USER MOD reduce.3.24.130724 H: found=0, std=0, add=872, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 872 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 398 TYR OH : rot 165:sc= 0.528 USER MOD Set 1.2: A 405 LYS NZ :NH3+ -126:sc= 0.91 (180deg=0.113) USER MOD Set 2.1: A 380 LYS NZ :NH3+ 176:sc= 0.861 (180deg=0) USER MOD Set 2.2: A 435 SER OG : rot 101:sc= 0.778 USER MOD Set 3.1: A 370 ASN : amide:sc= 0.0287 K(o=0.055,f=-0.71) USER MOD Set 3.2: A 386 THR OG1 : rot -51:sc= 0.0267 USER MOD Single : A 340 TYR OH : rot 30:sc= -2.12! USER MOD Single : A 342 TYR OH : rot 180:sc= 0 USER MOD Single : A 343 GLN : amide:sc= -1.6! K(o=-1.6!,f=-0.063) USER MOD Single : A 346 SER OG : rot 3:sc= 0.705 USER MOD Single : A 348 SER OG : rot 180:sc= 0.0631 USER MOD Single : A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 352 ASN : amide:sc= 0.497 K(o=0.5,f=-0.034) USER MOD Single : A 359 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00609) USER MOD Single : A 361 SER OG : rot 180:sc= 0 USER MOD Single : A 362 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.154) USER MOD Single : A 378 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 379 HIS : no HD1:sc= -1.15 K(o=-1.2,f=-2.7) USER MOD Single : A 381 ASN : amide:sc= -0.217 X(o=-0.22,f=-0.49) USER MOD Single : A 387 TYR OH : rot -122:sc= 0.45 USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 390 MET CE :methyl 136:sc= -3.09 (180deg=-5.1!) USER MOD Single : A 391 SER OG : rot -70:sc= 0.88 USER MOD Single : A 396 HIS : no HD1:sc= -0.131 K(o=-0.13,f=-9.7!) USER MOD Single : A 397 TYR OH : rot 63:sc= -0.917! USER MOD Single : A 399 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.073) USER MOD Single : A 401 ASN : amide:sc= -0.868 K(o=-0.87,f=0) USER MOD Single : A 409 GLN : amide:sc= -0.676 K(o=-0.68,f=-4.4!) USER MOD Single : A 416 MET CE :methyl -139:sc= -0.176 (180deg=-0.736) USER MOD Single : A 417 LYS NZ :NH3+ 161:sc= 1.29 (180deg=1.19) USER MOD Single : A 418 THR OG1 : rot -70:sc= 1.13 USER MOD Single : A 423 MET CE :methyl 161:sc= -0.128 (180deg=-0.582) USER MOD Single : A 424 SER OG : rot -89:sc= 1.13 USER MOD Single : A 427 THR OG1 : rot 170:sc= -0.0946 USER MOD Single : A 432 HIS : no HD1:sc= -0.228 X(o=-0.23,f=0) USER MOD Single : A 436 GLN : amide:sc= -0.223 K(o=-0.22,f=-1) USER MOD ----------------------------------------------------------------- ATOM 80 N LEU A 336 -1.225 6.928 -5.557 1.00 1.08 N ATOM 81 CA LEU A 336 -0.978 6.465 -4.185 1.00 0.60 C ATOM 82 C LEU A 336 -1.294 4.977 -4.036 1.00 0.50 C ATOM 83 O LEU A 336 -1.763 4.336 -4.979 1.00 0.62 O ATOM 84 CB LEU A 336 -1.780 7.276 -3.151 1.00 0.36 C ATOM 85 CG LEU A 336 -1.713 8.797 -3.311 1.00 0.30 C ATOM 86 CD1 LEU A 336 -2.468 9.491 -2.199 1.00 0.25 C ATOM 87 CD2 LEU A 336 -0.284 9.275 -3.338 1.00 0.39 C ATOM 0 HA LEU A 336 0.083 6.621 -3.990 1.00 0.60 H new ATOM 0 HB2 LEU A 336 -2.824 6.968 -3.204 1.00 0.36 H new ATOM 0 HB3 LEU A 336 -1.422 7.017 -2.155 1.00 0.36 H new ATOM 0 HG LEU A 336 -2.182 9.049 -4.262 1.00 0.30 H new ATOM 0 HD11 LEU A 336 -2.405 10.571 -2.335 1.00 0.25 H new ATOM 0 HD12 LEU A 336 -3.513 9.182 -2.221 1.00 0.25 H new ATOM 0 HD13 LEU A 336 -2.030 9.221 -1.238 1.00 0.25 H new ATOM 0 HD21 LEU A 336 -0.265 10.359 -3.453 1.00 0.39 H new ATOM 0 HD22 LEU A 336 0.209 9.000 -2.406 1.00 0.39 H new ATOM 0 HD23 LEU A 336 0.239 8.812 -4.175 1.00 0.39 H new ATOM 99 N LEU A 337 -1.017 4.428 -2.862 1.00 0.39 N ATOM 100 CA LEU A 337 -1.278 3.022 -2.588 1.00 0.30 C ATOM 101 C LEU A 337 -2.763 2.713 -2.654 1.00 0.26 C ATOM 102 O LEU A 337 -3.174 1.817 -3.390 1.00 0.25 O ATOM 103 CB LEU A 337 -0.713 2.636 -1.217 1.00 0.32 C ATOM 104 CG LEU A 337 -1.179 1.296 -0.639 1.00 0.31 C ATOM 105 CD1 LEU A 337 -0.797 0.136 -1.541 1.00 0.24 C ATOM 106 CD2 LEU A 337 -0.589 1.099 0.742 1.00 0.39 C ATOM 0 H LEU A 337 -0.609 4.939 -2.079 1.00 0.39 H new ATOM 0 HA LEU A 337 -0.780 2.431 -3.356 1.00 0.30 H new ATOM 0 HB2 LEU A 337 0.374 2.617 -1.289 1.00 0.32 H new ATOM 0 HB3 LEU A 337 -0.972 3.422 -0.508 1.00 0.32 H new ATOM 0 HG LEU A 337 -2.267 1.318 -0.570 1.00 0.31 H new ATOM 0 HD11 LEU A 337 -1.144 -0.798 -1.099 1.00 0.24 H new ATOM 0 HD12 LEU A 337 -1.259 0.268 -2.519 1.00 0.24 H new ATOM 0 HD13 LEU A 337 0.287 0.104 -1.653 1.00 0.24 H new ATOM 0 HD21 LEU A 337 -0.924 0.144 1.148 1.00 0.39 H new ATOM 0 HD22 LEU A 337 0.499 1.104 0.677 1.00 0.39 H new ATOM 0 HD23 LEU A 337 -0.917 1.907 1.396 1.00 0.39 H new ATOM 118 N TRP A 338 -3.564 3.479 -1.915 1.00 0.25 N ATOM 119 CA TRP A 338 -4.986 3.176 -1.765 1.00 0.24 C ATOM 120 C TRP A 338 -5.719 3.146 -3.106 1.00 0.24 C ATOM 121 O TRP A 338 -6.721 2.453 -3.241 1.00 0.24 O ATOM 122 CB TRP A 338 -5.674 4.133 -0.773 1.00 0.24 C ATOM 123 CG TRP A 338 -5.414 5.590 -1.017 1.00 0.21 C