USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1128 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 133 GLN : amide:sc= -0.0349 X(o=-0.011,f=-0.29) USER MOD Set 1.2: A 137 GLN : amide:sc= 0.024 X(o=-0.011,f=-0.025) USER MOD Set 2.1: A 100 TYR OH : rot 180:sc= 0.414 USER MOD Set 2.2: A 112 TYR OH : rot -126:sc= -0.618 USER MOD Set 2.3: A 138 ASN : amide:sc=-0.00157 X(o=-0.21,f=-0.49) USER MOD Set 3.1: A 74 ASN :FLIP amide:sc= 0.315 F(o=-0.76,f=0.6) USER MOD Set 3.2: A 106 THR OG1 : rot -2:sc= 0.289 USER MOD Set 4.1: A 63 MET CE :methyl 174:sc= -2.46 (180deg=-2.65!) USER MOD Set 4.2: A 82 CYS SG : rot 65:sc= 0.0412 USER MOD Set 5.1: A 52 LYS NZ :NH3+ -179:sc= 1.13 (180deg=0.713) USER MOD Set 5.2: A 84 LYS NZ :NH3+ 153:sc= 0.837 (180deg=0.496) USER MOD Set 5.3: A 88 TYR OH : rot 30:sc= 0.382 USER MOD Single : A 16 ASN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 19 GLN : amide:sc= -0.323 X(o=-0.32,f=-0.05) USER MOD Single : A 20 MET CE :methyl -129:sc= -0.538 (180deg=-3.95!) USER MOD Single : A 24 HIS : no HD1:sc= -0.212 X(o=-0.21,f=0.038) USER MOD Single : A 25 MET CE :methyl 150:sc= -0.297 (180deg=-0.569) USER MOD Single : A 40 TYR OH : rot 30:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.27 K(o=0.27,f=-1.5!) USER MOD Single : A 47 ASN : amide:sc= 0.13 X(o=0.13,f=-0.1) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 72:sc= 1.1 USER MOD Single : A 61 HIS : +bothHN:sc= -1.15 K(o=-1.2,f=-4) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0283) USER MOD Single : A 72 TYR OH : rot 180:sc= -0.291 USER MOD Single : A 73 HIS : no HD1:sc= -1.2! C(o=-1.2!,f=-6!) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0.329 X(o=0.33,f=-0.098) USER MOD Single : A 90 SER OG : rot 84:sc= 0.187 USER MOD Single : A 93 HIS : no HD1:sc= -0.301 K(o=-0.3,f=-0.94) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 101 ASN :FLIP amide:sc= -1.1 F(o=-1.7,f=-1.1) USER MOD Single : A 102 HIS : no HE2:sc= -1.13 K(o=-1.1,f=-2.1) USER MOD Single : A 108 SER OG : rot -140:sc= 0 USER MOD Single : A 109 SER OG : rot 171:sc= -1.49! USER MOD Single : A 118 HIS : no HD1:sc= -1.2 X(o=-1.2,f=-1.2) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 GLN : amide:sc= -0.423 X(o=-0.42,f=-0.31) USER MOD Single : A 127 HIS : no HD1:sc= -0.0267 X(o=-0.027,f=-0.39) USER MOD Single : A 129 SER OG : rot -82:sc= 0.504 USER MOD Single : A 139 GLN : amide:sc= -0.181 X(o=-0.18,f=-0.053) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 GLN : amide:sc= -0.0533 X(o=-0.053,f=-0.47) USER MOD Single : A 149 GLN :FLIP amide:sc= -0.0568 F(o=-1.6!,f=-0.057) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 GLN : amide:sc= -1.62 X(o=-1.6,f=-1.4) USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 207 N PRO A 14 10.930 17.427 -8.493 1.00 0.31 N ATOM 208 CA PRO A 14 10.609 16.496 -7.362 1.00 52.22 C ATOM 209 C PRO A 14 11.858 16.079 -6.545 1.00 21.23 C ATOM 210 O PRO A 14 11.763 15.759 -5.361 1.00 22.23 O ATOM 211 CB PRO A 14 9.973 15.264 -8.055 1.00 0.24 C ATOM 212 CG PRO A 14 9.531 15.733 -9.410 1.00 32.51 C ATOM 213 CD PRO A 14 10.407 16.914 -9.787 1.00 41.33 C ATOM 0 HA PRO A 14 9.952 16.974 -6.635 1.00 52.22 H new ATOM 0 HB2 PRO A 14 10.692 14.450 -8.140 1.00 0.24 H new ATOM 0 HB3 PRO A 14 9.129 14.885 -7.479 1.00 0.24 H new ATOM 0 HG2 PRO A 14 9.628 14.933 -10.144 1.00 32.51 H new ATOM 0 HG3 PRO A 14 8.481 16.024 -9.392 1.00 32.51 H new ATOM 0 HD2 PRO A 14 11.218 16.610 -10.449 1.00 41.33 H new ATOM 0 HD3 PRO A 14 9.836 17.678 -10.314 1.00 41.33 H new ATOM 221 N GLU A 15 13.015 16.094 -7.230 1.00 52.13 N ATOM 222 CA GLU A 15 14.346 15.838 -6.648 1.00 51.11 C ATOM 223 C GLU A 15 14.700 16.828 -5.507 1.00 74.41 C ATOM 224 O GLU A 15 15.266 16.425 -4.492 1.00 74.43 O ATOM 225 CB GLU A 15 15.403 15.914 -7.779 1.00 64.45 C ATOM 226 CG GLU A 15 15.140 14.935 -8.941 1.00 2.35 C ATOM 227 CD GLU A 15 16.060 15.169 -10.150 1.00 11.24 C ATOM 228 OE1 GLU A 15 15.834 16.143 -10.896 1.00 31.23 O ATOM 229 OE2 GLU A 15 17.011 14.387 -10.357 1.00 51.02 O ATOM 0 H GLU A 15 13.052 16.290 -8.230 1.00 52.13 H new ATOM 0 HA GLU A 15 14.337 14.845 -6.199 1.00 51.11 H new ATOM 0 HB2 GLU A 15 15.430 16.931 -8.171 1.00 64.45 H new ATOM 0 HB3 GLU A 15 16.387 15.709 -7.358 1.00 64.45 H new ATOM 0 HG2 GLU A 15 15.273 13.914 -8.584 1.00 2.35 H new ATOM 0 HG3 GLU A 15 14.102 15.029 -9.259 1.00 2.35 H new ATOM 236 N ASN A 16 14.366 18.123 -5.688 1.00 62.30 N ATOM 237 CA ASN A 16 14.568 19.155 -4.638 1.00 1.11 C ATOM 238 C ASN A 16 13.594 18.946 -3.463 1.00 32.42 C ATOM 239 O ASN A 16 14.015 18.904 -2.299 1.00 72.04 O ATOM 240 CB ASN A 16 14.432 20.585 -5.206 1.00 41.12 C ATOM 241 CG ASN A 16 15.434 20.878 -6.312 1.00 12.35 C ATOM 242 OD1 ASN A 16 16.496 20.267 -6.398 1.00 31.12 O ATOM 243 ND2 ASN A 16 15.125 21.834 -7.152 1.00 43.12 N ATOM 0 H ASN A 16 13.955 18.483 -6.549 1.00 62.30 H new ATOM 0 HA ASN A 16 15.587 19.041 -4.267 1.00 1.11 H new ATOM 0 HB2 ASN A 16 13.422 20.723 -5.591 1.00 41.12 H new ATOM 0 HB3 ASN A 16 14.567 21.306 -4.399 1.00 41.12 H new ATOM 0 HD21 ASN A 16 15.773 22.086 -7.899 1.00 43.12 H new ATOM 0 HD22 ASN A 16 14.237 22.327 -7.060 1.00 43.12 H new ATOM 250 N VAL A 17 12.299 18.769 -3.800 1.00 3.31 N ATOM 251 CA VAL A 17 11.226 18.482 -2.816 1.00 23.50 C ATOM 252 C VAL A 17 11.617 17.305 -1.874 1.00 62.12 C ATOM 253 O VAL A 17 11.473 17.387 -0.658 1.00 73.14 O ATOM 254 CB VAL A 17 9.862 18.162 -3.549 1.00 5.31 C ATOM 255 CG1 VAL A 17 8.735 17.773 -2.555 1.00 62.22 C ATOM 256 CG2 VAL A 17 9.421 19.349 -4.449 1.00 33.23 C ATOM 0 H VAL A 17 11.965 18.821 -4.762 1.00 3.31 H new ATOM 0 HA VAL A 17 11.096 19.376 -2.206 1.00 23.50 H new ATOM 0 HB VAL A 17 10.040 17.295 -4.185 1.00 5.31 H new ATOM 0 HG11 VAL A 17 7.819 17.563 -3.107 1.00 62.22 H new ATOM 0 HG12 VAL A 17 9.033 16.886 -1.996 1.00 62.22 H new ATOM 0 HG13 VAL A 17 8.560 18.597 -1.863 1.00 62.22 H new ATOM 0 HG21 VAL A 17 8.480 19.102 -4.941 1.00 33.23 H new ATOM 0 HG22 VAL A 17 9.287 20.240 -3.836 1.00 33.23 H new ATOM 0 HG23 VAL A 17 10.186 19.538 -5.202 1.00 33.23 H new ATOM 266 N LEU A 18 12.186 16.259 -2.476 1.00 2.13 N ATOM 267 CA LEU A 18 12.594 15.030 -1.779 1.00 71.15 C ATOM 268 C LEU A 18 13.935 15.207 -1.010 1.00 43.45 C ATOM 269 O LEU A 18 14.038 14.769 0.139 1.00 14.01 O ATOM 270 CB LEU A 18 12.646 13.884 -2.819 1.00 74.11 C ATOM 271 CG LEU A 18 13.073 12.462 -2.331 1.00 35.42 C ATOM 272 CD1 LEU A 18 12.361 12.025 -1.034 1.00 44.14 C ATOM 273 CD2 LEU A 18 12.818 11.437 -3.442 1.00 43.21 C ATOM 0 H LEU A 18 12.381 16.238 -3.477 1.00 2.13 H new ATOM 0 HA LEU A 18 11.863 14.782 -1.009 1.00 71.15 H new ATOM 0 HB2 LEU A 18 11.657 13.798 -3.270 1.00 74.11 H new ATOM 0 HB3 LEU A 18 13.332 14.184 -3.611 1.00 74.11 H new ATOM 0 HG LEU A 18 14.137 12.512 -2.099 1.00 35.42 H new ATOM 0 HD11 LEU A 18 12.702 11.030 -0.749 1.00 44.14 H new ATOM 0 HD12 LEU A 18 12.594 12.730 -0.236 1.00 44.14 H new ATOM 0 HD13 LEU A 18 11.284 12.006 -1.199 1.00 44.14 H new ATOM 0 HD21 LEU A 18 13.117 10.447 -3.099 1.00 43.21 H new ATOM 0 HD22 LEU A 18 11.757 11.429 -3.694 1.00 43.21 H new ATOM 0 HD23 LEU A 18 13.398 11.705 -4.325 1.00 43.21 H new ATOM 285 N GLN A 19 14.936 15.904 -1.611 1.00 31.13 N ATOM 286 CA GLN A 19 16.258 16.116 -0.953 1.00 22.43 C ATOM 287 C GLN A 19 16.131 16.986 0.327 1.00 71.30 C ATOM 288 O GLN A 19 17.001 16.930 1.200 1.00 40.04 O ATOM 289 CB GLN A 19 17.315 16.735 -1.914 1.00 31.42 C ATOM 290 CG GLN A 19 17.099 18.226 -2.222 1.00 33.14 C ATOM 291 CD GLN A 19 18.143 18.891 -3.133 1.00 73.05 C ATOM 292 OE1 GLN A 19 18.382 20.089 -3.033 1.00 44.41 O ATOM 293 NE2 GLN A 19 18.762 18.145 -4.023 1.00 22.15 N ATOM 0 H GLN A 19 14.857 16.324 -2.537 1.00 31.13 H new ATOM 0 HA GLN A 19 16.609 15.124 -0.668 1.00 22.43 H new ATOM 0 HB2 GLN A 19 18.305 16.607 -1.476 1.00 31.42 H new ATOM 0 HB3 GLN A 19 17.306 16.178 -2.851 1.00 31.42 H new ATOM 0 HG2 GLN A 19 16.119 18.341 -2.684 1.00 33.14 H new ATOM 0 HG3 GLN A 19 17.072 18.770 -1.278 1.00 33.14 H new ATOM 0 HE21 GLN A 19 18.549 17.150 -4.091 1.00 22.15 H new ATOM 0 HE22 GLN A 19 19.455 18.562 -4.645 1.00 22.15 H new ATOM 302 N MET A 20 15.044 17.800 0.414 1.00 23.43 N ATOM 303 CA MET A 20 14.743 18.601 1.627 1.00 34.53 C ATOM 304 C MET A 20 14.547 17.709 2.884 1.00 4.45 C ATOM 305 O MET A 20 14.958 18.097 3.982 1.00 44.23 O ATOM 306 CB MET A 20 13.515 19.535 1.416 1.00 60.31 C ATOM 307 CG MET A 20 13.705 20.605 0.331 1.00 35.25 C ATOM 308 SD MET A 20 12.412 21.875 0.319 1.00 2.12 S ATOM 309 CE MET A 20 10.913 20.915 0.124 1.00 33.05 C ATOM 0 H MET A 20 14.366 17.917 -0.339 1.00 23.43 H new ATOM 0 HA MET A 20 15.615 19.231 1.803 1.00 34.53 H new ATOM 0 HB2 MET A 20 12.650 18.924 1.158 1.00 60.31 H new ATOM 0 HB3 MET A 20 13.285 20.030 2.360 1.00 60.31 H new ATOM 0 HG2 MET A 20 14.672 21.086 0.475 1.00 35.25 H new ATOM 0 HG3 MET A 20 13.732 20.119 -0.644 1.00 35.25 H new ATOM 0 HE1 MET A 20 10.324 21.323 -0.698 1.00 33.05 H new ATOM 0 HE2 MET A 20 11.170 19.878 -0.094 1.00 33.05 H new ATOM 0 HE3 MET A 20 10.331 20.959 1.044 1.00 33.05 H new ATOM 319 N LEU A 21 13.922 16.515 2.732 1.00 33.12 N ATOM 320 CA LEU A 21 13.827 15.538 3.852 1.00 23.52 C ATOM 321 C LEU A 21 15.048 14.588 3.880 1.00 51.55 C ATOM 322 O LEU A 21 15.478 14.186 4.955 1.00 54.42 O ATOM 323 CB LEU A 21 12.466 14.752 3.857 1.00 42.34 C ATOM 324 CG LEU A 21 12.084 13.826 2.634 1.00 33.25 C ATOM 325 CD1 LEU A 21 12.876 12.497 2.603 1.00 0.11 C ATOM 326 CD2 LEU A 21 10.566 13.535 2.618 1.00 74.41 C ATOM 0 H LEU A 21 13.483 16.207 1.864 1.00 33.12 H new ATOM 0 HA LEU A 21 13.843 16.117 4.775 1.00 23.52 H new ATOM 0 HB2 LEU A 21 12.455 14.129 4.751 1.00 42.34 H new ATOM 0 HB3 LEU A 21 11.668 15.486 3.970 1.00 42.34 H new ATOM 0 HG LEU A 21 12.360 14.382 1.738 1.00 33.25 H new ATOM 0 HD11 LEU A 21 12.566 11.909 1.739 1.00 0.11 H new ATOM 0 HD12 LEU A 21 13.943 12.711 2.533 1.00 0.11 H new ATOM 0 HD13 LEU A 21 12.678 11.934 3.515 1.00 0.11 H new ATOM 0 HD21 LEU A 21 10.327 12.896 1.768 1.00 74.41 H new ATOM 0 HD22 LEU A 21 10.282 13.031 3.542 1.00 74.41 H new ATOM 0 HD23 LEU A 21 10.017 14.473 2.533 1.00 74.41 H new ATOM 338 N GLU A 22 15.600 14.237 2.690 1.00 1.54 N ATOM 339 CA GLU A 22 16.749 13.288 2.577 1.00 12.35 C ATOM 340 C GLU A 22 18.002 13.807 3.301 1.00 53.01 C ATOM 341 O GLU A 22 18.777 13.014 3.828 1.00 13.43 O ATOM 342 CB GLU A 22 17.104 12.982 1.099 1.00 72.01 C ATOM 343 CG GLU A 22 16.064 12.156 0.329 1.00 61.23 C ATOM 344 CD GLU A 22 16.548 11.803 -1.084 1.00 23.35 C ATOM 345 OE1 GLU A 22 16.546 12.692 -1.955 1.00 71.11 O ATOM 346 OE2 GLU A 22 16.970 10.652 -1.320 1.00 71.13 O ATOM 0 H GLU A 22 15.271 14.594 1.793 1.00 1.54 H new ATOM 0 HA GLU A 22 16.422 12.367 3.060 1.00 12.35 H new ATOM 0 HB2 GLU A 22 17.252 13.927 0.576 1.00 72.01 H new ATOM 0 HB3 GLU A 22 18.056 12.451 1.074 1.00 72.01 H new ATOM 0 HG2 GLU A 22 15.848 11.240 0.879 1.00 61.23 H new ATOM 0 HG3 GLU A 22 15.131 12.716 0.264 1.00 61.23 H new ATOM 353 N ALA A 23 18.187 15.142 3.297 1.00 40.24 N ATOM 354 CA ALA A 23 19.263 15.823 4.051 1.00 10.31 C ATOM 355 C ALA A 23 19.186 15.502 5.565 1.00 55.22 C ATOM 356 O ALA A 23 20.206 15.451 6.257 1.00 13.35 O ATOM 357 CB ALA A 23 19.195 17.338 3.805 1.00 62.53 C ATOM 0 H ALA A 23 17.593 15.782 2.770 1.00 40.24 H new ATOM 0 HA ALA A 23 20.222 15.451 3.692 1.00 10.31 H new ATOM 0 HB1 ALA A 23 19.990 17.833 4.363 1.00 62.53 H new ATOM 0 HB2 ALA A 23 19.319 17.540 2.741 1.00 62.53 H new ATOM 0 HB3 ALA A 23 18.228 17.717 4.136 1.00 62.53 H new ATOM 363 N HIS A 24 17.957 15.280 6.058 1.00 73.11 N ATOM 364 CA HIS A 24 17.703 14.838 7.442 1.00 11.42 C ATOM 365 C HIS A 24 17.866 13.303 7.580 1.00 31.05 C ATOM 366 O HIS A 24 18.476 12.834 8.538 1.00 55.34 O ATOM 367 CB HIS A 24 16.293 15.291 7.896 1.00 51.01 C ATOM 368 CG HIS A 24 16.145 16.790 7.960 1.00 1.01 C ATOM 369 ND1 HIS A 24 16.188 17.503 9.138 1.00 62.02 N ATOM 370 CD2 HIS A 24 16.004 17.713 6.979 1.00 14.33 C ATOM 371 CE1 HIS A 24 16.084 18.789 8.878 1.00 54.12 C ATOM 372 NE2 HIS A 24 15.971 18.941 7.582 1.00 45.42 N ATOM 0 H HIS A 24 17.107 15.402 5.507 1.00 73.11 H new ATOM 0 HA HIS A 24 18.443 15.304 8.093 1.00 11.42 H new ATOM 0 HB2 HIS A 24 15.550 14.888 7.209 1.00 51.01 H new ATOM 0 HB3 HIS A 24 16.081 14.869 8.878 1.00 51.01 H new ATOM 0 HD2 HIS A 24 15.931 17.517 5.919 1.00 14.33 H new ATOM 0 HE1 HIS A 24 16.091 19.584 9.609 1.00 54.12 H new ATOM 0 HE2 HIS A 24 15.874 19.834 7.098 1.00 45.42 H new ATOM 381 N MET A 25 17.344 12.537 6.597 1.00 60.20 N ATOM 382 CA MET A 25 17.437 11.051 6.578 1.00 2.21 C ATOM 383 C MET A 25 18.906 10.536 6.493 1.00 54.14 C ATOM 384 O MET A 25 19.159 9.367 6.788 1.00 55.11 O ATOM 385 CB MET A 25 16.574 10.463 5.423 1.00 13.23 C ATOM 386 CG MET A 25 15.062 10.400 5.713 1.00 61.52 C ATOM 387 SD MET A 25 14.391 11.964 6.318 1.00 14.33 S ATOM 388 CE MET A 25 12.661 11.565 6.522 1.00 13.11 C ATOM 0 H MET A 25 16.847 12.925 5.795 1.00 60.20 H new ATOM 0 HA MET A 25 17.041 10.698 7.530 1.00 2.21 H new ATOM 0 HB2 MET A 25 16.733 11.064 4.528 1.00 13.23 H new ATOM 0 HB3 MET A 25 16.929 9.457 5.199 1.00 13.23 H new ATOM 0 HG2 MET A 25 14.535 10.113 4.803 1.00 61.52 H new ATOM 0 HG3 MET A 25 14.872 9.620 6.451 1.00 61.52 H new ATOM 0 HE1 MET A 25 12.242 12.165 7.330 1.00 13.11 H new ATOM 0 HE2 MET A 25 12.127 11.780 5.597 1.00 13.11 H new ATOM 0 HE3 MET A 25 12.558 10.507 6.764 1.00 13.11 H new ATOM 502 N PRO A 33 10.391 8.790 11.863 1.00 61.44 N ATOM 503 CA PRO A 33 10.736 9.290 10.494 1.00 11.11 C ATOM 504 C PRO A 33 9.538 9.312 9.508 1.00 21.01 C ATOM 505 O PRO A 33 9.504 10.148 8.603 1.00 45.12 O ATOM 506 CB PRO A 33 11.843 8.317 10.015 1.00 62.30 C ATOM 507 CG PRO A 33 11.678 7.087 10.857 1.00 22.34 C ATOM 508 CD PRO A 33 11.174 7.568 12.195 1.00 44.33 C ATOM 0 HA PRO A 33 11.053 10.332 10.528 1.00 11.11 H new ATOM 0 HB2 PRO A 33 11.733 8.086 8.955 1.00 62.30 H new ATOM 0 HB3 PRO A 33 12.834 8.753 10.145 1.00 62.30 H new ATOM 0 HG2 PRO A 33 10.973 6.393 10.400 1.00 22.34 H new ATOM 0 HG3 PRO A 33 12.624 6.556 10.963 1.00 22.34 H new ATOM 0 HD2 PRO A 33 10.554 6.816 12.682 1.00 44.33 H new ATOM 0 HD3 PRO A 33 11.996 7.792 12.875 1.00 44.33 H new ATOM 516 N LEU A 34 8.565 8.391 9.715 1.00 65.15 N ATOM 517 CA LEU A 34 7.347 8.272 8.869 1.00 51.14 C ATOM 518 C LEU A 34 6.585 9.605 8.790 1.00 12.55 C ATOM 519 O LEU A 34 6.264 10.073 7.697 1.00 61.14 O ATOM 520 CB LEU A 34 6.414 7.154 9.414 1.00 24.31 C ATOM 521 CG LEU A 34 5.094 6.883 8.606 1.00 75.35 C ATOM 522 CD1 LEU A 34 5.388 6.422 7.160 1.00 62.23 C ATOM 523 CD2 LEU A 34 4.185 5.868 9.332 1.00 25.04 C ATOM 0 H LEU A 34 8.601 7.709 10.473 1.00 65.15 H new ATOM 0 HA LEU A 34 7.669 8.007 7.862 1.00 51.14 H new ATOM 0 HB2 LEU A 34 6.984 6.226 9.457 1.00 24.31 H new ATOM 0 HB3 LEU A 34 6.140 7.408 10.438 1.00 24.31 H new ATOM 0 HG LEU A 34 4.559 7.831 8.547 1.00 75.35 H new ATOM 0 HD11 LEU A 34 4.449 6.246 6.636 1.00 62.23 H new ATOM 0 HD12 LEU A 34 5.954 7.195 6.640 1.00 62.23 H new ATOM 0 HD13 LEU A 34 5.969 5.500 7.183 1.00 62.23 H new ATOM 0 HD21 LEU A 34 3.281 5.704 8.745 1.00 25.04 H new ATOM 0 HD22 LEU A 34 4.716 4.924 9.451 1.00 25.04 H new ATOM 0 HD23 LEU A 34 3.915 6.258 10.313 1.00 25.04 H new ATOM 535 N GLY A 35 6.381 10.223 9.970 1.00 53.44 N ATOM 536 CA GLY A 35 5.647 11.485 10.098 1.00 33.32 C ATOM 537 C GLY A 35 6.253 12.636 9.297 1.00 65.12 C ATOM 538 O GLY A 35 5.523 13.492 8.796 1.00 64.05 O ATOM 0 H GLY A 35 6.723 9.856 10.858 1.00 53.44 H new ATOM 0 HA2 GLY A 35 4.618 11.331 9.773 1.00 33.32 H new ATOM 0 HA3 GLY A 35 5.609 11.767 11.150 1.00 33.32 H new ATOM 542 N GLU A 36 7.595 12.630 9.168 1.00 30.23 N ATOM 543 CA GLU A 36 8.331 13.626 8.364 1.00 12.21 C ATOM 544 C GLU A 36 7.995 13.493 6.862 1.00 73.43 C ATOM 545 O GLU A 36 7.696 14.491 6.199 1.00 64.24 O ATOM 546 CB GLU A 36 9.858 13.479 8.590 1.00 63.24 C ATOM 547 CG GLU A 36 10.717 14.535 7.859 1.00 24.11 C ATOM 548 CD GLU A 36 10.370 15.975 8.273 1.00 32.15 C ATOM 549 OE1 GLU A 36 10.746 16.383 9.389 1.00 72.52 O ATOM 550 OE2 GLU A 36 9.700 16.693 7.508 1.00 63.41 O ATOM 0 H GLU A 36 8.196 11.938 9.616 1.00 30.23 H new ATOM 0 HA GLU A 36 8.019 14.618 8.691 1.00 12.21 H new ATOM 0 HB2 GLU A 36 10.062 13.539 9.659 1.00 63.24 H new ATOM 0 HB3 GLU A 36 10.167 12.487 8.262 1.00 63.24 H new ATOM 0 HG2 GLU A 36 11.770 14.346 8.066 1.00 24.11 H new ATOM 0 HG3 GLU A 36 10.579 14.428 6.783 1.00 24.11 H new ATOM 557 N TRP A 37 8.032 12.245 6.348 1.00 74.45 N ATOM 558 CA TRP A 37 7.611 11.936 4.962 1.00 14.34 C ATOM 559 C TRP A 37 6.155 12.395 4.710 1.00 21.34 C ATOM 560 O TRP A 37 5.871 13.025 3.697 1.00 42.22 O ATOM 561 CB TRP A 37 7.710 10.418 4.673 1.00 