.00 C ATOM 773 OG SER A 55 -3.051 -9.732 -7.231 1.00 0.00 O ATOM 0 H SER A 55 -1.895 -8.849 -5.130 1.00 0.00 H new ATOM 0 HA SER A 55 -4.270 -7.538 -6.087 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.676 -10.463 -5.418 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.951 -9.874 -6.467 1.00 0.00 H new ATOM 0 HG SER A 55 -3.109 -10.615 -7.653 1.00 0.00 H new ATOM 779 N ASP A 56 -6.041 -8.600 -4.336 1.00 0.00 N ATOM 780 CA ASP A 56 -7.002 -8.872 -3.261 1.00 0.00 C ATOM 781 C ASP A 56 -6.513 -9.963 -2.307 1.00 0.00 C ATOM 782 O ASP A 56 -6.754 -9.871 -1.110 1.00 0.00 O ATOM 783 CB ASP A 56 -8.346 -9.295 -3.870 1.00 0.00 C ATOM 784 CG ASP A 56 -9.370 -9.729 -2.813 1.00 0.00 C ATOM 785 OD1 ASP A 56 -10.050 -8.852 -2.244 1.00 0.00 O ATOM 786 OD2 ASP A 56 -9.638 -10.945 -2.669 1.00 0.00 O ATOM 0 H ASP A 56 -6.468 -8.623 -5.262 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.115 -7.954 -2.684 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.755 -8.465 -4.446 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -8.181 -10.116 -4.567 1.00 0.00 H new ATOM 791 N GLU A 57 -5.786 -10.959 -2.823 1.00 0.00 N ATOM 792 CA GLU A 57 -5.262 -12.087 -2.055 1.00 0.00 C ATOM 793 C GLU A 57 -4.201 -11.656 -1.053 1.00 0.00 C ATOM 794 O GLU A 57 -4.045 -12.269 0.005 1.00 0.00 O ATOM 795 CB GLU A 57 -4.615 -13.089 -3.025 1.00 0.00 C ATOM 796 CG GLU A 57 -5.651 -13.906 -3.794 1.00 0.00 C ATOM 797 CD GLU A 57 -6.328 -14.929 -2.884 1.00 0.00 C ATOM 798 OE1 GLU A 57 -7.283 -14.566 -2.160 1.00 0.00 O ATOM 799 OE2 GLU A 57 -5.887 -16.101 -2.893 1.00 0.00 O ATOM 0 H GLU A 57 -5.541 -11.002 -3.812 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.095 -12.529 -1.509 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -3.983 -12.551 -3.732 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -3.966 -13.763 -2.467 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -6.402 -13.240 -4.220 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -5.170 -14.418 -4.627 1.00 0.00 H new ATOM 806 N GLU A 58 -3.434 -10.628 -1.392 1.00 0.00 N ATOM 807 CA GLU A 58 -2.315 -10.163 -0.594 1.00 0.00 C ATOM 808 C GLU A 58 -2.885 -9.177 0.424 1.00 0.00 C ATOM 809 O GLU A 58 -2.708 -9.330 1.631 1.00 0.00 O ATOM 810 CB GLU A 58 -1.252 -9.528 -1.499 1.00 0.00 C ATOM 811 CG GLU A 58 -0.935 -10.302 -2.786 1.00 0.00 C ATOM 812 CD GLU A 58 -0.308 -11.677 -2.545 1.00 0.00 C ATOM 813 OE1 GLU A 58 -1.004 -12.617 -2.093 1.00 0.00 O ATOM 814 OE2 GLU A 58 0.904 -11.792 -2.842 1.00 0.00 O ATOM 0 H GLU A 58 -3.577 -10.087 -2.245 1.00 0.00 H new ATOM 0 HA GLU A 58 -1.817 -10.979 -0.071 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.582 -8.525 -1.770 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.331 -9.416 -0.926 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.854 -10.428 -3.358 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.257 -9.707 -3.398 1.00 0.00 H new ATOM 821 N LEU A 59 -3.712 -8.244 -0.054 1.00 0.00 N ATOM 822 CA LEU A 59 -4.475 -7.273 0.727 1.00 0.00 C ATOM 823 C LEU A 59 -5.700 -7.917 1.406 1.00 0.00 C ATOM 824 O LEU A 59 -6.650 -7.223 1.775 1.00 0.00 O ATOM 825 CB LEU A 59 -4.855 -6.109 -0.206 1.00 0.00 C ATOM 826 CG LEU A 59 -3.635 -5.248 -0.597 1.00 0.00 C ATOM 827 CD1 LEU A 59 -3.794 -4.622 -1.986 1.00 0.00 C ATOM 828 CD2 LEU A 59 -3.377 -4.135 0.426 1.00 0.00 C ATOM 0 H LEU A 59 -3.875 -8.142 -1.056 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.867 -6.891 1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -5.320 -6.507 -1.108 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.598 -5.480 0.285 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.782 -5.926 -0.613 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.912 -4.025 -2.219 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.905 -5.411 -2.730 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.678 -3.984 -1.999 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.511 -3.550 0.117 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.251 -3.486 0.485 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.186 -4.577 1.404 1.00 0.00 H new ATOM 840 N ALA A 60 -5.706 -9.236 1.600 1.00 0.00 N ATOM 841 CA ALA A 60 -6.753 -9.977 2.295 1.00 0.00 C ATOM 842 C ALA A 60 -6.719 -9.773 3.822 1.00 0.00 C ATOM 843 O ALA A 60 -7.601 -10.263 4.533 1.00 0.00 O ATOM 844 CB ALA A 60 -6.615 -11.453 1.952 1.00 0.00 C ATOM 0 H ALA A 60 -4.954 -9.837 1.264 1.00 0.00 H new ATOM 0 HA ALA A 60 -7.717 -9.594 1.959 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -7.392 -12.020 2.465 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -6.719 -11.588 0.875 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.635 -11.810 2.270 1.00 0.00 H new ATOM 850 N VAL A 61 -5.718 -9.056 4.332 1.00 0.00 N ATOM 851 CA VAL A 61 -5.454 -8.781 5.742 1.00 0.00 C ATOM 852 C VAL A 61 -5.752 -7.314 6.078 1.00 0.00 C ATOM 853 O VAL A 61 -5.794 -6.450 5.203 1.00 0.00 O ATOM 854 CB VAL A 61 -3.988 -9.139 6.071 1.00 0.00 C ATOM 855 CG1 VAL A 61 -3.828 -10.629 6.342 1.00 0.00 C ATOM 856 CG2 VAL A 61 -3.009 -8.771 4.952 1.00 0.00 C ATOM 0 H VAL A 61 -5.021 -8.622 3.727 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.113 -9.396 6.354 1.00 0.00 H new ATOM 0 HB VAL A 61 -3.751 -8.552 6.958 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.785 -10.847 6.570 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.452 -10.914 7.189 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.133 -11.194 5.461 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -1.997 -9.049 5.248 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.280 -9.304 4.041 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.052 -7.697 4.770 1.00 0.00 H new ATOM 866 N GLU A 62 -5.935 -7.020 7.364 1.00 0.00 N ATOM 867 CA GLU A 62 -6.293 -5.687 7.865 1.00 0.00 C ATOM 868 C GLU A 62 -5.155 -4.670 7.683 1.00 0.00 C ATOM 869 O GLU A 62 -5.405 -3.487 7.469 1.00 0.00 O ATOM 870 CB GLU A 62 -6.722 -5.764 9.347 1.00 0.00 C ATOM 871 CG GLU A 62 -5.668 -6.486 10.204 1.00 0.00 C ATOM 872 CD GLU A 62 -5.872 -6.456 11.716 1.00 0.00 C ATOM 873 OE1 GLU A 62 -6.680 -5.681 12.266 1.00 0.00 O ATOM 874 OE2 GLU A 62 -5.149 -7.229 12.386 1.00 0.00 O ATOM 0 H GLU A 62 -5.837 -7.714 8.105 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.135 -5.334 7.269 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.879 -4.757 9.734 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.675 -6.287 9.424 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.629 -7.528 9.887 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.694 -6.049 9.984 1.00 0.00 H new ATOM 881 N LYS A 63 -3.895 -5.101 7.775 1.00 0.00 N ATOM 882 CA LYS A 63 -2.740 -4.216 7.920 1.00 0.00 C ATOM 883 C LYS A 63 -1.623 -4.850 7.129 1.00 0.00 C ATOM 884 O LYS A 63 -1.354 -6.031 7.358 1.00 0.00 O ATOM 885 CB LYS A 63 -2.378 -4.086 9.410 1.00 0.00 C ATOM 886 CG LYS A 63 -1.584 -2.822 9.762 1.00 0.00 C ATOM 887 CD LYS A 63 -0.210 -2.618 9.106 1.00 0.00 C ATOM 888 CE LYS A 63 0.679 -1.665 9.925 1.00 0.00 C ATOM 889 NZ LYS A 63 0.001 -0.425 10.366 1.00 0.00 N ATOM 0 H LYS A 63 -3.646 -6.090 7.750 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.939 -3.210 7.551 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.297 -4.098 9.997 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.798 -4.959 9.708 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.203 -1.960 9.512 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.442 -2.809 10.843 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.289 -3.581 9.002 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.343 -2.217 8.101 1.00 0.00 H new ATOM 0 HE2 LYS A 63 1.047 -2.196 10.803 1.00 0.00 H new ATOM 0 HE3 LYS A 63 1.550 -1.396 9.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.651 0.136 10.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.282 0.131 9.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.843 -0.670 10.922 1.00 0.00 H new ATOM 903 N VAL A 64 -0.999 -4.118 6.204 1.00 0.00 N ATOM 904 CA VAL A 64 -0.029 -4.725 5.300 1.00 0.00 C ATOM 905 C VAL A 64 1.186 -3.790 5.200 1.00 0.00 C ATOM 906 O VAL A 64 1.202 -2.842 4.406 1.00 0.00 O ATOM 907 CB VAL A 64 -0.676 -5.083 3.934 1.00 0.00 C ATOM 908 CG1 VAL A 64 0.084 -6.237 3.283 1.00 0.00 C ATOM 909 CG2 VAL A 64 -2.151 -5.500 4.027 1.00 0.00 C ATOM 0 H VAL A 64 -1.147 -3.118 6.064 1.00 0.00 H new ATOM 0 HA VAL A 64 0.321 -5.681 5.690 1.00 0.00 H new ATOM 0 HB VAL A 64 -0.623 -4.168 3.344 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.376 -6.482 2.326 1.00 0.00 H new ATOM 0 HG12 VAL A 64 1.122 -5.945 3.123 1.00 0.00 H new ATOM 0 HG13 VAL A 64 0.050 -7.109 3.936 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -2.527 -5.733 3.031 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.241 -6.380 4.664 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -2.734 -4.683 4.453 1.00 0.00 H new ATOM 919 N THR A 65 2.171 -3.991 6.075 1.00 0.00 N ATOM 920 CA THR A 65 3.433 -3.258 6.059 1.00 0.00 C ATOM 921 C THR A 65 4.372 -3.883 5.022 1.00 0.00 C ATOM 922 O THR A 65 4.830 -5.018 5.196 1.00 0.00 O ATOM 923 CB THR A 65 4.089 -3.282 7.450 1.00 0.00 C ATOM 924 OG1 THR A 65 3.180 -2.865 8.452 1.00 0.00 O ATOM 925 CG2 THR A 65 5.316 -2.357 7.469 1.00 0.00 C ATOM 0 H THR A 65 2.112 -4.679 6.826 1.00 0.00 H new ATOM 0 HA THR A 65 3.237 -2.220 5.791 1.00 0.00 H new ATOM 0 HB THR A 65 4.393 -4.308 7.657 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.535 -2.073 8.907 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.774 -2.380 8.458 1.00 0.00 H new ATOM 0 HG22 THR A 65 6.038 -2.696 6.726 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.007 -1.338 7.236 1.00 0.00 H new ATOM 933 N LEU A 66 4.704 -3.136 3.967 1.00 0.00 N ATOM 934 CA LEU A 66 5.673 -3.546 2.957 1.00 0.00 C ATOM 935 C LEU A 66 6.833 -2.574 3.025 1.00 0.00 C ATOM 936 O LEU A 66 6.627 -1.360 3.034 1.00 0.00 O ATOM 937 CB LEU A 66 5.069 -3.516 1.546 1.00 0.00 C ATOM 938 CG LEU A 66 4.154 -4.678 1.125 1.00 0.00 C ATOM 939 CD1 LEU A 66 4.800 -6.046 1.334 1.00 0.00 C ATOM 940 CD2 LEU A 66 2.815 -4.633 1.859 1.00 0.00 C ATOM 0 H LEU A 66 4.299 -2.216 3.791 1.00 0.00 H new ATOM 0 HA LEU A 66 5.990 -4.570 3.154 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.501 -2.591 1.446 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.891 -3.464 0.832 1.00 0.00 H new ATOM 0 HG LEU A 66 3.984 -4.545 0.056 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.108 -6.827 1.020 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.714 -6.111 0.743 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.040 -6.178 2.389 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.195 -5.469 1.536 1.00 0.00 H new ATOM 0 HD22 LEU A 66 2.986 -4.702 2.933 1.00 0.00 H new ATOM 0 HD23 LEU A 66 2.307 -3.696 1.632 1.00 0.00 H new ATOM 952 N SER A 67 8.055 -3.097 3.055 1.00 0.00 N ATOM 953 CA SER A 67 9.251 -2.286 3.209 1.00 0.00 C ATOM 954 C SER A 67 10.403 -2.928 2.451 1.00 0.00 C ATOM 955 O SER A 67 10.319 -4.078 2.012 1.00 0.00 O ATOM 956 CB SER A 67 9.576 -2.120 4.698 1.00 0.00 C ATOM 957 OG SER A 67 10.584 -1.140 4.873 1.00 0.00 O ATOM 0 H SER A 67 8.241 -4.097 2.973 1.00 0.00 H new ATOM 0 HA SER A 67 9.084 -1.293 2.791 1.00 0.00 H new ATOM 0 HB2 SER A 67 8.678 -1.830 5.243 1.00 0.00 H new ATOM 0 HB3 SER A 67 9.908 -3.072 5.113 1.00 0.00 H new ATOM 0 HG SER A 67 10.782 -1.041 5.828 1.00 0.00 H new ATOM 963 N THR A 68 11.478 -2.166 2.318 1.00 0.00 N ATOM 964 CA THR A 68 12.635 -2.456 1.498 1.00 0.00 C ATOM 965 C THR A 68 13.743 -3.098 2.320 1.00 0.00 C ATOM 966 O THR A 68 14.006 -2.653 3.436 1.00 0.00 O ATOM 967 CB THR A 68 13.147 -1.152 0.885 1.00 0.00 C ATOM 968 OG1 THR A 68 12.918 0.003 1.689 1.00 0.00 O ATOM 969 CG2 THR A 68 12.442 -0.880 -0.441 1.00 0.00 C ATOM 0 H THR A 68 11.567 -1.277 2.810 1.00 0.00 H new ATOM 0 HA THR A 68 12.343 -3.156 0.715 1.00 0.00 H new ATOM 0 HB THR A 68 14.221 -1.304 0.777 1.00 0.00 H new ATOM 0 HG1 THR A 68 11.962 0.216 1.690 1.00 0.00 H new ATOM 0 HG21 THR A 68 12.815 0.051 -0.867 1.00 0.00 H new ATOM 0 HG22 THR A 68 12.638 -1.700 -1.132 1.00 0.00 H new ATOM 0 HG23 THR A 68 11.368 -0.797 -0.272 1.00 0.00 H new ATOM 977 N THR A 69 14.427 -4.100 1.767 1.00 0.00 N ATOM 978 CA THR A 69 15.420 -4.819 2.544 1.00 0.00 C ATOM 979 C THR A 69 16.661 -3.975 2.897 1.00 0.00 C ATOM 980 O THR A 69 17.257 -4.186 3.961 1.00 0.00 O ATOM 981 CB THR A 69 15.747 -6.186 1.901 1.00 0.00 C ATOM 982 OG1 THR A 69 16.010 -6.096 0.512 1.00 0.00 O ATOM 983 CG2 THR A 69 14.604 -7.199 2.054 1.00 0.00 C ATOM 0 H THR A 69 14.312 -4.422 0.806 1.00 0.00 H new ATOM 0 HA THR A 69 14.973 -5.032 3.515 1.00 0.00 H new ATOM 0 HB THR A 69 16.636 -6.518 2.437 1.00 0.00 H new ATOM 0 HG1 THR A 69 16.390 -5.216 0.307 1.00 0.00 H new ATOM 0 HG21 THR A 69 14.887 -8.141 1.584 1.00 0.00 H new ATOM 0 HG22 THR A 69 14.406 -7.366 3.113 1.00 0.00 H new ATOM 0 HG23 THR A 69 13.706 -6.810 1.574 1.00 0.00 H new ATOM 991 N GLY A 70 17.028 -2.990 2.069 1.00 0.00 N ATOM 992 CA GLY A 70 18.260 -2.212 2.226 1.00 0.00 C ATOM 993 C GLY A 70 18.034 -0.715 2.098 1.00 0.00 C ATOM 994 O GLY A 70 17.855 0.000 3.083 1.00 0.00 O