ATOM 124 CD1 TRP A 338 -4.667 6.421 -0.240 1.00 0.20 C ATOM 125 CD2 TRP A 338 -5.908 6.393 -2.094 1.00 0.22 C ATOM 126 NE1 TRP A 338 -4.654 7.680 -0.773 1.00 0.17 N ATOM 127 CE2 TRP A 338 -5.405 7.688 -1.914 1.00 0.19 C ATOM 128 CE3 TRP A 338 -6.717 6.140 -3.197 1.00 0.28 C ATOM 129 CZ2 TRP A 338 -5.685 8.723 -2.797 1.00 0.22 C ATOM 130 CZ3 TRP A 338 -6.994 7.167 -4.071 1.00 0.31 C ATOM 131 CH2 TRP A 338 -6.477 8.445 -3.869 1.00 0.28 C ATOM 0 H TRP A 338 -3.254 4.311 -1.413 1.00 0.25 H new ATOM 0 HA TRP A 338 -5.044 2.171 -1.347 1.00 0.24 H new ATOM 0 HB2 TRP A 338 -6.749 3.960 -0.810 1.00 0.24 H new ATOM 0 HB3 TRP A 338 -5.346 3.884 0.236 1.00 0.24 H new ATOM 0 HD1 TRP A 338 -4.158 6.128 0.666 1.00 0.20 H new ATOM 0 HE1 TRP A 338 -4.163 8.484 -0.382 1.00 0.17 H new ATOM 0 HE3 TRP A 338 -7.122 5.153 -3.365 1.00 0.28 H new ATOM 0 HZ2 TRP A 338 -5.288 9.715 -2.639 1.00 0.22 H new ATOM 0 HZ3 TRP A 338 -7.623 6.979 -4.928 1.00 0.31 H new ATOM 0 HH2 TRP A 338 -6.709 9.229 -4.575 1.00 0.28 H new ATOM 142 N ASP A 339 -5.219 3.879 -4.095 1.00 0.25 N ATOM 143 CA ASP A 339 -5.839 3.881 -5.417 1.00 0.27 C ATOM 144 C ASP A 339 -5.543 2.582 -6.118 1.00 0.26 C ATOM 145 O ASP A 339 -6.442 1.919 -6.628 1.00 0.33 O ATOM 146 CB ASP A 339 -5.350 5.070 -6.260 1.00 0.36 C ATOM 147 CG ASP A 339 -4.798 4.677 -7.632 1.00 1.00 C ATOM 148 OD1 ASP A 339 -5.606 4.364 -8.534 1.00 1.80 O ATOM 149 OD2 ASP A 339 -3.560 4.666 -7.809 1.00 1.19 O ATOM 0 H ASP A 339 -4.395 4.474 -4.009 1.00 0.25 H new ATOM 0 HA ASP A 339 -6.917 3.985 -5.292 1.00 0.27 H new ATOM 0 HB2 ASP A 339 -6.176 5.768 -6.399 1.00 0.36 H new ATOM 0 HB3 ASP A 339 -4.575 5.600 -5.706 1.00 0.36 H new ATOM 154 N TYR A 340 -4.279 2.209 -6.105 1.00 0.22 N ATOM 155 CA TYR A 340 -3.834 1.025 -6.794 1.00 0.20 C ATOM 156 C TYR A 340 -4.444 -0.222 -6.176 1.00 0.17 C ATOM 157 O TYR A 340 -4.933 -1.099 -6.882 1.00 0.17 O ATOM 158 CB TYR A 340 -2.318 0.936 -6.757 1.00 0.21 C ATOM 159 CG TYR A 340 -1.798 -0.250 -7.504 1.00 0.20 C ATOM 160 CD1 TYR A 340 -1.651 -0.209 -8.881 1.00 0.26 C ATOM 161 CD2 TYR A 340 -1.468 -1.413 -6.835 1.00 0.17 C ATOM 162 CE1 TYR A 340 -1.187 -1.297 -9.577 1.00 0.28 C ATOM 163 CE2 TYR A 340 -1.002 -2.511 -7.526 1.00 0.18 C ATOM 164 CZ TYR A 340 -0.864 -2.447 -8.900 1.00 0.24 C ATOM 165 OH TYR A 340 -0.405 -3.534 -9.602 1.00 0.28 O ATOM 0 H TYR A 340 -3.540 2.717 -5.619 1.00 0.22 H new ATOM 0 HA TYR A 340 -4.162 1.090 -7.831 1.00 0.20 H new ATOM 0 HB2 TYR A 340 -1.893 1.845 -7.183 1.00 0.21 H new ATOM 0 HB3 TYR A 340 -1.985 0.884 -5.720 1.00 0.21 H new ATOM 0 HD1 TYR A 340 -1.906 0.694 -9.416 1.00 0.26 H new ATOM 0 HD2 TYR A 340 -1.576 -1.462 -5.762 1.00 0.17 H new ATOM 0 HE1 TYR A 340 -1.077 -1.249 -10.650 1.00 0.28 H new ATOM 0 HE2 TYR A 340 -0.746 -3.417 -6.997 1.00 0.18 H new ATOM 0 HH TYR A 340 0.071 -3.229 -10.402 1.00 0.28 H new ATOM 175 N VAL A 341 -4.417 -0.295 -4.856 1.00 0.17 N ATOM 176 CA VAL A 341 -4.968 -1.438 -4.150 1.00 0.15 C ATOM 177 C VAL A 341 -6.480 -1.526 -4.359 1.00 0.15 C ATOM 178 O VAL A 341 -7.024 -2.608 -4.570 1.00 0.15 O ATOM 179 CB VAL A 341 -4.625 -1.381 -2.645 1.00 0.16 C ATOM 180 CG1 VAL A 341 -5.002 -0.043 -2.048 1.00 0.18 C ATOM 181 CG2 VAL A 341 -5.318 -2.493 -1.886 1.00 0.15 C ATOM 0 H VAL A 341 -4.019 0.424 -4.252 1.00 0.17 H new ATOM 0 HA VAL A 341 -4.513 -2.338 -4.563 1.00 0.15 H new ATOM 0 HB VAL A 341 -3.547 -1.512 -2.554 1.00 0.16 H new ATOM 0 HG11 VAL A 341 -4.749 -0.033 -0.988 1.00 0.18 H new ATOM 0 HG12 VAL A 341 -4.456 0.750 -2.559 1.00 0.18 H new ATOM 0 HG13 VAL A 341 -6.073 0.119 -2.166 1.00 0.18 H new ATOM 0 HG21 VAL A 341 -5.059 -2.429 -0.829 1.00 0.15 H new ATOM 0 HG22 VAL A 341 -6.397 -2.395 -2.001 1.00 0.15 H new ATOM 0 HG23 VAL A 341 -4.997 -3.457 -2.280 1.00 0.15 H new ATOM 191 N TYR A 342 -7.144 -0.378 -4.338 1.00 0.17 N ATOM 192 CA TYR A 342 -8.580 -0.315 -4.576 1.00 0.17 C ATOM 193 C TYR A 342 -8.871 -0.699 -6.025 1.00 0.17 C ATOM 194 O TYR A 342 -9.908 -1.285 -6.341 1.00 0.18 O ATOM 195 CB TYR A 342 -9.085 1.100 -4.278 1.00 0.20 C ATOM 196 CG TYR A 342 -10.583 1.232 -4.133 1.00 0.31 C ATOM 197 CD1 TYR A 342 -11.223 0.845 -2.965 1.00 0.48 C ATOM 198 CD2 TYR A 342 -11.352 1.763 -5.157 1.00 0.44 C ATOM 199 CE1 TYR A 342 -12.587 0.978 -2.824 1.00 0.67 C ATOM 200 CE2 TYR A 342 -12.717 1.903 -5.023 1.00 0.62 C ATOM 201 CZ TYR A 342 -13.331 1.507 -3.854 1.00 0.71 C ATOM 202 OH TYR A 342 -14.693 1.648 -3.713 1.00 0.92 O ATOM 0 H TYR A 342 -6.708 0.527 -4.158 1.00 0.17 H new ATOM 0 HA TYR A 342 -9.097 -1.014 -3.919 1.00 0.17 H new ATOM 0 HB2 TYR A 342 -8.615 1.450 -3.359 1.00 0.20 H new ATOM 0 HB3 TYR A 342 -8.754 1.762 -5.078 1.00 0.20 H new ATOM 0 HD1 TYR A 342 -10.643 0.433 -2.153 1.00 0.48 H new ATOM 0 HD2 TYR A 342 -10.874 2.072 -6.075 1.00 0.44 H new ATOM 0 HE1 