71.22 C ATOM 562 CG TRP A 37 9.116 9.863 4.598 1.00 72.42 C ATOM 563 CD1 TRP A 37 9.881 9.402 5.626 1.00 50.24 C ATOM 564 CD2 TRP A 37 9.899 9.677 3.411 1.00 15.23 C ATOM 565 NE1 TRP A 37 11.087 8.948 5.156 1.00 72.21 N ATOM 566 CE2 TRP A 37 11.124 9.109 3.801 1.00 54.45 C ATOM 567 CE3 TRP A 37 9.677 9.941 2.058 1.00 74.45 C ATOM 568 CZ2 TRP A 37 12.128 8.799 2.891 1.00 23.04 C ATOM 569 CZ3 TRP A 37 10.671 9.635 1.154 1.00 1.43 C ATOM 570 CH2 TRP A 37 11.885 9.066 1.574 1.00 3.11 C ATOM 0 H TRP A 37 8.350 11.431 6.874 1.00 74.45 H new ATOM 0 HA TRP A 37 8.284 12.476 4.296 1.00 14.34 H new ATOM 0 HB2 TRP A 37 7.166 9.881 5.450 1.00 71.22 H new ATOM 0 HB3 TRP A 37 7.205 10.211 3.730 1.00 71.22 H new ATOM 0 HD1 TRP A 37 9.581 9.395 6.663 1.00 50.24 H new ATOM 0 HE1 TRP A 37 11.835 8.554 5.727 1.00 72.21 H new ATOM 0 HE3 TRP A 37 8.746 10.376 1.727 1.00 74.45 H new ATOM 0 HZ2 TRP A 37 13.063 8.364 3.213 1.00 23.04 H new ATOM 0 HZ3 TRP A 37 10.514 9.836 0.105 1.00 1.43 H new ATOM 0 HH2 TRP A 37 12.642 8.835 0.840 1.00 3.11 H new ATOM 581 N GLU A 38 5.259 12.083 5.676 1.00 73.25 N ATOM 582 CA GLU A 38 3.818 12.431 5.609 1.00 52.23 C ATOM 583 C GLU A 38 3.594 13.943 5.396 1.00 4.10 C ATOM 584 O GLU A 38 2.708 14.337 4.641 1.00 1.20 O ATOM 585 CB GLU A 38 3.079 11.995 6.898 1.00 33.22 C ATOM 586 CG GLU A 38 3.172 10.496 7.222 1.00 54.44 C ATOM 587 CD GLU A 38 2.330 10.086 8.438 1.00 40.30 C ATOM 588 OE1 GLU A 38 2.304 10.831 9.438 1.00 11.12 O ATOM 589 OE2 GLU A 38 1.682 9.027 8.403 1.00 1.23 O ATOM 0 H GLU A 38 5.515 11.581 6.526 1.00 73.25 H new ATOM 0 HA GLU A 38 3.414 11.893 4.751 1.00 52.23 H new ATOM 0 HB2 GLU A 38 3.482 12.559 7.739 1.00 33.22 H new ATOM 0 HB3 GLU A 38 2.028 12.267 6.806 1.00 33.22 H new ATOM 0 HG2 GLU A 38 2.847 9.923 6.354 1.00 54.44 H new ATOM 0 HG3 GLU A 38 4.214 10.235 7.405 1.00 54.44 H new ATOM 596 N ARG A 39 4.417 14.773 6.066 1.00 40.34 N ATOM 597 CA ARG A 39 4.357 16.247 5.933 1.00 51.14 C ATOM 598 C ARG A 39 4.689 16.713 4.501 1.00 64.13 C ATOM 599 O ARG A 39 4.229 17.770 4.069 1.00 35.21 O ATOM 600 CB ARG A 39 5.290 16.927 6.967 1.00 53.31 C ATOM 601 CG ARG A 39 4.889 16.661 8.435 1.00 13.52 C ATOM 602 CD ARG A 39 3.443 17.095 8.752 1.00 25.30 C ATOM 603 NE ARG A 39 3.066 16.774 10.135 1.00 20.25 N ATOM 604 CZ ARG A 39 1.831 16.670 10.579 1.00 43.34 C ATOM 605 NH1 ARG A 39 0.805 16.849 9.796 1.00 65.33 N ATOM 606 NH2 ARG A 39 1.630 16.381 11.816 1.00 50.01 N ATOM 0 H ARG A 39 5.137 14.447 6.710 1.00 40.34 H new ATOM 0 HA ARG A 39 3.331 16.551 6.138 1.00 51.14 H new ATOM 0 HB2 ARG A 39 6.310 16.576 6.809 1.00 53.31 H new ATOM 0 HB3 ARG A 39 5.292 18.002 6.789 1.00 53.31 H new ATOM 0 HG2 ARG A 39 4.999 15.598 8.649 1.00 13.52 H new ATOM 0 HG3 ARG A 39 5.575 17.192 9.095 1.00 13.52 H new ATOM 0 HD2 ARG A 39 3.342 18.168 8.588 1.00 25.30 H new ATOM 0 HD3 ARG A 39 2.757 16.601 8.064 1.00 25.30 H new ATOM 0 HE ARG A 39 3.820 16.620 10.804 1.00 20.25 H new ATOM 0 HH11 ARG A 39 0.948 17.076 8.812 1.00 65.33 H new ATOM 0 HH12 ARG A 39 -0.141 16.762 10.167 1.00 65.33 H new ATOM 0 HH21 ARG A 39 2.423 16.235 12.441 1.00 50.01 H new ATOM 0 HH22 ARG A 39 0.678 16.298 12.172 1.00 50.01 H new ATOM 620 N TYR A 40 5.485 15.914 3.775 1.00 62.25 N ATOM 621 CA TYR A 40 5.770 16.145 2.342 1.00 75.23 C ATOM 622 C TYR A 40 4.664 15.567 1.433 1.00 63.23 C ATOM 623 O TYR A 40 4.360 16.174 0.417 1.00 71.55 O ATOM 624 CB TYR A 40 7.152 15.563 1.963 1.00 54.23 C ATOM 625 CG TYR A 40 8.326 16.399 2.488 1.00 44.24 C ATOM 626 CD1 TYR A 40 8.611 16.476 3.852 1.00 64.05 C ATOM 627 CD2 TYR A 40 9.148 17.112 1.617 1.00 71.24 C ATOM 628 CE1 TYR A 40 9.665 17.226 4.321 1.00 33.41 C ATOM 629 CE2 TYR A 40 10.202 17.861 2.087 1.00 53.22 C ATOM 630 CZ TYR A 40 10.457 17.914 3.438 1.00 64.02 C ATOM 631 OH TYR A 40 11.517 18.655 3.901 1.00 72.25 O ATOM 0 H TYR A 40 5.950 15.091 4.158 1.00 62.25 H new ATOM 0 HA TYR A 40 5.788 17.223 2.182 1.00 75.23 H new ATOM 0 HB2 TYR A 40 7.232 14.549 2.356 1.00 54.23 H new ATOM 0 HB3 TYR A 40 7.223 15.491 0.878 1.00 54.23 H new ATOM 0 HD1 TYR A 40 7.992 15.936 4.553 1.00 64.05 H new ATOM 0 HD2 TYR A 40 8.954 17.076 0.555 1.00 71.24 H new ATOM 0 HE1 TYR A 40 9.868 17.273 5.381 1.00 33.41 H new ATOM 0 HE2 TYR A 40 10.828 18.406 1.397 1.00 53.22 H new ATOM 0 HH TYR A 40 11.866 18.249 4.722 1.00 72.25 H new ATOM 641 N ILE A 41 4.072 14.402 1.800 1.00 23.45 N ATOM 642 CA ILE A 41 2.972 13.775 1.010 1.00 43.14 C ATOM 643 C ILE A 41 1.696 14.679 0.997 1.00 20.34 C ATOM 644 O ILE A 41 1.096 14.885 -0.060 1.00 71.01 O ATOM 645 CB ILE A 41 2.621 12.290 1.487 1.00 54.23 C ATOM 646 CG1 ILE A 41 3.605 11.221 0.879 1.00 43.41 C ATOM 647 CG2 ILE A 41 1.154 11.892 1.143 1.00 20.43 C ATOM 648 CD1 ILE A 41 5.065 11.336 1.272 1.00 70.41 C ATOM 0 H ILE A 41 4.334 13.877 2.634 1.00 23.45 H new ATOM 0 HA ILE A 41 3.344 13.689 -0.011 1.00 43.14 H new ATOM 0 HB ILE A 41 2.737 12.296 2.571 1.00 54.23 H new ATOM 0 HG12 ILE A 41 3.252 10.231 1.168 1.00 43.41 H new ATOM 0 HG13 ILE A 41 3.540 11.278 -0.208 1.00 43.41 H new ATOM 0 HG21 ILE A 41 0.963 10.875 1.486 1.00 20.43 H new ATOM 0 HG22 ILE A 41 0.466 12.577 1.637 1.00 20.43 H new ATOM 0 HG23 ILE A 41 1.006 11.944 0.064 1.00 20.43 H new ATOM 0 HD11 ILE A 41 5.636 10.543 0.788 1.00 70.41 H new ATOM 0 HD12 ILE A 41 5.451 12.305 0.957 1.00 70.41 H new ATOM 0 HD13 ILE A 41 5.159 11.242 2.354 1.00 70.41 H new ATOM 660 N GLN A 42 1.298 15.221 2.168 1.00 3.24 N ATOM 661 CA GLN A 42 0.157 16.171 2.253 1.00 52.12 C ATOM 662 C GLN A 42 0.461 17.467 1.455 1.00 40.33 C ATOM 663 O GLN A 42 -0.391 17.978 0.724 1.00 22.33 O ATOM 664 CB GLN A 42 -0.179 16.537 3.731 1.00 1.10 C ATOM 665 CG GLN A 42 0.974 17.203 4.520 1.00 62.32 C ATOM 666 CD GLN A 42 0.515 18.048 5.708 1.00 43.31 C ATOM 667 OE1 GLN A 42 0.409 17.571 6.835 1.00 2.44 O ATOM 668 NE2 GLN A 42 0.218 19.309 5.444 1.00 41.53 N ATOM 0 H GLN A 42 1.743 15.022 3.064 1.00 3.24 H new ATOM 0 HA GLN A 42 -0.709 15.672 1.817 1.00 52.12 H new ATOM 0 HB2 GLN A 42 -1.038 17.208 3.737 1.00 1.10 H new ATOM 0 HB3 GLN A 42 -0.480 15.630 4.254 1.00 1.10 H new ATOM 0 HG2 GLN A 42 1.649 16.426 4.880 1.00 62.32 H new ATOM 0 HG3 GLN A 42 1.548 17.833 3.840 1.00 62.32 H new ATOM 0 HE21 GLN A 42 0.319 19.669 4.495 1.00 41.53 H new ATOM 0 HE22 GLN A 42 -0.112 19.922 6.189 1.00 41.53 H new ATOM 677 N TRP A 43 1.712 17.947 1.595 1.00 61.15 N ATOM 678 CA TRP A 43 2.191 19.200 0.992 1.00 44.01 C ATOM 679 C TRP A 43 2.193 19.107 -0.548 1.00 13.11 C ATOM 680 O TRP A 43 1.751 20.015 -1.237 1.00 12.21 O ATOM 681 CB TRP A 43 3.612 19.507 1.524 1.00 32.35 C ATOM 682 CG TRP A 43 4.194 20.833 1.086 1.00 41.10 C ATOM 683 CD1 TRP A 43 3.889 22.073 1.582 1.00 53.32 C ATOM 684 CD2 TRP A 43 5.197 21.044 0.080 1.00 14.24 C ATOM 685 NE1 TRP A 43 4.630 23.031 0.943 1.00 3.15 N ATOM 686 CE2 TRP A 43 5.441 22.426 0.021 1.00 2.12 C ATOM 687 CE3 TRP A 43 5.911 20.194 -0.775 1.00 11.44 C ATOM 688 CZ2 TRP A 43 6.367 22.979 -0.855 1.00 22.44 C ATOM 689 CZ3 TRP A 43 6.829 20.747 -1.646 1.00 31.05 C ATOM 690 CH2 TRP A 43 7.054 22.126 -1.678 1.00 41.43 C ATOM 0 H TRP A 43 2.427 17.465 2.140 1.00 61.15 H new ATOM 0 HA TRP A 43 1.517 20.011 1.270 1.00 44.01 H new ATOM 0 HB2 TRP A 43 3.587 19.482 2.613 1.00 32.35 H new ATOM 0 HB3 TRP A 43 4.283 18.710 1.202 1.00 32.35 H new ATOM 0 HD1 TRP A 43 3.169 22.267 2.363 1.00 53.32 H new ATOM 0 HE1 TRP A 43 4.585 24.034 1.125 1.00 3.15 H new ATOM 0 HE3 TRP A 43 5.747 19.127 -0.753 1.00 11.44 H new ATOM 0 HZ2 TRP A 43 6.539 24.045 -0.886 1.00 22.44 H new ATOM 0 HZ3 TRP A 43 7.382 20.103 -2.314 1.00 31.05 H new ATOM 0 HH2 TRP A 43 7.784 22.527 -2.365 1.00 41.43 H new ATOM 701 N VAL A 44 2.676 17.980 -1.066 1.00 50.12 N ATOM 702 CA VAL A 44 2.782 17.746 -2.515 1.00 32.35 C ATOM 703 C VAL A 44 1.392 17.522 -3.170 1.00 43.32 C ATOM 704 O VAL A 44 1.235 17.702 -4.364 1.00 34.55 O ATOM 705 CB VAL A 44 3.762 16.558 -2.826 1.00 42.33 C ATOM 706 CG1 VAL A 44 3.213 15.210 -2.350 1.00 61.00 C ATOM 707 CG2 VAL A 44 4.111 16.504 -4.309 1.00 10.03 C ATOM 0 H VAL A 44 3.006 17.200 -0.498 1.00 50.12 H new ATOM 0 HA VAL A 44 3.200 18.649 -2.959 1.00 32.35 H new ATOM 0 HB VAL A 44 4.675 16.751 -2.263 1.00 42.33 H new ATOM 0 HG11 VAL A 44 3.927 14.422 -2.588 1.00 61.00 H new ATOM 0 HG12 VAL A 44 3.054 15.242 -1.272 1.00 61.00 H new ATOM 0 HG13 VAL A 44 2.266 15.005 -2.850 1.00 61.00 H new ATOM 0 HG21 VAL A 44 4.790 15.672 -4.493 1.00 10.03 H new ATOM 0 HG22 VAL A 44 3.201 16.365 -4.892 1.00 10.03 H new ATOM 0 HG23 VAL A 44 4.592 17.437 -4.604 1.00 10.03 H new ATOM 717 N GLU A 45 0.387 17.128 -2.378 1.00 62.43 N ATOM 718 CA GLU A 45 -1.006 17.014 -2.862 1.00 25.31 C ATOM 719 C GLU A 45 -1.702 18.388 -2.946 1.00 52.20 C ATOM 720 O GLU A 45 -2.305 18.725 -3.972 1.00 62.35 O ATOM 721 CB GLU A 45 -1.796 16.028 -1.968 1.00 74.54 C ATOM 722 CG GLU A 45 -1.357 14.559 -2.132 1.00 60.31 C ATOM 723 CD GLU A 45 -1.696 13.972 -3.514 1.00 11.32 C ATOM 724 OE1 GLU A 45 -1.042 14.324 -4.522 1.00 52.51 O ATOM 725 OE2 GLU A 45 -2.634 13.153 -3.614 1.00 13.05 O ATOM 0 H GLU A 45 0.507 16.881 -1.396 1.00 62.43 H new ATOM 0 HA GLU A 45 -0.982 16.619 -3.878 1.00 25.31 H new ATOM 0 HB2 GLU A 45 -1.676 16.320 -0.925 1.00 74.54 H new ATOM 0 HB3 GLU A 45 -2.858 16.110 -2.201 1.00 74.54 H new ATOM 0 HG2 GLU A 45 -0.282 14.488 -1.969 1.00 60.31 H new ATOM 0 HG3 GLU A 45 -1.837 13.956 -1.361 1.00 60.31 H new ATOM 732 N GLU A 46 -1.600 19.180 -1.866 1.00 74.35 N ATOM 733 CA GLU A 46 -2.226 20.524 -1.803 1.00 73.23 C ATOM 734 C GLU A 46 -1.520 21.547 -2.738 1.00 33.14 C ATOM 735 O GLU A 46 -2.158 22.484 -3.231 1.00 61.33 O ATOM 736 CB GLU A 46 -2.254 21.034 -0.335 1.00 41.44 C ATOM 737 CG GLU A 46 -0.869 21.204 0.315 1.00 24.22 C ATOM 738 CD GLU A 46 -0.924 21.540 1.810 1.00 43.14 C ATOM 739 OE1 GLU A 46 -1.076 22.731 2.158 1.00 13.53 O ATOM 740 OE2 GLU A 46 -0.819 20.612 2.648 1.00 1.31 O ATOM 0 H GLU A 46 -1.091 18.919 -1.021 1.00 74.35 H new ATOM 0 HA GLU A 46 -3.251 20.428 -2.162 1.00 73.23 H new ATOM 0 HB2 GLU A 46 -2.773 21.992 -0.308 1.00 41.44 H new ATOM 0 HB3 GLU A 46 -2.839 20.338 0.266 1.00 41.44 H new ATOM 0 HG2 GLU A 46 -0.299 20.285 0.179 1.00 24.22 H new ATOM 0 HG3 GLU A 46 -0.328 21.994 -0.206 1.00 24.22 H new ATOM 747 N ASN A 47 -0.202 21.361 -2.972 1.00 32.23 N ATOM 748 CA ASN A 47 0.599 22.244 -3.859 1.00 44.00 C ATOM 749 C ASN A 47 0.766 21.671 -5.289 1.00 62.40 C ATOM 750 O ASN A 47 0.986 22.436 -6.225 1.00 64.02 O ATOM 751 CB ASN A 47 1.988 22.544 -3.235 1.00 53.14 C ATOM 752 CG ASN A 47 1.892 23.440 -1.999 1.00 55.31 C ATOM 753 OD1 ASN A 47 1.832 24.652 -2.109 1.00 61.11 O ATOM 754 ND2 ASN A 47 1.891 22.865 -0.821 1.00 74.35 N ATOM 0 H ASN A 47 0.336 20.601 -2.556 1.00 32.23 H new ATOM 0 HA ASN A 47 0.039 23.175 -3.951 1.00 44.00 H new ATOM 0 HB2 ASN A 47 2.471 21.606 -2.963 1.00 53.14 H new ATOM 0 HB3 ASN A 47 2.622 23.025 -3.980 1.00 53.14 H new ATOM 0 HD21 ASN A 47 1.839 23.434 0.024 1.00 74.35 H new ATOM 0 HD22 ASN A 47 1.942 21.849 -0.749 1.00 74.35 H new ATOM 761 N PHE A 48 0.692 20.331 -5.470 1.00 44.33 N ATOM 762 CA PHE A 48 0.840 19.693 -6.821 1.00 72.32 C ATOM 763 C PHE A 48 -0.279 18.637 -7.100 1.00 13.40 C ATOM 764 O PHE A 48 0.002 17.433 -7.169 1.00 54.35 O ATOM 765 CB PHE A 48 2.255 19.045 -6.975 1.00 11.55 C ATOM 766 CG PHE A 48 3.424 19.977 -6.646 1.00 22.45 C ATOM 767 CD1 PHE A 48 3.892 20.895 -7.579 1.00 23.31 C ATOM 768 CD2 PHE A 48 4.040 19.946 -5.390 1.00 52.11 C ATOM 769 CE1 PHE A 48 4.935 21.741 -7.269 1.00 75.23 C ATOM 770 CE2 PHE A 48 5.081 20.795 -5.082 1.00 52.23 C ATOM 771 CZ PHE A 48 5.531 21.694 -6.023 1.00 1.33 C ATOM 0 H PHE A 48 0.533 19.667 -4.712 1.00 44.33 H new ATOM 0 HA PHE A 48 0.732 20.484 -7.563 1.00 72.32 H new ATOM 0 HB2 PHE A 48 2.312 18.170 -6.327 1.00 11.55 H new ATOM 0 HB3 PHE A 48 2.368 18.690 -8.000 1.00 11.55 H new ATOM 0 HD1 PHE A 48 3.434 20.946 -8.556 1.00 23.31 H new ATOM 0 HD2 PHE A 48 3.693 19.243 -4.647 1.00 52.11 H new ATOM 0 HE1 PHE A 48 5.289 22.446 -8.006 1.00 75.23 H new ATOM 0 HE2 PHE A 48 5.542 20.755 -4.106 1.00 52.23 H new ATOM 0 HZ PHE A 48 6.348 22.361 -5.788 1.00 1.33 H new ATOM 781 N PRO A 49 -1.579 19.066 -7.261 1.00 1.13 N ATOM 782 CA PRO A 49 -2.669 18.143 -7.686 1.00 62.34 C ATOM 783 C PRO A 49 -2.530 17.719 -9.173 1.00 75.43 C ATOM 784 O PRO A 49 -2.950 16.625 -9.565 1.00 35.45 O ATOM 785 CB PRO A 49 -3.949 18.981 -7.435 1.00 3.23 C ATOM 786 CG PRO A 49 -3.507 20.408 -7.555 1.00 4.11 C ATOM 787 CD PRO A 49 -2.091 20.447 -7.020 1.00 53.52 C ATOM 0 HA PRO A 49 -2.664 17.198 -7.142 1.00 62.34 H new ATOM 0 HB2 PRO A 49 -4.724 18.745 -8.164 1.00 3.23 H new ATOM 0 HB3 PRO A 49 -4.366 18.779 -6.449 1.00 3.23 H new ATOM 0 HG2 PRO A 49 -3.543 20.743 -8.592 1.00 4.11 H new ATOM 0 HG3 PRO A 49 -4.159 21.069 -6.984 1.00 4.11 H new ATOM 0 HD2 PRO A 49 -1.488 21.193 -7.538 1.00 53.52 H new ATOM 0 HD3 PRO A 49 -2.071 20.701 -5.960 1.00 53.52 H new ATOM 795 N GLU A 50 -1.936 18.612 -9.985 1.00 53.34 N ATOM 796 CA GLU A 50 -1.676 18.374 -11.423 1.00 2.21 C ATOM 797 C GLU A 50 -0.370 17.570 -11.617 1.00 73.22 C ATOM 798 O GLU A 50 -0.320 16.606 -12.393 1.00 72.34 O ATOM 799 CB GLU A 50 -1.553 19.727 -12.163 1.00 64.30 C ATOM 800 CG GLU A 50 -2.762 20.667 -11.992 1.00 3.13 C ATOM 801 CD GLU A 50 -2.466 22.087 -12.497 1.00 55.21 C ATOM 802 OE1 GLU A 50 -1.895 22.890 -11.723 1.00 31.10 O ATOM 803 OE2 GLU A 50 -2.759 22.396 -13.674 1.00 74.44 O ATOM 0 H GLU A 50 -1.619 19.527 -9.663 1.00 53.34 H new ATOM 0 HA GLU A 50 -2.508 17.801 -11.832 1.00 2.21 H new ATOM 0 HB2 GLU A 50 -0.659 20.239 -11.808 1.00 64.30 H new ATOM 0 HB3 GLU A 50 -1.409 19.533 -13.226 1.00 64.30 H new ATOM 0 HG2 GLU A 50 -3.616 20.261 -12.534 1.00 3.13 H new ATOM 0 HG3 GLU A 50 -3.043 20.708 -10.940 1.00 3.13 H new ATOM 810 N ASN A 51 0.693 18.000 -10.910 1.00 74.05 N ATOM 811 CA ASN A 51 2.040 17.403 -11.023 1.00 13.02 C ATOM 812 C ASN A 51 2.167 16.188 -10.065 1.00 4.23 C ATOM 813 O ASN A 51 2.819 16.250 -9.016 1.00 62.35 O ATOM 814 CB ASN A 51 3.118 18.479 -10.742 1.00 71.04 C ATOM 815 CG ASN A 51 2.902 19.761 -11.549 1.00 22.13 C ATOM 816 OD1 ASN A 51 2.279 20.703 -11.082 1.00 3.01 O ATOM 817 ND2 ASN A 51 3.372 19.792 -12.778 1.00 43.51 N ATOM 0 H ASN A 51 0.643 18.771 -10.244 1.00 74.05 H new ATOM 0 HA ASN A 51 2.195 17.036 -12.038 1.00 13.02 H new ATOM 0 HB2 ASN A 51 3.116 18.720 -9.679 1.00 71.04 H new ATOM 0 HB3 ASN A 51 4.102 18.070 -10.974 1.00 71.04 H new ATOM 0 HD21 ASN A 51 3.219 20.614 -13.362 1.00 43.51 H new ATOM 0 HD22 ASN A 51 3.889 18.994 -13.147 1.00 43.51 H new ATOM 824 N LYS A 52 1.509 15.087 -10.464 1.00 24.42 N ATOM 825 CA LYS A 52 1.371 13.855 -9.651 1.00 43.40 C ATOM 826 C LYS A 52 2.701 13.067 -9.528 1.00 61.32 C ATOM 827 O LYS A 52 2.924 12.357 -8.533 1.00 24.31 O ATOM 828 CB LYS A 52 0.254 12.973 -10.276 1.00 12.03 C ATOM 829 CG LYS A 52 -0.077 11.681 -9.497 1.00 54.10 C ATOM 830 CD LYS A 52 -0.561 11.949 -8.053 1.00 64.12 C ATOM 831 CE LYS A 52 -1.915 12.671 -7.992 1.00 73.40 C ATOM 832 NZ LYS A 52 -2.419 12.784 -6.596 1.00 23.55 N ATOM 0 H LYS A 52 1.050 15.021 -11.372 1.00 24.42 H new ATOM 0 HA LYS A 52 1.100 14.140 -8.634 1.00 43.40 H new ATOM 0 HB2 LYS A 52 -0.654 13.570 -10.360 1.00 12.03 H new ATOM 0 HB3 LYS A 52 0.552 12.701 -11.289 1.00 12.03 H new ATOM 0 HG2 LYS A 52 -0.847 11.127 -10.035 1.00 54.10 H new ATOM 0 HG3 LYS A 52 0.809 11.046 -9.465 1.00 54.10 H new ATOM 0 HD2 LYS A 52 -0.638 11.001 -7.521 1.00 64.12 H new ATOM 0 HD3 LYS A 52 0.186 12.547 -7.532 1.00 64.12 H new ATOM 0 HE2 LYS A 52 -1.816 13.667 -8.424 1.00 73.40 H new ATOM 0 HE3 LYS A 52 -2.642 12.131 -8.598 1.00 73.40 H new ATOM 0 HZ1 LYS A 52 -3.343 13.262 -6.598 1.00 23.55 H new ATOM 0 HZ2 LYS A 52 -2.522 11.834 -6.186 1.00 23.55 H new ATOM 0 HZ3 LYS A 52 -1.745 13.335 -6.027 1.00 23.55 H new ATOM 846 N GLU A 53 3.583 13.234 -10.531 1.00 14.31 N ATOM 847 CA GLU A 53 4.924 12.602 -10.565 1.00 1.54 C ATOM 848 C GLU A 53 5.745 12.924 -9.288 1.00 32.25 C ATOM 849 O GLU A 53 6.510 12.089 -8.812 1.00 74.41 O ATOM 850 CB GLU A 53 5.697 13.075 -11.823 1.00 52.44 C ATOM 851 CG GLU A 53 5.937 14.597 -11.885 1.00 63.22 C ATOM 852 CD GLU A 53 6.721 15.055 -13.121 1.00 64.13 C ATOM 853 OE1 GLU A 53 6.123 15.122 -14.219 1.00 64.41 O ATOM 854 OE2 GLU A 53 7.930 15.344 -13.002 1.00 2.43 O ATOM 0 H GLU A 53 3.388 13.814 -11.347 1.00 14.31 H new ATOM 0 HA GLU A 53 4.782 11.522 -10.605 1.00 1.54 H new ATOM 0 HB2 GLU A 53 6.660 12.565 -11.856 1.00 52.44 H new ATOM 0 HB3 GLU A 53 5.144 12.770 -12.711 1.00 52.44 H new ATOM 0 HG2 GLU A 53 4.974 15.107 -11.869 1.00 63.22 H new ATOM 0 HG3 GLU A 53 6.477 14.906 -10.990 1.00 63.22 H new ATOM 861 N TYR A 54 5.540 14.147 -8.747 