ATOM 0 H GLY A 70 16.471 -2.708 1.262 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.697 -2.426 3.201 1.00 0.00 H new ATOM 0 HA3 GLY A 70 18.983 -2.531 1.475 1.00 0.00 H new ATOM 998 N LYS A 71 18.071 -0.241 0.860 1.00 0.00 N ATOM 999 CA LYS A 71 17.579 1.006 0.309 1.00 0.00 C ATOM 1000 C LYS A 71 17.224 0.758 -1.136 1.00 0.00 C ATOM 1001 O LYS A 71 17.967 0.097 -1.860 1.00 0.00 O ATOM 1002 CB LYS A 71 18.645 2.080 0.390 1.00 0.00 C ATOM 1003 CG LYS A 71 20.043 1.717 -0.116 1.00 0.00 C ATOM 1004 CD LYS A 71 20.539 2.744 -1.125 1.00 0.00 C ATOM 1005 CE LYS A 71 19.911 2.673 -2.525 1.00 0.00 C ATOM 1006 NZ LYS A 71 20.106 1.332 -3.129 1.00 0.00 N ATOM 0 H LYS A 71 18.505 -0.800 0.126 1.00 0.00 H new ATOM 0 HA LYS A 71 16.710 1.346 0.873 1.00 0.00 H new ATOM 0 HB2 LYS A 71 18.296 2.946 -0.173 1.00 0.00 H new ATOM 0 HB3 LYS A 71 18.733 2.391 1.431 1.00 0.00 H new ATOM 0 HG2 LYS A 71 20.735 1.663 0.724 1.00 0.00 H new ATOM 0 HG3 LYS A 71 20.022 0.729 -0.577 1.00 0.00 H new ATOM 0 HD2 LYS A 71 20.359 3.739 -0.718 1.00 0.00 H new ATOM 0 HD3 LYS A 71 21.618 2.631 -1.227 1.00 0.00 H new ATOM 0 HE2 LYS A 71 18.846 2.895 -2.461 1.00 0.00 H new ATOM 0 HE3 LYS A 71 20.357 3.433 -3.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 19.924 1.382 -4.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 21.084 1.017 -2.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 19.447 0.656 -2.693 1.00 0.00 H new ATOM 1020 N ALA A 72 16.122 1.329 -1.570 1.00 0.00 N ATOM 1021 CA ALA A 72 15.741 1.395 -2.955 1.00 0.00 C ATOM 1022 C ALA A 72 16.078 2.790 -3.424 1.00 0.00 C ATOM 1023 O ALA A 72 16.757 3.559 -2.736 1.00 0.00 O ATOM 1024 CB ALA A 72 14.244 1.103 -3.090 1.00 0.00 C ATOM 0 H ALA A 72 15.449 1.773 -0.945 1.00 0.00 H new ATOM 0 HA ALA A 72 16.267 0.657 -3.561 1.00 0.00 H new ATOM 0 HB1 ALA A 72 13.957 1.153 -4.140 1.00 0.00 H new ATOM 0 HB2 ALA A 72 14.031 0.106 -2.703 1.00 0.00 H new ATOM 0 HB3 ALA A 72 13.677 1.841 -2.523 1.00 0.00 H new ATOM 1030 N ILE A 73 15.595 3.113 -4.610 1.00 0.00 N ATOM 1031 CA ILE A 73 15.657 4.474 -5.105 1.00 0.00 C ATOM 1032 C ILE A 73 14.240 5.061 -5.272 1.00 0.00 C ATOM 1033 O ILE A 73 14.058 6.276 -5.223 1.00 0.00 O ATOM 1034 CB ILE A 73 16.543 4.508 -6.372 1.00 0.00 C ATOM 1035 CG1 ILE A 73 17.790 3.574 -6.370 1.00 0.00 C ATOM 1036 CG2 ILE A 73 16.997 5.938 -6.552 1.00 0.00 C ATOM 1037 CD1 ILE A 73 18.958 3.965 -5.465 1.00 0.00 C ATOM 0 H ILE A 73 15.155 2.450 -5.248 1.00 0.00 H new ATOM 0 HA ILE A 73 16.136 5.135 -4.383 1.00 0.00 H new ATOM 0 HB ILE A 73 15.928 4.130 -7.189 1.00 0.00 H new ATOM 0 HG12 ILE A 73 17.462 2.574 -6.084 1.00 0.00 H new ATOM 0 HG13 ILE A 73 18.163 3.507 -7.392 1.00 0.00 H new ATOM 0 HG21 ILE A 73 17.628 6.011 -7.438 1.00 0.00 H new ATOM 0 HG22 ILE A 73 16.127 6.584 -6.672 1.00 0.00 H new ATOM 0 HG23 ILE A 73 17.564 6.253 -5.676 1.00 0.00 H new ATOM 0 HD11 ILE A 73 19.756 3.229 -5.562 1.00 0.00 H new ATOM 0 HD12 ILE A 73 19.332 4.946 -5.757 1.00 0.00 H new ATOM 0 HD13 ILE A 73 18.620 3.999 -4.429 1.00 0.00 H new ATOM 1049 N GLU A 74 13.206 4.221 -5.355 1.00 0.00 N ATOM 1050 CA GLU A 74 11.903 4.572 -5.915 1.00 0.00 C ATOM 1051 C GLU A 74 10.803 3.736 -5.228 1.00 0.00 C ATOM 1052 O GLU A 74 11.129 2.729 -4.588 1.00 0.00 O ATOM 1053 CB GLU A 74 12.015 4.296 -7.427 1.00 0.00 C ATOM 1054 CG GLU A 74 11.934 2.816 -7.741 1.00 0.00 C ATOM 1055 CD GLU A 74 12.199 2.469 -9.206 1.00 0.00 C ATOM 1056 OE1 GLU A 74 12.329 3.373 -10.054 1.00 0.00 O ATOM 1057 OE2 GLU A 74 12.379 1.266 -9.488 1.00 0.00 O ATOM 0 H GLU A 74 13.254 3.256 -5.027 1.00 0.00 H new ATOM 0 HA GLU A 74 11.630 5.614 -5.750 1.00 0.00 H new ATOM 0 HB2 GLU A 74 11.218 4.822 -7.952 1.00 0.00 H new ATOM 0 HB3 GLU A 74 12.959 4.695 -7.799 1.00 0.00 H new ATOM 0 HG2 GLU A 74 12.653 2.284 -7.118 1.00 0.00 H new ATOM 0 HG3 GLU A 74 10.944 2.452 -7.467 1.00 0.00 H new ATOM 1064 N PHE A 75 9.525 4.113 -5.363 1.00 0.00 N ATOM 1065 CA PHE A 75 8.372 3.458 -4.743 1.00 0.00 C ATOM 1066 C PHE A 75 7.077 3.922 -5.423 1.00 0.00 C ATOM 1067 O PHE A 75 6.801 5.121 -5.435 1.00 0.00 O ATOM 1068 CB PHE A 75 8.333 3.837 -3.244 1.00 0.00 C ATOM 1069 CG PHE A 75 7.808 2.791 -2.282 1.00 0.00 C ATOM 1070 CD1 PHE A 75 8.312 1.484 -2.336 1.00 0.00 C ATOM 1071 CD2 PHE A 75 6.992 3.153 -1.200 1.00 0.00 C ATOM 1072 CE1 PHE A 75 8.059 0.557 -1.313 1.00 0.00 C ATOM 1073 CE2 PHE A 75 6.791 2.256 -0.148 1.00 0.00 C ATOM 1074 CZ PHE A 75 7.316 0.954 -0.194 1.00 0.00 C ATOM 0 H PHE A 75 9.258 4.917 -5.932 1.00 0.00 H new ATOM 0 HA PHE A 75 8.461 2.377 -4.854 1.00 0.00 H new ATOM 0 HB2 PHE A 75 9.344 4.103 -2.936 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.721 4.733 -3.137 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.909 1.183 -3.184 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.520 4.124 -1.180 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.434 -0.453 -1.388 1.00 0.00 H new ATOM 0 HE2 PHE A 75 6.222 2.569 0.715 1.00 0.00 H new ATOM 0 HZ PHE A 75 7.149 0.268 0.623 1.00 0.00 H new ATOM 1084 N ALA A 76 6.241 3.025 -5.951 1.00 0.00 N ATOM 1085 CA ALA A 76 4.884 3.387 -6.374 1.00 0.00 C ATOM 1086 C ALA A 76 3.868 2.811 -5.393 1.00 0.00 C ATOM 1087 O ALA A 76 4.167 1.822 -4.720 1.00 0.00 O ATOM 1088 CB ALA A 76 4.613 2.935 -7.811 1.00 0.00 C ATOM 0 H ALA A 76 6.478 2.044 -6.096 1.00 0.00 H new ATOM 0 HA ALA A 76 4.787 4.473 -6.365 1.00 0.00 H new ATOM 0 HB1 ALA A 76 3.600 3.217 -8.096 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.326 3.413 -8.483 1.00 0.00 H new ATOM 0 HB3 ALA A 76 4.721 1.852 -7.878 1.00 0.00 H new ATOM 1094 N VAL A 77 2.689 3.427 -5.329 1.00 0.00 N ATOM 1095 CA VAL A 77 1.520 3.023 -4.566 1.00 0.00 C ATOM 1096 C VAL A 77 0.315 3.538 -5.368 1.00 0.00 C ATOM 1097 O VAL A 77 -0.108 4.680 -5.193 1.00 0.00 O ATOM 1098 CB VAL A 77 1.562 3.592 -3.121 1.00 0.00 C ATOM 1099 CG1 VAL A 77 0.302 3.193 -2.340 1.00 0.00 C ATOM 1100 CG2 VAL A 77 2.763 3.120 -2.287 1.00 0.00 C ATOM 0 H VAL A 77 2.518 4.287 -5.851 1.00 0.00 H new ATOM 0 HA VAL A 77 1.468 1.942 -4.437 1.00 0.00 H new ATOM 0 HB VAL A 77 1.638 4.670 -3.261 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.354 3.603 -1.331 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.580 3.586 -2.846 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.236 2.106 -2.287 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.713 3.565 -1.293 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.741 2.034 -2.200 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.688 3.426 -2.776 1.00 0.00 H new ATOM 1110 N SER A 78 -0.253 2.717 -6.252 1.00 0.00 N ATOM 1111 CA SER A 78 -1.425 3.080 -7.058 1.00 0.00 C ATOM 1112 C SER A 78 -2.421 1.921 -7.104 1.00 0.00 C ATOM 1113 O SER A 78 -2.047 0.770 -6.864 1.00 0.00 O ATOM 1114 CB SER A 78 -1.025 3.498 -8.483 1.00 0.00 C ATOM 1115 OG SER A 78 0.081 4.379 -8.497 1.00 0.00 O ATOM 0 H SER A 78 0.088 1.773 -6.432 1.00 0.00 H new ATOM 0 HA SER A 78 -1.901 3.937 -6.582 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.785 2.609 -9.065 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.874 3.978 -8.970 1.00 0.00 H new ATOM 0 HG SER A 78 0.299 4.615 -9.423 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.679 2.217 -7.430 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.749 1.252 -7.607 1.00 0.00 C ATOM 1123 C GLY A 79 -6.036 1.935 -7.184 1.00 0.00 C ATOM 1124 O GLY A 79 -6.584 2.733 -7.947 1.00 0.00 O ATOM 0 H GLY A 79 -3.987 3.177 -7.583 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.808 0.928 -8.646 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.569 0.362 -7.005 1.00 0.00 H new ATOM 1128 N GLY A 80 -6.452 1.691 -5.942 1.00 0.00 N ATOM 1129 CA GLY A 80 -7.708 2.173 -5.389 1.00 0.00 C ATOM 1130 C GLY A 80 -8.446 1.000 -4.747 1.00 0.00 C ATOM 1131 O GLY A 80 -7.865 -0.074 -4.549 1.00 0.00 O ATOM 0 H GLY A 80 -5.908 1.138 -5.279 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.521 2.951 -4.649 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.319 2.619 -6.173 1.00 0.00 H new ATOM 1135 N VAL A 81 -9.713 1.230 -4.411 1.00 0.00 N ATOM 1136 CA VAL A 81 -10.711 0.203 -4.149 1.00 0.00 C ATOM 1137 C VAL A 81 -12.015 0.665 -4.802 1.00 0.00 C ATOM 1138 O VAL A 81 -12.200 1.859 -5.053 1.00 0.00 O ATOM 1139 CB VAL A 81 -10.908 -0.069 -2.639 1.00 0.00 C ATOM 1140 CG1 VAL A 81 -9.903 -1.076 -2.086 1.00 0.00 C ATOM 1141 CG2 VAL A 81 -10.896 1.181 -1.754 1.00 0.00 C ATOM 0 H VAL A 81 -10.084 2.175 -4.311 1.00 0.00 H new ATOM 0 HA VAL A 81 -10.376 -0.745 -4.570 1.00 0.00 H new ATOM 0 HB VAL A 81 -11.913 -0.490 -2.593 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -10.088 -1.228 -1.023 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -10.011 -2.024 -2.613 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -8.891 -0.695 -2.227 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -11.041 0.891 -0.713 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -9.939 1.692 -1.859 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -11.700 1.851 -2.060 1.00 0.00 H new ATOM 1266 N GLU A 91 -21.431 -1.652 5.900 1.00 0.00 N ATOM 1267 CA GLU A 91 -20.900 -0.511 6.639 1.00 0.00 C ATOM 1268 C GLU A 91 -19.838 0.187 5.781 1.00 0.00 C ATOM 1269 O GLU A 91 -19.393 -0.390 4.791 1.00 0.00 O ATOM 1270 CB GLU A 91 -20.363 -0.983 8.002 1.00 0.00 C ATOM 1271 CG GLU A 91 -21.536 -1.299 8.941 1.00 0.00 C ATOM 1272 CD GLU A 91 -21.157 -1.434 10.420 1.00 0.00 C ATOM 1273 OE1 GLU A 91 -19.972 -1.280 10.796 1.00 0.00 O ATOM 1274 OE2 GLU A 91 -22.063 -1.699 11.237 1.00 0.00 O ATOM 0 HA GLU A 91 -21.682 0.220 6.847 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -19.741 -1.868 7.871 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.731 -0.211 8.441 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.284 -0.512 8.842 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -22.005 -2.227 8.614 1.00 0.00 H new ATOM 1281 N PRO A 92 -19.452 1.434 6.097 1.00 0.00 N ATOM 1282 CA PRO A 92 -18.406 2.143 5.370 1.00 0.00 C ATOM 1283 C PRO A 92 -17.019 1.608 5.737 1.00 0.00 C ATOM 1284 O PRO A 92 -16.888 0.772 6.636 1.00 0.00 O ATOM 1285 CB PRO A 92 -18.593 3.617 5.752 1.00 0.00 C ATOM 1286 CG PRO A 92 -19.141 3.525 7.171 1.00 0.00 C ATOM 1287 CD PRO A 92 -20.047 2.300 7.099 1.00 0.00 C ATOM 0 HA PRO A 92 -18.479 2.006 4.291 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -17.653 4.168 5.715 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -19.286 4.125 5.082 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -18.346 3.398 7.905 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -19.693 4.422 7.451 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -20.106 1.799 8.065 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -21.063 2.580 6.822 1.00 0.00 H new ATOM 1295 N MET A 93 -15.971 2.110 5.076 1.00 0.00 N ATOM 1296 CA MET A 93 -14.611 1.646 5.272 1.00 0.00 C ATOM 1297 C MET A 93 -13.657 2.814 5.094 1.00 0.00 C ATOM 1298 O MET A 93 -14.043 3.885 4.612 1.00 0.00 O ATOM 1299 CB MET A 93 -14.282 0.469 4.328 1.00 0.00 C ATOM 1300 CG MET A 93 -14.071 0.872 2.863 1.00 0.00 C ATOM 1301 SD MET A 93 -13.062 -0.272 1.885 1.00 0.00 S ATOM 1302 CE MET A 93 -11.427 -0.051 2.627 1.00 0.00 C ATOM 0 H MET A 93 -16.053 2.856 4.386 1.00 0.00 H new ATOM 0 HA MET A 93 -14.498 1.262 6.286 1.00 0.00 H new ATOM 0 HB2 MET A 93 -13.382 -0.029 4.688 1.00 0.00 H new ATOM 0 HB3 MET A 93 -15.092 -0.259 4.379 1.00 0.00 H new ATOM 0 HG2 MET A 93 -15.046 0.970 2.386 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.603 1.856 2.837 1.00 0.00 H new ATOM 0 HE1 MET A 93 -10.686 -0.599 2.045 1.00 0.00 H new ATOM 0 HE2 MET A 93 -11.171 1.009 2.635 1.00 0.00 H new ATOM 0 HE3 MET A 93 -11.437 -0.430 3.649 1.00 0.00 H new ATOM 1312 N GLN A 94 -12.395 2.627 5.458 1.00 0.00 N ATOM 1313 CA GLN A 94 -11.337 3.582 5.202 1.00 0.00 C ATOM 1314 C GLN A 94 -10.057 2.835 4.865 1.00 0.00 C ATOM 1315 O GLN A 94 -9.883 1.653 5.173 1.00 0.00 O ATOM 1316 CB GLN A 94 -11.143 4.512 6.414 1.00 0.00 C ATOM 1317 CG GLN A 94 -12.149 5.676 6.448 1.00 0.00 C ATOM 1318 CD GLN A 94 -13.157 5.574 7.588 1.00 0.00 C ATOM 1319 OE1 GLN A 94 -12.900 6.008 8.707 1.00 0.00 O ATOM 1320 NE2 GLN A 94 -14.330 5.023 7.322 1.00 0.00 N ATOM 0 H GLN A 94 -12.077 1.791 5.948 1.00 0.00 H new ATOM 0 HA GLN A 94 -11.609 4.208 4.352 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -11.239 3.930 7.330 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.130 4.915 6.397 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -11.603 6.615 6.539 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.686 5.710 5.500 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -14.526 4.668 6.386 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -15.038 4.954 8.053 1.00 0.00 H new ATOM 1329 N TRP A 95 -9.165 3.578 4.220 1.00 0.00 N ATOM 1330 CA TRP A 95 -7.798 3.231 3.906 1.00 0.00 C ATOM 1331 C TRP A 95 -6.991 4.399 4.455 1.00 0.00 C ATOM 1332 O TRP A 95 -7.150 5.539 4.001 1.00 0.00 O ATOM 1333 CB TRP A 95 -7.622 3.062 2.382 1.00 0.00 C ATOM 1334 CG TRP A 95 -7.749 1.674 1.819 1.00 0.00 C ATOM 1335 CD1 TRP A 95 -8.201 0.578 2.474 1.00 0.00 C ATOM 1336 CD2 TRP A 95 -7.282 1.184 0.519 1.00 0.00 C ATOM 1337 NE1 TRP A 95 -8.027 -0.538 1.685 1.00 0.00 N ATOM 1338 CE2 TRP A 95 -7.377 -0.237 0.517 1.00 0.00 C ATOM 1339 CE3 TRP A 95 -6.734 1.778 -0.638 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 -6.874 -1.034 -0.517 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 -6.285 0.987 -1.716 1.00 0.00 C ATOM 1342 CH2 TRP A 95 -6.316 -0.415 -1.644 1.00 0.00 C ATOM 0 H TRP A 95 -9.405 4.509 3.880 1.00 0.00 H new ATOM 0 HA TRP A 95 -7.479 2.283 4.338 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -8.358 3.695 1.886 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -6.638 3.446 2.112 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -8.632 0.579 3.464 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -8.343 -1.474 1.939 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -6.657 2.854 -0.