TYR A 342 -13.070 0.668 -1.909 1.00 0.67 H new ATOM 0 HE2 TYR A 342 -13.302 2.321 -5.829 1.00 0.62 H new ATOM 0 HH TYR A 342 -15.068 2.038 -4.530 1.00 0.92 H new ATOM 212 N GLN A 343 -7.923 -0.363 -6.890 1.00 0.18 N ATOM 213 CA GLN A 343 -7.996 -0.666 -8.311 1.00 0.19 C ATOM 214 C GLN A 343 -7.791 -2.163 -8.558 1.00 0.18 C ATOM 215 O GLN A 343 -8.361 -2.729 -9.492 1.00 0.23 O ATOM 216 CB GLN A 343 -6.936 0.160 -9.045 1.00 0.26 C ATOM 217 CG GLN A 343 -7.031 0.133 -10.558 1.00 0.71 C ATOM 218 CD GLN A 343 -6.083 1.128 -11.207 1.00 1.41 C ATOM 219 OE1 GLN A 343 -5.592 0.911 -12.314 1.00 2.07 O ATOM 220 NE2 GLN A 343 -5.813 2.231 -10.519 1.00 2.22 N ATOM 0 H GLN A 343 -7.073 0.133 -6.621 1.00 0.18 H new ATOM 0 HA GLN A 343 -8.984 -0.407 -8.690 1.00 0.19 H new ATOM 0 HB2 GLN A 343 -7.009 1.195 -8.711 1.00 0.26 H new ATOM 0 HB3 GLN A 343 -5.950 -0.201 -8.752 1.00 0.26 H new ATOM 0 HG2 GLN A 343 -6.804 -0.871 -10.917 1.00 0.71 H new ATOM 0 HG3 GLN A 343 -8.054 0.357 -10.861 1.00 0.71 H new ATOM 0 HE21 GLN A 343 -6.238 2.378 -9.604 1.00 2.22 H new ATOM 0 HE22 GLN A 343 -5.180 2.931 -10.906 1.00 2.22 H new ATOM 229 N LEU A 344 -6.995 -2.807 -7.705 1.00 0.16 N ATOM 230 CA LEU A 344 -6.782 -4.246 -7.796 1.00 0.15 C ATOM 231 C LEU A 344 -8.056 -4.964 -7.399 1.00 0.17 C ATOM 232 O LEU A 344 -8.400 -6.010 -7.941 1.00 0.24 O ATOM 233 CB LEU A 344 -5.654 -4.693 -6.865 1.00 0.15 C ATOM 234 CG LEU A 344 -4.289 -4.058 -7.113 1.00 0.12 C ATOM 235 CD1 LEU A 344 -3.292 -4.561 -6.089 1.00 0.13 C ATOM 236 CD2 LEU A 344 -3.798 -4.355 -8.521 1.00 0.19 C ATOM 0 H LEU A 344 -6.489 -2.353 -6.945 1.00 0.16 H new ATOM 0 HA LEU A 344 -6.508 -4.489 -8.822 1.00 0.15 H new ATOM 0 HB2 LEU A 344 -5.951 -4.479 -5.838 1.00 0.15 H new ATOM 0 HB3 LEU A 344 -5.549 -5.775 -6.947 1.00 0.15 H new ATOM 0 HG LEU A 344 -4.388 -2.977 -7.013 1.00 0.12 H new ATOM 0 HD11 LEU A 344 -2.320 -4.103 -6.272 1.00 0.13 H new ATOM 0 HD12 LEU A 344 -3.634 -4.298 -5.088 1.00 0.13 H new ATOM 0 HD13 LEU A 344 -3.204 -5.644 -6.169 1.00 0.13 H new ATOM 0 HD21 LEU A 344 -2.823 -3.891 -8.672 1.00 0.19 H new ATOM 0 HD22 LEU A 344 -3.712 -5.433 -8.656 1.00 0.19 H new ATOM 0 HD23 LEU A 344 -4.507 -3.954 -9.246 1.00 0.19 H new ATOM 248 N LEU A 345 -8.750 -4.366 -6.444 1.00 0.18 N ATOM 249 CA LEU A 345 -9.984 -4.916 -5.917 1.00 0.20 C ATOM 250 C LEU A 345 -11.071 -4.973 -6.986 1.00 0.25 C ATOM 251 O LEU A 345 -11.993 -5.783 -6.906 1.00 0.36 O ATOM 252 CB LEU A 345 -10.457 -4.067 -4.736 1.00 0.17 C ATOM 253 CG LEU A 345 -9.552 -4.105 -3.506 1.00 0.15 C ATOM 254 CD1 LEU A 345 -9.932 -3.018 -2.515 1.00 0.16 C ATOM 255 CD2 LEU A 345 -9.628 -5.464 -2.835 1.00 0.15 C ATOM 0 H LEU A 345 -8.471 -3.484 -6.013 1.00 0.18 H new ATOM 0 HA LEU A 345 -9.790 -5.936 -5.585 1.00 0.20 H new ATOM 0 HB2 LEU A 345 -10.551 -3.033 -5.067 1.00 0.17 H new ATOM 0 HB3 LEU A 345 -11.453 -4.400 -4.445 1.00 0.17 H new ATOM 0 HG LEU A 345 -8.529 -3.927 -3.837 1.00 0.15 H new ATOM 0 HD11 LEU A 345 -9.272 -3.068 -1.649 1.00 0.16 H new ATOM 0 HD12 LEU A 345 -9.834 -2.042 -2.990 1.00 0.16 H new ATOM 0 HD13 LEU A 345 -10.963 -3.163 -2.194 1.00 0.16 H new ATOM 0 HD21 LEU A 345 -8.978 -5.475 -1.960 1.00 0.15 H new ATOM 0 HD22 LEU A 345 -10.655 -5.660 -2.526 1.00 0.15 H new ATOM 0 HD23 LEU A 345 -9.306 -6.234 -3.536 1.00 0.15 H new ATOM 267 N SER A 346 -10.954 -4.117 -7.989 1.00 0.28 N ATOM 268 CA SER A 346 -11.951 -4.052 -9.043 1.00 0.35 C ATOM 269 C SER A 346 -11.554 -4.909 -10.243 1.00 0.36 C ATOM 270 O SER A 346 -12.161 -4.818 -11.313 1.00 0.54 O ATOM 271 CB SER A 346 -12.170 -2.596 -9.464 1.00 0.46 C ATOM 272 OG SER A 346 -10.942 -1.947 -9.771 1.00 1.06 O ATOM 0 H SER A 346 -10.181 -3.460 -8.094 1.00 0.28 H new ATOM 0 HA SER A 346 -12.886 -4.453 -8.653 1.00 0.35 H new ATOM 0 HB2 SER A 346 -12.826 -2.563 -10.334 1.00 0.46 H new ATOM 0 HB3 SER A 346 -12.676 -2.058 -8.663 1.00 0.46 H new ATOM 0 HG SER A 346 -10.204 -2.586 -9.685 1.00 1.06 H new ATOM 278 N ASP A 347 -10.543 -5.748 -10.067 1.00 0.32 N ATOM 279 CA ASP A 347 -10.077 -6.589 -11.157 1.00 0.34 C ATOM 280 C ASP A 347 -9.801 -8.006 -10.666 1.00 0.34 C ATOM 281 O ASP A 347 -9.043 -8.211 -9.721 1.00 0.43 O ATOM 282 CB ASP A 347 -8.815 -6.001 -11.784 1.00 0.41 C ATOM 283 CG ASP A 347 -8.793 -6.163 -13.291 1.00 0.80 C ATOM 284 OD1 ASP A 347 -9.189 -7.242 -13.782 1.00 0.99 O ATOM 285 OD2 ASP A 347 -8.379 -5.211 -13.989 1.00 1.18 O ATOM 0 H ASP A 347 -10.035 -5.863 -9.190 1.00 0.32 H new ATOM 0 HA ASP A 347 -10.862 -6.628 -11.912 1.00 0.34 H new ATOM 0 HB2 ASP A 347 -8.747 -4.942 -11.533 1.00 0.41 H new ATOM 0 HB3 ASP A 347 -7.939 -6.487 -11.356 1.00 0.41 H new ATOM 290 N SER A 348 -10.409 -8.980 -11.327 1.00 0.40 N ATOM 291 CA SER A 348 -10.303 -10.376 -10.933 1.00 0.43 C ATOM 292 C SER A 348 -8.947 -10.986 -11.278 