1.00 12.40 N ATOM 862 CA TYR A 54 6.158 14.611 -7.492 1.00 10.10 C ATOM 863 C TYR A 54 5.779 13.696 -6.300 1.00 13.53 C ATOM 864 O TYR A 54 6.654 13.192 -5.599 1.00 1.42 O ATOM 865 CB TYR A 54 5.698 16.052 -7.182 1.00 54.21 C ATOM 866 CG TYR A 54 6.287 17.179 -8.028 1.00 53.21 C ATOM 867 CD1 TYR A 54 6.166 17.201 -9.414 1.00 75.02 C ATOM 868 CD2 TYR A 54 6.947 18.241 -7.420 1.00 31.14 C ATOM 869 CE1 TYR A 54 6.688 18.235 -10.160 1.00 12.33 C ATOM 870 CE2 TYR A 54 7.458 19.273 -8.157 1.00 64.15 C ATOM 871 CZ TYR A 54 7.331 19.272 -9.525 1.00 12.10 C ATOM 872 OH TYR A 54 7.847 20.315 -10.257 1.00 2.54 O ATOM 0 H TYR A 54 4.933 14.844 -9.178 1.00 12.40 H new ATOM 0 HA TYR A 54 7.239 14.580 -7.625 1.00 10.10 H new ATOM 0 HB2 TYR A 54 4.613 16.088 -7.283 1.00 54.21 H new ATOM 0 HB3 TYR A 54 5.928 16.261 -6.137 1.00 54.21 H new ATOM 0 HD1 TYR A 54 5.653 16.393 -9.914 1.00 75.02 H new ATOM 0 HD2 TYR A 54 7.058 18.251 -6.346 1.00 31.14 H new ATOM 0 HE1 TYR A 54 6.593 18.231 -11.236 1.00 12.33 H new ATOM 0 HE2 TYR A 54 7.962 20.090 -7.663 1.00 64.15 H new ATOM 0 HH TYR A 54 8.267 20.962 -9.653 1.00 2.54 H new ATOM 882 N LEU A 55 4.457 13.513 -6.091 1.00 21.15 N ATOM 883 CA LEU A 55 3.911 12.639 -5.026 1.00 70.14 C ATOM 884 C LEU A 55 4.466 11.207 -5.136 1.00 1.45 C ATOM 885 O LEU A 55 4.972 10.655 -4.159 1.00 42.12 O ATOM 886 CB LEU A 55 2.361 12.602 -5.104 1.00 35.44 C ATOM 887 CG LEU A 55 1.654 11.582 -4.148 1.00 61.23 C ATOM 888 CD1 LEU A 55 1.702 12.024 -2.672 1.00 43.24 C ATOM 889 CD2 LEU A 55 0.223 11.286 -4.602 1.00 64.21 C ATOM 0 H LEU A 55 3.738 13.966 -6.655 1.00 21.15 H new ATOM 0 HA LEU A 55 4.219 13.055 -4.067 1.00 70.14 H new ATOM 0 HB2 LEU A 55 1.981 13.600 -4.885 1.00 35.44 H new ATOM 0 HB3 LEU A 55 2.073 12.370 -6.129 1.00 35.44 H new ATOM 0 HG LEU A 55 2.219 10.652 -4.211 1.00 61.23 H new ATOM 0 HD11 LEU A 55 1.198 11.282 -2.053 1.00 43.24 H new ATOM 0 HD12 LEU A 55 2.740 12.117 -2.354 1.00 43.24 H new ATOM 0 HD13 LEU A 55 1.202 12.986 -2.564 1.00 43.24 H new ATOM 0 HD21 LEU A 55 -0.237 10.575 -3.916 1.00 64.21 H new ATOM 0 HD22 LEU A 55 -0.355 12.210 -4.608 1.00 64.21 H new ATOM 0 HD23 LEU A 55 0.240 10.862 -5.606 1.00 64.21 H new ATOM 901 N ILE A 56 4.385 10.645 -6.354 1.00 4.10 N ATOM 902 CA ILE A 56 4.842 9.269 -6.644 1.00 25.12 C ATOM 903 C ILE A 56 6.358 9.091 -6.349 1.00 72.22 C ATOM 904 O ILE A 56 6.769 8.043 -5.859 1.00 12.30 O ATOM 905 CB ILE A 56 4.512 8.886 -8.131 1.00 51.03 C ATOM 906 CG1 ILE A 56 2.992 9.089 -8.418 1.00 1.31 C ATOM 907 CG2 ILE A 56 4.928 7.428 -8.446 1.00 4.25 C ATOM 908 CD1 ILE A 56 2.611 8.952 -9.879 1.00 73.02 C ATOM 0 H ILE A 56 4.002 11.128 -7.166 1.00 4.10 H new ATOM 0 HA ILE A 56 4.303 8.592 -5.981 1.00 25.12 H new ATOM 0 HB ILE A 56 5.088 9.545 -8.781 1.00 51.03 H new ATOM 0 HG12 ILE A 56 2.424 8.363 -7.836 1.00 1.31 H new ATOM 0 HG13 ILE A 56 2.697 10.078 -8.068 1.00 1.31 H new ATOM 0 HG21 ILE A 56 4.685 7.196 -9.483 1.00 4.25 H new ATOM 0 HG22 ILE A 56 6.001 7.314 -8.290 1.00 4.25 H new ATOM 0 HG23 ILE A 56 4.391 6.746 -7.787 1.00 4.25 H new ATOM 0 HD11 ILE A 56 1.538 9.107 -9.991 1.00 73.02 H new ATOM 0 HD12 ILE A 56 3.149 9.696 -10.467 1.00 73.02 H new ATOM 0 HD13 ILE A 56 2.872 7.954 -10.231 1.00 73.02 H new ATOM 920 N THR A 57 7.159 10.149 -6.613 1.00 25.52 N ATOM 921 CA THR A 57 8.609 10.206 -6.256 1.00 71.24 C ATOM 922 C THR A 57 8.817 10.011 -4.730 1.00 35.33 C ATOM 923 O THR A 57 9.661 9.225 -4.290 1.00 3.41 O ATOM 924 CB THR A 57 9.232 11.583 -6.697 1.00 15.54 C ATOM 925 OG1 THR A 57 9.195 11.714 -8.124 1.00 45.00 O ATOM 926 CG2 THR A 57 10.677 11.789 -6.226 1.00 14.32 C ATOM 0 H THR A 57 6.825 10.992 -7.080 1.00 25.52 H new ATOM 0 HA THR A 57 9.111 9.396 -6.785 1.00 71.24 H new ATOM 0 HB THR A 57 8.620 12.346 -6.217 1.00 15.54 H new ATOM 0 HG1 THR A 57 8.271 11.862 -8.415 1.00 45.00 H new ATOM 0 HG21 THR A 57 11.036 12.759 -6.568 1.00 14.32 H new ATOM 0 HG22 THR A 57 10.714 11.752 -5.137 1.00 14.32 H new ATOM 0 HG23 THR A 57 11.309 11.002 -6.637 1.00 14.32 H new ATOM 934 N LEU A 58 8.004 10.733 -3.943 1.00 74.04 N ATOM 935 CA LEU A 58 8.027 10.690 -2.463 1.00 51.32 C ATOM 936 C LEU A 58 7.530 9.321 -1.910 1.00 42.43 C ATOM 937 O LEU A 58 8.006 8.860 -0.873 1.00 11.14 O ATOM 938 CB LEU A 58 7.173 11.876 -1.896 1.00 70.04 C ATOM 939 CG LEU A 58 7.895 13.269 -1.759 1.00 11.55 C ATOM 940 CD1 LEU A 58 8.922 13.248 -0.618 1.00 44.52 C ATOM 941 CD2 LEU A 58 8.542 13.747 -3.085 1.00 2.34 C ATOM 0 H LEU A 58 7.302 11.372 -4.316 1.00 74.04 H new ATOM 0 HA LEU A 58 9.059 10.799 -2.131 1.00 51.32 H new ATOM 0 HB2 LEU A 58 6.303 12.006 -2.540 1.00 70.04 H new ATOM 0 HB3 LEU A 58 6.802 11.588 -0.913 1.00 70.04 H new ATOM 0 HG LEU A 58 7.121 13.996 -1.514 1.00 11.55 H new ATOM 0 HD11 LEU A 58 9.406 14.222 -0.546 1.00 44.52 H new ATOM 0 HD12 LEU A 58 8.417 13.023 0.322 1.00 44.52 H new ATOM 0 HD13 LEU A 58 9.673 12.484 -0.819 1.00 44.52 H new ATOM 0 HD21 LEU A 58 9.024 14.712 -2.928 1.00 2.34 H new ATOM 0 HD22 LEU A 58 9.285 13.019 -3.410 1.00 2.34 H new ATOM 0 HD23 LEU A 58 7.772 13.846 -3.850 1.00 2.34 H new ATOM 953 N LEU A 59 6.590 8.681 -2.635 1.00 52.13 N ATOM 954 CA LEU A 59 5.971 7.390 -2.229 1.00 13.14 C ATOM 955 C LEU A 59 6.882 6.167 -2.508 1.00 73.33 C ATOM 956 O LEU A 59 7.028 5.290 -1.646 1.00 5.21 O ATOM 957 CB LEU A 59 4.618 7.209 -2.952 1.00 14.22 C ATOM 958 CG LEU A 59 3.498 8.226 -2.583 1.00 2.22 C ATOM 959 CD1 LEU A 59 2.299 8.086 -3.541 1.00 32.43 C ATOM 960 CD2 LEU A 59 3.061 8.074 -1.104 1.00 1.11 C ATOM 0 H LEU A 59 6.234 9.040 -3.521 1.00 52.13 H new ATOM 0 HA LEU A 59 5.821 7.435 -1.150 1.00 13.14 H new ATOM 0 HB2 LEU A 59 4.793 7.268 -4.026 1.00 14.22 H new ATOM 0 HB3 LEU A 59 4.250 6.204 -2.744 1.00 14.22 H new ATOM 0 HG LEU A 59 3.905 9.231 -2.697 1.00 2.22 H new ATOM 0 HD11 LEU A 59 1.528 8.805 -3.266 1.00 32.43 H new ATOM 0 HD12 LEU A 59 2.626 8.277 -4.563 1.00 32.43 H new ATOM 0 HD13 LEU A 59 1.894 7.076 -3.472 1.00 32.43 H new ATOM 0 HD21 LEU A 59 2.278 8.799 -0.880 1.00 1.11 H new ATOM 0 HD22 LEU A 59 2.681 7.066 -0.939 1.00 1.11 H new ATOM 0 HD23 LEU A 59 3.916 8.250 -0.452 1.00 1.11 H new ATOM 972 N GLU A 60 7.468 6.102 -3.725 1.00 51.02 N ATOM 973 CA GLU A 60 8.387 5.006 -4.110 1.00 11.30 C ATOM 974 C GLU A 60 9.690 5.045 -3.277 1.00 11.32 C ATOM 975 O GLU A 60 10.351 4.026 -3.095 1.00 41.43 O ATOM 976 CB GLU A 60 8.663 5.024 -5.649 1.00 64.20 C ATOM 977 CG GLU A 60 9.375 6.280 -6.235 1.00 33.04 C ATOM 978 CD GLU A 60 10.913 6.267 -6.125 1.00 20.22 C ATOM 979 OE1 GLU A 60 11.548 5.388 -6.746 1.00 45.31 O ATOM 980 OE2 GLU A 60 11.496 7.124 -5.426 1.00 1.11 O ATOM 0 H GLU A 60 7.321 6.796 -4.458 1.00 51.02 H new ATOM 0 HA GLU A 60 7.900 4.057 -3.883 1.00 11.30 H new ATOM 0 HB2 GLU A 60 9.267 4.150 -5.893 1.00 64.20 H new ATOM 0 HB3 GLU A 60 7.709 4.907 -6.164 1.00 64.20 H new ATOM 0 HG2 GLU A 60 9.102 6.377 -7.286 1.00 33.04 H new ATOM 0 HG3 GLU A 60 8.997 7.165 -5.724 1.00 33.04 H new ATOM 987 N HIS A 61 10.036 6.244 -2.774 1.00 65.13 N ATOM 988 CA HIS A 61 11.182 6.450 -1.864 1.00 3.11 C ATOM 989 C HIS A 61 10.812 6.049 -0.410 1.00 1.25 C ATOM 990 O HIS A 61 11.608 5.417 0.296 1.00 52.04 O ATOM 991 CB HIS A 61 11.653 7.938 -1.941 1.00 3.31 C ATOM 992 CG HIS A 61 13.115 8.112 -2.236 1.00 13.30 C ATOM 993 ND1 HIS A 61 13.625 8.051 -3.511 1.00 45.23 N ATOM 994 CD2 HIS A 61 14.172 8.358 -1.427 1.00 32.52 C ATOM 995 CE1 HIS A 61 14.922 8.243 -3.477 1.00 32.42 C ATOM 996 NE2 HIS A 61 15.282 8.435 -2.228 1.00 65.43 N ATOM 0 H HIS A 61 9.527 7.102 -2.987 1.00 65.13 H new ATOM 0 HA HIS A 61 12.006 5.809 -2.178 1.00 3.11 H new ATOM 0 HB2 HIS A 61 11.076 8.449 -2.712 1.00 3.31 H new ATOM 0 HB3 HIS A 61 11.425 8.428 -0.994 1.00 3.31 H new ATOM 0 HD1 HIS A 61 13.078 7.882 -4.355 1.00 45.23 H new ATOM 0 HD2 HIS A 61 14.146 8.472 -0.353 1.00 32.52 H new ATOM 0 HE1 HIS A 61 15.583 8.243 -4.331 1.00 32.42 H new ATOM 0 HE2 HIS A 61 16.234 8.613 -1.906 1.00 65.43 H new ATOM 1005 N LEU A 62 9.591 6.444 0.003 1.00 62.15 N ATOM 1006 CA LEU A 62 8.999 6.120 1.325 1.00 34.13 C ATOM 1007 C LEU A 62 9.051 4.606 1.628 1.00 30.42 C ATOM 1008 O LEU A 62 9.521 4.191 2.690 1.00 74.05 O ATOM 1009 CB LEU A 62 7.529 6.636 1.355 1.00 45.23 C ATOM 1010 CG LEU A 62 6.661 6.281 2.602 1.00 14.21 C ATOM 1011 CD1 LEU A 62 7.257 6.848 3.892 1.00 14.32 C ATOM 1012 CD2 LEU A 62 5.211 6.760 2.416 1.00 51.30 C ATOM 0 H LEU A 62 8.974 7.008 -0.581 1.00 62.15 H new ATOM 0 HA LEU A 62 9.585 6.614 2.100 1.00 34.13 H new ATOM 0 HB2 LEU A 62 7.553 7.722 1.261 1.00 45.23 H new ATOM 0 HB3 LEU A 62 7.020 6.251 0.471 1.00 45.23 H new ATOM 0 HG LEU A 62 6.657 5.195 2.694 1.00 14.21 H new ATOM 0 HD11 LEU A 62 6.622 6.578 4.736 1.00 14.32 H new ATOM 0 HD12 LEU A 62 8.255 6.437 4.043 1.00 14.32 H new ATOM 0 HD13 LEU A 62 7.319 7.934 3.818 1.00 14.32 H new ATOM 0 HD21 LEU A 62 4.626 6.501 3.299 1.00 51.30 H new ATOM 0 HD22 LEU A 62 5.200 7.841 2.278 1.00 51.30 H new ATOM 0 HD23 LEU A 62 4.778 6.278 1.539 1.00 51.30 H new ATOM 1024 N MET A 63 8.589 3.790 0.666 1.00 62.40 N ATOM 1025 CA MET A 63 8.550 2.324 0.828 1.00 32.04 C ATOM 1026 C MET A 63 9.955 1.696 0.856 1.00 24.31 C ATOM 1027 O MET A 63 10.144 0.701 1.524 1.00 35.02 O ATOM 1028 CB MET A 63 7.680 1.665 -0.258 1.00 65.42 C ATOM 1029 CG MET A 63 8.151 1.882 -1.704 1.00 0.55 C ATOM 1030 SD MET A 63 7.012 1.179 -2.904 1.00 22.24 S ATOM 1031 CE MET A 63 5.472 1.925 -2.375 1.00 73.05 C ATOM 0 H MET A 63 8.237 4.119 -0.233 1.00 62.40 H new ATOM 0 HA MET A 63 8.094 2.132 1.799 1.00 32.04 H new ATOM 0 HB2 MET A 63 7.638 0.593 -0.065 1.00 65.42 H new ATOM 0 HB3 MET A 63 6.663 2.045 -0.165 1.00 65.42 H new ATOM 0 HG2 MET A 63 8.260 2.950 -1.892 1.00 0.55 H new ATOM 0 HG3 MET A 63 9.136 1.433 -1.834 1.00 0.55 H new ATOM 0 HE1 MET A 63 4.683 1.673 -3.084 1.00 73.05 H new ATOM 0 HE2 MET A 63 5.206 1.549 -1.387 1.00 73.05 H new ATOM 0 HE3 MET A 63 5.588 3.008 -2.331 1.00 73.05 H new ATOM 1041 N LYS A 64 10.922 2.280 0.114 1.00 42.43 N ATOM 1042 CA LYS A 64 12.339 1.833 0.142 1.00 41.44 C ATOM 1043 C LYS A 64 12.999 2.099 1.516 1.00 52.23 C ATOM 1044 O LYS A 64 13.801 1.285 1.990 1.00 63.12 O ATOM 1045 CB LYS A 64 13.150 2.515 -0.992 1.00 3.00 C ATOM 1046 CG LYS A 64 12.717 2.107 -2.417 1.00 3.51 C ATOM 1047 CD LYS A 64 12.925 0.605 -2.731 1.00 63.11 C ATOM 1048 CE LYS A 64 14.408 0.181 -2.721 1.00 34.30 C ATOM 1049 NZ LYS A 64 14.598 -1.205 -3.230 1.00 0.22 N ATOM 0 H LYS A 64 10.749 3.065 -0.514 1.00 42.43 H new ATOM 0 HA LYS A 64 12.344 0.755 -0.022 1.00 41.44 H new ATOM 0 HB2 LYS A 64 13.054 3.596 -0.891 1.00 3.00 H new ATOM 0 HB3 LYS A 64 14.205 2.275 -0.863 1.00 3.00 H new ATOM 0 HG2 LYS A 64 11.664 2.353 -2.550 1.00 3.51 H new ATOM 0 HG3 LYS A 64 13.277 2.700 -3.140 1.00 3.51 H new ATOM 0 HD2 LYS A 64 12.379 0.009 -2.000 1.00 63.11 H new ATOM 0 HD3 LYS A 64 12.497 0.382 -3.708 1.00 63.11 H new ATOM 0 HE2 LYS A 64 14.987 0.874 -3.332 1.00 34.30 H new ATOM 0 HE3 LYS A 64 14.797 0.250 -1.705 1.00 34.30 H new ATOM 0 HZ1 LYS A 64 15.609 -1.448 -3.206 1.00 0.22 H new ATOM 0 HZ2 LYS A 64 14.067 -1.870 -2.632 1.00 0.22 H new ATOM 0 HZ3 LYS A 64 14.251 -1.266 -4.208 1.00 0.22 H new ATOM 1063 N GLU A 65 12.646 3.237 2.145 1.00 22.31 N ATOM 1064 CA GLU A 65 13.107 3.569 3.508 1.00 72.32 C ATOM 1065 C GLU A 65 12.530 2.566 4.539 1.00 13.25 C ATOM 1066 O GLU A 65 13.280 1.859 5.216 1.00 33.34 O ATOM 1067 CB GLU A 65 12.708 5.036 3.860 1.00 53.00 C ATOM 1068 CG GLU A 65 12.995 5.494 5.316 1.00 33.45 C ATOM 1069 CD GLU A 65 14.462 5.329 5.756 1.00 15.51 C ATOM 1070 OE1 GLU A 65 15.335 6.054 5.233 1.00 51.30 O ATOM 1071 OE2 GLU A 65 14.747 4.474 6.621 1.00 51.35 O ATOM 0 H GLU A 65 12.041 3.945 1.729 1.00 22.31 H new ATOM 0 HA GLU A 65 14.194 3.490 3.545 1.00 72.32 H new ATOM 0 HB2 GLU A 65 13.234 5.707 3.180 1.00 53.00 H new ATOM 0 HB3 GLU A 65 11.642 5.157 3.667 1.00 53.00 H new ATOM 0 HG2 GLU A 65 12.714 6.542 5.417 1.00 33.45 H new ATOM 0 HG3 GLU A 65 12.358 4.927 5.995 1.00 33.45 H new ATOM 1078 N PHE A 66 11.191 2.441 4.582 1.00 44.50 N ATOM 1079 CA PHE A 66 10.498 1.615 5.604 1.00 61.31 C ATOM 1080 C PHE A 66 10.352 0.142 5.196 1.00 45.21 C ATOM 1081 O PHE A 66 9.709 -0.648 5.908 1.00 64.54 O ATOM 1082 CB PHE A 66 9.150 2.254 5.975 1.00 24.42 C ATOM 1083 CG PHE A 66 9.339 3.631 6.596 1.00 75.14 C ATOM 1084 CD1 PHE A 66 9.601 3.766 7.951 1.00 3.21 C ATOM 1085 CD2 PHE A 66 9.322 4.776 5.816 1.00 75.15 C ATOM 1086 CE1 PHE A 66 9.825 5.002 8.506 1.00 31.42 C ATOM 1087 CE2 PHE A 66 9.558 6.010 6.371 1.00 3.43 C ATOM 1088 CZ PHE A 66 9.808 6.123 7.712 1.00 24.25 C ATOM 0 H PHE A 66 10.562 2.899 3.923 1.00 44.50 H new ATOM 0 HA PHE A 66 11.129 1.600 6.493 1.00 61.31 H new ATOM 0 HB2 PHE A 66 8.528 2.338 5.084 1.00 24.42 H new ATOM 0 HB3 PHE A 66 8.620 1.608 6.674 1.00 24.42 H new ATOM 0 HD1 PHE A 66 9.629 2.887 8.578 1.00 3.21 H new ATOM 0 HD2 PHE A 66 9.121 4.697 4.758 1.00 75.15 H new ATOM 0 HE1 PHE A 66 10.014 5.093 9.565 1.00 31.42 H new ATOM 0 HE2 PHE A 66 9.546 6.892 5.748 1.00 3.43 H new ATOM 0 HZ PHE A 66 9.992 7.095 8.146 1.00 24.25 H new ATOM 1098 N LEU A 67 10.957 -0.225 4.052 1.00 14.42 N ATOM 1099 CA LEU A 67 11.126 -1.629 3.655 1.00 14.35 C ATOM 1100 C LEU A 67 11.957 -2.394 4.705 1.00 5.33 C ATOM 1101 O LEU A 67 11.542 -3.442 5.175 1.00 11.45 O ATOM 1102 CB LEU A 67 11.787 -1.749 2.243 1.00 53.24 C ATOM 1103 CG LEU A 67 11.265 -2.921 1.350 1.00 3.42 C ATOM 1104 CD1 LEU A 67 9.753 -2.760 1.056 1.00 51.03 C ATOM 1105 CD2 LEU A 67 12.087 -3.040 0.044 1.00 74.34 C ATOM 0 H LEU A 67 11.340 0.442 3.382 1.00 14.42 H new ATOM 0 HA LEU A 67 10.134 -2.078 3.599 1.00 14.35 H new ATOM 0 HB2 LEU A 67 11.632 -0.812 1.708 1.00 53.24 H new ATOM 0 HB3 LEU A 67 12.863 -1.867 2.374 1.00 53.24 H new ATOM 0 HG LEU A 67 11.398 -3.851 1.903 1.00 3.42 H new ATOM 0 HD11 LEU A 67 9.413 -3.587 0.433 1.00 51.03 H new ATOM 0 HD12 LEU A 67 9.198 -2.760 1.994 1.00 51.03 H new ATOM 0 HD13 LEU A 67 9.582 -1.819 0.534 1.00 51.03 H new ATOM 0 HD21 LEU A 67 11.700 -3.864 -0.556 1.00 74.34 H new ATOM 0 HD22 LEU A 67 12.008 -2.111 -0.521 1.00 74.34 H new ATOM 0 HD23 LEU A 67 13.132 -3.229 0.288 1.00 74.34 H new ATOM 1117 N ASP A 68 13.118 -1.842 5.105 1.00 3.40 N ATOM 1118 CA ASP A 68 14.019 -2.508 6.073 1.00 72.11 C ATOM 1119 C ASP A 68 13.678 -2.095 7.533 1.00 40.15 C ATOM 1120 O ASP A 68 14.122 -2.746 8.487 1.00 22.11 O ATOM 1121 CB ASP A 68 15.494 -2.173 5.719 1.00 53.05 C ATOM 1122 CG ASP A 68 16.517 -2.998 6.521 1.00 50.32 C ATOM 1123 OD1 ASP A 68 16.538 -4.240 6.369 1.00 42.14 O ATOM 1124 OD2 ASP A 68 17.301 -2.419 7.303 1.00 42.53 O ATOM 0 H ASP A 68 13.456 -0.938 4.775 1.00 3.40 H new ATOM 0 HA ASP A 68 13.878 -3.587 6.007 1.00 72.11 H new ATOM 0 HB2 ASP A 68 15.653 -2.346 4.655 1.00 53.05 H new ATOM 0 HB3 ASP A 68 15.672 -1.113 5.899 1.00 53.05 H new ATOM 1129 N LYS A 69 12.873 -1.017 7.705 1.00 31.33 N ATOM 1130 CA LYS A 69 12.345 -0.615 9.034 1.00 40.54 C ATOM 1131 C LYS A 69 11.192 -1.578 9.411 1.00 0.44 C ATOM 1132 O LYS A 69 10.017 -1.313 9.120 1.00 5.05 O ATOM 1133 CB LYS A 69 11.855 0.867 9.028 1.00 2.15 C ATOM 1134 CG LYS A 69 12.829 1.871 8.367 1.00 11.13 C ATOM 1135 CD LYS A 69 14.163 2.063 9.116 1.00 31.23 C ATOM 1136 CE LYS A 69 14.028 2.932 10.374 1.00 13.31 C ATOM 1137 NZ LYS A 69 15.331 3.076 11.081 1.00 51.23 N ATOM 0 H LYS A 69 12.575 -0.411 6.941 1.00 31.33 H new ATOM 0 HA LYS A 69 13.141 -0.680 9.776 1.00 40.54 H new ATOM 0 HB2 LYS A 69 10.898 0.916 8.509 1.00 2.15 H new ATOM 0 HB3 LYS A 69 11.676 1.180 10.057 1.00 2.15 H new ATOM 0 HG2 LYS A 69 13.043 1.535 7.352 1.00 11.13 H new ATOM 0 HG3 LYS A 69 12.332 2.838 8.284 1.00 11.13 H new ATOM 0 HD2 LYS A 69 14.559 1.087 9.397 1.00 31.23 H new ATOM 0 HD3 LYS A 69 14.888 2.519 8.443 1.00 31.23 H new ATOM 0 HE2 LYS A 69 13.652 3.917 10.098 1.00 13.31 H new ATOM 0 HE3 LYS A 69 13.295 2.488 11.047 1.00 13.31 H new ATOM 0 HZ1 LYS A 69 15.204 3.669 11.926 1.00 51.23 H new ATOM 0 HZ2 LYS A 69 15.677 2.137 11.365 1.00 51.23 H new ATOM 0 HZ3 LYS A 69 16.023 3.522 10.446 1.00 51.23 H new ATOM 1151 N LYS A 70 11.557 -2.722 10.019 1.00 34.43 N ATOM 1152 CA LYS A 70 10.652 -3.881 10.185 1.00 11.41 C ATOM 1153 C LYS A 70 9.436 -3.610 11.113 1.00 31.13 C ATOM 1154 O LYS A 70 8.396 -4.263 10.973 1.00 2.24 O ATOM 1155 CB LYS A 70 11.455 -5.127 10.643 1.00 73.12 C ATOM 1156 CG LYS A 70 12.506 -5.602 9.603 1.00 35.11 C ATOM 1157 CD LYS A 70 13.202 -6.931 9.992 1.00 50.35 C ATOM 1158 CE LYS A 70 14.029 -6.838 11.292 1.00 12.32 C ATOM 1159 NZ LYS A 70 14.599 -8.157 11.693 1.00 22.14 N ATOM 0 H LYS A 70 12.487 -2.872 10.410 1.00 34.43 H new ATOM 0 HA LYS A 70 10.217 -4.075 9.205 1.00 11.41 H new ATOM 0 HB2 LYS A 70 11.961 -4.899 11.581 1.00 