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -6.915 -2.111 -0.448 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -5.912 1.466 -2.609 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -5.914 -1.011 -2.450 1.00 0.00 H new ATOM 1353 N VAL A 96 -6.201 4.168 5.496 1.00 0.00 N ATOM 1354 CA VAL A 96 -5.090 5.051 5.827 1.00 0.00 C ATOM 1355 C VAL A 96 -3.898 4.428 5.112 1.00 0.00 C ATOM 1356 O VAL A 96 -3.730 3.208 5.177 1.00 0.00 O ATOM 1357 CB VAL A 96 -4.858 5.135 7.349 1.00 0.00 C ATOM 1358 CG1 VAL A 96 -3.915 6.301 7.676 1.00 0.00 C ATOM 1359 CG2 VAL A 96 -6.164 5.310 8.136 1.00 0.00 C ATOM 0 H VAL A 96 -6.310 3.374 6.127 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.273 6.080 5.516 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.411 4.188 7.651 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.758 6.351 8.754 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.958 6.146 7.177 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -4.358 7.235 7.330 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.942 5.363 9.202 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -6.658 6.229 7.822 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.821 4.462 7.944 1.00 0.00 H new ATOM 1369 N VAL A 97 -3.118 5.231 4.397 1.00 0.00 N ATOM 1370 CA VAL A 97 -1.883 4.803 3.766 1.00 0.00 C ATOM 1371 C VAL A 97 -0.824 5.844 4.131 1.00 0.00 C ATOM 1372 O VAL A 97 -1.127 6.924 4.650 1.00 0.00 O ATOM 1373 CB VAL A 97 -2.126 4.507 2.260 1.00 0.00 C ATOM 1374 CG1 VAL A 97 -2.904 5.584 1.489 1.00 0.00 C ATOM 1375 CG2 VAL A 97 -0.852 4.204 1.457 1.00 0.00 C ATOM 0 H VAL A 97 -3.334 6.215 4.239 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.500 3.848 4.126 1.00 0.00 H new ATOM 0 HB VAL A 97 -2.744 3.612 2.332 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.017 5.277 0.449 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -3.889 5.713 1.938 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -2.359 6.527 1.532 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.115 4.009 0.417 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -0.178 5.059 1.507 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.357 3.328 1.876 1.00 0.00 H new ATOM 1385 N THR A 98 0.447 5.500 3.989 1.00 0.00 N ATOM 1386 CA THR A 98 1.562 6.380 4.300 1.00 0.00 C ATOM 1387 C THR A 98 2.766 5.839 3.522 1.00 0.00 C ATOM 1388 O THR A 98 2.788 4.646 3.210 1.00 0.00 O ATOM 1389 CB THR A 98 1.821 6.397 5.832 1.00 0.00 C ATOM 1390 OG1 THR A 98 0.697 6.044 6.608 1.00 0.00 O ATOM 1391 CG2 THR A 98 2.179 7.799 6.307 1.00 0.00 C ATOM 0 H THR A 98 0.737 4.584 3.648 1.00 0.00 H new ATOM 0 HA THR A 98 1.360 7.412 4.012 1.00 0.00 H new ATOM 0 HB THR A 98 2.623 5.671 5.968 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.933 6.075 7.559 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.356 7.785 7.383 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.080 8.137 5.796 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.358 8.480 6.083 1.00 0.00 H new ATOM 1399 N VAL A 99 3.763 6.675 3.220 1.00 0.00 N ATOM 1400 CA VAL A 99 5.035 6.235 2.649 1.00 0.00 C ATOM 1401 C VAL A 99 6.130 6.766 3.563 1.00 0.00 C ATOM 1402 O VAL A 99 6.562 7.909 3.441 1.00 0.00 O ATOM 1403 CB VAL A 99 5.181 6.653 1.169 1.00 0.00 C ATOM 1404 CG1 VAL A 99 6.581 6.308 0.636 1.00 0.00 C ATOM 1405 CG2 VAL A 99 4.127 5.931 0.309 1.00 0.00 C ATOM 0 H VAL A 99 3.708 7.683 3.367 1.00 0.00 H new ATOM 0 HA VAL A 99 5.101 5.148 2.610 1.00 0.00 H new ATOM 0 HB VAL A 99 5.034 7.731 1.110 1.00 0.00 H new ATOM 0 HG11 VAL A 99 6.658 6.612 -0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.334 6.833 1.224 1.00 0.00 H new ATOM 0 HG13 VAL A 99 6.745 5.233 0.714 1.00 0.00 H new ATOM 0 HG21 VAL A 99 4.239 6.233 -0.732 1.00 0.00 H new ATOM 0 HG22 VAL A 99 4.266 4.853 0.392 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.129 6.196 0.658 1.00 0.00 H new ATOM 1415 N TYR A 100 6.520 5.958 4.542 1.00 0.00 N ATOM 1416 CA TYR A 100 7.677 6.239 5.371 1.00 0.00 C ATOM 1417 C TYR A 100 8.952 6.014 4.548 1.00 0.00 C ATOM 1418 O TYR A 100 8.932 5.374 3.493 1.00 0.00 O ATOM 1419 CB TYR A 100 7.629 5.357 6.627 1.00 0.00 C ATOM 1420 CG TYR A 100 6.597 5.795 7.651 1.00 0.00 C ATOM 1421 CD1 TYR A 100 5.246 5.411 7.526 1.00 0.00 C ATOM 1422 CD2 TYR A 100 7.004 6.561 8.759 1.00 0.00 C ATOM 1423 CE1 TYR A 100 4.301 5.809 8.493 1.00 0.00 C ATOM 1424 CE2 TYR A 100 6.069 6.952 9.728 1.00 0.00 C ATOM 1425 CZ TYR A 100 4.712 6.594 9.595 1.00 0.00 C ATOM 1426 OH TYR A 100 3.839 7.029 10.541 1.00 0.00 O ATOM 0 H TYR A 100 6.040 5.090 4.780 1.00 0.00 H new ATOM 0 HA TYR A 100 7.674 7.278 5.700 1.00 0.00 H new ATOM 0 HB2 TYR A 100 7.417 4.330 6.329 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.613 5.356 7.096 1.00 0.00 H new ATOM 0 HD1 TYR A 100 4.934 4.809 6.685 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.040 6.849 8.863 1.00 0.00 H new ATOM 0 HE1 TYR A 100 3.267 5.515 8.393 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.390 7.531 10.581 1.00 0.00 H new ATOM 0 HH TYR A 100 4.321 7.553 11.215 1.00 0.00 H new ATOM 1436 N LYS A 101 10.065 6.555 5.042 1.00 0.00 N ATOM 1437 CA LYS A 101 11.349 6.702 4.375 1.00 0.00 C ATOM 1438 C LYS A 101 12.457 6.112 5.258 1.00 0.00 C ATOM 1439 O LYS A 101 12.170 5.217 6.052 1.00 0.00 O ATOM 1440 CB LYS A 101 11.515 8.190 4.014 1.00 0.00 C ATOM 1441 CG LYS A 101 12.471 8.366 2.827 1.00 0.00 C ATOM 1442 CD LYS A 101 11.843 9.179 1.696 1.00 0.00 C ATOM 1443 CE LYS A 101 12.836 9.421 0.557 1.00 0.00 C ATOM 1444 NZ LYS A 101 12.449 10.594 -0.248 1.00 0.00 N ATOM 0 H LYS A 101 10.090 6.929 5.991 1.00 0.00 H new ATOM 0 HA LYS A 101 11.411 6.141 3.442 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.543 8.619 3.769 1.00 0.00 H new ATOM 0 HB3 LYS A 101 11.896 8.737 4.877 1.00 0.00 H new ATOM 0 HG2 LYS A 101 13.381 8.861 3.166 1.00 0.00 H new ATOM 0 HG3 LYS A 101 12.763 7.386 2.449 1.00 0.00 H new ATOM 0 HD2 LYS A 101 10.969 8.654 1.312 1.00 0.00 H new ATOM 0 HD3 LYS A 101 11.495 10.136 2.085 1.00 0.00 H new ATOM 0 HE2 LYS A 101 13.834 9.572 0.967 1.00 0.00 H new ATOM 0 HE3 LYS A 101 12.884 8.539 -0.