1.00 0.35 C ATOM 293 O SER A 348 -8.725 -12.162 -11.030 1.00 0.40 O ATOM 294 CB SER A 348 -11.429 -11.177 -11.579 1.00 0.59 C ATOM 295 OG SER A 348 -11.636 -10.772 -12.924 1.00 0.79 O ATOM 0 H SER A 348 -10.989 -8.824 -12.151 1.00 0.40 H new ATOM 0 HA SER A 348 -10.394 -10.417 -9.848 1.00 0.43 H new ATOM 0 HB2 SER A 348 -11.188 -12.240 -11.549 1.00 0.59 H new ATOM 0 HB3 SER A 348 -12.349 -11.043 -11.010 1.00 0.59 H new ATOM 0 HG SER A 348 -12.361 -11.301 -13.317 1.00 0.79 H new ATOM 301 N ARG A 349 -8.063 -10.209 -11.894 1.00 0.34 N ATOM 302 CA ARG A 349 -6.710 -10.670 -12.176 1.00 0.37 C ATOM 303 C ARG A 349 -5.970 -10.984 -10.885 1.00 0.31 C ATOM 304 O ARG A 349 -5.210 -11.946 -10.789 1.00 0.42 O ATOM 305 CB ARG A 349 -5.931 -9.593 -12.898 1.00 0.45 C ATOM 306 CG ARG A 349 -6.669 -8.954 -14.048 1.00 0.71 C ATOM 307 CD ARG A 349 -5.727 -8.105 -14.857 1.00 1.07 C ATOM 308 NE ARG A 349 -6.397 -7.406 -15.951 1.00 1.86 N ATOM 309 CZ ARG A 349 -5.777 -6.600 -16.810 1.00 2.54 C ATOM 310 NH1 ARG A 349 -4.466 -6.414 -16.722 1.00 2.75 N ATOM 311 NH2 ARG A 349 -6.464 -5.975 -17.757 1.00 3.43 N ATOM 0 H ARG A 349 -8.259 -9.258 -12.207 1.00 0.34 H new ATOM 0 HA ARG A 349 -6.789 -11.566 -12.792 1.00 0.37 H new ATOM 0 HB2 ARG A 349 -5.658 -8.818 -12.182 1.00 0.45 H new ATOM 0 HB3 ARG A 349 -5.002 -10.023 -13.273 1.00 0.45 H new ATOM 0 HG2 ARG A 349 -7.111 -9.724 -14.680 1.00 0.71 H new ATOM 0 HG3 ARG A 349 -7.489 -8.343 -13.670 1.00 0.71 H new ATOM 0 HD2 ARG A 349 -5.250 -7.375 -14.203 1.00 1.07 H new ATOM 0 HD3 ARG A 349 -4.935 -8.734 -15.264 1.00 1.07 H new ATOM 0 HE ARG A 349 -7.401 -7.544 -16.063 1.00 1.86 H new ATOM 0 HH11 ARG A 349 -3.931 -6.889 -15.995 1.00 2.75 H new ATOM 0 HH12 ARG A 349 -3.993 -5.796 -17.381 1.00 2.75 H new ATOM 0 HH21 ARG A 349 -7.472 -6.111 -17.830 1.00 3.43 H new ATOM 0 HH22 ARG A 349 -5.984 -5.358 -18.413 1.00 3.43 H new ATOM 325 N TYR A 350 -6.187 -10.126 -9.906 1.00 0.26 N ATOM 326 CA TYR A 350 -5.414 -10.135 -8.677 1.00 0.30 C ATOM 327 C TYR A 350 -6.144 -10.800 -7.509 1.00 0.24 C ATOM 328 O TYR A 350 -5.853 -10.475 -6.364 1.00 0.25 O ATOM 329 CB TYR A 350 -5.081 -8.694 -8.289 1.00 0.40 C ATOM 330 CG TYR A 350 -4.832 -7.803 -9.480 1.00 0.47 C ATOM 331 CD1 TYR A 350 -3.628 -7.848 -10.160 1.00 0.54 C ATOM 332 CD2 TYR A 350 -5.809 -6.925 -9.936 1.00 0.52 C ATOM 333 CE1 TYR A 350 -3.399 -7.045 -11.255 1.00 0.61 C ATOM 334 CE2 TYR A 350 -5.587 -6.120 -11.034 1.00 0.60 C ATOM 335 CZ TYR A 350 -4.381 -6.182 -11.691 1.00 0.63 C ATOM 336 OH TYR A 350 -4.158 -5.381 -12.789 1.00 0.72 O ATOM 0 H TYR A 350 -6.905 -9.402 -9.940 1.00 0.26 H new ATOM 0 HA TYR A 350 -4.514 -10.719 -8.871 1.00 0.30 H new ATOM 0 HB2 TYR A 350 -5.902 -8.283 -7.701 1.00 0.40 H new ATOM 0 HB3 TYR A 350 -4.198 -8.691 -7.650 1.00 0.40 H new ATOM 0 HD1 TYR A 350 -2.855 -8.524 -9.826 1.00 0.54 H new ATOM 0 HD2 TYR A 350 -6.757 -6.872 -9.422 1.00 0.52 H new ATOM 0 HE1 TYR A 350 -2.451 -7.091 -11.771 1.00 0.61 H new ATOM 0 HE2 TYR A 350 -6.357 -5.444 -11.376 1.00 0.60 H new ATOM 0 HH TYR A 350 -4.953 -4.834 -12.962 1.00 0.72 H new ATOM 346 N GLU A 351 -7.073 -11.719 -7.763 1.00 0.22 N ATOM 347 CA GLU A 351 -7.895 -12.265 -6.690 1.00 0.23 C ATOM 348 C GLU A 351 -7.064 -13.009 -5.637 1.00 0.21 C ATOM 349 O GLU A 351 -7.410 -13.013 -4.456 1.00 0.25 O ATOM 350 CB GLU A 351 -8.970 -13.179 -7.271 1.00 0.31 C ATOM 351 CG GLU A 351 -8.476 -14.523 -7.803 1.00 0.36 C ATOM 352 CD GLU A 351 -7.235 -14.455 -8.669 1.00 0.97 C ATOM 353 OE1 GLU A 351 -7.246 -13.744 -9.680 1.00 1.22 O ATOM 354 OE2 GLU A 351 -6.238 -15.120 -8.335 1.00 1.45 O ATOM 0 H GLU A 351 -7.273 -12.096 -8.690 1.00 0.22 H new ATOM 0 HA GLU A 351 -8.369 -11.426 -6.181 1.00 0.23 H new ATOM 0 HB2 GLU A 351 -9.718 -13.366 -6.500 1.00 0.31 H new ATOM 0 HB3 GLU A 351 -9.472 -12.650 -8.081 1.00 0.31 H new ATOM 0 HG2 GLU A 351 -8.274 -15.179 -6.956 1.00 0.36 H new ATOM 0 HG3 GLU A 351 -9.278 -14.985 -8.380 1.00 0.36 H new ATOM 361 N ASN A 352 -5.976 -13.641 -6.060 1.00 0.22 N ATOM 362 CA ASN A 352 -5.114 -14.357 -5.137 1.00 0.24 C ATOM 363 C ASN A 352 -4.099 -13.402 -4.527 1.00 0.19 C ATOM 364 O ASN A 352 -3.273 -13.790 -3.706 1.00 0.21 O ATOM 365 CB ASN A 352 -4.382 -15.500 -5.826 1.00 0.32 C ATOM 366 CG ASN A 352 -4.143 -16.677 -4.899 1.00 0.62 C ATOM 367 OD1 ASN A 352 -4.814 -17.701 -4.999 1.00 1.06 O ATOM 368 ND2 ASN A 352 -3.229 -16.523 -3.959 1.00 1.06 N ATOM 0 H ASN A 352 -5.673 -13.671 -7.034 1.00 0.22 H new ATOM 0 HA ASN A 352 -5.745 -14.778 -4.354 1.00 0.24 H new ATOM 0 HB2 ASN A 352 -4.961 -15.832 -6.688 1.00 0.32 H new ATOM 0 HB3 ASN A 352 -3.426 -15.139 -6.205 1.00 0.32 H new ATOM 0 HD21 ASN A 352 -3.061 -17.269 -3.284 1.00 1.06 H new ATOM 0 HD22 ASN A 352 -2.691 -15.658 -3.908 1.00 1.06 H new ATOM 375 N PHE A 353 -4.151 -12.154 -4.956 1.00 0.16 N ATOM 376 CA PHE A 353 -3.313 -11.114 -4.390 1.00 0.14 C ATOM 377 C PHE A 353 -4.133 -10.320 -3.386 1.00 0.12 C ATOM 378 O PHE A 353 -3.697 -10.065 -2.265 1.00 0.11 O ATOM 379 CB PHE A 353 -2.779 -10.182 -5.485 1.00 0.16 C ATOM 380 CG PHE A 353 -1.847 -10.841 -6.463 1.00 0.19 C ATOM 381 CD1 PHE A 353 -2.331 -11.698 -7.440 1.00 0.30 C ATOM 382 CD2 PHE A 353 -0.484 -10.592 -6.413 1.00 0.21 C ATOM 383 CE1 PHE A 353 -1.477 -12.294 -8.343 1.00 0.34 C ATOM 384 CE2 PHE A 353 0.375 -11.185 -7.318 1.00 0.25 C ATOM 385 CZ PHE A 353 -0.122 -12.037 -8.283 1.00 0.29 C ATOM 0 H PHE A 353 -4.770 -11.835 -5.701 1.00 0.16 H new ATOM 0 HA PHE A 353 -2.457 -11.574 -3.896 1.00 0.14 H new ATOM 0 HB2 PHE A 353 -3.624 -9.764 -6.032 1.00 0.16 H new ATOM 0 HB3 PHE A 353 -2.260 -9.348 -5.013 1.00 0.16 H new ATOM 0 HD1 PHE A 353 -3.390 -11.901 -7.494 1.00 0.30 H new ATOM 0 HD2 PHE A 353 -0.090 -9.927 -5.659 1.00 0.21 H new ATOM 0 HE1 PHE A 353 -1.868 -12.961 -9.097 1.00 0.34 H new ATOM 0 HE2 PHE A 353 1.435 -10.982 -7.270 1.00 0.25 H new ATOM 0 HZ PHE A 353 0.548 -12.502 -8.991 1.00 0.29 H new ATOM 395 N ILE A 354 -5.334 -9.948 -3.801 1.00 0.11 N ATOM 396 CA ILE A 354 -6.254 -9.207 -2.959 1.00 0.11 C ATOM 397 C ILE A 354 -7.690 -9.408 -3.447 1.00 0.12 C ATOM 398 O ILE A 354 -7.916 -9.625 -4.635 1.00 0.16 O ATOM 399 CB ILE A 354 -5.894 -7.714 -2.960 1.00 0.11 C ATOM 400 CG1 ILE A 354 -6.685 -6.976 -1.892 1.00 0.12 C ATOM 401 CG2 ILE A 354 -6.140 -7.099 -4.332 1.00 0.13 C ATOM 402 CD1 ILE A 354 -6.160 -5.597 -1.620 1.00 0.12 C ATOM 0 H ILE A 354 -5.697 -10.153 -4.732 1.00 0.11 H new ATOM 0 HA ILE A 354 -6.175 -9.581 -1.938 1.00 0.11 H new ATOM 0 HB ILE A 354 -4.833 -7.618 -2.731 1.00 0.11 H new ATOM 0 HG12 ILE A 354 -7.727 -6.907 -2.203 1.00 0.12 H new ATOM 0 HG13 ILE A 354 -6.665 -7.555 -0.969 1.00 0.12 H new ATOM 0 HG21 ILE A 354 -5.878 -6.041 -4.309 1.00 0.13 H new ATOM 0 HG22 ILE A 354 -5.526 -7.609 -5.075 1.00 0.13 H new ATOM 0 HG23 ILE A 354 -7.192 -7.207 -4.596 1.00 0.13 H new ATOM 0 HD11 ILE A 354 -6.767 -5.122 -0.849 1.00 0.12 H new ATOM 0 HD12 ILE A 354 -5.126 -5.662 -1.280 1.00 0.12 H new ATOM 0 HD13 ILE A 354 -6.205 -5.004 -2.533 1.00 0.12 H new ATOM 414 N ARG A 355 -8.655 -9.371 -2.537 1.00 0.12 N ATOM 415 CA ARG A 355 -10.049 -9.556 -2.917 1.00 0.14 C ATOM 416 C ARG A 355 -10.999 -8.905 -1.912 1.00 0.14 C ATOM 417 O ARG A 355 -10.692 -8.796 -0.723 1.00 0.15 O ATOM 418 CB ARG A 355 -10.358 -11.050 -3.053 1.00 0.18 C ATOM 419 CG ARG A 355 -10.094 -11.843 -1.786 1.00 0.24 C ATOM 420 CD ARG A 355 -10.386 -13.321 -1.976 1.00 0.40 C ATOM 421 NE ARG A 355 -9.552 -13.933 -3.004 1.00 0.90 N ATOM 422 CZ ARG A 355 -9.815 -15.115 -3.561 1.00 1.53 C ATOM 423 NH1 ARG A 355 -10.917 -15.780 -3.226 1.00 1.59 N ATOM 424 NH2 ARG A 355 -8.982 -15.618 -4.464 1.00 2.39 N ATOM 0 H ARG A 355 -8.501 -9.216 -1.541 1.00 0.12 H new ATOM 0 HA ARG A 355 -10.204 -9.066 -3.878 1.00 0.14 H new ATOM 0 HB2 ARG A 355 -11.403 -11.172 -3.337 1.00 0.18 H new ATOM 0 HB3 ARG A 355 -9.758 -11.464 -3.863 1.00 0.18 H new ATOM 0 HG2 ARG A 355 -9.054 -11.713 -1.486 1.00 0.24 H new ATOM 0 HG3 ARG A 355 -10.711 -11.452 -0.977 1.00 0.24 H new ATOM 0 HD2 ARG A 355 -10.231 -13.842 -1.031 1.00 0.40 H new ATOM 0 HD3 ARG A 355 -11.435 -13.448 -2.242 1.00 0.40 H new ATOM 0 HE ARG A 355 -8.721 -13.429 -3.314 1.00 0.90 H new ATOM 0 HH11 ARG A 355 -11.563 -15.386 -2.542 1.00 1.59 H new ATOM 0 HH12 ARG A 355 -11.117 -16.684 -3.653 1.00 1.59 H new ATOM 0 HH21 ARG A 355 -8.144 -15.100 -4.729 1.00 2.39 H new ATOM 0 HH22 ARG A 355 -9.180 -16.522 -4.892 1.00 2.39 H new ATOM 438 N TRP A 356 -12.148 -8.462 -2.413 1.00 0.15 N ATOM 439 CA TRP A 356 -13.195 -7.878 -1.579 1.00 0.16 C ATOM 440 C TRP A 356 -13.861 -8.931 -0.702 1.00 0.18 C ATOM 441 O TRP A 356 -14.338 -9.951 -1.199 1.00 0.25 O ATOM 442 CB TRP A 356 -14.275 -7.228 -2.448 1.00 0.18 C ATOM 443 CG TRP A 356 -13.945 -5.849 -2.918 1.00 0.18 C ATOM 444 CD1 TRP A 356 -13.763 -5.436 -4.205 1.00 0.21 C ATOM 445 CD2 TRP A 356 -13.773 -4.694 -2.098 1.00 0.16 C ATOM 446 NE1 TRP A 356 -13.498 -4.089 -4.228 1.00 0.22 N ATOM 447 CE2 TRP A 356 -13.495 -3.616 -2.945 1.00 0.19 C ATOM 448 CE3 TRP A 356 -13.827 -4.468 -0.727 1.00 0.15 C ATOM 449 CZ2 TRP A 356 -13.275 -2.333 -2.461 1.00 0.21 C ATOM 450 CZ3 TRP A 356 -13.605 -3.197 -0.251 1.00 0.17 C ATOM 451 CH2 TRP A 356 -13.334 -2.142 -1.113 1.00 0.20 C ATOM 0 H TRP A 356 -12.380 -8.497 -3.406 1.00 0.15 H new ATOM 0 HA TRP A 356 -12.717 -7.130 -0.947 1.00 0.16 H new ATOM 0 HB2 TRP A 356 -14.454 -7.861 -3.317 1.00 0.18 H new ATOM 0 HB3 TRP A 356 -15.206 -7.192 -1.882 1.00 0.18 H new ATOM 0 HD1 TRP A 356 -13.819 -6.073 -5.075 1.00 0.21 H new ATOM 0 HE1 TRP A 356 -13.331 -3.532 -5.066 1.00 0.22 H new ATOM 0 HE3 TRP A 356 -14.040 -5.279 -0.046 1.00 0.15 H new ATOM 0 HZ2 TRP A 356 -13.064 -1.513 -3.131 1.00 0.21 H new ATOM 0 HZ3 TRP A 356 -13.642 -3.016 0.813 1.00 0.17 H new ATOM 0 HH2 TRP A 356 -13.167 -1.155 -0.708 1.00 0.20 H new ATOM 462 N GLU A 357 -13.897 -8.674 0.598 1.00 0.18 N ATOM 463 CA GLU A 357 -14.643 -9.508 1.525 1.00 0.22 C ATOM 464 C GLU A 357 -16.061 -8.968 1.656 1.00 0.22 C ATOM 465 O GLU A 357 -17.038 -9.702 1.505 1.00 0.31 O ATOM 466 CB GLU A 357 -13.960 -9.531 2.889 1.00 0.25 C ATOM 467 CG GLU A 357 -12.619 -10.235 2.877 1.00 0.52 C ATOM 468 CD GLU A 357 -12.729 -11.694 2.493 1.00 0.45 C ATOM 469 OE1 GLU A 357 -13.160 -12.506 3.340 1.00 0.73 O ATOM 470 OE2 GLU A 357 -12.397 -12.035 1.344 1.00 0.79 O ATOM 0 H GLU A 357 -13.414 -7.889 1.035 1.00 0.18 H new ATOM 0 HA GLU A 357 -14.677 -10.528 1.143 1.00 0.22 H new ATOM 0 HB2 GLU A 357 -13.822 -8.507 3.235 1.00 0.25 H new ATOM 0 HB3 GLU A 357 -14.615 -10.024 3.607 1.00 0.25 H new ATOM 0 HG2 GLU A 357 -11.954 -9.729 2.178 1.00 0.52 H new ATOM 0 HG3 GLU A 357 -12.163 -10.157 3.864 1.00 0.52 H new ATOM 477 N ASP A 358 -16.147 -7.670 1.915 1.00 0.19 N ATOM 478 CA ASP A 358 -17.417 -6.962 2.002 1.00 0.22 C ATOM 479 C ASP A 358 -17.290 -5.639 1.262 1.00 0.20 C ATOM 480 O ASP A 358 -16.926 -4.632 1.862 1.00 0.22 O ATOM 481 CB ASP A 358 -17.798 -6.668 3.461 1.00 0.28 C ATOM 482 CG ASP A 358 -18.025 -7.906 4.303 1.00 1.02 C ATOM 483 OD1 ASP A 358 -17.055 -8.405 4.908 1.00 2.07 O ATOM 484 OD2 ASP A 358 -19.183 -8.362 4.395 1.00 1.30 O ATOM 0 H ASP A 358 -15.333 -7.076 2.071 1.00 0.19 H new ATOM 0 HA ASP A 358 -18.190 -7.591 1.561 1.00 0.22 H new ATOM 0 HB2 ASP A 358 -17.009 -6.071 3.918 1.00 0.28 H new ATOM 0 HB3 ASP A 358 -18.704 -6.062 3.474 1.00 0.28 H new ATOM 489 N LYS A 359 -17.585 -5.636 -0.032 1.00 0.23 N ATOM 490 CA LYS A 359 -17.354 -4.455 -0.865 1.00 0.26 C ATOM 491 C LYS A 359 -18.184 -3.257 -0.400 1.00 0.28 C ATOM 492 O LYS A 359 -17.717 -2.120 -0.447 1.00 0.33 O ATOM 493 CB LYS A 359 -17.634 -4.762 -2.337 1.00 0.35 C ATOM 494 CG LYS A 359 -17.308 -3.604 -3.277 1.00 0.41 C ATOM 495 CD LYS A 359 -17.007 -4.098 -4.682 1.00 0.60 C ATOM 496 CE LYS A 359 -16.673 -2.953 -5.628 1.00 0.96 C ATOM 497 NZ LYS A 359 -17.871 -2.141 -5.969 1.00 1.65 N ATOM 0 H LYS A 359 -17.983 -6.433 -0.529 1.00 0.23 H new ATOM 0 HA LYS A 359 -16.303 -4.188 -0.759 1.00 0.26 H new ATOM 0 HB2 LYS A 359 -17.052 -5.635 -2.634 1.00 0.35 H new ATOM 0 HB3 LYS A 359 -18.685 -5.026 -2.451 1.00 0.35 H new ATOM 0 HG2 LYS A 359 -18.148 -2.910 -3.306 1.00 0.41 H new ATOM 0 HG3 LYS A 359 -16.451 -3.052 -2.892 1.00 0.41 H new ATOM 0 HD2 LYS A 359 -16.172 -4.797 -4.650 1.00 0.60 H new ATOM 0 HD3 LYS A 359 -17.867 -4.647 -5.066 1.00 0.60 H new ATOM 0 HE2 LYS A 359 -15.920 -2.312 -5.169 1.00 0.96 H new ATOM 0 HE3 LYS A 359 -16.236 -3.355 -6.542 1.00 0.96 H new ATOM 0 HZ1 LYS A 359 -17.608 -1.404 -6.654 1.00 1.65 H new ATOM 0 HZ2 LYS A 359 -18.600 -2.755 -6.384 1.00 1.65 H new ATOM 0 HZ3 LYS A 359 -18.244 -1.694 -5.107 1.00 1.65 H new ATOM 511 N GLU A 360 -19.402 -3.513 0.068 1.00 0.32 N ATOM 512 CA GLU A 360 -20.272 -2.446 0.545 1.00 0.36 C ATOM 513 C GLU A 360 -19.764 -1.882 1.872 1.00 0.34 C ATOM 514 O GLU A 360 -19.754 -0.669 2.080 1.00 0.42 O ATOM 515 CB GLU A 360 -21.709 -2.953 0.693 1.00 0.45 C ATOM 516 CG GLU A 360 -22.696 -1.873 1.099 1.00 0.94 C ATOM 517 CD GLU A 360 -24.120 -2.378 1.144 1.00 1.10 C ATOM 518 OE1 GLU A 360 -24.547 -2.870 2.209 1.00 1.40 O ATOM 519 OE2 GLU A 360 -24.826 -2.275 0.122 1.00 1.33 O ATOM 0 H GLU A 360 -19.807 -4.447 0.127 1.00 0.32 H new ATOM 0 HA GLU A 360 -20.261 -1.643 -0.192 1.00 0.36 H new ATOM 0 HB2 GLU A 360 -22.030 -3.390 -0.252 1.00 0.45 H new ATOM 0 HB3 GLU A 360 -21.729 -3.750 1.436 1.00 0.45 H new ATOM 0 HG2 GLU A 360 -22.421 -1.484 2.079 1.00 0.94 H new ATOM 0 HG3 GLU A 360 -22.630 -1.042 0.396 1.00 0.94 H new ATOM 526 N SER A 361 -19.330 -2.768 2.761 1.00 0.28 N ATOM 527 CA SER A 361 -18.746 -2.360 4.028 1.00 0.27 C ATOM 528 C SER A 361 -17.346 -1.785 3.814 1.00 0.23 C ATOM 529 O SER A 361 -16.791 -1.124 4.691 1.00 0.25 O ATOM 530 CB SER A 361 -18.686 -3.562 4.973 1.00 0.29 C ATOM 531 OG SER A 361 -19.987 -4.016 5.313 1.00 1.10 O ATOM 0 H SER A 361 -19.373 -3.778 2.624 1.00 0.28 H new ATOM 0 HA SER A 361 -19.369 -1.583 4.472 1.00 0.27 H new ATOM 0 HB2 SER A 361 -18.128 -4.371 4.501 1.00 0.29 H new ATOM 0 HB3 SER A 361 -18.146 -3.288 5.879 1.00 0.29 H new ATOM 0 HG SER A 361 -19.918 -4.785 5.916 1.00 1.10 H new ATOM 537 N LYS A 362 -16.811 -2.030 2.614 1.00 0.20 N ATOM 538 CA LYS A 362 -15.465 -1.617 2.219 1.00 0.19 C ATOM 539 C LYS A 362 -14.407 -2.455 2.939 1.00 0.15 C ATOM 540 O LYS A 362 -13.263 -2.033 3.091 1.00 0.16 O ATOM 541 CB LYS A 362 -15.234 -0.120 2.467 1.00 0.24 C ATOM 542 CG LYS A 362 -16.311 0.772 