73.12 H new ATOM 0 HB3 LYS A 70 10.761 -5.943 10.845 1.00 73.12 H new ATOM 0 HG2 LYS A 70 12.019 -5.726 8.636 1.00 35.11 H new ATOM 0 HG3 LYS A 70 13.262 -4.827 9.482 1.00 35.11 H new ATOM 0 HD2 LYS A 70 12.446 -7.707 10.107 1.00 50.35 H new ATOM 0 HD3 LYS A 70 13.856 -7.241 9.177 1.00 50.35 H new ATOM 0 HE2 LYS A 70 14.838 -6.121 11.155 1.00 12.32 H new ATOM 0 HE3 LYS A 70 13.398 -6.457 12.095 1.00 12.32 H new ATOM 0 HZ1 LYS A 70 15.146 -8.046 12.571 1.00 22.14 H new ATOM 0 HZ2 LYS A 70 13.827 -8.836 11.850 1.00 22.14 H new ATOM 0 HZ3 LYS A 70 15.222 -8.510 10.939 1.00 22.14 H new ATOM 1173 N LYS A 71 9.549 -2.631 12.024 1.00 62.24 N ATOM 1174 CA LYS A 71 8.445 -2.261 12.943 1.00 22.04 C ATOM 1175 C LYS A 71 7.359 -1.377 12.263 1.00 72.10 C ATOM 1176 O LYS A 71 6.324 -1.085 12.866 1.00 2.04 O ATOM 1177 CB LYS A 71 9.002 -1.593 14.227 1.00 2.22 C ATOM 1178 CG LYS A 71 9.839 -0.310 14.021 1.00 14.41 C ATOM 1179 CD LYS A 71 10.315 0.282 15.375 1.00 72.14 C ATOM 1180 CE LYS A 71 11.205 1.524 15.218 1.00 71.25 C ATOM 1181 NZ LYS A 71 12.495 1.204 14.560 1.00 32.34 N ATOM 0 H LYS A 71 10.395 -2.075 12.149 1.00 62.24 H new ATOM 0 HA LYS A 71 7.944 -3.187 13.225 1.00 22.04 H new ATOM 0 HB2 LYS A 71 8.163 -1.353 14.880 1.00 2.22 H new ATOM 0 HB3 LYS A 71 9.617 -2.323 14.753 1.00 2.22 H new ATOM 0 HG2 LYS A 71 10.704 -0.535 13.397 1.00 14.41 H new ATOM 0 HG3 LYS A 71 9.245 0.432 13.487 1.00 14.41 H new ATOM 0 HD2 LYS A 71 9.444 0.542 15.976 1.00 72.14 H new ATOM 0 HD3 LYS A 71 10.864 -0.483 15.924 1.00 72.14 H new ATOM 0 HE2 LYS A 71 10.677 2.277 14.633 1.00 71.25 H new ATOM 0 HE3 LYS A 71 11.397 1.959 16.199 1.00 71.25 H new ATOM 0 HZ1 LYS A 71 13.099 2.051 14.550 1.00 32.34 H new ATOM 0 HZ2 LYS A 71 12.973 0.444 15.085 1.00 32.34 H new ATOM 0 HZ3 LYS A 71 12.319 0.893 13.583 1.00 32.34 H new ATOM 1195 N TYR A 72 7.603 -0.958 11.005 1.00 70.23 N ATOM 1196 CA TYR A 72 6.600 -0.227 10.181 1.00 64.40 C ATOM 1197 C TYR A 72 5.894 -1.144 9.149 1.00 32.15 C ATOM 1198 O TYR A 72 5.026 -0.680 8.406 1.00 42.12 O ATOM 1199 CB TYR A 72 7.266 0.968 9.462 1.00 3.31 C ATOM 1200 CG TYR A 72 7.657 2.123 10.398 1.00 63.40 C ATOM 1201 CD1 TYR A 72 8.893 2.147 11.054 1.00 3.24 C ATOM 1202 CD2 TYR A 72 6.788 3.198 10.615 1.00 31.14 C ATOM 1203 CE1 TYR A 72 9.243 3.194 11.883 1.00 15.42 C ATOM 1204 CE2 TYR A 72 7.139 4.247 11.444 1.00 42.04 C ATOM 1205 CZ TYR A 72 8.365 4.243 12.073 1.00 52.02 C ATOM 1206 OH TYR A 72 8.720 5.297 12.891 1.00 73.04 O ATOM 0 H TYR A 72 8.491 -1.112 10.528 1.00 70.23 H new ATOM 0 HA TYR A 72 5.833 0.138 10.864 1.00 64.40 H new ATOM 0 HB2 TYR A 72 8.158 0.616 8.944 1.00 3.31 H new ATOM 0 HB3 TYR A 72 6.584 1.346 8.700 1.00 3.31 H new ATOM 0 HD1 TYR A 72 9.586 1.331 10.909 1.00 3.24 H new ATOM 0 HD2 TYR A 72 5.825 3.208 10.126 1.00 31.14 H new ATOM 0 HE1 TYR A 72 10.201 3.193 12.382 1.00 15.42 H new ATOM 0 HE2 TYR A 72 6.454 5.068 11.598 1.00 42.04 H new ATOM 0 HH TYR A 72 7.991 5.951 12.916 1.00 73.04 H new ATOM 1216 N HIS A 73 6.252 -2.442 9.115 1.00 44.12 N ATOM 1217 CA HIS A 73 5.644 -3.423 8.173 1.00 13.23 C ATOM 1218 C HIS A 73 4.129 -3.610 8.394 1.00 35.14 C ATOM 1219 O HIS A 73 3.420 -3.987 7.483 1.00 24.31 O ATOM 1220 CB HIS A 73 6.352 -4.796 8.274 1.00 50.05 C ATOM 1221 CG HIS A 73 7.743 -4.826 7.709 1.00 33.45 C ATOM 1222 ND1 HIS A 73 8.408 -5.995 7.424 1.00 60.33 N ATOM 1223 CD2 HIS A 73 8.601 -3.829 7.386 1.00 1.30 C ATOM 1224 CE1 HIS A 73 9.599 -5.719 6.957 1.00 31.33 C ATOM 1225 NE2 HIS A 73 9.746 -4.415 6.926 1.00 65.25 N ATOM 0 H HIS A 73 6.961 -2.844 9.728 1.00 44.12 H new ATOM 0 HA HIS A 73 5.783 -3.008 7.175 1.00 13.23 H new ATOM 0 HB2 HIS A 73 6.393 -5.092 9.322 1.00 50.05 H new ATOM 0 HB3 HIS A 73 5.748 -5.541 7.756 1.00 50.05 H new ATOM 0 HD2 HIS A 73 8.415 -2.769 7.475 1.00 1.30 H new ATOM 0 HE1 HIS A 73 10.338 -6.444 6.648 1.00 31.33 H new ATOM 0 HE2 HIS A 73 10.580 -3.920 6.610 1.00 65.25 H new ATOM 1234 N ASN A 74 3.647 -3.383 9.616 1.00 71.13 N ATOM 1235 CA ASN A 74 2.204 -3.499 9.946 1.00 32.44 C ATOM 1236 C ASN A 74 1.631 -2.154 10.439 1.00 45.53 C ATOM 1237 O ASN A 74 0.623 -2.116 11.150 1.00 52.04 O ATOM 1238 CB ASN A 74 2.021 -4.624 10.989 1.00 32.35 C ATOM 1239 CG ASN A 74 2.513 -5.996 10.491 1.00 12.21 C ATOM 1240 OD1 ASN A 74 2.371 -6.287 9.200 1.00 44.31 O flip ATOM 1241 ND2 ASN A 74 2.995 -6.801 11.268 1.00 34.14 N flip ATOM 0 H ASN A 74 4.231 -3.115 10.408 1.00 71.13 H new ATOM 0 HA ASN A 74 1.643 -3.757 9.048 1.00 32.44 H new ATOM 0 HB2 ASN A 74 2.561 -4.359 11.898 1.00 32.35 H new ATOM 0 HB3 ASN A 74 0.966 -4.697 11.254 1.00 32.35 H new ATOM 0 HD21 ASN A 74 3.096 -6.560 12.254 1.00 34.14 H new ATOM 0 HD22 ASN A 74 3.298 -7.716 10.932 1.00 34.14 H new ATOM 1248 N ASP A 75 2.277 -1.057 10.017 1.00 62.23 N ATOM 1249 CA ASP A 75 1.848 0.315 10.339 1.00 25.15 C ATOM 1250 C ASP A 75 0.658 0.716 9.416 1.00 74.52 C ATOM 1251 O ASP A 75 0.843 0.793 8.201 1.00 2.32 O ATOM 1252 CB ASP A 75 3.056 1.277 10.150 1.00 23.24 C ATOM 1253 CG ASP A 75 2.833 2.690 10.706 1.00 14.40 C ATOM 1254 OD1 ASP A 75 1.942 3.389 10.223 1.00 13.45 O ATOM 1255 OD2 ASP A 75 3.537 3.102 11.642 1.00 74.42 O ATOM 0 H ASP A 75 3.117 -1.095 9.439 1.00 62.23 H new ATOM 0 HA ASP A 75 1.511 0.377 11.374 1.00 25.15 H new ATOM 0 HB2 ASP A 75 3.930 0.843 10.635 1.00 23.24 H new ATOM 0 HB3 ASP A 75 3.284 1.350 9.087 1.00 23.24 H new ATOM 1260 N PRO A 76 -0.574 0.992 9.970 1.00 22.23 N ATOM 1261 CA PRO A 76 -1.760 1.381 9.146 1.00 2.02 C ATOM 1262 C PRO A 76 -1.513 2.635 8.254 1.00 33.40 C ATOM 1263 O PRO A 76 -1.989 2.689 7.114 1.00 5.24 O ATOM 1264 CB PRO A 76 -2.873 1.633 10.206 1.00 71.24 C ATOM 1265 CG PRO A 76 -2.144 1.816 11.508 1.00 50.41 C ATOM 1266 CD PRO A 76 -0.920 0.933 11.416 1.00 24.00 C ATOM 0 HA PRO A 76 -2.020 0.607 8.424 1.00 2.02 H new ATOM 0 HB2 PRO A 76 -3.461 2.516 9.957 1.00 71.24 H new ATOM 0 HB3 PRO A 76 -3.565 0.793 10.257 1.00 71.24 H new ATOM 0 HG2 PRO A 76 -1.865 2.859 11.658 1.00 50.41 H new ATOM 0 HG3 PRO A 76 -2.771 1.530 12.352 1.00 50.41 H new ATOM 0 HD2 PRO A 76 -0.107 1.303 12.041 1.00 24.00 H new ATOM 0 HD3 PRO A 76 -1.132 -0.086 11.739 1.00 24.00 H new ATOM 1274 N ARG A 77 -0.731 3.605 8.777 1.00 20.40 N ATOM 1275 CA ARG A 77 -0.377 4.855 8.060 1.00 23.52 C ATOM 1276 C ARG A 77 0.533 4.545 6.841 1.00 64.21 C ATOM 1277 O ARG A 77 0.163 4.851 5.702 1.00 64.15 O ATOM 1278 CB ARG A 77 0.338 5.834 9.033 1.00 70.03 C ATOM 1279 CG ARG A 77 -0.481 6.232 10.293 1.00 74.14 C ATOM 1280 CD ARG A 77 0.416 6.673 11.474 1.00 43.22 C ATOM 1281 NE ARG A 77 1.414 7.682 11.087 1.00 43.51 N ATOM 1282 CZ ARG A 77 2.469 8.028 11.802 1.00 1.41 C ATOM 1283 NH1 ARG A 77 2.677 7.552 12.992 1.00 63.52 N ATOM 1284 NH2 ARG A 77 3.310 8.872 11.319 1.00 50.55 N ATOM 0 H ARG A 77 -0.325 3.545 9.711 1.00 20.40 H new ATOM 0 HA ARG A 77 -1.291 5.322 7.693 1.00 23.52 H new ATOM 0 HB2 ARG A 77 1.274 5.380 9.357 1.00 70.03 H new ATOM 0 HB3 ARG A 77 0.596 6.741 8.486 1.00 70.03 H new ATOM 0 HG2 ARG A 77 -1.162 7.043 10.037 1.00 74.14 H new ATOM 0 HG3 ARG A 77 -1.095 5.387 10.604 1.00 74.14 H new ATOM 0 HD2 ARG A 77 -0.211 7.075 12.270 1.00 43.22 H new ATOM 0 HD3 ARG A 77 0.927 5.801 11.881 1.00 43.22 H new ATOM 0 HE ARG A 77 1.280 8.153 10.192 1.00 43.51 H new ATOM 0 HH11 ARG A 77 2.016 6.891 13.400 1.00 63.52 H new ATOM 0 HH12 ARG A 77 3.502 7.839 13.519 1.00 63.52 H new ATOM 0 HH21 ARG A 77 3.159 9.268 10.391 1.00 50.55 H new ATOM 0 HH22 ARG A 77 4.128 9.146 11.864 1.00 50.55 H new ATOM 1298 N PHE A 78 1.704 3.908 7.100 1.00 74.34 N ATOM 1299 CA PHE A 78 2.684 3.524 6.048 1.00 25.02 C ATOM 1300 C PHE A 78 2.038 2.659 4.927 1.00 45.51 C ATOM 1301 O PHE A 78 2.224 2.941 3.735 1.00 64.11 O ATOM 1302 CB PHE A 78 3.907 2.780 6.675 1.00 0.31 C ATOM 1303 CG PHE A 78 4.867 2.161 5.643 1.00 12.13 C ATOM 1304 CD1 PHE A 78 5.499 2.958 4.683 1.00 53.24 C ATOM 1305 CD2 PHE A 78 5.101 0.782 5.605 1.00 51.54 C ATOM 1306 CE1 PHE A 78 6.326 2.397 3.731 1.00 51.51 C ATOM 1307 CE2 PHE A 78 5.925 0.223 4.649 1.00 64.13 C ATOM 1308 CZ PHE A 78 6.539 1.027 3.712 1.00 15.03 C ATOM 0 H PHE A 78 1.996 3.646 8.042 1.00 74.34 H new ATOM 0 HA PHE A 78 3.031 4.448 5.585 1.00 25.02 H new ATOM 0 HB2 PHE A 78 4.464 3.480 7.298 1.00 0.31 H new ATOM 0 HB3 PHE A 78 3.540 1.991 7.332 1.00 0.31 H new ATOM 0 HD1 PHE A 78 5.338 4.026 4.687 1.00 53.24 H new ATOM 0 HD2 PHE A 78 4.628 0.144 6.337 1.00 51.54 H new ATOM 0 HE1 PHE A 78 6.809 3.027 2.999 1.00 51.51 H new ATOM 0 HE2 PHE A 78 6.089 -0.844 4.635 1.00 64.13 H new ATOM 0 HZ PHE A 78 7.185 0.590 2.965 1.00 15.03 H new ATOM 1318 N ILE A 79 1.280 1.617 5.329 1.00 2.44 N ATOM 1319 CA ILE A 79 0.556 0.734 4.380 1.00 51.52 C ATOM 1320 C ILE A 79 -0.472 1.539 3.555 1.00 11.35 C ATOM 1321 O ILE A 79 -0.589 1.324 2.352 1.00 54.10 O ATOM 1322 CB ILE A 79 -0.132 -0.508 5.104 1.00 62.21 C ATOM 1323 CG1 ILE A 79 0.901 -1.660 5.363 1.00 41.14 C ATOM 1324 CG2 ILE A 79 -1.358 -1.069 4.316 1.00 5.30 C ATOM 1325 CD1 ILE A 79 2.070 -1.331 6.273 1.00 45.41 C ATOM 0 H ILE A 79 1.151 1.363 6.308 1.00 2.44 H new ATOM 0 HA ILE A 79 1.300 0.323 3.697 1.00 51.52 H new ATOM 0 HB ILE A 79 -0.499 -0.130 6.058 1.00 62.21 H new ATOM 0 HG12 ILE A 79 0.366 -2.509 5.789 1.00 41.14 H new ATOM 0 HG13 ILE A 79 1.298 -1.984 4.401 1.00 41.14 H new ATOM 0 HG21 ILE A 79 -1.784 -1.913 4.859 1.00 5.30 H new ATOM 0 HG22 ILE A 79 -2.111 -0.288 4.211 1.00 5.30 H new ATOM 0 HG23 ILE A 79 -1.036 -1.398 3.328 1.00 5.30 H new ATOM 0 HD11 ILE A 79 2.711 -2.207 6.373 1.00 45.41 H new ATOM 0 HD12 ILE A 79 2.643 -0.508 5.846 1.00 45.41 H new ATOM 0 HD13 ILE A 79 1.696 -1.041 7.255 1.00 45.41 H new ATOM 1337 N SER A 80 -1.181 2.488 4.204 1.00 5.41 N ATOM 1338 CA SER A 80 -2.143 3.382 3.513 1.00 64.43 C ATOM 1339 C SER A 80 -1.461 4.245 2.417 1.00 11.31 C ATOM 1340 O SER A 80 -2.103 4.616 1.433 1.00 25.43 O ATOM 1341 CB SER A 80 -2.868 4.284 4.532 1.00 34.22 C ATOM 1342 OG SER A 80 -3.780 5.180 3.911 1.00 24.11 O ATOM 0 H SER A 80 -1.107 2.657 5.207 1.00 5.41 H new ATOM 0 HA SER A 80 -2.874 2.745 3.015 1.00 64.43 H new ATOM 0 HB2 SER A 80 -3.405 3.661 5.247 1.00 34.22 H new ATOM 0 HB3 SER A 80 -2.131 4.854 5.097 1.00 34.22 H new ATOM 0 HG SER A 80 -4.216 5.729 4.595 1.00 24.11 H new ATOM 1348 N TYR A 81 -0.156 4.552 2.590 1.00 1.04 N ATOM 1349 CA TYR A 81 0.646 5.279 1.570 1.00 45.54 C ATOM 1350 C TYR A 81 1.126 4.358 0.426 1.00 33.23 C ATOM 1351 O TYR A 81 1.343 4.830 -0.693 1.00 43.10 O ATOM 1352 CB TYR A 81 1.842 6.003 2.210 1.00 24.35 C ATOM 1353 CG TYR A 81 1.424 7.163 3.118 1.00 44.02 C ATOM 1354 CD1 TYR A 81 0.772 8.282 2.591 1.00 73.40 C ATOM 1355 CD2 TYR A 81 1.653 7.139 4.490 1.00 23.14 C ATOM 1356 CE1 TYR A 81 0.364 9.316 3.404 1.00 63.25 C ATOM 1357 CE2 TYR A 81 1.250 8.173 5.298 1.00 44.01 C ATOM 1358 CZ TYR A 81 0.605 9.260 4.753 1.00 73.41 C ATOM 1359 OH TYR A 81 0.177 10.289 5.564 1.00 55.23 O ATOM 0 H TYR A 81 0.370 4.308 3.429 1.00 1.04 H new ATOM 0 HA TYR A 81 -0.019 6.023 1.132 1.00 45.54 H new ATOM 0 HB2 TYR A 81 2.425 5.287 2.790 1.00 24.35 H new ATOM 0 HB3 TYR A 81 2.494 6.382 1.423 1.00 24.35 H new ATOM 0 HD1 TYR A 81 0.585 8.336 1.529 1.00 73.40 H new ATOM 0 HD2 TYR A 81 2.158 6.290 4.928 1.00 23.14 H new ATOM 0 HE1 TYR A 81 -0.145 10.169 2.980 1.00 63.25 H new ATOM 0 HE2 TYR A 81 1.439 8.134 6.361 1.00 44.01 H new ATOM 0 HH TYR A 81 0.424 10.098 6.493 1.00 55.23 H new ATOM 1369 N CYS A 82 1.320 3.059 0.717 1.00 54.44 N ATOM 1370 CA CYS A 82 1.554 2.039 -0.333 1.00 54.14 C ATOM 1371 C CYS A 82 0.256 1.806 -1.157 1.00 11.45 C ATOM 1372 O CYS A 82 0.312 1.590 -2.364 1.00 24.12 O ATOM 1373 CB CYS A 82 2.061 0.714 0.282 1.00 13.45 C ATOM 1374 SG CYS A 82 3.598 0.883 1.223 1.00 43.20 S ATOM 0 H CYS A 82 1.320 2.687 1.667 1.00 54.44 H new ATOM 0 HA CYS A 82 2.328 2.410 -1.004 1.00 54.14 H new ATOM 0 HB2 CYS A 82 1.289 0.309 0.936 1.00 13.45 H new ATOM 0 HB3 CYS A 82 2.214 -0.011 -0.517 1.00 13.45 H new ATOM 0 HG CYS A 82 3.389 1.633 2.264 1.00 43.20 H new ATOM 1380 N LEU A 83 -0.909 1.888 -0.477 1.00 51.11 N ATOM 1381 CA LEU A 83 -2.251 1.825 -1.117 1.00 51.10 C ATOM 1382 C LEU A 83 -2.500 3.082 -1.979 1.00 71.15 C ATOM 1383 O LEU A 83 -3.048 3.004 -3.084 1.00 12.11 O ATOM 1384 CB LEU A 83 -3.356 1.702 -0.032 1.00 71.21 C ATOM 1385 CG LEU A 83 -3.270 0.445 0.883 1.00 62.24 C ATOM 1386 CD1 LEU A 83 -4.351 0.465 1.978 1.00 31.23 C ATOM 1387 CD2 LEU A 83 -3.332 -0.852 0.055 1.00 23.23 C ATOM 0 H LEU A 83 -0.950 2.000 0.536 1.00 51.11 H new ATOM 0 HA LEU A 83 -2.284 0.947 -1.762 1.00 51.10 H new ATOM 0 HB2 LEU A 83 -3.320 2.590 0.599 1.00 71.21 H new ATOM 0 HB3 LEU A 83 -4.327 1.702 -0.527 1.00 71.21 H new ATOM 0 HG LEU A 83 -2.303 0.472 1.385 1.00 62.24 H new ATOM 0 HD11 LEU A 83 -4.259 -0.428 2.596 1.00 31.23 H new ATOM 0 HD12 LEU A 83 -4.223 1.351 2.599 1.00 31.23 H new ATOM 0 HD13 LEU A 83 -5.338 0.486 1.515 1.00 31.23 H new ATOM 0 HD21 LEU A 83 -3.270 -1.712 0.721 1.00 23.23 H new ATOM 0 HD22 LEU A 83 -4.272 -0.887 -0.496 1.00 23.23 H new ATOM 0 HD23 LEU A 83 -2.498 -0.876 -0.647 1.00 23.23 H new ATOM 1399 N LYS A 84 -2.069 4.233 -1.443 1.00 53.35 N ATOM 1400 CA LYS A 84 -2.071 5.531 -2.142 1.00 62.55 C ATOM 1401 C LYS A 84 -1.212 5.446 -3.428 1.00 15.00 C ATOM 1402 O LYS A 84 -1.641 5.870 -4.491 1.00 33.30 O ATOM 1403 CB LYS A 84 -1.548 6.623 -1.142 1.00 43.21 C ATOM 1404 CG LYS A 84 -0.721 7.774 -1.745 1.00 71.32 C ATOM 1405 CD LYS A 84 -1.555 8.793 -2.542 1.00 14.43 C ATOM 1406 CE LYS A 84 -2.351 9.732 -1.639 1.00 23.21 C ATOM 1407 NZ LYS A 84 -3.156 10.700 -2.417 1.00 31.12 N ATOM 0 H LYS A 84 -1.702 4.291 -0.493 1.00 53.35 H new ATOM 0 HA LYS A 84 -3.078 5.803 -2.460 1.00 62.55 H new ATOM 0 HB2 LYS A 84 -2.408 7.054 -0.629 1.00 43.21 H new ATOM 0 HB3 LYS A 84 -0.940 6.128 -0.385 1.00 43.21 H new ATOM 0 HG2 LYS A 84 -0.202 8.295 -0.941 1.00 71.32 H new ATOM 0 HG3 LYS A 84 0.044 7.355 -2.399 1.00 71.32 H new ATOM 0 HD2 LYS A 84 -0.893 9.381 -3.178 1.00 14.43 H new ATOM 0 HD3 LYS A 84 -2.241 8.260 -3.201 1.00 14.43 H new ATOM 0 HE2 LYS A 84 -3.009 9.146 -0.997 1.00 23.21 H new ATOM 0 HE3 LYS A 84 -1.667 10.273 -0.985 1.00 23.21 H new ATOM 0 HZ1 LYS A 84 -3.985 10.989 -1.860 1.00 31.12 H new ATOM 0 HZ2 LYS A 84 -2.577 11.536 -2.636 1.00 31.12 H new ATOM 0 HZ3 LYS A 84 -3.472 10.256 -3.303 1.00 31.12 H new ATOM 1421 N PHE A 85 -0.008 4.878 -3.300 1.00 54.21 N ATOM 1422 CA PHE A 85 0.919 4.673 -4.428 1.00 45.42 C ATOM 1423 C PHE A 85 0.359 3.663 -5.454 1.00 52.31 C ATOM 1424 O PHE A 85 0.566 3.829 -6.655 1.00 45.34 O ATOM 1425 CB PHE A 85 2.282 4.205 -3.870 1.00 15.40 C ATOM 1426 CG PHE A 85 3.346 3.861 -4.911 1.00 10.53 C ATOM 1427 CD1 PHE A 85 4.071 4.863 -5.543 1.00 5.42 C ATOM 1428 CD2 PHE A 85 3.643 2.538 -5.229 1.00 45.22 C ATOM 1429 CE1 PHE A 85 5.062 4.549 -6.451 1.00 3.22 C ATOM 1430 CE2 PHE A 85 4.628 2.224 -6.137 1.00 3.10 C ATOM 1431 CZ PHE A 85 5.340 3.230 -6.749 1.00 3.54 C ATOM 0 H PHE A 85 0.357 4.544 -2.408 1.00 54.21 H new ATOM 0 HA PHE A 85 1.045 5.616 -4.961 1.00 45.42 H new ATOM 0 HB2 PHE A 85 2.675 4.988 -3.221 1.00 15.40 H new ATOM 0 HB3 PHE A 85 2.115 3.327 -3.245 1.00 15.40 H new ATOM 0 HD1 PHE A 85 3.857 5.898 -5.322 1.00 5.42 H new ATOM 0 HD2 PHE A 85 3.089 1.742 -4.753 1.00 45.22 H new ATOM 0 HE1 PHE A 85 5.622 5.338 -6.930 1.00 3.22 H new ATOM 0 HE2 PHE A 85 4.842 1.191 -6.369 1.00 3.10 H new ATOM 0 HZ PHE A 85 6.115 2.988 -7.461 1.00 3.54 H new ATOM 1441 N ALA A 86 -0.373 2.646 -4.954 1.00 24.41 N ATOM 1442 CA ALA A 86 -0.914 1.532 -5.763 1.00 70.41 C ATOM 1443 C ALA A 86 -1.750 2.014 -6.970 1.00 54.22 C ATOM 1444 O ALA A 86 -1.539 1.561 -8.090 1.00 25.43 O ATOM 1445 CB ALA A 86 -1.751 0.600 -4.875 1.00 51.42 C ATOM 0 H ALA A 86 -0.608 2.574 -3.964 1.00 24.41 H new ATOM 0 HA ALA A 86 -0.061 0.990 -6.171 1.00 70.41 H new ATOM 0 HB1 ALA A 86 -2.146 -0.218 -5.477 1.00 51.42 H new ATOM 0 HB2 ALA A 86 -1.125 0.196 -4.080 1.00 51.42 H new ATOM 0 HB3 ALA A 86 -2.577 1.160 -4.437 1.00 51.42 H new ATOM 1451 N GLU A 87 -2.654 2.980 -6.743 1.00 71.40 N ATOM 1452 CA GLU A 87 -3.551 3.508 -7.807 1.00 44.21 C ATOM 1453 C GLU A 87 -2.788 4.249 -8.952 1.00 62.23 C ATOM 1454 O GLU A 87 -3.378 4.590 -9.977 1.00 63.33 O ATOM 1455 CB GLU A 87 -4.623 4.435 -7.186 1.00 14.25 C ATOM 1456 CG GLU A 87 -4.049 5.660 -6.462 1.00 15.20 C ATOM 1457 CD GLU A 87 -5.118 6.657 -6.011 1.00 3.44 C ATOM 1458 OE1 GLU A 87 -5.721 6.458 -4.941 1.00 55.10 O ATOM 1459 OE2 GLU A 87 -5.373 7.640 -6.736 1.00 23.13 O ATOM 0 H GLU A 87 -2.790 3.418 -5.832 1.00 71.40 H new ATOM 0 HA GLU A 87 -4.030 2.644 -8.268 1.00 44.21 H new ATOM 0 HB2 GLU A 87 -5.295 4.774 -7.974 1.00 14.25 H new ATOM 0 HB3 GLU A 87 -5.223 3.858 -6.482 1.00 14.25 H new ATOM 0 HG2 GLU A 87 -3.484 