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 13.140 10.734 -1.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 11.506 10.438 -0.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 12.427 11.439 0.358 1.00 0.00 H new ATOM 1458 N ASN A 102 13.713 6.569 5.128 1.00 0.00 N ATOM 1459 CA ASN A 102 14.867 6.236 5.987 1.00 0.00 C ATOM 1460 C ASN A 102 14.637 6.694 7.445 1.00 0.00 C ATOM 1461 O ASN A 102 15.348 7.570 7.942 1.00 0.00 O ATOM 1462 CB ASN A 102 16.180 6.886 5.470 1.00 0.00 C ATOM 1463 CG ASN A 102 16.488 6.731 3.995 1.00 0.00 C ATOM 1464 OD1 ASN A 102 17.036 5.725 3.552 1.00 0.00 O ATOM 1465 ND2 ASN A 102 16.163 7.733 3.193 1.00 0.00 N ATOM 0 H ASN A 102 13.967 7.216 4.381 1.00 0.00 H new ATOM 0 HA ASN A 102 14.965 5.151 5.954 1.00 0.00 H new ATOM 0 HB2 ASN A 102 16.144 7.951 5.699 1.00 0.00 H new ATOM 0 HB3 ASN A 102 17.012 6.466 6.036 1.00 0.00 H new ATOM 0 HD21 ASN A 102 16.367 7.675 2.195 1.00 0.00 H new ATOM 0 HD22 ASN A 102 15.708 8.563 3.573 1.00 0.00 H new ATOM 1472 N GLY A 103 13.618 6.185 8.135 1.00 0.00 N ATOM 1473 CA GLY A 103 13.190 6.708 9.424 1.00 0.00 C ATOM 1474 C GLY A 103 12.738 8.165 9.301 1.00 0.00 C ATOM 1475 O GLY A 103 13.394 9.072 9.815 1.00 0.00 O ATOM 0 H GLY A 103 13.064 5.392 7.810 1.00 0.00 H new ATOM 0 HA2 GLY A 103 12.372 6.101 9.813 1.00 0.00 H new ATOM 0 HA3 GLY A 103 14.009 6.637 10.140 1.00 0.00 H new ATOM 1479 N LYS A 104 11.643 8.409 8.578 1.00 0.00 N ATOM 1480 CA LYS A 104 10.712 9.513 8.787 1.00 0.00 C ATOM 1481 C LYS A 104 9.445 9.217 7.994 1.00 0.00 C ATOM 1482 O LYS A 104 9.457 8.372 7.102 1.00 0.00 O ATOM 1483 CB LYS A 104 11.297 10.872 8.346 1.00 0.00 C ATOM 1484 CG LYS A 104 11.334 11.888 9.494 1.00 0.00 C ATOM 1485 CD LYS A 104 9.952 12.268 10.050 1.00 0.00 C ATOM 1486 CE LYS A 104 10.054 13.475 10.986 1.00 0.00 C ATOM 1487 NZ LYS A 104 8.845 13.612 11.827 1.00 0.00 N ATOM 0 H LYS A 104 11.371 7.813 7.796 1.00 0.00 H new ATOM 0 HA LYS A 104 10.504 9.592 9.854 1.00 0.00 H new ATOM 0 HB2 LYS A 104 12.306 10.724 7.962 1.00 0.00 H new ATOM 0 HB3 LYS A 104 10.700 11.274 7.527 1.00 0.00 H new ATOM 0 HG2 LYS A 104 11.939 11.481 10.304 1.00 0.00 H new ATOM 0 HG3 LYS A 104 11.834 12.792 9.147 1.00 0.00 H new ATOM 0 HD2 LYS A 104 9.275 12.497 9.227 1.00 0.00 H new ATOM 0 HD3 LYS A 104 9.526 11.421 10.587 1.00 0.00 H new ATOM 0 HE2 LYS A 104 10.932 13.369 11.623 1.00 0.00 H new ATOM 0 HE3 LYS A 104 10.194 14.382 10.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.947 14.439 12.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 8.011 13.737 11.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 8.726 12.756 12.406 1.00 0.00 H new ATOM 1501 N GLU A 105 8.380 9.944 8.297 1.00 0.00 N ATOM 1502 CA GLU A 105 7.222 10.160 7.442 1.00 0.00 C ATOM 1503 C GLU A 105 7.616 11.213 6.388 1.00 0.00 C ATOM 1504 O GLU A 105 8.414 12.101 6.704 1.00 0.00 O ATOM 1505 CB GLU A 105 6.123 10.668 8.395 1.00 0.00 C ATOM 1506 CG GLU A 105 4.756 11.072 7.834 1.00 0.00 C ATOM 1507 CD GLU A 105 3.952 11.918 8.831 1.00 0.00 C ATOM 1508 OE1 GLU A 105 4.260 11.905 10.045 1.00 0.00 O ATOM 1509 OE2 GLU A 105 2.975 12.586 8.411 1.00 0.00 O ATOM 0 H GLU A 105 8.296 10.424 9.193 1.00 0.00 H new ATOM 0 HA GLU A 105 6.876 9.275 6.908 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.952 9.890 9.139 1.00 0.00 H new ATOM 0 HB3 GLU A 105 6.525 11.532 8.924 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.895 11.634 6.911 1.00 0.00 H new ATOM 0 HG3 GLU A 105 4.190 10.176 7.579 1.00 0.00 H new ATOM 1516 N ILE A 106 7.075 11.146 5.166 1.00 0.00 N ATOM 1517 CA ILE A 106 7.129 12.207 4.154 1.00 0.00 C ATOM 1518 C ILE A 106 5.765 12.450 3.479 1.00 0.00 C ATOM 1519 O ILE A 106 5.626 13.411 2.723 1.00 0.00 O ATOM 1520 CB ILE A 106 8.182 11.873 3.074 1.00 0.00 C ATOM 1521 CG1 ILE A 106 7.930 10.487 2.442 1.00 0.00 C ATOM 1522 CG2 ILE A 106 9.611 11.958 3.632 1.00 0.00 C ATOM 1523 CD1 ILE A 106 8.418 10.391 1.003 1.00 0.00 C ATOM 0 H ILE A 106 6.569 10.321 4.843 1.00 0.00 H new ATOM 0 HA ILE A 106 7.410 13.121 4.677 1.00 0.00 H new ATOM 0 HB ILE A 106 8.080 12.624 2.291 1.00 0.00 H new ATOM 0 HG12 ILE A 106 8.429 9.725 3.041 1.00 0.00 H new ATOM 0 HG13 ILE A 106 6.863 10.268 2.473 1.00 0.00 H new ATOM 0 HG21 ILE A 106 10.324 11.717 2.844 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.800 12.968 3.996 1.00 0.00 H new ATOM 0 HG23 ILE A 106 9.724 11.250 4.453 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.212 9.393 0.615 1.00 0.00 H new ATOM 0 HD12 ILE A 106 7.900 11.131 0.393 1.00 0.00 H new ATOM 0 HD13 ILE A 106 9.491 10.579 0.969 1.00 0.00 H new ATOM 1535 N GLU A 107 4.771 11.589 3.695 1.00 0.00 N ATOM 1536 CA GLU A 107 3.527 11.495 2.931 1.00 0.00 C ATOM 1537 C GLU A 107 2.390 11.086 3.884 1.00 0.00 C ATOM 1538 O GLU A 107 2.675 10.542 4.955 1.00 0.00 O ATOM 1539 CB GLU A 107 3.805 10.471 1.817 1.00 0.00 C ATOM 1540 CG GLU A 107 2.623 10.105 0.921 1.00 0.00 C ATOM 1541 CD GLU A 107 1.902 11.327 0.352 1.00 0.00 C ATOM 1542 OE1 GLU A 107 2.434 12.031 -0.536 1.00 0.00 O ATOM 1543 OE2 GLU A 107 0.778 11.582 0.837 1.00 0.00 O ATOM 0 H GLU A 107 4.814 10.902 4.448 1.00 0.00 H new ATOM 0 HA GLU A 107 3.210 12.435 2.479 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.604 10.861 1.186 1.00 0.00 H new ATOM 0 HB3 GLU A 107 4.180 9.557 2.278 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.977 9.484 0.098 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.914 9.505 1.492 1.00 0.00 H new ATOM 1550 N LYS A 108 1.115 11.330 3.542 1.00 0.00 N ATOM 1551 CA LYS A 108 -0.028 11.104 4.435 1.00 0.00 C ATOM 1552 C LYS A 108 -1.359 10.830 3.718 1.00 0.00 C ATOM 1553 O LYS A 108 -2.420 11.067 4.301 1.00 0.00 O ATOM 1554 CB LYS A 108 -0.136 12.298 5.403 1.00 0.00 C ATOM 1555 CG LYS A 108 -0.785 11.915 6.742 1.00 0.00 C ATOM 1556 CD LYS A 108 -0.887 13.149 7.633 1.00 0.00 C ATOM 1557 CE LYS A 108 -1.400 12.753 9.013 1.00 0.00 C ATOM 1558 NZ LYS A 108 -1.193 13.819 10.007 1.00 0.00 N ATOM 0 H LYS A 108 0.848 11.694 2.627 1.00 0.00 H new ATOM 0 HA LYS A 108 0.166 10.182 4.984 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.859 12.702 5.588 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -0.720 13.090 4.934 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -1.776 11.495 6.570 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.194 11.145 7.237 1.00 0.00 H new ATOM 0 HD2 LYS A 108 0.089 13.626 7.722 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -1.559 13.879 7.182 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -2.462 12.517 8.951 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -0.891 11.847 9.