1.867 1.00 0.33 C ATOM 543 CD LYS A 362 -16.260 0.775 0.351 1.00 0.46 C ATOM 544 CE LYS A 362 -17.461 1.492 -0.245 1.00 1.22 C ATOM 545 NZ LYS A 362 -17.591 2.880 0.269 1.00 1.83 N ATOM 0 H LYS A 362 -17.311 -2.530 1.879 1.00 0.20 H new ATOM 0 HA LYS A 362 -15.372 -1.789 1.147 1.00 0.19 H new ATOM 0 HB2 LYS A 362 -15.184 0.058 3.541 1.00 0.24 H new ATOM 0 HB3 LYS A 362 -14.267 0.163 2.052 1.00 0.24 H new ATOM 0 HG2 LYS A 362 -17.292 0.430 2.197 1.00 0.33 H new ATOM 0 HG3 LYS A 362 -16.188 1.790 2.237 1.00 0.33 H new ATOM 0 HD2 LYS A 362 -15.343 1.260 0.018 1.00 0.46 H new ATOM 0 HD3 LYS A 362 -16.229 -0.251 -0.015 1.00 0.46 H new ATOM 0 HE2 LYS A 362 -17.368 1.515 -1.331 1.00 1.22 H new ATOM 0 HE3 LYS A 362 -18.368 0.933 -0.014 1.00 1.22 H new ATOM 0 HZ1 LYS A 362 -18.336 3.377 -0.259 1.00 1.83 H new ATOM 0 HZ2 LYS A 362 -17.840 2.854 1.278 1.00 1.83 H new ATOM 0 HZ3 LYS A 362 -16.688 3.381 0.148 1.00 1.83 H new ATOM 559 N ILE A 363 -14.799 -3.653 3.357 1.00 0.14 N ATOM 560 CA ILE A 363 -13.882 -4.590 3.998 1.00 0.13 C ATOM 561 C ILE A 363 -13.207 -5.433 2.915 1.00 0.11 C ATOM 562 O ILE A 363 -13.882 -6.109 2.135 1.00 0.14 O ATOM 563 CB ILE A 363 -14.600 -5.536 5.013 1.00 0.15 C ATOM 564 CG1 ILE A 363 -15.027 -4.827 6.313 1.00 0.19 C ATOM 565 CG2 ILE A 363 -13.689 -6.694 5.383 1.00 0.17 C ATOM 566 CD1 ILE A 363 -15.685 -3.491 6.144 1.00 0.19 C ATOM 0 H ILE A 363 -15.753 -4.001 3.263 1.00 0.14 H new ATOM 0 HA ILE A 363 -13.151 -4.008 4.560 1.00 0.13 H new ATOM 0 HB ILE A 363 -15.501 -5.885 4.509 1.00 0.15 H new ATOM 0 HG12 ILE A 363 -15.711 -5.482 6.853 1.00 0.19 H new ATOM 0 HG13 ILE A 363 -14.145 -4.699 6.941 1.00 0.19 H new ATOM 0 HG21 ILE A 363 -14.200 -7.347 6.091 1.00 0.17 H new ATOM 0 HG22 ILE A 363 -13.436 -7.259 4.486 1.00 0.17 H new ATOM 0 HG23 ILE A 363 -12.777 -6.308 5.838 1.00 0.17 H new ATOM 0 HD11 ILE A 363 -15.942 -3.086 7.123 1.00 0.19 H new ATOM 0 HD12 ILE A 363 -15.001 -2.810 5.638 1.00 0.19 H new ATOM 0 HD13 ILE A 363 -16.591 -3.604 5.549 1.00 0.19 H new ATOM 578 N PHE A 364 -11.887 -5.393 2.859 1.00 0.09 N ATOM 579 CA PHE A 364 -11.153 -6.060 1.792 1.00 0.08 C ATOM 580 C PHE A 364 -9.980 -6.854 2.362 1.00 0.08 C ATOM 581 O PHE A 364 -9.338 -6.424 3.324 1.00 0.09 O ATOM 582 CB PHE A 364 -10.658 -5.027 0.772 1.00 0.09 C ATOM 583 CG PHE A 364 -9.458 -4.238 1.222 1.00 0.09 C ATOM 584 CD1 PHE A 364 -9.584 -3.203 2.134 1.00 0.09 C ATOM 585 CD2 PHE A 364 -8.203 -4.541 0.732 1.00 0.10 C ATOM 586 CE1 PHE A 364 -8.474 -2.484 2.542 1.00 0.10 C ATOM 587 CE2 PHE A 364 -7.092 -3.831 1.135 1.00 0.10 C ATOM 588 CZ PHE A 364 -7.225 -2.801 2.040 1.00 0.10 C ATOM 0 H PHE A 364 -11.300 -4.907 3.537 1.00 0.09 H new ATOM 0 HA PHE A 364 -11.823 -6.757 1.289 1.00 0.08 H new ATOM 0 HB2 PHE A 364 -10.413 -5.540 -0.158 1.00 0.09 H new ATOM 0 HB3 PHE A 364 -11.470 -4.335 0.549 1.00 0.09 H new ATOM 0 HD1 PHE A 364 -10.557 -2.955 2.530 1.00 0.09 H new ATOM 0 HD2 PHE A 364 -8.090 -5.347 0.022 1.00 0.10 H new ATOM 0 HE1 PHE A 364 -8.583 -1.677 3.251 1.00 0.10 H new ATOM 0 HE2 PHE A 364 -6.118 -4.082 0.741 1.00 0.10 H new ATOM 0 HZ PHE A 364 -6.356 -2.243 2.357 1.00 0.10 H new ATOM 598 N ARG A 365 -9.702 -8.014 1.780 1.00 0.08 N ATOM 599 CA ARG A 365 -8.621 -8.856 2.262 1.00 0.09 C ATOM 600 C ARG A 365 -7.443 -8.831 1.322 1.00 0.09 C ATOM 601 O ARG A 365 -7.589 -9.023 0.115 1.00 0.10 O ATOM 602 CB ARG A 365 -9.051 -10.313 2.416 1.00 0.13 C ATOM 603 CG ARG A 365 -7.906 -11.209 2.870 1.00 0.20 C ATOM 604 CD ARG A 365 -8.131 -12.675 2.535 1.00 0.26 C ATOM 605 NE ARG A 365 -9.341 -13.212 3.149 1.00 0.58 N ATOM 606 CZ ARG A 365 -10.049 -14.222 2.635 1.00 0.73 C ATOM 607 NH1 ARG A 365 -9.682 -14.772 1.484 1.00 1.04 N ATOM 608 NH2 ARG A 365 -11.120 -14.686 3.269 1.00 1.14 N ATOM 0 H ARG A 365 -10.209 -8.389 0.978 1.00 0.08 H new ATOM 0 HA ARG A 365 -8.343 -8.449 3.234 1.00 0.09 H new ATOM 0 HB2 ARG A 365 -9.866 -10.375 3.138 1.00 0.13 H new ATOM 0 HB3 ARG A 365 -9.439 -10.677 1.465 1.00 0.13 H new ATOM 0 HG2 ARG A 365 -6.981 -10.873 2.402 1.00 0.20 H new ATOM 0 HG3 ARG A 365 -7.775 -11.104 3.947 1.00 0.20 H new ATOM 0 HD2 ARG A 365 -8.195 -12.791 1.453 1.00 0.26 H new ATOM 0 HD3 ARG A 365 -7.271 -13.256 2.868 1.00 0.26 H new ATOM 0 HE ARG A 365 -9.665 -12.792 4.020 1.00 0.58 H new ATOM 0 HH11 ARG A 365 -8.859 -14.424 0.992 1.00 1.04 H new ATOM 0 HH12 ARG A 365 -10.223 -15.543 1.092 1.00 1.04 H new ATOM 0 HH21 ARG A 365 -11.408 -14.271 4.155 1.00 1.14 H new ATOM 0 HH22 ARG A 365 -11.655 -15.457 2.870 1.00 1.14 H new ATOM 622 N ILE A 366 -6.276 -8.635 1.891 1.00 0.09 N ATOM 623 CA ILE A 366 -5.049 -8.840 1.163 1.00 0.09 C ATOM 624 C ILE A 366 -4.682 -10.311 1.245 1.00 0.09 C ATOM 625 O ILE A 366 -4.440 -10.855 2.326 1.00 0.12 O ATOM 626 CB ILE A 366 -3.919 -7.941 1.691 1.00 0.10 