5.326 -5.592 1.00 15.20 H new ATOM 0 HG3 GLU A 87 -3.346 6.167 -7.123 1.00 15.20 H new ATOM 1466 N TYR A 88 -1.480 4.494 -8.757 1.00 32.05 N ATOM 1467 CA TYR A 88 -0.592 5.101 -9.782 1.00 24.24 C ATOM 1468 C TYR A 88 0.272 4.024 -10.500 1.00 21.11 C ATOM 1469 O TYR A 88 1.235 4.350 -11.199 1.00 34.51 O ATOM 1470 CB TYR A 88 0.311 6.165 -9.100 1.00 22.43 C ATOM 1471 CG TYR A 88 -0.463 7.171 -8.223 1.00 75.54 C ATOM 1472 CD1 TYR A 88 -1.581 7.850 -8.718 1.00 60.35 C ATOM 1473 CD2 TYR A 88 -0.097 7.413 -6.896 1.00 42.25 C ATOM 1474 CE1 TYR A 88 -2.293 8.726 -7.924 1.00 2.41 C ATOM 1475 CE2 TYR A 88 -0.809 8.286 -6.107 1.00 1.15 C ATOM 1476 CZ TYR A 88 -1.904 8.941 -6.618 1.00 30.42 C ATOM 1477 OH TYR A 88 -2.614 9.818 -5.820 1.00 3.52 O ATOM 0 H TYR A 88 -1.001 4.278 -7.883 1.00 32.05 H new ATOM 0 HA TYR A 88 -1.208 5.576 -10.545 1.00 24.24 H new ATOM 0 HB2 TYR A 88 1.053 5.657 -8.484 1.00 22.43 H new ATOM 0 HB3 TYR A 88 0.856 6.712 -9.869 1.00 22.43 H new ATOM 0 HD1 TYR A 88 -1.892 7.686 -9.739 1.00 60.35 H new ATOM 0 HD2 TYR A 88 0.761 6.905 -6.482 1.00 42.25 H new ATOM 0 HE1 TYR A 88 -3.153 9.242 -8.324 1.00 2.41 H new ATOM 0 HE2 TYR A 88 -0.507 8.457 -5.084 1.00 1.15 H new ATOM 0 HH TYR A 88 -3.553 9.829 -6.101 1.00 3.52 H new ATOM 1487 N ASN A 89 -0.089 2.739 -10.314 1.00 72.04 N ATOM 1488 CA ASN A 89 0.609 1.574 -10.923 1.00 24.24 C ATOM 1489 C ASN A 89 -0.413 0.633 -11.593 1.00 62.23 C ATOM 1490 O ASN A 89 -1.480 0.376 -11.037 1.00 22.10 O ATOM 1491 CB ASN A 89 1.412 0.795 -9.848 1.00 62.20 C ATOM 1492 CG ASN A 89 2.538 1.626 -9.250 1.00 14.41 C ATOM 1493 OD1 ASN A 89 3.678 1.572 -9.690 1.00 21.34 O ATOM 1494 ND2 ASN A 89 2.217 2.424 -8.267 1.00 4.33 N ATOM 0 H ASN A 89 -0.882 2.471 -9.731 1.00 72.04 H new ATOM 0 HA ASN A 89 1.303 1.946 -11.677 1.00 24.24 H new ATOM 0 HB2 ASN A 89 0.737 0.477 -9.053 1.00 62.20 H new ATOM 0 HB3 ASN A 89 1.828 -0.109 -10.293 1.00 62.20 H new ATOM 0 HD21 ASN A 89 2.926 3.024 -7.845 1.00 4.33 H new ATOM 0 HD22 ASN A 89 1.258 2.447 -7.921 1.00 4.33 H new ATOM 1501 N SER A 90 -0.061 0.110 -12.778 1.00 62.25 N ATOM 1502 CA SER A 90 -0.934 -0.796 -13.554 1.00 21.43 C ATOM 1503 C SER A 90 -0.857 -2.244 -13.015 1.00 61.03 C ATOM 1504 O SER A 90 -1.885 -2.848 -12.689 1.00 65.51 O ATOM 1505 CB SER A 90 -0.549 -0.752 -15.051 1.00 12.11 C ATOM 1506 OG SER A 90 0.813 -1.104 -15.251 1.00 60.43 O ATOM 0 H SER A 90 0.834 0.301 -13.228 1.00 62.25 H new ATOM 0 HA SER A 90 -1.963 -0.455 -13.444 1.00 21.43 H new ATOM 0 HB2 SER A 90 -1.188 -1.434 -15.612 1.00 12.11 H new ATOM 0 HB3 SER A 90 -0.728 0.249 -15.444 1.00 12.11 H new ATOM 0 HG SER A 90 0.896 -2.080 -15.291 1.00 60.43 H new ATOM 1512 N ASP A 91 0.374 -2.781 -12.910 1.00 14.32 N ATOM 1513 CA ASP A 91 0.629 -4.167 -12.457 1.00 53.14 C ATOM 1514 C ASP A 91 0.570 -4.295 -10.908 1.00 23.14 C ATOM 1515 O ASP A 91 1.594 -4.459 -10.221 1.00 13.33 O ATOM 1516 CB ASP A 91 1.982 -4.660 -13.007 1.00 62.31 C ATOM 1517 CG ASP A 91 2.018 -4.741 -14.537 1.00 14.12 C ATOM 1518 OD1 ASP A 91 2.298 -3.715 -15.192 1.00 32.44 O ATOM 1519 OD2 ASP A 91 1.749 -5.826 -15.093 1.00 20.14 O ATOM 0 H ASP A 91 1.224 -2.266 -13.137 1.00 14.32 H new ATOM 0 HA ASP A 91 -0.164 -4.802 -12.853 1.00 53.14 H new ATOM 0 HB2 ASP A 91 2.771 -3.990 -12.666 1.00 62.31 H new ATOM 0 HB3 ASP A 91 2.199 -5.644 -12.592 1.00 62.31 H new ATOM 1524 N LEU A 92 -0.659 -4.201 -10.373 1.00 31.22 N ATOM 1525 CA LEU A 92 -0.931 -4.345 -8.927 1.00 33.44 C ATOM 1526 C LEU A 92 -0.669 -5.771 -8.411 1.00 14.12 C ATOM 1527 O LEU A 92 -0.263 -5.943 -7.260 1.00 63.24 O ATOM 1528 CB LEU A 92 -2.374 -3.892 -8.596 1.00 33.22 C ATOM 1529 CG LEU A 92 -2.668 -2.378 -8.823 1.00 45.43 C ATOM 1530 CD1 LEU A 92 -4.077 -1.993 -8.318 1.00 75.25 C ATOM 1531 CD2 LEU A 92 -1.575 -1.505 -8.172 1.00 35.32 C ATOM 0 H LEU A 92 -1.495 -4.023 -10.929 1.00 31.22 H new ATOM 0 HA LEU A 92 -0.229 -3.693 -8.406 1.00 33.44 H new ATOM 0 HB2 LEU A 92 -3.068 -4.474 -9.202 1.00 33.22 H new ATOM 0 HB3 LEU A 92 -2.582 -4.133 -7.554 1.00 33.22 H new ATOM 0 HG LEU A 92 -2.650 -2.190 -9.897 1.00 45.43 H new ATOM 0 HD11 LEU A 92 -4.248 -0.931 -8.492 1.00 75.25 H new ATOM 0 HD12 LEU A 92 -4.827 -2.574 -8.854 1.00 75.25 H new ATOM 0 HD13 LEU A 92 -4.151 -2.202 -7.251 1.00 75.25 H new ATOM 0 HD21 LEU A 92 -1.800 -0.452 -8.343 1.00 35.32 H new ATOM 0 HD22 LEU A 92 -1.544 -1.700 -7.100 1.00 35.32 H new ATOM 0 HD23 LEU A 92 -0.607 -1.745 -8.613 1.00 35.32 H new ATOM 1543 N HIS A 93 -0.912 -6.795 -9.258 1.00 53.53 N ATOM 1544 CA HIS A 93 -0.538 -8.190 -8.925 1.00 41.31 C ATOM 1545 C HIS A 93 0.971 -8.326 -8.592 1.00 61.11 C ATOM 1546 O HIS A 93 1.338 -9.131 -7.747 1.00 62.23 O ATOM 1547 CB HIS A 93 -0.946 -9.173 -10.051 1.00 32.33 C ATOM 1548 CG HIS A 93 -0.217 -9.003 -11.364 1.00 22.42 C ATOM 1549 ND1 HIS A 93 -0.534 -8.030 -12.279 1.00 33.12 N ATOM 1550 CD2 HIS A 93 0.812 -9.700 -11.914 1.00 24.12 C ATOM 1551 CE1 HIS A 93 0.258 -8.131 -13.324 1.00 74.54 C ATOM 1552 NE2 HIS A 93 1.083 -9.133 -13.130 1.00 72.24 N ATOM 0 H HIS A 93 -1.360 -6.686 -10.168 1.00 53.53 H new ATOM 0 HA HIS A 93 -1.095 -8.457 -8.027 1.00 41.31 H new ATOM 0 HB2 HIS A 93 -0.785 -10.191 -9.696 1.00 32.33 H new ATOM 0 HB3 HIS A 93 -2.015 -9.065 -10.233 1.00 32.33 H new ATOM 0 HD2 HIS A 93 1.321 -10.544 -11.473 1.00 24.12 H new ATOM 0 HE1 HIS A 93 0.234 -7.495 -14.197 1.00 74.54 H new ATOM 0 HE2 HIS A 93 1.808 -9.439 -13.779 1.00 72.24 H new ATOM 1561 N GLN A 94 1.825 -7.522 -9.264 1.00 41.24 N ATOM 1562 CA GLN A 94 3.283 -7.499 -9.007 1.00 14.51 C ATOM 1563 C GLN A 94 3.617 -6.663 -7.745 1.00 1.11 C ATOM 1564 O GLN A 94 4.407 -7.098 -6.895 1.00 13.43 O ATOM 1565 CB GLN A 94 4.051 -6.943 -10.242 1.00 14.51 C ATOM 1566 CG GLN A 94 3.910 -7.789 -11.528 1.00 51.21 C ATOM 1567 CD GLN A 94 4.723 -7.261 -12.718 1.00 62.42 C ATOM 1568 OE1 GLN A 94 4.955 -6.066 -12.855 1.00 64.32 O ATOM 1569 NE2 GLN A 94 5.161 -8.144 -13.591 1.00 13.20 N ATOM 0 H GLN A 94 1.526 -6.875 -9.994 1.00 41.24 H new ATOM 0 HA GLN A 94 3.605 -8.525 -8.829 1.00 14.51 H new ATOM 0 HB2 GLN A 94 3.697 -5.933 -10.448 1.00 14.51 H new ATOM 0 HB3 GLN A 94 5.108 -6.865 -9.990 1.00 14.51 H new ATOM 0 HG2 GLN A 94 4.222 -8.811 -11.314 1.00 51.21 H new ATOM 0 HG3 GLN A 94 2.858 -7.829 -11.810 1.00 51.21 H new ATOM 0 HE21 GLN A 94 4.958 -9.135 -13.460 1.00 13.20 H new ATOM 0 HE22 GLN A 94 5.704 -7.837 -14.398 1.00 13.20 H new ATOM 1578 N PHE A 95 2.996 -5.467 -7.644 1.00 40.54 N ATOM 1579 CA PHE A 95 3.215 -4.524 -6.520 1.00 43.41 C ATOM 1580 C PHE A 95 2.854 -5.141 -5.140 1.00 35.52 C ATOM 1581 O PHE A 95 3.719 -5.280 -4.268 1.00 50.05 O ATOM 1582 CB PHE A 95 2.399 -3.224 -6.755 1.00 42.32 C ATOM 1583 CG PHE A 95 2.473 -2.222 -5.603 1.00 60.23 C ATOM 1584 CD1 PHE A 95 3.704 -1.723 -5.171 1.00 72.12 C ATOM 1585 CD2 PHE A 95 1.323 -1.798 -4.941 1.00 64.51 C ATOM 1586 CE1 PHE A 95 3.776 -0.838 -4.119 1.00 43.53 C ATOM 1587 CE2 PHE A 95 1.400 -0.911 -3.893 1.00 73.34 C ATOM 1588 CZ PHE A 95 2.626 -0.431 -3.480 1.00 13.23 C ATOM 0 H PHE A 95 2.330 -5.127 -8.337 1.00 40.54 H new ATOM 0 HA PHE A 95 4.280 -4.294 -6.495 1.00 43.41 H new ATOM 0 HB2 PHE A 95 2.758 -2.742 -7.665 1.00 42.32 H new ATOM 0 HB3 PHE A 95 1.355 -3.489 -6.925 1.00 42.32 H new ATOM 0 HD1 PHE A 95 4.610 -2.035 -5.668 1.00 72.12 H new ATOM 0 HD2 PHE A 95 0.359 -2.171 -5.255 1.00 64.51 H new ATOM 0 HE1 PHE A 95 4.735 -0.463 -3.795 1.00 43.53 H new ATOM 0 HE2 PHE A 95 0.499 -0.589 -3.392 1.00 73.34 H new ATOM 0 HZ PHE A 95 2.684 0.264 -2.655 1.00 13.23 H new ATOM 1598 N PHE A 96 1.571 -5.490 -4.964 1.00 60.10 N ATOM 1599 CA PHE A 96 1.053 -6.050 -3.699 1.00 64.54 C ATOM 1600 C PHE A 96 1.704 -7.408 -3.333 1.00 32.15 C ATOM 1601 O PHE A 96 1.817 -7.733 -2.147 1.00 43.20 O ATOM 1602 CB PHE A 96 -0.473 -6.220 -3.781 1.00 45.41 C ATOM 1603 CG PHE A 96 -1.286 -4.928 -3.739 1.00 72.55 C ATOM 1604 CD1 PHE A 96 -1.696 -4.394 -2.522 1.00 73.35 C ATOM 1605 CD2 PHE A 96 -1.673 -4.274 -4.905 1.00 61.03 C ATOM 1606 CE1 PHE A 96 -2.458 -3.248 -2.472 1.00 43.54 C ATOM 1607 CE2 PHE A 96 -2.443 -3.130 -4.852 1.00 71.24 C ATOM 1608 CZ PHE A 96 -2.835 -2.617 -3.636 1.00 10.14 C ATOM 0 H PHE A 96 0.862 -5.394 -5.691 1.00 60.10 H new ATOM 0 HA PHE A 96 1.312 -5.341 -2.913 1.00 64.54 H new ATOM 0 HB2 PHE A 96 -0.712 -6.748 -4.704 1.00 45.41 H new ATOM 0 HB3 PHE A 96 -0.794 -6.857 -2.957 1.00 45.41 H new ATOM 0 HD1 PHE A 96 -1.413 -4.885 -1.603 1.00 73.35 H new ATOM 0 HD2 PHE A 96 -1.367 -4.667 -5.863 1.00 61.03 H new ATOM 0 HE1 PHE A 96 -2.761 -2.843 -1.517 1.00 43.54 H new ATOM 0 HE2 PHE A 96 -2.739 -2.636 -5.766 1.00 71.24 H new ATOM 0 HZ PHE A 96 -3.437 -1.721 -3.595 1.00 10.14 H new ATOM 1618 N GLU A 97 2.104 -8.202 -4.356 1.00 12.42 N ATOM 1619 CA GLU A 97 2.822 -9.479 -4.130 1.00 22.41 C ATOM 1620 C GLU A 97 4.196 -9.222 -3.488 1.00 61.33 C ATOM 1621 O GLU A 97 4.551 -9.879 -2.518 1.00 33.34 O ATOM 1622 CB GLU A 97 2.995 -10.284 -5.442 1.00 73.03 C ATOM 1623 CG GLU A 97 3.618 -11.686 -5.256 1.00 45.32 C ATOM 1624 CD GLU A 97 3.844 -12.440 -6.574 1.00 70.14 C ATOM 1625 OE1 GLU A 97 4.863 -12.187 -7.243 1.00 41.01 O ATOM 1626 OE2 GLU A 97 2.997 -13.274 -6.963 1.00 31.33 O ATOM 0 H GLU A 97 1.943 -7.982 -5.339 1.00 12.42 H new ATOM 0 HA GLU A 97 2.213 -10.074 -3.449 1.00 22.41 H new ATOM 0 HB2 GLU A 97 2.020 -10.394 -5.917 1.00 73.03 H new ATOM 0 HB3 GLU A 97 3.620 -9.710 -6.126 1.00 73.03 H new ATOM 0 HG2 GLU A 97 4.571 -11.584 -4.738 1.00 45.32 H new ATOM 0 HG3 GLU A 97 2.968 -12.281 -4.614 1.00 45.32 H new ATOM 1633 N PHE A 98 4.931 -8.231 -4.029 1.00 50.23 N ATOM 1634 CA PHE A 98 6.229 -7.775 -3.488 1.00 51.33 C ATOM 1635 C PHE A 98 6.098 -7.372 -1.994 1.00 52.15 C ATOM 1636 O PHE A 98 6.916 -7.782 -1.151 1.00 71.53 O ATOM 1637 CB PHE A 98 6.756 -6.597 -4.375 1.00 0.24 C ATOM 1638 CG PHE A 98 7.660 -5.581 -3.670 1.00 44.21 C ATOM 1639 CD1 PHE A 98 9.023 -5.813 -3.501 1.00 51.41 C ATOM 1640 CD2 PHE A 98 7.130 -4.384 -3.182 1.00 54.30 C ATOM 1641 CE1 PHE A 98 9.826 -4.880 -2.871 1.00 4.24 C ATOM 1642 CE2 PHE A 98 7.930 -3.458 -2.549 1.00 23.25 C ATOM 1643 CZ PHE A 98 9.275 -3.702 -2.395 1.00 74.13 C ATOM 0 H PHE A 98 4.639 -7.719 -4.861 1.00 50.23 H new ATOM 0 HA PHE A 98 6.953 -8.589 -3.522 1.00 51.33 H new ATOM 0 HB2 PHE A 98 7.304 -7.019 -5.217 1.00 0.24 H new ATOM 0 HB3 PHE A 98 5.898 -6.066 -4.787 1.00 0.24 H new ATOM 0 HD1 PHE A 98 9.458 -6.732 -3.866 1.00 51.41 H new ATOM 0 HD2 PHE A 98 6.076 -4.181 -3.303 1.00 54.30 H new ATOM 0 HE1 PHE A 98 10.882 -5.070 -2.750 1.00 4.24 H new ATOM 0 HE2 PHE A 98 7.501 -2.541 -2.174 1.00 23.25 H new ATOM 0 HZ PHE A 98 9.902 -2.974 -1.902 1.00 74.13 H new ATOM 1653 N LEU A 99 5.053 -6.581 -1.689 1.00 3.24 N ATOM 1654 CA LEU A 99 4.748 -6.143 -0.314 1.00 14.32 C ATOM 1655 C LEU A 99 4.541 -7.357 0.624 1.00 54.34 C ATOM 1656 O LEU A 99 5.266 -7.519 1.605 1.00 74.24 O ATOM 1657 CB LEU A 99 3.494 -5.225 -0.308 1.00 33.54 C ATOM 1658 CG LEU A 99 3.610 -3.888 -1.113 1.00 50.54 C ATOM 1659 CD1 LEU A 99 2.284 -3.106 -1.077 1.00 24.43 C ATOM 1660 CD2 LEU A 99 4.785 -3.013 -0.607 1.00 12.13 C ATOM 0 H LEU A 99 4.398 -6.228 -2.387 1.00 3.24 H new ATOM 0 HA LEU A 99 5.599 -5.574 0.060 1.00 14.32 H new ATOM 0 HB2 LEU A 99 2.653 -5.792 -0.706 1.00 33.54 H new ATOM 0 HB3 LEU A 99 3.253 -4.982 0.727 1.00 33.54 H new ATOM 0 HG LEU A 99 3.822 -4.150 -2.150 1.00 50.54 H new ATOM 0 HD11 LEU A 99 2.392 -2.181 -1.644 1.00 24.43 H new ATOM 0 HD12 LEU A 99 1.492 -3.712 -1.518 1.00 24.43 H new ATOM 0 HD13 LEU A 99 2.028 -2.871 -0.044 1.00 24.43 H new ATOM 0 HD21 LEU A 99 4.832 -2.094 -1.191 1.00 12.13 H new ATOM 0 HD22 LEU A 99 4.630 -2.768 0.444 1.00 12.13 H new ATOM 0 HD23 LEU A 99 5.721 -3.561 -0.717 1.00 12.13 H new ATOM 1672 N TYR A 100 3.589 -8.229 0.257 1.00 12.21 N ATOM 1673 CA TYR A 100 3.234 -9.434 1.036 1.00 12.12 C ATOM 1674 C TYR A 100 4.447 -10.393 1.230 1.00 75.21 C ATOM 1675 O TYR A 100 4.619 -10.976 2.306 1.00 15.12 O ATOM 1676 CB TYR A 100 2.054 -10.165 0.346 1.00 43.44 C ATOM 1677 CG TYR A 100 1.572 -11.428 1.079 1.00 43.23 C ATOM 1678 CD1 TYR A 100 0.941 -11.347 2.325 1.00 23.14 C ATOM 1679 CD2 TYR A 100 1.757 -12.701 0.531 1.00 35.11 C ATOM 1680 CE1 TYR A 100 0.519 -12.485 2.986 1.00 4.10 C ATOM 1681 CE2 TYR A 100 1.334 -13.833 1.190 1.00 12.11 C ATOM 1682 CZ TYR A 100 0.716 -13.721 2.415 1.00 22.23 C ATOM 1683 OH TYR A 100 0.295 -14.857 3.074 1.00 32.10 O ATOM 0 H TYR A 100 3.038 -8.120 -0.594 1.00 12.21 H new ATOM 0 HA TYR A 100 2.931 -9.114 2.033 1.00 12.12 H new ATOM 0 HB2 TYR A 100 1.218 -9.472 0.254 1.00 43.44 H new ATOM 0 HB3 TYR A 100 2.354 -10.439 -0.665 1.00 43.44 H new ATOM 0 HD1 TYR A 100 0.781 -10.380 2.778 1.00 23.14 H new ATOM 0 HD2 TYR A 100 2.242 -12.798 -0.429 1.00 35.11 H new ATOM 0 HE1 TYR A 100 0.036 -12.404 3.948 1.00 4.10 H new ATOM 0 HE2 TYR A 100 1.486 -14.806 0.747 1.00 12.11 H new ATOM 0 HH TYR A 100 0.509 -15.646 2.534 1.00 32.10 H new ATOM 1693 N ASN A 101 5.288 -10.530 0.182 1.00 61.32 N ATOM 1694 CA ASN A 101 6.510 -11.374 0.226 1.00 43.44 C ATOM 1695 C ASN A 101 7.586 -10.775 1.165 1.00 23.44 C ATOM 1696 O ASN A 101 8.358 -11.520 1.778 1.00 51.42 O ATOM 1697 CB ASN A 101 7.108 -11.594 -1.192 1.00 51.23 C ATOM 1698 CG ASN A 101 6.203 -12.400 -2.134 1.00 55.24 C ATOM 1699 OD1 ASN A 101 6.382 -12.221 -3.429 1.00 44.30 O flip ATOM 1700 ND2 ASN A 101 5.367 -13.192 -1.705 1.00 15.05 N flip ATOM 0 H ASN A 101 5.144 -10.064 -0.714 1.00 61.32 H new ATOM 0 HA ASN A 101 6.204 -12.341 0.625 1.00 43.44 H new ATOM 0 HB2 ASN A 101 7.312 -10.623 -1.644 1.00 51.23 H new ATOM 0 HB3 ASN A 101 8.064 -12.108 -1.096 1.00 51.23 H new ATOM 0 HD21 ASN A 101 5.248 -13.313 -0.699 1.00 15.05 H new ATOM 0 HD22 ASN A 101 4.793 -13.729 -2.355 1.00 15.05 H new ATOM 1707 N HIS A 102 7.632 -9.427 1.274 1.00 42.24 N ATOM 1708 CA HIS A 102 8.576 -8.734 2.192 1.00 4.41 C ATOM 1709 C HIS A 102 7.967 -8.564 3.625 1.00 33.24 C ATOM 1710 O HIS A 102 8.638 -8.078 4.542 1.00 21.34 O ATOM 1711 CB HIS A 102 8.995 -7.352 1.601 1.00 60.30 C ATOM 1712 CG HIS A 102 10.270 -6.801 2.202 1.00 23.14 C ATOM 1713 ND1 HIS A 102 10.326 -6.278 3.471 1.00 62.13 N ATOM 1714 CD2 HIS A 102 11.548 -6.789 1.745 1.00 21.00 C ATOM 1715 CE1 HIS A 102 11.564 -5.983 3.776 1.00 62.22 C ATOM 1716 NE2 HIS A 102 12.328 -6.275 2.748 1.00 32.02 N ATOM 0 H HIS A 102 7.031 -8.797 0.742 1.00 42.24 H new ATOM 0 HA HIS A 102 9.465 -9.357 2.287 1.00 4.41 H new ATOM 0 HB2 HIS A 102 9.124 -7.450 0.523 1.00 60.30 H new ATOM 0 HB3 HIS A 102 8.188 -6.637 1.762 1.00 60.30 H new ATOM 0 HD1 HIS A 102 9.523 -6.140 4.084 1.00 62.13 H new ATOM 0 HD2 HIS A 102 11.886 -7.122 0.775 1.00 21.00 H new ATOM 0 HE1 HIS A 102 11.901 -5.569 4.715 1.00 62.22 H new ATOM 1725 N GLY A 103 6.705 -8.986 3.815 1.00 32.12 N ATOM 1726 CA GLY A 103 6.013 -8.846 5.111 1.00 51.44 C ATOM 1727 C GLY A 103 5.286 -7.510 5.305 1.00 50.15 C ATOM 1728 O GLY A 103 4.740 -7.250 6.387 1.00 53.44 O ATOM 0 H GLY A 103 6.142 -9.427 3.088 1.00 32.12 H new ATOM 0 HA2 GLY A 103 5.290 -9.656 5.212 1.00 51.44 H new ATOM 0 HA3 GLY A 103 6.742 -8.968 5.912 1.00 51.44 H new ATOM 1732 N ILE A 104 5.277 -6.660 4.265 1.00 60.42 N ATOM 1733 CA ILE A 104 4.565 -5.368 4.290 1.00 73.00 C ATOM 1734 C ILE A 104 3.030 -5.611 4.183 1.00 24.12 C ATOM 1735 O ILE A 104 2.561 -6.211 3.212 1.00 61.10 O ATOM 1736 CB ILE A 104 5.015 -4.408 3.114 1.00 13.52 C ATOM 1737 CG1 ILE A 104 6.573 -4.374 2.927 1.00 53.23 C ATOM 1738 CG2 ILE A 104 4.447 -2.975 3.312 1.00 64.11 C ATOM 1739 CD1 ILE A 104 7.362 -3.833 4.101 1.00 50.11 C ATOM 0 H ILE A 104 5.760 -6.846 3.386 1.00 60.42 H new ATOM 0 HA ILE A 104 4.814 -4.883 5.234 1.00 73.00 H new ATOM 0 HB ILE A 104 4.596 -4.820 2.196 1.00 13.52 H new ATOM 0 HG12 ILE A 104 6.918 -5.386 2.716 1.00 53.23 H new ATOM 0 HG13 ILE A 104 6.802 -3.770 2.049 1.00 53.23 H new ATOM 0 HG21 ILE A 104 4.772 -2.338 2.490 1.00 64.11 H new ATOM 0 HG22 ILE A 104 3.358 -3.015 3.331 1.00 64.11 H new ATOM 0 HG23 ILE A 104 4.812 -2.566 4.254 1.00 64.11 H new ATOM 0 HD11 ILE A 104 8.426 -3.854 3.865 1.00 50.11 H new ATOM 0 HD12 ILE A 104 7.056 -2.807 4.303 1.00 50.11 H new ATOM 0 HD13 ILE A 104 7.173 -4.448 4.981 1.00 50.11 H new ATOM 1751 N GLY A 105 2.288 -5.155 5.198 1.00 40.23 N ATOM 1752 CA GLY A 105 0.823 -5.205 5.226 1.00 44.15 C ATOM 1753 C GLY A 105 0.210 -6.549 5.619 1.00 0.25 C ATOM 1754 O GLY A 105 -0.954 -6.802 5.302 1.00 4.33 O ATOM 0 H GLY A 105 2.694 -4.735 6.034 1.00 40.23 H new ATOM 0 HA2 GLY A 105 0.466 -4.447 5.923 1.00 44.15 H new ATOM 0 HA3 GLY A 105 0.450 -4.932 4.239 1.00 44.15 H new ATOM 1758 N THR A 106 0.964 -7.400 6.337 1.00 70.41 N ATOM 1759 CA THR A 106 0.476 -8.741 6.757 1.00 32.44 C ATOM 1760 C THR A 106 -0.542 -8.675 7.922 