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -1.556 13.508 10.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -0.177 14.027 10.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -1.699 14.676 9.707 1.00 0.00 H new ATOM 1572 N LYS A 109 -1.321 10.310 2.492 1.00 0.00 N ATOM 1573 CA LYS A 109 -2.519 9.959 1.710 1.00 0.00 C ATOM 1574 C LYS A 109 -3.516 9.154 2.547 1.00 0.00 C ATOM 1575 O LYS A 109 -3.158 8.140 3.139 1.00 0.00 O ATOM 1576 CB LYS A 109 -2.127 9.204 0.424 1.00 0.00 C ATOM 1577 CG LYS A 109 -1.845 10.168 -0.740 1.00 0.00 C ATOM 1578 CD LYS A 109 -3.071 10.473 -1.614 1.00 0.00 C ATOM 1579 CE LYS A 109 -3.359 9.347 -2.617 1.00 0.00 C ATOM 1580 NZ LYS A 109 -4.319 9.757 -3.668 1.00 0.00 N ATOM 0 H LYS A 109 -0.448 10.116 2.002 1.00 0.00 H new ATOM 0 HA LYS A 109 -3.015 10.885 1.420 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.243 8.596 0.615 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.929 8.521 0.144 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.458 11.104 -0.337 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.062 9.743 -1.368 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -3.942 10.622 -0.976 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -2.908 11.406 -2.154 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -2.426 9.033 -3.084 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.755 8.483 -2.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -4.984 8.979 -3.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -4.846 10.595 -3.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -3.802 9.985 -4.541 1.00 0.00 H new ATOM 1594 N SER A 110 -4.776 9.571 2.591 1.00 0.00 N ATOM 1595 CA SER A 110 -5.813 8.945 3.377 1.00 0.00 C ATOM 1596 C SER A 110 -7.144 9.081 2.659 1.00 0.00 C ATOM 1597 O SER A 110 -7.409 10.116 2.047 1.00 0.00 O ATOM 1598 CB SER A 110 -5.862 9.681 4.712 1.00 0.00 C ATOM 1599 OG SER A 110 -5.687 11.079 4.554 1.00 0.00 O ATOM 0 H SER A 110 -5.106 10.378 2.062 1.00 0.00 H new ATOM 0 HA SER A 110 -5.612 7.884 3.527 1.00 0.00 H new ATOM 0 HB2 SER A 110 -6.819 9.488 5.198 1.00 0.00 H new ATOM 0 HB3 SER A 110 -5.086 9.290 5.370 1.00 0.00 H new ATOM 0 HG SER A 110 -4.731 11.284 4.492 1.00 0.00 H new ATOM 1605 N LEU A 111 -7.967 8.031 2.696 1.00 0.00 N ATOM 1606 CA LEU A 111 -9.214 7.987 1.968 1.00 0.00 C ATOM 1607 C LEU A 111 -10.318 7.477 2.877 1.00 0.00 C ATOM 1608 O LEU A 111 -10.152 7.243 4.081 1.00 0.00 O ATOM 1609 CB LEU A 111 -9.160 7.156 0.669 1.00 0.00 C ATOM 1610 CG LEU A 111 -7.907 7.308 -0.203 1.00 0.00 C ATOM 1611 CD1 LEU A 111 -6.719 6.647 0.483 1.00 0.00 C ATOM 1612 CD2 LEU A 111 -8.135 6.545 -1.490 1.00 0.00 C ATOM 0 H LEU A 111 -7.776 7.188 3.238 1.00 0.00 H new ATOM 0 HA LEU A 111 -9.421 9.009 1.652 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.262 6.104 0.935 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -10.028 7.417 0.063 1.00 0.00 H new ATOM 0 HG LEU A 111 -7.716 8.367 -0.375 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.831 6.757 -0.140 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.546 7.122 1.449 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -6.928 5.588 0.632 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -7.256 6.638 -2.129 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -8.309 5.493 -1.263 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -9.004 6.954 -2.006 1.00 0.00 H new ATOM 1624 N VAL A 112 -11.454 7.282 2.237 1.00 0.00 N ATOM 1625 CA VAL A 112 -12.733 6.860 2.763 1.00 0.00 C ATOM 1626 C VAL A 112 -13.572 6.304 1.619 1.00 0.00 C ATOM 1627 O VAL A 112 -13.531 6.843 0.510 1.00 0.00 O ATOM 1628 CB VAL A 112 -13.368 8.072 3.465 1.00 0.00 C ATOM 1629 CG1 VAL A 112 -13.680 9.271 2.551 1.00 0.00 C ATOM 1630 CG2 VAL A 112 -14.618 7.694 4.276 1.00 0.00 C ATOM 0 H VAL A 112 -11.507 7.432 1.229 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.645 6.061 3.499 1.00 0.00 H new ATOM 0 HB VAL A 112 -12.584 8.404 4.145 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -14.125 10.072 3.141 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -12.758 9.627 2.091 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -14.378 8.963 1.773 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -15.027 8.586 4.751 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.366 7.262 3.611 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -14.349 6.966 5.041 1.00 0.00 H new ATOM 1640 N PHE A 113 -14.318 5.238 1.890 1.00 0.00 N ATOM 1641 CA PHE A 113 -15.310 4.651 1.000 1.00 0.00 C ATOM 1642 C PHE A 113 -16.508 4.275 1.879 1.00 0.00 C ATOM 1643 O PHE A 113 -16.448 4.416 3.107 1.00 0.00 O ATOM 1644 CB PHE A 113 -14.716 3.461 0.226 1.00 0.00 C ATOM 1645 CG PHE A 113 -13.576 3.817 -0.718 1.00 0.00 C ATOM 1646 CD1 PHE A 113 -12.276 4.034 -0.219 1.00 0.00 C ATOM 1647 CD2 PHE A 113 -13.806 3.921 -2.102 1.00 0.00 C ATOM 1648 CE1 PHE A 113 -11.238 4.423 -1.084 1.00 0.00 C ATOM 1649 CE2 PHE A 113 -12.755 4.255 -2.973 1.00 0.00 C ATOM 1650 CZ PHE A 113 -11.478 4.543 -2.464 1.00 0.00 C ATOM 0 H PHE A 113 -14.243 4.738 2.776 1.00 0.00 H new ATOM 0 HA PHE A 113 -15.634 5.349 0.228 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -14.358 2.722 0.943 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -15.511 2.987 -0.350 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -12.076 3.901 0.834 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -14.795 3.743 -2.497 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -10.255 4.630 -0.688 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -12.930 4.290 -4.038 1.00 0.00 H new ATOM 0 HZ PHE A 113 -10.686 4.855 -3.128 1.00 0.00 H new ATOM 1796 N ASP A 123 -8.096 7.357 -7.355 1.00 0.00 N ATOM 1797 CA ASP A 123 -7.955 7.721 -5.937 1.00 0.00 C ATOM 1798 C ASP A 123 -6.612 7.293 -5.337 1.00 0.00 C ATOM 1799 O ASP A 123 -6.207 7.807 -4.291 1.00 0.00 O ATOM 1800 CB ASP A 123 -9.097 7.113 -5.090 1.00 0.00 C ATOM 1801 CG ASP A 123 -10.041 8.147 -4.445 1.00 0.00 C ATOM 1802 OD1 ASP A 123 -9.769 9.369 -4.423 1.00 0.00 O ATOM 1803 OD2 ASP A 123 -11.117 7.747 -3.945 1.00 0.00 O ATOM 