1.00 60.40 C ATOM 1761 O THR A 106 -1.392 -9.561 8.052 1.00 64.03 O ATOM 1762 CB THR A 106 1.653 -9.688 7.130 1.00 13.55 C ATOM 1763 OG1 THR A 106 2.484 -9.070 8.127 1.00 62.55 O ATOM 1764 CG2 THR A 106 2.501 -10.048 5.896 1.00 34.43 C ATOM 0 H THR A 106 1.914 -7.190 6.642 1.00 70.41 H new ATOM 0 HA THR A 106 -0.045 -9.150 5.891 1.00 32.44 H new ATOM 0 HB THR A 106 1.227 -10.609 7.528 1.00 13.55 H new ATOM 0 HG1 THR A 106 2.139 -8.176 8.332 1.00 62.55 H new ATOM 0 HG21 THR A 106 3.314 -10.711 6.194 1.00 34.43 H new ATOM 0 HG22 THR A 106 1.875 -10.550 5.158 1.00 34.43 H new ATOM 0 HG23 THR A 106 2.915 -9.138 5.461 1.00 34.43 H new ATOM 1772 N LEU A 107 -0.438 -7.632 8.775 1.00 22.10 N ATOM 1773 CA LEU A 107 -1.486 -7.309 9.781 1.00 74.05 C ATOM 1774 C LEU A 107 -2.387 -6.141 9.297 1.00 23.15 C ATOM 1775 O LEU A 107 -3.102 -5.530 10.097 1.00 42.32 O ATOM 1776 CB LEU A 107 -0.880 -6.983 11.175 1.00 50.00 C ATOM 1777 CG LEU A 107 -0.157 -8.147 11.926 1.00 42.20 C ATOM 1778 CD1 LEU A 107 0.377 -7.668 13.294 1.00 64.05 C ATOM 1779 CD2 LEU A 107 -1.087 -9.366 12.093 1.00 34.24 C ATOM 0 H LEU A 107 0.360 -6.997 8.790 1.00 22.10 H new ATOM 0 HA LEU A 107 -2.102 -8.202 9.890 1.00 74.05 H new ATOM 0 HB2 LEU A 107 -0.169 -6.166 11.052 1.00 50.00 H new ATOM 0 HB3 LEU A 107 -1.682 -6.614 11.815 1.00 50.00 H new ATOM 0 HG LEU A 107 0.693 -8.460 11.320 1.00 42.20 H new ATOM 0 HD11 LEU A 107 0.877 -8.495 13.799 1.00 64.05 H new ATOM 0 HD12 LEU A 107 1.086 -6.854 13.143 1.00 64.05 H new ATOM 0 HD13 LEU A 107 -0.454 -7.317 13.906 1.00 64.05 H new ATOM 0 HD21 LEU A 107 -0.556 -10.159 12.619 1.00 34.24 H new ATOM 0 HD22 LEU A 107 -1.967 -9.076 12.667 1.00 34.24 H new ATOM 0 HD23 LEU A 107 -1.396 -9.725 11.111 1.00 34.24 H new ATOM 1791 N SER A 108 -2.380 -5.860 7.980 1.00 72.14 N ATOM 1792 CA SER A 108 -3.220 -4.800 7.380 1.00 13.40 C ATOM 1793 C SER A 108 -4.254 -5.389 6.393 1.00 43.34 C ATOM 1794 O SER A 108 -3.905 -5.759 5.271 1.00 72.14 O ATOM 1795 CB SER A 108 -2.328 -3.773 6.659 1.00 53.31 C ATOM 1796 OG SER A 108 -1.383 -3.191 7.547 1.00 60.35 O ATOM 0 H SER A 108 -1.798 -6.356 7.305 1.00 72.14 H new ATOM 0 HA SER A 108 -3.768 -4.307 8.183 1.00 13.40 H new ATOM 0 HB2 SER A 108 -1.804 -4.259 5.836 1.00 53.31 H new ATOM 0 HB3 SER A 108 -2.950 -2.991 6.224 1.00 53.31 H new ATOM 0 HG SER A 108 -1.297 -2.234 7.352 1.00 60.35 H new ATOM 1802 N SER A 109 -5.526 -5.467 6.838 1.00 14.33 N ATOM 1803 CA SER A 109 -6.690 -5.865 5.984 1.00 74.23 C ATOM 1804 C SER A 109 -6.818 -5.054 4.652 1.00 44.41 C ATOM 1805 O SER A 109 -6.922 -5.684 3.586 1.00 14.31 O ATOM 1806 CB SER A 109 -8.004 -5.753 6.796 1.00 64.00 C ATOM 1807 OG SER A 109 -9.163 -5.958 5.998 1.00 4.11 O ATOM 0 H SER A 109 -5.787 -5.257 7.802 1.00 14.33 H new ATOM 0 HA SER A 109 -6.505 -6.898 5.690 1.00 74.23 H new ATOM 0 HB2 SER A 109 -7.990 -6.485 7.604 1.00 64.00 H new ATOM 0 HB3 SER A 109 -8.057 -4.768 7.259 1.00 64.00 H new ATOM 0 HG SER A 109 -9.951 -6.021 6.577 1.00 4.11 H new ATOM 1813 N PRO A 110 -6.773 -3.659 4.660 1.00 15.20 N ATOM 1814 CA PRO A 110 -6.975 -2.840 3.418 1.00 45.12 C ATOM 1815 C PRO A 110 -5.966 -3.153 2.274 1.00 23.44 C ATOM 1816 O PRO A 110 -6.223 -2.814 1.114 1.00 50.43 O ATOM 1817 CB PRO A 110 -6.823 -1.381 3.928 1.00 52.24 C ATOM 1818 CG PRO A 110 -6.040 -1.495 5.199 1.00 51.35 C ATOM 1819 CD PRO A 110 -6.529 -2.766 5.839 1.00 62.41 C ATOM 0 HA PRO A 110 -7.940 -3.051 2.957 1.00 45.12 H new ATOM 0 HB2 PRO A 110 -6.303 -0.760 3.198 1.00 52.24 H new ATOM 0 HB3 PRO A 110 -7.795 -0.921 4.103 1.00 52.24 H new ATOM 0 HG2 PRO A 110 -4.969 -1.538 5.001 1.00 51.35 H new ATOM 0 HG3 PRO A 110 -6.210 -0.635 5.847 1.00 51.35 H new ATOM 0 HD2 PRO A 110 -5.789 -3.187 6.519 1.00 62.41 H new ATOM 0 HD3 PRO A 110 -7.438 -2.603 6.418 1.00 62.41 H new ATOM 1827 N LEU A 111 -4.827 -3.802 2.611 1.00 14.45 N ATOM 1828 CA LEU A 111 -3.847 -4.279 1.610 1.00 23.43 C ATOM 1829 C LEU A 111 -4.460 -5.404 0.740 1.00 11.32 C ATOM 1830 O LEU A 111 -4.514 -5.305 -0.494 1.00 54.42 O ATOM 1831 CB LEU A 111 -2.561 -4.817 2.298 1.00 55.24 C ATOM 1832 CG LEU A 111 -1.373 -5.115 1.320 1.00 0.44 C ATOM 1833 CD1 LEU A 111 -0.627 -3.819 0.940 1.00 23.43 C ATOM 1834 CD2 LEU A 111 -0.413 -6.194 1.865 1.00 64.33 C ATOM 0 H LEU A 111 -4.564 -4.008 3.575 1.00 14.45 H new ATOM 0 HA LEU A 111 -3.586 -3.429 0.979 1.00 23.43 H new ATOM 0 HB2 LEU A 111 -2.230 -4.090 3.039 1.00 55.24 H new ATOM 0 HB3 LEU A 111 -2.809 -5.731 2.837 1.00 55.24 H new ATOM 0 HG LEU A 111 -1.806 -5.528 0.409 1.00 0.44 H new ATOM 0 HD11 LEU A 111 0.192 -4.056 0.261 1.00 23.43 H new ATOM 0 HD12 LEU A 111 -1.317 -3.132 0.450 1.00 23.43 H new ATOM 0 HD13 LEU A 111 -0.228 -3.352 1.840 1.00 23.43 H new ATOM 0 HD21 LEU A 111 0.391 -6.361 1.148 1.00 64.33 H new ATOM 0 HD22 LEU A 111 0.009 -5.860 2.813 1.00 64.33 H new ATOM 0 HD23 LEU A 111 -0.961 -7.124 2.019 1.00 64.33 H new ATOM 1846 N TYR A 112 -4.937 -6.460 1.427 1.00 61.33 N ATOM 1847 CA TYR A 112 -5.545 -7.649 0.792 1.00 2.54 C ATOM 1848 C TYR A 112 -6.857 -7.286 0.057 1.00 61.05 C ATOM 1849 O TYR A 112 -7.151 -7.839 -1.001 1.00 71.35 O ATOM 1850 CB TYR A 112 -5.832 -8.738 1.860 1.00 52.23 C ATOM 1851 CG TYR A 112 -4.598 -9.226 2.647 1.00 23.41 C ATOM 1852 CD1 TYR A 112 -4.165 -8.568 3.799 1.00 42.20 C ATOM 1853 CD2 TYR A 112 -3.887 -10.363 2.251 1.00 41.02 C ATOM 1854 CE1 TYR A 112 -3.076 -9.021 4.518 1.00 53.15 C ATOM 1855 CE2 TYR A 112 -2.806 -10.825 2.974 1.00 72.42 C ATOM 1856 CZ TYR A 112 -2.403 -10.151 4.107 1.00 31.00 C ATOM 1857 OH TYR A 112 -1.342 -10.622 4.844 1.00 63.23 O ATOM 0 H TYR A 112 -4.912 -6.514 2.445 1.00 61.33 H new ATOM 0 HA TYR A 112 -4.836 -8.034 0.059 1.00 2.54 H new ATOM 0 HB2 TYR A 112 -6.563 -8.347 2.568 1.00 52.23 H new ATOM 0 HB3 TYR A 112 -6.292 -9.595 1.368 1.00 52.23 H new ATOM 0 HD1 TYR A 112 -4.692 -7.687 4.135 1.00 42.20 H new ATOM 0 HD2 TYR A 112 -4.191 -10.892 1.359 1.00 41.02 H new ATOM 0 HE1 TYR A 112 -2.752 -8.490 5.401 1.00 53.15 H new ATOM 0 HE2 TYR A 112 -2.278 -11.711 2.653 1.00 72.42 H new ATOM 0 HH TYR A 112 -0.558 -10.719 4.264 1.00 63.23 H new ATOM 1867 N ILE A 113 -7.636 -6.358 0.654 1.00 70.44 N ATOM 1868 CA ILE A 113 -8.894 -5.834 0.066 1.00 11.04 C ATOM 1869 C ILE A 113 -8.639 -5.097 -1.281 1.00 31.13 C ATOM 1870 O ILE A 113 -9.328 -5.353 -2.277 1.00 23.33 O ATOM 1871 CB ILE A 113 -9.624 -4.865 1.082 1.00 1.42 C ATOM 1872 CG1 ILE A 113 -9.977 -5.609 2.414 1.00 3.54 C ATOM 1873 CG2 ILE A 113 -10.892 -4.213 0.468 1.00 4.52 C ATOM 1874 CD1 ILE A 113 -10.990 -6.739 2.280 1.00 3.04 C ATOM 0 H ILE A 113 -7.412 -5.948 1.561 1.00 70.44 H new ATOM 0 HA ILE A 113 -9.537 -6.691 -0.136 1.00 11.04 H new ATOM 0 HB ILE A 113 -8.924 -4.061 1.307 1.00 1.42 H new ATOM 0 HG12 ILE A 113 -9.059 -6.015 2.838 1.00 3.54 H new ATOM 0 HG13 ILE A 113 -10.363 -4.880 3.127 1.00 3.54 H new ATOM 0 HG21 ILE A 113 -11.357 -3.557 1.204 1.00 4.52 H new ATOM 0 HG22 ILE A 113 -10.613 -3.632 -0.411 1.00 4.52 H new ATOM 0 HG23 ILE A 113 -11.598 -4.992 0.179 1.00 4.52 H new ATOM 0 HD11 ILE A 113 -11.165 -7.189 3.257 1.00 3.04 H new ATOM 0 HD12 ILE A 113 -11.927 -6.343 1.890 1.00 3.04 H new ATOM 0 HD13 ILE A 113 -10.603 -7.495 1.597 1.00 3.04 H new ATOM 1886 N ALA A 114 -7.632 -4.196 -1.296 1.00 71.44 N ATOM 1887 CA ALA A 114 -7.270 -3.403 -2.500 1.00 41.24 C ATOM 1888 C ALA A 114 -6.675 -4.286 -3.629 1.00 62.11 C ATOM 1889 O ALA A 114 -6.899 -4.027 -4.819 1.00 42.23 O ATOM 1890 CB ALA A 114 -6.297 -2.275 -2.118 1.00 54.11 C ATOM 0 H ALA A 114 -7.049 -3.996 -0.483 1.00 71.44 H new ATOM 0 HA ALA A 114 -8.187 -2.965 -2.893 1.00 41.24 H new ATOM 0 HB1 ALA A 114 -6.039 -1.701 -3.008 1.00 54.11 H new ATOM 0 HB2 ALA A 114 -6.770 -1.619 -1.387 1.00 54.11 H new ATOM 0 HB3 ALA A 114 -5.392 -2.705 -1.688 1.00 54.11 H new ATOM 1896 N TRP A 115 -5.922 -5.327 -3.239 1.00 10.33 N ATOM 1897 CA TRP A 115 -5.350 -6.306 -4.185 1.00 52.14 C ATOM 1898 C TRP A 115 -6.473 -7.167 -4.830 1.00 21.15 C ATOM 1899 O TRP A 115 -6.597 -7.224 -6.059 1.00 32.33 O ATOM 1900 CB TRP A 115 -4.315 -7.205 -3.448 1.00 1.35 C ATOM 1901 CG TRP A 115 -3.431 -8.062 -4.343 1.00 33.30 C ATOM 1902 CD1 TRP A 115 -3.350 -8.045 -5.713 1.00 2.51 C ATOM 1903 CD2 TRP A 115 -2.454 -9.023 -3.907 1.00 42.00 C ATOM 1904 NE1 TRP A 115 -2.435 -8.968 -6.143 1.00 3.35 N ATOM 1905 CE2 TRP A 115 -1.864 -9.569 -5.059 1.00 51.25 C ATOM 1906 CE3 TRP A 115 -2.029 -9.480 -2.652 1.00 2.30 C ATOM 1907 CZ2 TRP A 115 -0.880 -10.546 -4.998 1.00 33.42 C ATOM 1908 CZ3 TRP A 115 -1.047 -10.450 -2.591 1.00 42.34 C ATOM 1909 CH2 TRP A 115 -0.485 -10.974 -3.758 1.00 63.43 C ATOM 0 H TRP A 115 -5.692 -5.516 -2.263 1.00 10.33 H new ATOM 0 HA TRP A 115 -4.841 -5.770 -4.986 1.00 52.14 H new ATOM 0 HB2 TRP A 115 -3.674 -6.566 -2.840 1.00 1.35 H new ATOM 0 HB3 TRP A 115 -4.853 -7.861 -2.764 1.00 1.35 H new ATOM 0 HD1 TRP A 115 -3.925 -7.397 -6.358 1.00 2.51 H new ATOM 0 HE1 TRP A 115 -2.215 -9.174 -7.118 1.00 3.35 H new ATOM 0 HE3 TRP A 115 -2.462 -9.080 -1.747 1.00 2.30 H new ATOM 0 HZ2 TRP A 115 -0.441 -10.954 -5.896 1.00 33.42 H new ATOM 0 HZ3 TRP A 115 -0.710 -10.808 -1.629 1.00 42.34 H new ATOM 0 HH2 TRP A 115 0.278 -11.734 -3.681 1.00 63.43 H new ATOM 1920 N ALA A 116 -7.291 -7.803 -3.972 1.00 70.22 N ATOM 1921 CA ALA A 116 -8.391 -8.706 -4.387 1.00 12.12 C ATOM 1922 C ALA A 116 -9.461 -7.998 -5.256 1.00 23.13 C ATOM 1923 O ALA A 116 -9.960 -8.576 -6.236 1.00 22.21 O ATOM 1924 CB ALA A 116 -9.044 -9.323 -3.148 1.00 71.32 C ATOM 0 H ALA A 116 -7.210 -7.707 -2.960 1.00 70.22 H new ATOM 0 HA ALA A 116 -7.950 -9.485 -5.009 1.00 12.12 H new ATOM 0 HB1 ALA A 116 -9.852 -9.987 -3.455 1.00 71.32 H new ATOM 0 HB2 ALA A 116 -8.300 -9.891 -2.590 1.00 71.32 H new ATOM 0 HB3 ALA A 116 -9.445 -8.531 -2.516 1.00 71.32 H new ATOM 1930 N GLY A 117 -9.794 -6.747 -4.873 1.00 24.42 N ATOM 1931 CA GLY A 117 -10.724 -5.892 -5.633 1.00 23.10 C ATOM 1932 C GLY A 117 -10.280 -5.665 -7.080 1.00 61.24 C ATOM 1933 O GLY A 117 -11.098 -5.657 -8.002 1.00 51.42 O ATOM 0 H GLY A 117 -9.426 -6.305 -4.031 1.00 24.42 H new ATOM 0 HA2 GLY A 117 -11.714 -6.349 -5.630 1.00 23.10 H new ATOM 0 HA3 GLY A 117 -10.816 -4.929 -5.131 1.00 23.10 H new ATOM 1937 N HIS A 118 -8.964 -5.499 -7.263 1.00 22.11 N ATOM 1938 CA HIS A 118 -8.345 -5.357 -8.588 1.00 3.21 C ATOM 1939 C HIS A 118 -8.357 -6.696 -9.375 1.00 2.21 C ATOM 1940 O HIS A 118 -8.718 -6.720 -10.555 1.00 30.33 O ATOM 1941 CB HIS A 118 -6.897 -4.830 -8.424 1.00 51.05 C ATOM 1942 CG HIS A 118 -6.103 -4.778 -9.703 1.00 53.41 C ATOM 1943 ND1 HIS A 118 -6.224 -3.769 -10.628 1.00 45.13 N ATOM 1944 CD2 HIS A 118 -5.184 -5.626 -10.207 1.00 63.23 C ATOM 1945 CE1 HIS A 118 -5.419 -3.997 -11.637 1.00 50.55 C ATOM 1946 NE2 HIS A 118 -4.778 -5.120 -11.411 1.00 11.13 N ATOM 0 H HIS A 118 -8.296 -5.459 -6.494 1.00 22.11 H new ATOM 0 HA HIS A 118 -8.929 -4.642 -9.167 1.00 3.21 H new ATOM 0 HB2 HIS A 118 -6.935 -3.829 -7.993 1.00 51.05 H new ATOM 0 HB3 HIS A 118 -6.371 -5.465 -7.710 1.00 51.05 H new ATOM 0 HD2 HIS A 118 -4.833 -6.537 -9.745 1.00 63.23 H new ATOM 0 HE1 HIS A 118 -5.303 -3.368 -12.507 1.00 50.55 H new ATOM 0 HE2 HIS A 118 -4.090 -5.546 -12.032 1.00 11.13 H new ATOM 1955 N LEU A 119 -7.950 -7.798 -8.704 1.00 31.15 N ATOM 1956 CA LEU A 119 -7.789 -9.131 -9.341 1.00 35.41 C ATOM 1957 C LEU A 119 -9.120 -9.672 -9.928 1.00 12.55 C ATOM 1958 O LEU A 119 -9.133 -10.234 -11.024 1.00 52.34 O ATOM 1959 CB LEU A 119 -7.209 -10.137 -8.319 1.00 51.23 C ATOM 1960 CG LEU A 119 -5.749 -9.885 -7.834 1.00 2.51 C ATOM 1961 CD1 LEU A 119 -5.358 -10.866 -6.704 1.00 75.45 C ATOM 1962 CD2 LEU A 119 -4.744 -9.962 -9.007 1.00 75.22 C ATOM 0 H LEU A 119 -7.724 -7.791 -7.709 1.00 31.15 H new ATOM 0 HA LEU A 119 -7.097 -9.012 -10.174 1.00 35.41 H new ATOM 0 HB2 LEU A 119 -7.860 -10.147 -7.445 1.00 51.23 H new ATOM 0 HB3 LEU A 119 -7.253 -11.133 -8.760 1.00 51.23 H new ATOM 0 HG LEU A 119 -5.708 -8.874 -7.429 1.00 2.51 H new ATOM 0 HD11 LEU A 119 -4.335 -10.666 -6.386 1.00 75.45 H new ATOM 0 HD12 LEU A 119 -6.033 -10.734 -5.858 1.00 75.45 H new ATOM 0 HD13 LEU A 119 -5.431 -11.890 -7.070 1.00 75.45 H new ATOM 0 HD21 LEU A 119 -3.736 -9.782 -8.635 1.00 75.22 H new ATOM 0 HD22 LEU A 119 -4.791 -10.951 -9.462 1.00 75.22 H new ATOM 0 HD23 LEU A 119 -4.996 -9.207 -9.752 1.00 75.22 H new ATOM 1974 N GLU A 120 -10.225 -9.489 -9.185 1.00 45.14 N ATOM 1975 CA GLU A 120 -11.595 -9.818 -9.657 1.00 41.34 C ATOM 1976 C GLU A 120 -11.909 -9.180 -11.039 1.00 31.21 C ATOM 1977 O GLU A 120 -12.400 -9.857 -11.952 1.00 1.10 O ATOM 1978 CB GLU A 120 -12.621 -9.334 -8.610 1.00 52.33 C ATOM 1979 CG GLU A 120 -14.092 -9.511 -9.022 1.00 10.45 C ATOM 1980 CD GLU A 120 -15.073 -9.058 -7.941 1.00 20.14 C ATOM 1981 OE1 GLU A 120 -15.379 -9.849 -7.038 1.00 21.32 O ATOM 1982 OE2 GLU A 120 -15.509 -7.890 -7.970 1.00 23.03 O ATOM 0 H GLU A 120 -10.201 -9.109 -8.239 1.00 45.14 H new ATOM 0 HA GLU A 120 -11.658 -10.899 -9.779 1.00 41.34 H new ATOM 0 HB2 GLU A 120 -12.451 -9.874 -7.678 1.00 52.33 H new ATOM 0 HB3 GLU A 120 -12.440 -8.279 -8.404 1.00 52.33 H new ATOM 0 HG2 GLU A 120 -14.279 -8.945 -9.935 1.00 10.45 H new ATOM 0 HG3 GLU A 120 -14.275 -10.560 -9.254 1.00 10.45 H new ATOM 1989 N ALA A 121 -11.589 -7.877 -11.170 1.00 15.15 N ATOM 1990 CA ALA A 121 -11.762 -7.114 -12.428 1.00 33.32 C ATOM 1991 C ALA A 121 -10.894 -7.685 -13.580 1.00 1.53 C ATOM 1992 O ALA A 121 -11.289 -7.628 -14.752 1.00 11.14 O ATOM 1993 CB ALA A 121 -11.435 -5.631 -12.190 1.00 50.11 C ATOM 0 H ALA A 121 -11.203 -7.321 -10.407 1.00 15.15 H new ATOM 0 HA ALA A 121 -12.804 -7.210 -12.734 1.00 33.32 H new ATOM 0 HB1 ALA A 121 -11.564 -5.076 -13.119 1.00 50.11 H new ATOM 0 HB2 ALA A 121 -12.105 -5.228 -11.431 1.00 50.11 H new ATOM 0 HB3 ALA A 121 -10.403 -5.536 -11.851 1.00 50.11 H new ATOM 1999 N GLN A 122 -9.710 -8.237 -13.232 1.00 51.40 N ATOM 2000 CA GLN A 122 -8.804 -8.903 -14.207 1.00 52.01 C ATOM 2001 C GLN A 122 -9.381 -10.275 -14.651 1.00 30.11 C ATOM 2002 O GLN A 122 -9.204 -10.700 -15.799 1.00 13.24 O ATOM 2003 CB GLN A 122 -7.391 -9.112 -13.584 1.00 53.32 C ATOM 2004 CG GLN A 122 -6.778 -7.877 -12.893 1.00 52.43 C ATOM 2005 CD GLN A 122 -6.616 -6.653 -13.800 1.00 11.43 C ATOM 2006 OE1 GLN A 122 -5.596 -6.483 -14.455 1.00 42.23 O ATOM 2007 NE2 GLN A 122 -7.598 -5.771 -13.803 1.00 74.22 N ATOM 0 H GLN A 122 -9.354 -8.236 -12.276 1.00 51.40 H new ATOM 0 HA GLN A 122 -8.721 -8.256 -15.080 1.00 52.01 H new ATOM 0 HB2 GLN A 122 -7.451 -9.921 -12.856 1.00 53.32 H new ATOM 0 HB3 GLN A 122 -6.712 -9.440 -14.371 1.00 53.32 H new ATOM 0 HG2 GLN A 122 -7.405 -7.603 -12.044 1.00 52.43 H new ATOM 0 HG3 GLN A 122 -5.801 -8.148 -12.493 1.00 52.43 H new ATOM 0 HE21 GLN A 122 -8.437 -5.939 -13.247 1.00 74.22 H new ATOM 0 HE22 GLN A 122 -7.518 -4.921 -14.361 1.00 74.22 H new ATOM 2016 N GLY A 123 -10.079 -10.951 -13.717 1.00 61.01 N ATOM 2017 CA GLY A 123 -10.594 -12.317 -13.926 1.00 20.52 C ATOM 2018 C GLY A 123 -9.998 -13.314 -12.935 1.00 71.45 C ATOM 2019 O GLY A 123 -10.390 -14.483 -12.904 1.00 33.44 O ATOM 0 H GLY A 123 -10.301 -10.566 -12.799 1.00 61.01 H new ATOM 0 HA2 GLY A 123 -11.680 -12.314 -13.827 1.00 20.52 H new ATOM 0 HA3 GLY A 123 -10.367 -12.638 -14.943 1.00 20.52 H new ATOM 2023 N GLU A 124 -9.062 -12.823 -12.104 1.00 4.51 N ATOM 2024 CA GLU A 124 -8.322 -13.626 -11.110 1.00 3.42 C ATOM 2025 C GLU A 124 -9.117 -13.767 -9.780 1.00 12.32 C ATOM 2026 O GLU A 124 -8.602 -13.468 -8.701 1.00 75.22 O ATOM 2027 CB GLU A 124 -6.924 -12.978 -10.861 1.00 14.30 C ATOM 2028 CG GLU A 124 -6.125 -12.633 -12.136 1.00 33.11 C ATOM 2029 CD GLU A 124 -5.787 -13.856 -13.006 1.00 31.41 C ATOM 2030 OE1 GLU A 124 -4.746 -14.501 -12.761 1.00 41.32 O ATOM 2031 OE2 GLU A 124 -6.561 -14.180 -13.934 1.00 41.51 O ATOM 0 H GLU A 124 -8.792 -11.839 -12.103 1.00 4.51 H new ATOM 0 HA GLU A 124 -8.187 -14.633 -11.506 1.00 3.42 H new ATOM 0 HB2 GLU A 124 -7.062 -12.066 -10.280 1.00 14.30 H new ATOM 0 HB3 GLU A 124 -6.329 -13.658 -10.251 1.00 14.30 H new ATOM 0 HG2 GLU A 124 -6.698 -11.922 -12.732 1.00 33.11 H new ATOM 0 HG3 GLU A 124 -5.199 -12.135 -11.850 1.00 33.11 H new ATOM 2038 N LEU A 125 -10.374 -14.244 -9.884 1.00 3.12 N ATOM 2039 CA LEU A 125 -11.266 -14.500 -8.724 1.00 11.25 C ATOM 2040 C LEU A 125 -10.678 -15.543 -7.736 1.00 72.40 C ATOM 2041 O LEU A 125 -10.740 -15.347 -6.523 1.00 34.33 O ATOM 2042 CB LEU A 125 -12.668 -14.946 -9.241 1.00 10.44 C ATOM 2043 CG LEU A 125 -13.577 -13.799 -9.815 1.00 24.04 C ATOM 2044 CD1 LEU A 125 -14.584 -14.319 -10.860 1.00 41.10 C ATOM 2045 CD2 LEU A 125 -14.316 -13.064 -8.676 1.00 71.20 C ATOM 0 H LEU A 125 -10.806 -14.466 -10.781 1.00 3.12 H new ATOM 0 HA LEU A 125 -11.361 -13.571 -8.161 1.00 11.25 H new ATOM 0 HB2 LEU A 125 -12.527 -15.697 -10.019 1.00 10.44 H new ATOM 0 HB3 LEU A 125 -13.200 -15.431 -8.422 1.00 10.44 H new ATOM 0 HG LEU A 125 -12.917 -13.095 -10.322 1.00 24.04 H new ATOM 0 HD11 LEU A 125 -15.189 -13.490 -11.227 1.00 41.10 H new ATOM 0 HD12 LEU A 125 -14.044 -14.770 -11.692 1.00 41.10 H new ATOM 0 HD13 LEU A 125 -15.232 -15.065 -10.401 1.00 41.10 H new ATOM 0 HD21 LEU A 125 -14.939 -12.275 -9.096 1.00 71.20 H new ATOM 0 HD22 LEU A 125 -14.943 -13.771 -8.134 1.00 71.20 H new ATOM 0 HD23 LEU A 125 -13.588 -12.627 -7.993 1.00 71.20 H new ATOM 2057 N GLN A 126 -10.092 -16.633 -8.270 1.00 33.14 N ATOM 2058 CA GLN A 126 -9.488 -17.715 -7.446 1.00 3.55 C ATOM 2059 C GLN A 126 -8.256 -17.217 -6.648 1.00 24.34 C ATOM 2060 O GLN A 126 -8.057 -17.617 -5.503 1.00 42.35 O ATOM 2061 CB GLN A 126 -9.094 -18.940 -8.330 1.00 12.11 C ATOM 2062 CG GLN A 126 -10.270 -19.803 -8.852 1.00 0.23 C ATOM 2063 CD GLN A 126 -11.239 -19.066 -9.782 1.00 74.44 C ATOM 2064 OE1 GLN A 126 -11.056 -19.040 -10.991 1.00 65.14 O ATOM 2065 NE2 GLN A 126 -12.266 -18.455 -9.223 1.00 65.01 N ATOM 0 H GLN A 126 -10.021 -16.794 -9.275 1.00 33.14 H new ATOM 0 HA GLN A 126 -10.248 -18.027 -6.729 1.00 3.55 H new ATOM 0 HB2 GLN A 126 -8.526 -18.578 -9.187 1.00 12.11 H new ATOM 0 HB3 GLN A 126 -8.427 -19.580 -7.753 1.00 12.11 H new ATOM 0 HG2 GLN A 126 -9.864 -20.665 -9.381 1.00 0.23 H new ATOM 0 HG3 GLN A 126 -10.828 -20.187 -7.998 1.00 0.23 H new ATOM 0 HE21 GLN A 126 -12.394 -18.494 -8.212 1.00 65.01 H new ATOM 0 HE22 GLN A 126 -12.932 -17.944 -9.802 1.00 65.01 H new ATOM 2074 N HIS A 127 -7.436 -16.347 -7.269 1.00 33.23 N ATOM 2075 CA HIS A 127 -6.249 -15.757 -6.614 1.00 72.41 C ATOM 2076 C HIS A 127 -6.661 -14.682 -5.580 1.00 42.04 C ATOM 2077 O HIS A 127 -6.111 -14.628 -4.489 1.00 20.13 O ATOM 2078 CB HIS A 127 -5.277 -15.159 -7.671 1.00 20.02 C ATOM 2079 CG HIS A 127 -4.015 -14.548 -7.092 1.00 32.31 C ATOM 2080 ND1 HIS A 127 -3.365 -13.474 -7.658 1.00 5.31 N ATOM 2081 CD2 HIS A 127 -3.286 -14.876 -5.993 1.00 75.15 C ATOM 2082 CE1 HIS A 127 -2.306 -13.177 -6.939 1.00 24.25 C ATOM 2083 NE2 HIS A 127 -2.234 -14.008 -5.925 1.00 23.13 N ATOM 0 H HIS A 127 -7.574 -16.035 -8.230 1.00 33.23 H new ATOM 0 HA HIS A 127 -5.729 -16.553 -6.082 1.00 72.41 H new ATOM 0 HB2 HIS A 127 -4.996 -15.944 -8.373 1.00 20.02 H new ATOM 0 HB3 HIS A 127 -5.806 -14.396 -8.242 1.00 20.02 H new ATOM 0 HD2 HIS A 127 -3.500 -15.677 -5.300 1.00 75.15 H new ATOM 0 HE1 HIS A 127 -1.609 -12.379 -7.148 1.00 24.25 H new ATOM 0 HE2 HIS A 127 -1.511 -14.006 -5.205 1.00 23.13 H new ATOM 2092 N ALA A 128 -7.622 -13.835 -5.953 1.00 11.20 N ATOM 2093 CA ALA A 128 -8.127 -12.735 -5.103 1.00 13.01 C ATOM 2094 C ALA A 128 -8.761 -13.236 -3.785 1.00 73.53 C ATOM 2095 O ALA A 128 -8.491 -12.695 -2.709 1.00 41.40 O ATOM 2096 CB ALA A 128 -9.133 -11.932 -5.908 1.00 62.32 C ATOM 0 H ALA A 128 -8.082 -13.887 -6.862 1.00 11.20 H new ATOM 0 HA ALA A 128 -7.282 -12.112 -4.811 1.00 13.01 H new ATOM 0 HB1 ALA A 128 -9.518 -11.115 -5.298 1.00 62.32 H new ATOM 0 HB2 ALA A 128 -8.648 -11.525 -6.795 1.00 62.32 H new ATOM 0 HB3 ALA A 128 -9.957 -12.579 -6.210 1.00 62.32 H new ATOM 2102 N SER A 129 -9.605 -14.269 -3.897 1.00 45.43 N ATOM 2103 CA SER A 129 -10.174 -14.983 -2.734 1.00 11.25 C ATOM 2104 C SER A 129 -9.059 -15.673 -1.913 1.00 31.30 C ATOM 2105 O SER A 129 -9.073 -15.646 -0.674 1.00 21.54 O ATOM 2106 CB SER A 129 -11.202 -16.024 -3.217 1.00 24.22 C ATOM 2107 OG SER A 129 -10.604 -16.986 -4.078 1.00 24.12 O ATOM 0 H SER A 129 -9.917 -14.638 -4.795 1.00 45.43 H new ATOM 0 HA SER A 129 -10.671 -14.259 -2.088 1.00 11.25 H new ATOM 0 HB2 SER A 129 -11.643 -16.528 -2.357 1.00 24.22 H new ATOM 0 HB3 SER A 129 -12.014 -15.519 -3.741 1.00 24.22 H new ATOM 0 HG SER A 129 -10.552 -16.624 -4.987 1.00 24.12 H new ATOM 2113 N ALA A 130 -8.077 -16.264 -2.634 1.00 34.55 N ATOM 2114 CA ALA A 130 -6.872 -16.875 -2.030 1.00 63.30 C ATOM 2115 C ALA A 130 -5.987 -15.830 -1.305 1.00 33.51 C ATOM 2116 O ALA A 130 -5.197 -16.197 -0.456 1.00 15.31 O ATOM 2117 CB ALA A 130 -6.051 -17.636 -3.087 1.00 73.24 C ATOM 0 H ALA A 130 -8.099 -16.330 -3.652 1.00 34.55 H new ATOM 0 HA ALA A 130 -7.219 -17.585 -1.280 1.00 63.30 H new ATOM 0 HB1 ALA A 130 -5.171 -18.075 -2.617 1.00 73.24 H new ATOM 0 HB2 ALA A 130 -6.662 -18.426 -3.523 1.00 73.24 H new ATOM 0 HB3 ALA A 130 -5.738 -16.946 -3.870 1.00 73.24 H new ATOM 2123 N VAL A 131 -6.127 -14.537 -1.662 1.00 1.43 N ATOM 2124 CA VAL A 131 -5.448 -13.415 -0.969 1.00 21.42 C ATOM 2125 C VAL A 131 -6.227 -12.997 0.312 1.00 53.44 C ATOM 2126 O VAL A 131 -5.626 -12.785 1.370 1.00 22.21 O ATOM 2127 CB VAL A 131 -5.268 -12.182 -1.950 1.00 34.34 C ATOM 2128 CG1 VAL A 131 -4.867 -10.885 -1.211 1.00 23.12 C ATOM 2129 CG2 VAL A 131 -4.243 -12.511 -3.068 1.00 15.12 C ATOM 0 H VAL A 131 -6.715 -14.237 -2.440 1.00 1.43 H new ATOM 0 HA VAL A 131 -4.459 -13.754 -0.661 1.00 21.42 H new ATOM 0 HB VAL A 131 -6.242 -12.000 -2.405 1.00 34.34 H new ATOM 0 HG11 VAL A 131 -4.758 -10.075 -1.932 1.00 23.12 H new ATOM 0 HG12 VAL A 131 -5.639 -10.625 -0.487 1.00 23.12 H new ATOM 0 HG13 VAL A 131 -3.921 -11.039 -0.692 1.00 23.12 H new ATOM 0 HG21 VAL A 131 -4.136 -11.650 -3.728 1.00 15.12 H new ATOM 0 HG22 VAL A 131 -3.278 -12.746 -2.619 1.00 15.12 H new ATOM 0 HG23 VAL A 131 -4.594 -13.368 -3.643 1.00 15.12 H new ATOM 2139 N LEU A 132 -7.563 -12.914 0.205 1.00 30.50 N ATOM 2140 CA LEU A 132 -8.449 -12.496 1.326 1.00 52.15 C ATOM 2141 C LEU A 132 -8.354 -13.468 2.523 1.00 32.10 C ATOM 2142 O LEU A 132 -8.259 -13.039 3.681 1.00 31.21 O ATOM 2143 CB LEU A 132 -9.921 -12.380 0.846 1.00 21.40 C ATOM 2144 CG LEU A 132 -10.220 -11.260 -0.194 1.00 11.32 C ATOM 2145 CD1 LEU A 132 -11.677 -11.332 -0.706 1.00 55.50 C ATOM 2146 CD2 LEU A 132 -9.898 -9.864 0.386 1.00 23.53 C ATOM 0 H LEU A 132 -8.067 -13.132 -0.654 1.00 30.50 H new ATOM 0 HA LEU A 132 -8.107 -11.517 1.663 1.00 52.15 H new ATOM 0 HB2 LEU A 132 -10.217 -13.336 0.414 1.00 21.40 H new ATOM 0 HB3 LEU A 132 -10.554 -12.215 1.718 1.00 21.40 H new ATOM 0 HG LEU A 132 -9.567 -11.426 -1.051 1.00 11.32 H new ATOM 0 HD11 LEU A 132 -11.848 -10.535 -1.430 1.00 55.50 H new ATOM 0 HD12 LEU A 132 -11.848 -12.297 -1.182 1.00 55.50 H new ATOM 0 HD13 LEU A 132 -12.364 -11.214 0.132 1.00 55.50 H new ATOM 0 HD21 LEU A 132 -10.116 -9.101 -0.361 1.00 23.53 H new ATOM 0 HD22 LEU A 132 -10.508 -9.689 1.272 1.00 23.53 H new ATOM 0 HD23 LEU A 132 -8.843 -9.817 0.656 1.00 23.53 H new ATOM 2158 N GLN A 133 -8.358 -14.783 2.214 1.00 42.52 N ATOM 2159 CA GLN A 133 -8.202 -15.847 3.232 1.00 40.41 C ATOM 2160 C GLN A 133 -6.816 -15.765 3.930 1.00 51.45 C ATOM 2161 O GLN A 133 -6.707 -16.066 5.126 1.00 72.03 O ATOM 2162 CB GLN A 133 -8.410 -17.257 2.614 1.00 10.41 C ATOM 2163 CG GLN A 133 -7.388 -17.642 1.537 1.00 50.34 C ATOM 2164 CD GLN A 133 -7.466 -19.108 1.100 1.00 73.42 C ATOM 2165 OE1 GLN A 133 -8.163 -19.454 0.155 1.00 31.21 O ATOM 2166 NE2 GLN A 133 -6.765 -19.979 1.798 1.00 63.40 N ATOM 0 H GLN A 133 -8.468 -15.135 1.263 1.00 42.52 H new ATOM 0 HA GLN A 133 -8.974 -15.686 3.984 1.00 40.41 H new ATOM 0 HB2 GLN A 133 -8.372 -17.998 3.413 1.00 10.41 H new ATOM 0 HB3 GLN A 133 -9.409 -17.305 2.181 1.00 10.41 H new ATOM 0 HG2 GLN A 133 -7.537 -17.005 0.665 1.00 50.34 H new ATOM 0 HG3 GLN A 133 -6.385 -17.438 1.913 1.00 50.34 H new ATOM 0 HE21 GLN A 133 -6.193 -19.663 2.581 1.00 63.40 H new ATOM 0 HE22 GLN A 133 -6.795 -20.969 1.555 1.00 63.40 H new ATOM 2175 N ARG A 134 -5.763 -15.343 3.169 1.00 24.34 N ATOM 2176 CA ARG A 134 -4.405 -15.130 3.722 1.00 71.44 C ATOM 2177 C ARG A 134 -4.429 -14.081 4.828 1.00 21.31 C ATOM 2178 O ARG A 134 -3.875 -14.311 5.886 1.00 63.23 O ATOM 2179 CB ARG A 134 -3.384 -14.708 2.634 1.00 33.54 C ATOM 2180 CG ARG A 134 -3.059 -15.811 1.630 1.00 74.04 C ATOM 2181 CD ARG A 134 -2.084 -15.362 0.531 1.00 62.41 C ATOM 2182 NE ARG A 134 -1.705 -16.482 -0.342 1.00 12.13 N ATOM 2183 CZ ARG A 134 -1.037 -16.384 -1.470 1.00 75.22 C ATOM 2184 NH1 ARG A 134 -0.682 -15.229 -1.962 1.00 42.14 N ATOM 2185 NH2 ARG A 134 -0.731 -17.457 -2.113 1.00 53.21 N ATOM 0 H ARG A 134 -5.837 -15.146 2.171 1.00 24.34 H new ATOM 0 HA ARG A 134 -4.084 -16.088 4.132 1.00 71.44 H new ATOM 0 HB2 ARG A 134 -3.777 -13.845 2.096 1.00 33.54 H new ATOM 0 HB3 ARG A 134 -2.462 -14.389 3.119 1.00 33.54 H new ATOM 0 HG2 ARG A 134 -2.631 -16.662 2.161 1.00 74.04 H new ATOM 0 HG3 ARG A 134 -3.984 -16.156 1.167 1.00 74.04 H new ATOM 0 HD2 ARG A 134 -2.544 -14.574 -0.065 1.00 62.41 H new ATOM 0 HD3 ARG A 134 -1.190 -14.936 0.987 1.00 62.41 H new ATOM 0 HE ARG A 134 -1.985 -17.417 -0.047 1.00 12.13 H new ATOM 0 HH11 ARG A 134 -0.922 -14.369 -1.469 1.00 42.14 H new ATOM 0 HH12 ARG A 134 -0.164 -15.186 -2.840 1.00 42.14 H new ATOM 0 HH21 ARG A 134 -1.007 -18.368 -1.746 1.00 53.21 H new ATOM 0 HH22 ARG A 134 -0.213 -17.396 -2.990 1.00 53.21 H new ATOM 2199 N GLY A 135 -5.094 -12.944 4.574 1.00 11.12 N ATOM 2200 CA GLY A 135 -5.254 -11.900 5.587 1.00 42.25 C ATOM 2201 C GLY A 135 -5.887 -12.404 6.888 1.00 60.43 C ATOM 2202 O GLY A 135 -5.378 -12.153 7.974 1.00 32.35 O ATOM 0 H GLY A 135 -5.527 -12.728 3.676 1.00 11.12 H new ATOM 0 HA2 GLY A 135 -4.278 -11.469 5.810 1.00 42.25 H new ATOM 0 HA3 GLY A 135 -5.871 -11.099 5.178 1.00 42.25 H new ATOM 2206 N ILE A 136 -6.983 -13.149 6.750 1.00 74.35 N ATOM 2207 CA ILE A 136 -7.731 -13.733 7.882 1.00 33.54 C ATOM 2208 C ILE A 136 -6.836 -14.655 8.775 1.00 3.31 C ATOM 2209 O ILE A 136 -6.815 -14.500 10.001 1.00 41.42 O ATOM 2210 CB ILE A 136 -8.985 -14.508 7.330 1.00 60.54 C ATOM 2211 CG1 ILE A 136 -9.914 -13.522 6.539 1.00 52.51 C ATOM 2212 CG2 ILE A 136 -9.756 -15.221 8.467 1.00 41.33 C ATOM 2213 CD1 ILE A 136 -10.904 -14.174 5.595 1.00 0.04 C ATOM 0 H ILE A 136 -7.388 -13.372 5.841 1.00 74.35 H new ATOM 0 HA ILE A 136 -8.064 -12.921 8.528 1.00 33.54 H new ATOM 0 HB ILE A 136 -8.640 -15.284 6.647 1.00 60.54 H new ATOM 0 HG12 ILE A 136 -10.468 -12.917 7.257 1.00 52.51 H new ATOM 0 HG13 ILE A 136 -9.286 -12.840 5.965 1.00 52.51 H new ATOM 0 HG21 ILE A 136 -10.616 -15.746 8.050 1.00 41.33 H new ATOM 0 HG22 ILE A 136 -9.098 -15.936 8.960 1.00 41.33 H new ATOM 0 HG23 ILE A 136 -10.098 -14.483 9.193 1.00 41.33 H new ATOM 0 HD11 ILE A 136 -11.496 -13.404 5.100 1.00 0.04 H new ATOM 0 HD12 ILE A 136 -10.365 -14.755 4.847 1.00 0.04 H new ATOM 0 HD13 ILE A 136 -11.565 -14.833 6.159 1.00 0.04 H new ATOM 2225 N GLN A 137 -6.071 -15.574 8.143 1.00 31.10 N ATOM 2226 CA GLN A 137 -5.149 -16.500 8.875 1.00 51.35 C ATOM 2227 C GLN A 137 -3.836 -15.800 9.342 1.00 1.44 C ATOM 2228 O GLN A 137 -3.218 -16.231 10.319 1.00 25.11 O ATOM 2229 CB GLN A 137 -4.835 -17.752 8.011 1.00 40.55 C ATOM 2230 CG GLN A 137 -4.238 -17.438 6.631 1.00 65.01 C ATOM 2231 CD GLN A 137 -4.177 -18.649 5.694 1.00 41.15 C ATOM 2232 OE1 GLN A 137 -3.192 -19.373 5.652 1.00 2.53 O ATOM 2233 NE2 GLN A 137 -5.232 -18.878 4.938 1.00 51.21 N ATOM 0 H GLN A 137 -6.067 -15.701 7.131 1.00 31.10 H new ATOM 0 HA GLN A 137 -5.669 -16.817 9.779 1.00 51.35 H new ATOM 0 HB2 GLN A 137 -4.140 -18.390 8.557 1.00 40.55 H new ATOM 0 HB3 GLN A 137 -5.753 -18.324 7.875 1.00 40.55 H new ATOM 0 HG2 GLN A 137 -4.831 -16.654 6.159 1.00 65.01 H new ATOM 0 HG3 GLN A 137 -3.231 -17.041 6.763 1.00 65.01 H new ATOM 0 HE21 GLN A 137 -6.041 -18.260 4.991 1.00 51.21 H new ATOM 0 HE22 GLN A 137 -5.239 -19.674 4.300 1.00 51.21 H new ATOM 2242 N ASN A 138 -3.428 -14.711 8.650 1.00 4.01 N ATOM 2243 CA ASN A 138 -2.255 -13.879 9.048 1.00 34.11 C ATOM 2244 C ASN A 138 -2.648 -12.819 10.108 1.00 43.44 C ATOM 2245 O ASN A 138 -1.807 -12.031 10.532 1.00 74.14 O ATOM 2246 CB ASN A 138 -1.622 -13.171 7.813 1.00 22.05 C ATOM 2247 CG ASN A 138 -1.027 -14.142 6.789 1.00 52.23 C ATOM 2248 OD1 ASN A 138 -0.572 -15.229 7.127 1.00 22.14 O ATOM 2249 ND2 ASN A 138 -1.029 -13.758 5.526 1.00 14.34 N ATOM 0 H ASN A 138 -3.895 -14.381 7.805 1.00 4.01 H new ATOM 0 HA ASN A 138 -1.519 -14.554 9.484 1.00 34.11 H new ATOM 0 HB2 ASN A 138 -2.382 -12.562 7.325 1.00 22.05 H new ATOM 0 HB3 ASN A 138 -0.841 -12.492 8.155 1.00 22.05 H new ATOM 0 HD21 ASN A 138 -0.646 -14.371 4.806 1.00 14.34 H new ATOM 0 HD22 ASN A 138 -1.413 -12.849 5.270 1.00 14.34 H new ATOM 2256 N GLN A 139 -3.949 -12.782 10.470 1.00 4.23 N ATOM 2257 CA GLN A 139 -4.501 -11.922 11.551 1.00 60.22 C ATOM 2258 C GLN A 139 -4.546 -10.423 11.148 1.00 13.41 C ATOM 2259 O GLN A 139 -4.575 -9.536 12.010 1.00 73.34 O ATOM 2260 CB GLN A 139 -3.759 -12.132 12.914 1.00 21.33 C ATOM 2261 CG GLN A 139 -3.752 -13.587 13.438 1.00 33.10 C ATOM 2262 CD GLN A 139 -5.153 -14.197 13.575 1.00 42.22 C ATOM 2263 OE1 GLN A 139 -5.806 -14.059 14.600 1.00 64.34 O ATOM 2264 NE2 GLN A 139 -5.612 -14.885 12.546 1.00 5.23 N ATOM 0 H GLN A 139 -4.659 -13.356 10.015 1.00 4.23 H new ATOM 0 HA GLN A 139 -5.533 -12.242 11.697 1.00 60.22 H new ATOM 0 HB2 GLN A 139 -2.728 -11.797 12.804 1.00 21.33 H new ATOM 0 HB3 GLN A 139 -4.224 -11.494 13.665 1.00 21.33 H new ATOM 0 HG2 GLN A 139 -3.160 -14.205 12.762 1.00 33.10 H new ATOM 0 HG3 GLN A 139 -3.257 -13.612 14.409 1.00 33.10 H new ATOM 0 HE21 GLN A 139 -5.045 -14.983 11.704 1.00 5.23 H new ATOM 0 HE22 GLN A 139 -6.534 -15.319 12.593 1.00 5.23 H new ATOM 2273 N ALA A 140 -4.601 -10.172 9.828 1.00 32.03 N ATOM 2274 CA ALA A 140 -4.704 -8.823 9.244 1.00 60.12 C ATOM 2275 C ALA A 140 -5.967 -8.064 9.703 1.00 75.44 C ATOM 2276 O ALA A 140 -7.075 -8.295 9.215 1.00 52.41 O ATOM 2277 CB ALA A 140 -4.625 -8.899 7.716 1.00 0.54 C ATOM 0 H ALA A 140 -4.575 -10.912 9.126 1.00 32.03 H new ATOM 0 HA ALA A 140 -3.856 -8.247 9.614 1.00 60.12 H new ATOM 0 HB1 ALA A 140 -4.702 -7.896 7.297 1.00 0.54 H new ATOM 0 HB2 ALA A 140 -3.673 -9.342 7.422 1.00 0.54 H new ATOM 0 HB3 ALA A 140 -5.443 -9.513 7.339 1.00 0.54 H new ATOM 2283 N GLU A 141 -5.764 -7.159 10.668 1.00 10.45 N ATOM 2284 CA GLU A 141 -6.836 -6.344 11.254 1.00 11.31 C ATOM 2285 C GLU A 141 -7.211 -5.156 10.320 1.00 24.42 C ATOM 2286 O GLU A 141 -6.322 -4.559 9.691 1.00 32.42 O ATOM 2287 CB GLU A 141 -6.404 -5.838 12.657 1.00 40.10 C ATOM 2288 CG GLU A 141 -5.115 -4.990 12.678 1.00 52.24 C ATOM 2289 CD GLU A 141 -4.752 -4.492 14.085 1.00 14.15 C ATOM 2290 OE1 GLU A 141 -5.344 -3.484 14.535 1.00 73.25 O ATOM 2291 OE2 GLU A 141 -3.891 -5.110 14.750 1.00 11.13 O ATOM 0 H GLU A 141 -4.845 -6.970 11.067 1.00 10.45 H new ATOM 0 HA GLU A 141 -7.726 -6.963 11.365 1.00 11.31 H new ATOM 0 HB2 GLU A 141 -7.217 -5.247 13.079 1.00 40.10 H new ATOM 0 HB3 GLU A 141 -6.264 -6.700 13.310 1.00 40.10 H new ATOM 0 HG2 GLU A 141 -4.290 -5.582 12.283 1.00 52.24 H new ATOM 0 HG3 GLU A 141 -5.238 -4.134 12.015 1.00 52.24 H new ATOM 2298 N PRO A 142 -8.533 -4.801 10.168 1.00 15.40 N ATOM 2299 CA PRO A 142 -9.695 -5.567 10.732 1.00 71.53 C ATOM 2300 C PRO A 142 -10.042 -6.891 9.963 1.00 1.51 C ATOM 2301 O PRO A 142 -10.369 -6.874 8.769 1.00 32.43 O ATOM 2302 CB PRO A 142 -10.843 -4.533 10.636 1.00 53.20 C ATOM 2303 CG PRO A 142 -10.487 -3.665 9.467 1.00 34.40 C ATOM 2304 CD PRO A 142 -8.977 -3.557 9.481 1.00 14.11 C ATOM 0 HA PRO A 142 -9.490 -5.930 11.739 1.00 71.53 H new ATOM 0 HB2 PRO A 142 -11.804 -5.024 10.485 1.00 53.20 H new ATOM 0 HB3 PRO A 142 -10.924 -3.948 11.552 1.00 53.20 H new ATOM 0 HG2 PRO A 142 -10.839 -4.102 8.533 1.00 34.40 H new ATOM 0 HG3 PRO A 142 -10.951 -2.682 9.554 1.00 34.40 H new ATOM 0 HD2 PRO A 142 -8.572 -3.493 8.471 1.00 14.11 H new ATOM 0 HD3 PRO A 142 -8.646 -2.666 10.015 1.00 14.11 H new ATOM 2312 N ARG A 143 -9.977 -8.035 10.687 1.00 22.53 N ATOM 2313 CA ARG A 143 -10.244 -9.383 10.116 1.00 4.11 C ATOM 2314 C ARG A 143 -11.721 -9.575 9.714 1.00 64.24 C ATOM 2315 O ARG A 143 -11.998 -10.197 8.692 1.00 33.00 O ATOM 2316 CB ARG A 143 -9.853 -10.498 11.113 1.00 74.21 C ATOM 2317 CG ARG A 143 -8.356 -10.587 11.434 1.00 10.24 C ATOM 2318 CD ARG A 143 -8.047 -11.706 12.444 1.00 73.21 C ATOM 2319 NE ARG A 143 -8.670 -11.469 13.761 1.00 12.33 N ATOM 2320 CZ ARG A 143 -8.019 -11.173 14.869 1.00 42.21 C ATOM 2321 NH1 ARG A 143 -6.736 -10.964 14.863 1.00 62.33 N ATOM 2322 NH2 ARG A 143 -8.667 -11.065 15.981 1.00 54.11 N ATOM 0 H ARG A 143 -9.739 -8.052 11.679 1.00 22.53 H new ATOM 0 HA ARG A 143 -9.630 -9.453 9.218 1.00 4.11 H new ATOM 0 HB2 ARG A 143 -10.400 -10.341 12.043 1.00 74.21 H new ATOM 0 HB3 ARG A 143 -10.180 -11.456 10.709 1.00 74.21 H new ATOM 0 HG2 ARG A 143 -7.798 -10.765 10.515 1.00 10.24 H new ATOM 0 HG3 ARG A 143 -8.014 -9.633 11.835 1.00 10.24 H new ATOM 0 HD2 ARG A 143 -8.399 -12.658 12.046 1.00 73.21 H new ATOM 0 HD3 ARG A 143 -6.967 -11.792 12.567 1.00 73.21 H new ATOM 0 HE ARG A 143 -9.686 -11.540 13.819 1.00 12.33 H new ATOM 0 HH11 ARG