0 HA ASP A 123 -8.005 8.809 -5.908 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -9.686 6.448 -5.722 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -8.660 6.499 -4.302 1.00 0.00 H new ATOM 1808 N LEU A 124 -5.896 6.377 -5.993 1.00 0.00 N ATOM 1809 CA LEU A 124 -4.552 5.974 -5.631 1.00 0.00 C ATOM 1810 C LEU A 124 -3.719 5.931 -6.907 1.00 0.00 C ATOM 1811 O LEU A 124 -3.971 5.123 -7.805 1.00 0.00 O ATOM 1812 CB LEU A 124 -4.592 4.621 -4.922 1.00 0.00 C ATOM 1813 CG LEU A 124 -3.391 4.358 -4.001 1.00 0.00 C ATOM 1814 CD1 LEU A 124 -3.384 5.272 -2.767 1.00 0.00 C ATOM 1815 CD2 LEU A 124 -3.430 2.897 -3.549 1.00 0.00 C ATOM 0 H LEU A 124 -6.253 5.886 -6.813 1.00 0.00 H new ATOM 0 HA LEU A 124 -4.098 6.682 -4.937 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -5.507 4.558 -4.334 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -4.640 3.832 -5.672 1.00 0.00 H new ATOM 0 HG LEU A 124 -2.483 4.571 -4.566 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -2.515 5.044 -2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -3.340 6.313 -3.086 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.293 5.108 -2.188 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.582 2.696 -2.894 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -4.358 2.708 -3.010 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -3.377 2.245 -4.421 1.00 0.00 H new ATOM 1827 N ASN A 125 -2.761 6.842 -6.988 1.00 0.00 N ATOM 1828 CA ASN A 125 -1.917 7.125 -8.142 1.00 0.00 C ATOM 1829 C ASN A 125 -0.623 7.773 -7.633 1.00 0.00 C ATOM 1830 O ASN A 125 -0.330 8.917 -7.982 1.00 0.00 O ATOM 1831 CB ASN A 125 -2.683 8.044 -9.119 1.00 0.00 C ATOM 1832 CG ASN A 125 -1.979 8.146 -10.462 1.00 0.00 C ATOM 1833 OD1 ASN A 125 -1.397 9.172 -10.809 1.00 0.00 O ATOM 1834 ND2 ASN A 125 -2.062 7.107 -11.272 1.00 0.00 N ATOM 0 H ASN A 125 -2.537 7.445 -6.196 1.00 0.00 H new ATOM 0 HA ASN A 125 -1.661 6.215 -8.685 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -3.692 7.659 -9.265 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -2.781 9.038 -8.683 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -1.640 7.149 -12.200 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -2.548 6.263 -10.970 1.00 0.00 H new ATOM 1841 N LEU A 126 0.075 7.128 -6.694 1.00 0.00 N ATOM 1842 CA LEU A 126 1.224 7.696 -5.986 1.00 0.00 C ATOM 1843 C LEU A 126 2.499 7.043 -6.506 1.00 0.00 C ATOM 1844 O LEU A 126 2.515 5.856 -6.843 1.00 0.00 O ATOM 1845 CB LEU A 126 1.078 7.486 -4.466 1.00 0.00 C ATOM 1846 CG LEU A 126 1.392 8.725 -3.613 1.00 0.00 C ATOM 1847 CD1 LEU A 126 0.427 9.889 -3.879 1.00 0.00 C ATOM 1848 CD2 LEU A 126 1.292 8.312 -2.140 1.00 0.00 C ATOM 0 H LEU A 126 -0.148 6.177 -6.399 1.00 0.00 H new ATOM 0 HA LEU A 126 1.272 8.770 -6.168 1.00 0.00 H new ATOM 0 HB2 LEU A 126 0.058 7.165 -4.254 1.00 0.00 H new ATOM 0 HB3 LEU A 126 1.738 6.674 -4.160 1.00 0.00 H new ATOM 0 HG LEU A 126 2.390 9.078 -3.871 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.697 10.737 -3.249 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.490 10.182 -4.927 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.592 9.577 -3.650 1.00 0.00 H new ATOM 0 HD21 LEU A 126 1.510 9.171 -1.506 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.285 7.952 -1.931 1.00 0.00 H new ATOM 0 HD23 LEU A 126 2.010 7.518 -1.935 1.00 0.00 H new ATOM 1860 N TYR A 127 3.568 7.826 -6.606 1.00 0.00 N ATOM 1861 CA TYR A 127 4.767 7.444 -7.325 1.00 0.00 C ATOM 1862 C TYR A 127 5.947 8.281 -6.829 1.00 0.00 C ATOM 1863 O TYR A 127 5.836 9.494 -6.640 1.00 0.00 O ATOM 1864 CB TYR A 127 4.475 7.648 -8.821 1.00 0.00 C ATOM 1865 CG TYR A 127 5.574 7.345 -9.819 1.00 0.00 C ATOM 1866 CD1 TYR A 127 6.531 6.332 -9.595 1.00 0.00 C ATOM 1867 CD2 TYR A 127 5.583 8.065 -11.030 1.00 0.00 C ATOM 1868 CE1 TYR A 127 7.521 6.077 -10.561 1.00 0.00 C ATOM 1869 CE2 TYR A 127 6.551 7.795 -12.008 1.00 0.00 C ATOM 1870 CZ TYR A 127 7.534 6.812 -11.766 1.00 0.00 C ATOM 1871 OH TYR A 127 8.480 6.576 -12.708 1.00 0.00 O ATOM 0 H TYR A 127 3.622 8.753 -6.184 1.00 0.00 H new ATOM 0 HA TYR A 127 5.038 6.402 -7.157 1.00 0.00 H new ATOM 0 HB2 TYR A 127 3.614 7.031 -9.078 1.00 0.00 H new ATOM 0 HB3 TYR A 127 4.176 8.687 -8.962 1.00 0.00 H new ATOM 0 HD1 TYR A 127 6.503 5.754 -8.683 1.00 0.00 H new ATOM 0 HD2 TYR A 127 4.840 8.829 -11.206 1.00 0.00 H new ATOM 0 HE1 TYR A 127 8.270 5.320 -10.381 1.00 0.00 H new ATOM 0 HE2 TYR A 127 6.544 8.337 -12.942 1.00 0.00 H new ATOM 0 HH TYR A 127 9.361 6.819 -12.355 1.00 0.00 H new ATOM 1881 N TYR A 128 7.085 7.626 -6.630 1.00 0.00 N ATOM 1882 CA TYR A 128 8.364 8.157 -6.193 1.00 0.00 C ATOM 1883 C TYR A 128 9.417 7.482 -7.057 1.00 0.00 C ATOM 1884 O TYR A 128 9.430 6.257 -7.145 1.00 0.00 O ATOM 1885 CB TYR A 128 8.585 7.817 -4.706 1.00 0.00 C ATOM 1886 CG TYR A 128 7.675 8.579 -3.770 1.00 0.00 C ATOM 1887 CD1 TYR A 128 7.771 9.981 -3.677 1.00 0.00 C ATOM 1888 CD2 TYR A 128 6.711 7.886 -3.019 1.00 0.00 C ATOM 1889 CE1 TYR A 128 6.906 10.690 -2.826 1.00 0.00 C ATOM 1890 CE2 TYR A 128 5.819 8.590 -2.196 1.00 0.00 C ATOM 1891 CZ TYR A 128 5.918 9.990 -2.099 1.00 0.00 C ATOM 1892 OH TYR A 128 5.050 10.642 -1.297 1.00 0.00 O ATOM 0 H TYR A 128 7.137 6.619 -6.785 1.00 0.00 H new ATOM 0 HA TYR A 128 8.411 9.241 -6.293 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.431 6.748 -4.559 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.622 8.028 -4.444 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.510 10.511 -4.260 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.656 6.809 -3.075 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.996 11.762 -2.729 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.060 8.060 -1.640 1.00 0.00 H new ATOM 0 HH TYR A 128 4.134 10.478 -1.604 1.00 0.00 H new ATOM 1902 N ASN A 129 10.272 8.277 -7.684 1.00 0.00 N ATOM 1903 CA ASN A 129 11.633 7.994 -8.127 1.00 0.00 C ATOM 1904 C ASN A 129 12.318 9.357 -8.185 1.00 0.00 C ATOM 1905 O ASN A 129 11.685 10.349 -7.742 1.00 0.00 O ATOM 1906 CB ASN A 129 11.689 7.209 -9.460 1.00 0.00 C ATOM 1907 CG ASN A 129 11.439 8.014 -10.727 1.00 0.00 C ATOM 1908 OD1 ASN A 129 10.412 7.864 -11.379 1.00 0.00 O ATOM 1909 ND2 ASN A 129 12.376 8.842 -11.137 1.00 0.00 N ATOM 0 H ASN A 129 10.004 9.233 -7.919 1.00 0.00 H new ATOM 0 HA ASN A 129 12.150 7.325 -7.439 1.00 0.00 H new ATOM 0 HB2 ASN A 129 12.670 6.740 -9.540 1.00 0.00 H new ATOM 0 HB3 ASN A 129 10.954 6.405 -9.415 1.00 0.00 H new ATOM 0 HD21 ASN A 129 12.251 9.365 -12.004 1.00 0.00 H new ATOM 0 HD22 ASN A 129 13.228 8.961 -10.588 1.00 0.00 H new