A 143 -6.213 -11.028 13.990 1.00 62.33 H new ATOM 0 HH12 ARG A 143 -6.252 -10.736 15.732 1.00 62.33 H new ATOM 0 HH21 ARG A 143 -9.677 -11.208 15.999 1.00 54.11 H new ATOM 0 HH22 ARG A 143 -8.169 -10.836 16.841 1.00 54.11 H new ATOM 2336 N GLU A 144 -12.660 -9.059 10.542 1.00 72.34 N ATOM 2337 CA GLU A 144 -14.118 -9.128 10.251 1.00 70.30 C ATOM 2338 C GLU A 144 -14.444 -8.467 8.896 1.00 40.03 C ATOM 2339 O GLU A 144 -15.284 -8.969 8.145 1.00 44.04 O ATOM 2340 CB GLU A 144 -14.949 -8.470 11.393 1.00 62.14 C ATOM 2341 CG GLU A 144 -16.470 -8.362 11.115 1.00 41.22 C ATOM 2342 CD GLU A 144 -17.256 -7.675 12.241 1.00 52.13 C ATOM 2343 OE1 GLU A 144 -17.378 -6.431 12.227 1.00 65.12 O ATOM 2344 OE2 GLU A 144 -17.753 -8.376 13.151 1.00 3.24 O ATOM 0 H GLU A 144 -12.436 -8.589 11.419 1.00 72.34 H new ATOM 0 HA GLU A 144 -14.394 -10.181 10.192 1.00 70.30 H new ATOM 0 HB2 GLU A 144 -14.802 -9.045 12.307 1.00 62.14 H new ATOM 0 HB3 GLU A 144 -14.556 -7.470 11.578 1.00 62.14 H new ATOM 0 HG2 GLU A 144 -16.623 -7.809 10.188 1.00 41.22 H new ATOM 0 HG3 GLU A 144 -16.874 -9.362 10.960 1.00 41.22 H new ATOM 2351 N PHE A 145 -13.739 -7.359 8.585 1.00 25.13 N ATOM 2352 CA PHE A 145 -13.860 -6.674 7.290 1.00 4.24 C ATOM 2353 C PHE A 145 -13.396 -7.594 6.126 1.00 54.54 C ATOM 2354 O PHE A 145 -14.056 -7.667 5.091 1.00 12.23 O ATOM 2355 CB PHE A 145 -13.072 -5.344 7.300 1.00 42.42 C ATOM 2356 CG PHE A 145 -13.305 -4.480 6.061 1.00 61.15 C ATOM 2357 CD1 PHE A 145 -14.575 -3.956 5.795 1.00 64.01 C ATOM 2358 CD2 PHE A 145 -12.276 -4.199 5.162 1.00 12.10 C ATOM 2359 CE1 PHE A 145 -14.801 -3.179 4.675 1.00 13.01 C ATOM 2360 CE2 PHE A 145 -12.506 -3.420 4.044 1.00 73.40 C ATOM 2361 CZ PHE A 145 -13.767 -2.912 3.798 1.00 10.02 C ATOM 0 H PHE A 145 -13.075 -6.920 9.223 1.00 25.13 H new ATOM 0 HA PHE A 145 -14.912 -6.441 7.126 1.00 4.24 H new ATOM 0 HB2 PHE A 145 -13.350 -4.774 8.187 1.00 42.42 H new ATOM 0 HB3 PHE A 145 -12.008 -5.564 7.383 1.00 42.42 H new ATOM 0 HD1 PHE A 145 -15.389 -4.162 6.474 1.00 64.01 H new ATOM 0 HD2 PHE A 145 -11.288 -4.595 5.342 1.00 12.10 H new ATOM 0 HE1 PHE A 145 -15.786 -2.780 4.485 1.00 13.01 H new ATOM 0 HE2 PHE A 145 -11.697 -3.208 3.360 1.00 73.40 H new ATOM 0 HZ PHE A 145 -13.944 -2.307 2.921 1.00 10.02 H new ATOM 2371 N LEU A 146 -12.294 -8.336 6.341 1.00 65.42 N ATOM 2372 CA LEU A 146 -11.794 -9.341 5.368 1.00 64.21 C ATOM 2373 C LEU A 146 -12.816 -10.470 5.130 1.00 23.20 C ATOM 2374 O LEU A 146 -13.026 -10.878 3.996 1.00 2.30 O ATOM 2375 CB LEU A 146 -10.450 -9.953 5.853 1.00 71.21 C ATOM 2376 CG LEU A 146 -9.173 -9.132 5.537 1.00 60.32 C ATOM 2377 CD1 LEU A 146 -7.989 -9.598 6.391 1.00 35.00 C ATOM 2378 CD2 LEU A 146 -8.831 -9.201 4.032 1.00 0.22 C ATOM 0 H LEU A 146 -11.725 -8.262 7.184 1.00 65.42 H new ATOM 0 HA LEU A 146 -11.637 -8.819 4.424 1.00 64.21 H new ATOM 0 HB2 LEU A 146 -10.508 -10.096 6.932 1.00 71.21 H new ATOM 0 HB3 LEU A 146 -10.342 -10.941 5.406 1.00 71.21 H new ATOM 0 HG LEU A 146 -9.375 -8.091 5.790 1.00 60.32 H new ATOM 0 HD11 LEU A 146 -7.108 -9.004 6.147 1.00 35.00 H new ATOM 0 HD12 LEU A 146 -8.230 -9.473 7.447 1.00 35.00 H new ATOM 0 HD13 LEU A 146 -7.785 -10.649 6.188 1.00 35.00 H new ATOM 0 HD21 LEU A 146 -7.932 -8.617 3.836 1.00 0.22 H new ATOM 0 HD22 LEU A 146 -8.660 -10.239 3.745 1.00 0.22 H new ATOM 0 HD23 LEU A 146 -9.660 -8.796 3.452 1.00 0.22 H new ATOM 2390 N GLN A 147 -13.442 -10.963 6.221 1.00 52.33 N ATOM 2391 CA GLN A 147 -14.369 -12.114 6.171 1.00 1.13 C ATOM 2392 C GLN A 147 -15.726 -11.746 5.532 1.00 12.11 C ATOM 2393 O GLN A 147 -16.288 -12.536 4.770 1.00 22.14 O ATOM 2394 CB GLN A 147 -14.576 -12.716 7.588 1.00 20.21 C ATOM 2395 CG GLN A 147 -13.263 -13.115 8.303 1.00 5.43 C ATOM 2396 CD GLN A 147 -13.447 -14.164 9.398 1.00 3.03 C ATOM 2397 OE1 GLN A 147 -13.673 -13.846 10.557 1.00 75.21 O ATOM 2398 NE2 GLN A 147 -13.347 -15.426 9.028 1.00 43.04 N ATOM 0 H GLN A 147 -13.320 -10.576 7.157 1.00 52.33 H new ATOM 0 HA GLN A 147 -13.908 -12.868 5.533 1.00 1.13 H new ATOM 0 HB2 GLN A 147 -15.107 -11.991 8.205 1.00 20.21 H new ATOM 0 HB3 GLN A 147 -15.215 -13.595 7.508 1.00 20.21 H new ATOM 0 HG2 GLN A 147 -12.560 -13.497 7.563 1.00 5.43 H new ATOM 0 HG3 GLN A 147 -12.814 -12.223 8.740 1.00 5.43 H new ATOM 0 HE21 GLN A 147 -13.158 -15.658 8.053 1.00 43.04 H new ATOM 0 HE22 GLN A 147 -13.459 -16.170 9.717 1.00 43.04 H new ATOM 2407 N GLN A 148 -16.251 -10.546 5.844 1.00 65.13 N ATOM 2408 CA GLN A 148 -17.497 -10.049 5.223 1.00 73.40 C ATOM 2409 C GLN A 148 -17.277 -9.752 3.722 1.00 22.11 C ATOM 2410 O GLN A 148 -18.129 -10.068 2.902 1.00 70.04 O ATOM 2411 CB GLN A 148 -18.054 -8.808 5.974 1.00 54.10 C ATOM 2412 CG GLN A 148 -17.208 -7.530 5.866 1.00 63.53 C ATOM 2413 CD GLN A 148 -17.696 -6.401 6.773 1.00 10.35 C ATOM 2414 OE1 GLN A 148 -17.306 -6.307 7.931 1.00 41.43 O ATOM 2415 NE2 GLN A 148 -18.542 -5.540 6.257 1.00 42.31 N ATOM 0 H GLN A 148 -15.835 -9.904 6.519 1.00 65.13 H new ATOM 0 HA GLN A 148 -18.249 -10.834 5.304 1.00 73.40 H new ATOM 0 HB2 GLN A 148 -19.053 -8.594 5.594 1.00 54.10 H new ATOM 0 HB3 GLN A 148 -18.162 -9.062 7.028 1.00 54.10 H new ATOM 0 HG2 GLN A 148 -16.174 -7.766 6.116 1.00 63.53 H new ATOM 0 HG3 GLN A 148 -17.215 -7.185 4.832 1.00 63.53 H new ATOM 0 HE21 GLN A 148 -18.849 -5.644 5.290 1.00 42.31 H new ATOM 0 HE22 GLN A 148 -18.892 -4.767 6.823 1.00 42.31 H new ATOM 2424 N GLN A 149 -16.101 -9.186 3.362 1.00 60.40 N ATOM 2425 CA GLN A 149 -15.743 -8.963 1.943 1.00 32.54 C ATOM 2426 C GLN A 149 -15.371 -10.294 1.240 1.00 64.23 C ATOM 2427 O GLN A 149 -15.475 -10.386 0.026 1.00 23.33 O ATOM 2428 CB GLN A 149 -14.597 -7.926 1.803 1.00 10.44 C ATOM 2429 CG GLN A 149 -14.913 -6.523 2.379 1.00 34.43 C ATOM 2430 CD GLN A 149 -16.151 -5.858 1.769 1.00 4.45 C ATOM 2431 OE1 GLN A 149 -17.317 -6.111 2.339 1.00 51.21 O flip ATOM 2432 NE2 GLN A 149 -16.060 -5.126 0.795 1.00 73.31 N flip ATOM 0 H GLN A 149 -15.391 -8.879 4.027 1.00 60.40 H new ATOM 0 HA GLN A 149 -16.624 -8.555 1.447 1.00 32.54 H new ATOM 0 HB2 GLN A 149 -13.710 -8.316 2.302 1.00 10.44 H new ATOM 0 HB3 GLN A 149 -14.348 -7.822 0.747 1.00 10.44 H new ATOM 0 HG2 GLN A 149 -15.054 -6.608 3.456 1.00 34.43 H new ATOM 0 HG3 GLN A 149 -14.051 -5.875 2.221 1.00 34.43 H new ATOM 0 HE21 GLN A 149 -15.148 -4.948 0.375 1.00 73.31 H new ATOM 0 HE22 GLN A 149 -16.896 -4.693 0.402 1.00 73.31 H new ATOM 2441 N TYR A 150 -14.936 -11.310 2.025 1.00 65.43 N ATOM 2442 CA TYR A 150 -14.645 -12.675 1.513 1.00 0.20 C ATOM 2443 C TYR A 150 -15.944 -13.370 1.058 1.00 4.51 C ATOM 2444 O TYR A 150 -16.026 -13.799 -0.078 1.00 51.34 O ATOM 2445 CB TYR A 150 -13.909 -13.531 2.587 1.00 53.41 C ATOM 2446 CG TYR A 150 -13.423 -14.931 2.128 1.00 20.22 C ATOM 2447 CD1 TYR A 150 -12.182 -15.099 1.506 1.00 4.44 C ATOM 2448 CD2 TYR A 150 -14.191 -16.080 2.340 1.00 2.41 C ATOM 2449 CE1 TYR A 150 -11.732 -16.345 1.113 1.00 73.03 C ATOM 2450 CE2 TYR A 150 -13.742 -17.329 1.953 1.00 51.13 C ATOM 2451 CZ TYR A 150 -12.513 -17.457 1.342 1.00 32.24 C ATOM 2452 OH TYR A 150 -12.067 -18.704 0.961 1.00 5.13 O ATOM 0 H TYR A 150 -14.777 -11.209 3.027 1.00 65.43 H new ATOM 0 HA TYR A 150 -13.985 -12.579 0.651 1.00 0.20 H new ATOM 0 HB2 TYR A 150 -13.046 -12.968 2.942 1.00 53.41 H new ATOM 0 HB3 TYR A 150 -14.577 -13.662 3.438 1.00 53.41 H new ATOM 0 HD1 TYR A 150 -11.560 -14.234 1.328 1.00 4.44 H new ATOM 0 HD2 TYR A 150 -15.156 -15.990 2.816 1.00 2.41 H new ATOM 0 HE1 TYR A 150 -10.772 -16.447 0.628 1.00 73.03 H new ATOM 0 HE2 TYR A 150 -14.353 -18.202 2.129 1.00 51.13 H new ATOM 0 HH TYR A 150 -12.739 -19.378 1.197 1.00 5.13 H new ATOM 2462 N ARG A 151 -16.961 -13.444 1.948 1.00 71.22 N ATOM 2463 CA ARG A 151 -18.257 -14.116 1.644 1.00 33.51 C ATOM 2464 C ARG A 151 -19.042 -13.383 0.524 1.00 71.23 C ATOM 2465 O ARG A 151 -19.714 -14.023 -0.295 1.00 21.14 O ATOM 2466 CB ARG A 151 -19.136 -14.239 2.918 1.00 64.33 C ATOM 2467 CG ARG A 151 -19.557 -12.898 3.553 1.00 52.02 C ATOM 2468 CD ARG A 151 -20.506 -13.066 4.748 1.00 61.03 C ATOM 2469 NE ARG A 151 -21.785 -13.689 4.365 1.00 42.51 N ATOM 2470 CZ ARG A 151 -22.850 -13.787 5.140 1.00 22.01 C ATOM 2471 NH1 ARG A 151 -22.856 -13.320 6.355 1.00 73.20 N ATOM 2472 NH2 ARG A 151 -23.911 -14.361 4.683 1.00 55.20 N ATOM 0 H ARG A 151 -16.914 -13.047 2.886 1.00 71.22 H new ATOM 0 HA ARG A 151 -18.016 -15.117 1.285 1.00 33.51 H new ATOM 0 HB2 ARG A 151 -20.035 -14.803 2.668 1.00 64.33 H new ATOM 0 HB3 ARG A 151 -18.591 -14.821 3.662 1.00 64.33 H new ATOM 0 HG2 ARG A 151 -18.666 -12.362 3.878 1.00 52.02 H new ATOM 0 HG3 ARG A 151 -20.042 -12.281 2.796 1.00 52.02 H new ATOM 0 HD2 ARG A 151 -20.022 -13.676 5.510 1.00 61.03 H new ATOM 0 HD3 ARG A 151 -20.699 -12.091 5.195 1.00 61.03 H new ATOM 0 HE ARG A 151 -21.854 -14.076 3.424 1.00 42.51 H new ATOM 0 HH11 ARG A 151 -22.024 -12.865 6.730 1.00 73.20 H new ATOM 0 HH12 ARG A 151 -23.693 -13.409 6.932 1.00 73.20 H new ATOM 0 HH21 ARG A 151 -23.921 -14.733 3.733 1.00 55.20 H new ATOM 0 HH22 ARG A 151 -24.740 -14.443 5.271 1.00 55.20 H new ATOM 2486 N LEU A 152 -18.930 -12.036 0.492 1.00 12.41 N ATOM 2487 CA LEU A 152 -19.545 -11.203 -0.562 1.00 75.24 C ATOM 2488 C LEU A 152 -18.810 -11.407 -1.902 1.00 32.11 C ATOM 2489 O LEU A 152 -19.425 -11.391 -2.954 1.00 35.42 O ATOM 2490 CB LEU A 152 -19.540 -9.705 -0.147 1.00 62.40 C ATOM 2491 CG LEU A 152 -20.494 -9.324 1.034 1.00 64.53 C ATOM 2492 CD1 LEU A 152 -20.245 -7.875 1.511 1.00 52.33 C ATOM 2493 CD2 LEU A 152 -21.981 -9.552 0.661 1.00 32.23 C ATOM 0 H LEU A 152 -18.415 -11.501 1.191 1.00 12.41 H new ATOM 0 HA LEU A 152 -20.582 -11.513 -0.691 1.00 75.24 H new ATOM 0 HB2 LEU A 152 -18.523 -9.427 0.128 1.00 62.40 H new ATOM 0 HB3 LEU A 152 -19.811 -9.105 -1.016 1.00 62.40 H new ATOM 0 HG LEU A 152 -20.265 -9.988 1.867 1.00 64.53 H new ATOM 0 HD11 LEU A 152 -20.923 -7.641 2.332 1.00 52.33 H new ATOM 0 HD12 LEU A 152 -19.214 -7.776 1.852 1.00 52.33 H new ATOM 0 HD13 LEU A 152 -20.422 -7.185 0.686 1.00 52.33 H new ATOM 0 HD21 LEU A 152 -22.614 -9.277 1.505 1.00 32.23 H new ATOM 0 HD22 LEU A 152 -22.238 -8.937 -0.201 1.00 32.23 H new ATOM 0 HD23 LEU A 152 -22.138 -10.603 0.417 1.00 32.23 H new ATOM 2505 N PHE A 153 -17.484 -11.578 -1.836 1.00 41.11 N ATOM 2506 CA PHE A 153 -16.656 -11.981 -2.992 1.00 12.03 C ATOM 2507 C PHE A 153 -17.045 -13.401 -3.505 1.00 42.22 C ATOM 2508 O PHE A 153 -17.127 -13.637 -4.717 1.00 40.21 O ATOM 2509 CB PHE A 153 -15.166 -11.936 -2.571 1.00 52.44 C ATOM 2510 CG PHE A 153 -14.179 -12.048 -3.711 1.00 43.14 C ATOM 2511 CD1 PHE A 153 -13.754 -13.286 -4.173 1.00 71.42 C ATOM 2512 CD2 PHE A 153 -13.687 -10.906 -4.332 1.00 14.23 C ATOM 2513 CE1 PHE A 153 -12.874 -13.375 -5.216 1.00 41.13 C ATOM 2514 CE2 PHE A 153 -12.806 -11.004 -5.376 1.00 22.12 C ATOM 2515 CZ PHE A 153 -12.404 -12.238 -5.817 1.00 25.53 C ATOM 0 H PHE A 153 -16.948 -11.442 -0.979 1.00 41.11 H new ATOM 0 HA PHE A 153 -16.829 -11.289 -3.816 1.00 12.03 H new ATOM 0 HB2 PHE A 153 -14.981 -11.002 -2.040 1.00 52.44 H new ATOM 0 HB3 PHE A 153 -14.978 -12.746 -1.866 1.00 52.44 H new ATOM 0 HD1 PHE A 153 -14.122 -14.187 -3.705 1.00 71.42 H new ATOM 0 HD2 PHE A 153 -14.002 -9.932 -3.988 1.00 14.23 H new ATOM 0 HE1 PHE A 153 -12.549 -14.344 -5.566 1.00 41.13 H new ATOM 0 HE2 PHE A 153 -12.429 -10.110 -5.851 1.00 22.12 H new ATOM 0 HZ PHE A 153 -11.713 -12.314 -6.643 1.00 25.53 H new ATOM 2525 N GLN A 154 -17.294 -14.330 -2.557 1.00 42.05 N ATOM 2526 CA GLN A 154 -17.641 -15.737 -2.859 1.00 54.32 C ATOM 2527 C GLN A 154 -19.001 -15.847 -3.574 1.00 23.43 C ATOM 2528 O GLN A 154 -19.129 -16.593 -4.553 1.00 31.23 O ATOM 2529 CB GLN A 154 -17.647 -16.608 -1.569 1.00 52.43 C ATOM 2530 CG GLN A 154 -16.276 -16.772 -0.882 1.00 31.42 C ATOM 2531 CD GLN A 154 -15.204 -17.403 -1.768 1.00 31.31 C ATOM 2532 OE1 GLN A 154 -15.489 -18.245 -2.617 1.00 2.44 O ATOM 2533 NE2 GLN A 154 -13.964 -16.994 -1.588 1.00 44.20 N ATOM 0 H GLN A 154 -17.260 -14.126 -1.558 1.00 42.05 H new ATOM 0 HA GLN A 154 -16.870 -16.115 -3.531 1.00 54.32 H new ATOM 0 HB2 GLN A 154 -18.343 -16.167 -0.855 1.00 52.43 H new ATOM 0 HB3 GLN A 154 -18.031 -17.597 -1.819 1.00 52.43 H new ATOM 0 HG2 GLN A 154 -15.928 -15.793 -0.551 1.00 31.42 H new ATOM 0 HG3 GLN A 154 -16.400 -17.385 0.011 1.00 31.42 H new ATOM 0 HE21 GLN A 154 -13.756 -16.294 -0.876 1.00 44.20 H new ATOM 0 HE22 GLN A 154 -13.212 -17.378 -2.161 1.00 44.20 H new ATOM 2542 N THR A 155 -19.997 -15.056 -3.112 1.00 12.20 N ATOM 2543 CA THR A 155 -21.365 -15.083 -3.695 1.00 13.42 C ATOM 2544 C THR A 155 -21.363 -14.548 -5.153 1.00 71.02 C ATOM 2545 O THR A 155 -22.271 -14.851 -5.929 1.00 73.22 O ATOM 2546 CB THR A 155 -22.413 -14.299 -2.818 1.00 53.34 C ATOM 2547 OG1 THR A 155 -23.760 -14.581 -3.250 1.00 23.04 O ATOM 2548 CG2 THR A 155 -22.205 -12.779 -2.844 1.00 44.41 C ATOM 0 H THR A 155 -19.884 -14.395 -2.343 1.00 12.20 H new ATOM 0 HA THR A 155 -21.676 -16.128 -3.707 1.00 13.42 H new ATOM 0 HB THR A 155 -22.257 -14.647 -1.797 1.00 53.34 H new ATOM 0 HG1 THR A 155 -24.394 -14.085 -2.691 1.00 23.04 H new ATOM 0 HG21 THR A 155 -22.959 -12.298 -2.221 1.00 44.41 H new ATOM 0 HG22 THR A 155 -21.212 -12.541 -2.462 1.00 44.41 H new ATOM 0 HG23 THR A 155 -22.296 -12.417 -3.868 1.00 44.41 H new ATOM 2556 N ARG A 156 -20.314 -13.772 -5.515 1.00 51.04 N ATOM 2557 CA ARG A 156 -20.104 -13.285 -6.894 1.00 2.10 C ATOM 2558 C ARG A 156 -19.575 -14.421 -7.797 1.00 72.05 C ATOM 2559 O ARG A 156 -20.199 -14.753 -8.802 1.00 53.41 O ATOM 2560 CB ARG A 156 -19.103 -12.100 -6.906 1.00 62.21 C ATOM 2561 CG ARG A 156 -19.496 -10.922 -5.993 1.00 53.05 C ATOM 2562 CD ARG A 156 -18.401 -9.842 -5.922 1.00 52.34 C ATOM 2563 NE ARG A 156 -18.531 -8.971 -4.741 1.00 33.24 N ATOM 2564 CZ ARG A 156 -17.616 -8.102 -4.343 1.00 42.12 C ATOM 2565 NH1 ARG A 156 -16.513 -7.934 -5.008 1.00 5.24 N ATOM 2566 NH2 ARG A 156 -17.810 -7.400 -3.275 1.00 1.30 N ATOM 0 H ARG A 156 -19.593 -13.468 -4.860 1.00 51.04 H new ATOM 0 HA ARG A 156 -21.064 -12.943 -7.281 1.00 2.10 H new ATOM 0 HB2 ARG A 156 -18.122 -12.466 -6.603 1.00 62.21 H new ATOM 0 HB3 ARG A 156 -19.005 -11.734 -7.928 1.00 62.21 H new ATOM 0 HG2 ARG A 156 -20.420 -10.475 -6.359 1.00 53.05 H new ATOM 0 HG3 ARG A 156 -19.699 -11.296 -4.989 1.00 53.05 H new ATOM 0 HD2 ARG A 156 -17.423 -10.324 -5.906 1.00 52.34 H new ATOM 0 HD3 ARG A 156 -18.441 -9.231 -6.824 1.00 52.34 H new ATOM 0 HE ARG A 156 -19.387 -9.043 -4.191 1.00 33.24 H new ATOM 0 HH11 ARG A 156 -16.340 -8.477 -5.854 1.00 5.24 H new ATOM 0 HH12 ARG A 156 -15.820 -7.259 -4.684 1.00 5.24 H new ATOM 0 HH21 ARG A 156 -18.669 -7.516 -2.738 1.00 1.30 H new ATOM 0 HH22 ARG A 156 -17.104 -6.731 -2.969 1.00 1.30 H new ATOM 2580 N LEU A 157 -18.430 -15.028 -7.402 1.00 24.03 N ATOM 2581 CA LEU A 157 -17.738 -16.047 -8.232 1.00 74.21 C ATOM 2582 C LEU A 157 -18.560 -17.351 -8.413 1.00 13.32 C ATOM 2583 O LEU A 157 -18.423 -18.031 -9.436 1.00 31.42 O ATOM 2584 CB LEU A 157 -16.290 -16.324 -7.701 1.00 52.54 C ATOM 2585 CG LEU A 157 -16.104 -16.718 -6.189 1.00 62.10 C ATOM 2586 CD1 LEU A 157 -16.515 -18.176 -5.877 1.00 23.30 C ATOM 2587 CD2 LEU A 157 -14.659 -16.450 -5.721 1.00 74.11 C ATOM 0 H LEU A 157 -17.966 -14.831 -6.515 1.00 24.03 H new ATOM 0 HA LEU A 157 -17.647 -15.623 -9.232 1.00 74.21 H new ATOM 0 HB2 LEU A 157 -15.863 -17.124 -8.306 1.00 52.54 H new ATOM 0 HB3 LEU A 157 -15.693 -15.431 -7.886 1.00 52.54 H new ATOM 0 HG LEU A 157 -16.785 -16.079 -5.627 1.00 62.10 H new ATOM 0 HD11 LEU A 157 -16.361 -18.379 -4.817 1.00 23.30 H new ATOM 0 HD12 LEU A 157 -17.567 -18.318 -6.124 1.00 23.30 H new ATOM 0 HD13 LEU A 157 -15.907 -18.860 -6.469 1.00 23.30 H new ATOM 0 HD21 LEU A 157 -14.558 -16.731 -4.673 1.00 74.11 H new ATOM 0 HD22 LEU A 157 -13.967 -17.039 -6.323 1.00 74.11 H new ATOM 0 HD23 LEU A 157 -14.430 -15.391 -5.836 1.00 74.11 H new ATOM 2599 N THR A 158 -19.412 -17.695 -7.424 1.00 53.32 N ATOM 2600 CA THR A 158 -20.295 -18.892 -7.518 1.00 21.35 C ATOM 2601 C THR A 158 -21.572 -18.623 -8.362 1.00 74.23 C ATOM 2602 O THR A 158 -22.201 -19.566 -8.856 1.00 21.54 O ATOM 2603 CB THR A 158 -20.692 -19.452 -6.100 1.00 32.15 C ATOM 2604 OG1 THR A 158 -21.407 -20.696 -6.232 1.00 70.34 O ATOM 2605 CG2 THR A 158 -21.557 -18.474 -5.292 1.00 74.23 C ATOM 0 H THR A 158 -19.512 -17.170 -6.555 1.00 53.32 H new ATOM 0 HA THR A 158 -19.706 -19.652 -8.032 1.00 21.35 H new ATOM 0 HB THR A 158 -19.757 -19.601 -5.561 1.00 32.15 H new ATOM 0 HG1 THR A 158 -21.645 -21.032 -5.343 1.00 70.34 H new ATOM 0 HG21 THR A 158 -21.799 -18.915 -4.325 1.00 74.23 H new ATOM 0 HG22 THR A 158 -21.009 -17.544 -5.140 1.00 74.23 H new ATOM 0 HG23 THR A 158 -22.478 -18.267 -5.837 1.00 74.23 H new