C ATOM 627 CG1 ILE A 366 -4.237 -6.486 1.315 1.00 0.11 C ATOM 628 CG2 ILE A 366 -2.580 -8.387 1.127 1.00 0.09 C ATOM 629 CD1 ILE A 366 -3.223 -5.473 1.792 1.00 0.12 C ATOM 0 H ILE A 366 -6.152 -8.333 2.857 1.00 0.09 H new ATOM 0 HA ILE A 366 -5.194 -8.560 0.120 1.00 0.09 H new ATOM 0 HB ILE A 366 -3.850 -8.019 2.776 1.00 0.10 H new ATOM 0 HG12 ILE A 366 -4.318 -6.415 0.230 1.00 0.11 H new ATOM 0 HG13 ILE A 366 -5.212 -6.224 1.725 1.00 0.11 H new ATOM 0 HG21 ILE A 366 -1.790 -7.741 1.510 1.00 0.09 H new ATOM 0 HG22 ILE A 366 -2.384 -9.416 1.427 1.00 0.09 H new ATOM 0 HG23 ILE A 366 -2.604 -8.324 0.039 1.00 0.09 H new ATOM 0 HD11 ILE A 366 -3.531 -4.475 1.480 1.00 0.12 H new ATOM 0 HD12 ILE A 366 -3.156 -5.509 2.879 1.00 0.12 H new ATOM 0 HD13 ILE A 366 -2.249 -5.703 1.361 1.00 0.12 H new ATOM 641 N VAL A 367 -4.697 -10.947 0.091 1.00 0.10 N ATOM 642 CA VAL A 367 -4.595 -12.390 -0.008 1.00 0.12 C ATOM 643 C VAL A 367 -3.138 -12.831 -0.067 1.00 0.13 C ATOM 644 O VAL A 367 -2.716 -13.734 0.658 1.00 0.19 O ATOM 645 CB VAL A 367 -5.345 -12.886 -1.254 1.00 0.15 C ATOM 646 CG1 VAL A 367 -5.202 -14.378 -1.419 1.00 0.17 C ATOM 647 CG2 VAL A 367 -6.810 -12.510 -1.185 1.00 0.20 C ATOM 0 H VAL A 367 -4.781 -10.475 -0.810 1.00 0.10 H new ATOM 0 HA VAL A 367 -5.048 -12.826 0.882 1.00 0.12 H new ATOM 0 HB VAL A 367 -4.898 -12.400 -2.122 1.00 0.15 H new ATOM 0 HG11 VAL A 367 -5.743 -14.699 -2.309 1.00 0.17 H new ATOM 0 HG12 VAL A 367 -4.147 -14.633 -1.524 1.00 0.17 H new ATOM 0 HG13 VAL A 367 -5.612 -14.882 -0.544 1.00 0.17 H new ATOM 0 HG21 VAL A 367 -7.321 -12.871 -2.078 1.00 0.20 H new ATOM 0 HG22 VAL A 367 -7.260 -12.962 -0.301 1.00 0.20 H new ATOM 0 HG23 VAL A 367 -6.905 -11.426 -1.127 1.00 0.20 H new ATOM 657 N ASP A 368 -2.377 -12.187 -0.932 1.00 0.12 N ATOM 658 CA ASP A 368 -0.946 -12.429 -1.020 1.00 0.13 C ATOM 659 C ASP A 368 -0.217 -11.117 -0.844 1.00 0.12 C ATOM 660 O ASP A 368 0.097 -10.425 -1.810 1.00 0.12 O ATOM 661 CB ASP A 368 -0.560 -13.083 -2.348 1.00 0.18 C ATOM 662 CG ASP A 368 0.888 -13.542 -2.362 1.00 0.25 C ATOM 663 OD1 ASP A 368 1.172 -14.634 -1.824 1.00 0.52 O ATOM 664 OD2 ASP A 368 1.753 -12.823 -2.903 1.00 0.50 O ATOM 0 H ASP A 368 -2.727 -11.488 -1.588 1.00 0.12 H new ATOM 0 HA ASP A 368 -0.661 -13.123 -0.230 1.00 0.13 H new ATOM 0 HB2 ASP A 368 -1.212 -13.937 -2.534 1.00 0.18 H new ATOM 0 HB3 ASP A 368 -0.723 -12.375 -3.161 1.00 0.18 H new ATOM 669 N PRO A 369 0.018 -10.751 0.413 1.00 0.11 N ATOM 670 CA PRO A 369 0.587 -9.467 0.790 1.00 0.11 C ATOM 671 C PRO A 369 1.890 -9.134 0.077 1.00 0.12 C ATOM 672 O PRO A 369 2.104 -7.993 -0.338 1.00 0.14 O ATOM 673 CB PRO A 369 0.803 -9.625 2.294 1.00 0.13 C ATOM 674 CG PRO A 369 -0.245 -10.565 2.691 1.00 0.13 C ATOM 675 CD PRO A 369 -0.284 -11.563 1.594 1.00 0.13 C ATOM 0 HA PRO A 369 -0.066 -8.640 0.513 1.00 0.11 H new ATOM 0 HB2 PRO A 369 1.797 -10.013 2.518 1.00 0.13 H new ATOM 0 HB3 PRO A 369 0.707 -8.673 2.816 1.00 0.13 H new ATOM 0 HG2 PRO A 369 -0.015 -11.035 3.647 1.00 0.13 H new ATOM 0 HG3 PRO A 369 -1.206 -10.063 2.805 1.00 0.13 H new ATOM 0 HD2 PRO A 369 0.451 -12.355 1.740 1.00 0.13 H new ATOM 0 HD3 PRO A 369 -1.260 -12.043 1.517 1.00 0.13 H new ATOM 683 N ASN A 370 2.757 -10.123 -0.062 1.00 0.15 N ATOM 684 CA ASN A 370 4.037 -9.913 -0.730 1.00 0.18 C ATOM 685 C ASN A 370 3.807 -9.537 -2.191 1.00 0.16 C ATOM 686 O ASN A 370 4.407 -8.590 -2.703 1.00 0.17 O ATOM 687 CB ASN A 370 4.904 -11.170 -0.637 1.00 0.25 C ATOM 688 CG ASN A 370 6.393 -10.875 -0.716 1.00 0.43 C ATOM 689 OD1 ASN A 370 6.826 -9.898 -1.328 1.00 1.13 O ATOM 690 ND2 ASN A 370 7.188 -11.726 -0.090 1.00 0.99 N ATOM 0 H ASN A 370 2.603 -11.073 0.275 1.00 0.15 H new ATOM 0 HA ASN A 370 4.560 -9.097 -0.232 1.00 0.18 H new ATOM 0 HB2 ASN A 370 4.691 -11.683 0.301 1.00 0.25 H new ATOM 0 HB3 ASN A 370 4.632 -11.852 -1.442 1.00 0.25 H new ATOM 0 HD21 ASN A 370 8.198 -11.585 -0.103 1.00 0.99 H new ATOM 0 HD22 ASN A 370 6.791 -12.524 0.406 1.00 0.99 H new ATOM 697 N GLY A 371 2.905 -10.263 -2.845 1.00 0.16 N ATOM 698 CA GLY A 371 2.570 -9.979 -4.224 1.00 0.17 C ATOM 699 C GLY A 371 1.811 -8.674 -4.372 1.00 0.14 C ATOM 700 O GLY A 371 1.910 -8.003 -5.398 1.00 0.16 O ATOM 0 H GLY A 371 2.398 -11.049 -2.438 1.00 0.16 H new ATOM 0 HA2 GLY A 371 3.484 -9.935 -4.817 1.00 0.17 H new ATOM 0 HA3 GLY A 371 1.969 -10.795 -4.625 1.00 0.17 H new ATOM 704 N LEU A 372 1.052 -8.321 -3.344 1.00 0.13 N ATOM 705 CA LEU A 372 0.345 -7.047 -3.309 1.00 0.12 C ATOM 706 C LEU A 372 1.363 -5.907 -3.340 1.00 0.12 C ATOM 707 O LEU A 372 1.221 -4.942 -4.093 1.00 0.12 O ATOM 708 CB LEU A 372 -0.516 -6.974 -2.040 1.00 0.12 C ATOM 709 CG LEU A 372 -1.855 -6.248 -2.183 1.00 0.11 C ATOM 710 CD1 LEU A 372 -1.662 -4.761 -2.451 1.00 0.11 C ATOM 711 CD2 LEU A 372 -2.668 -6.881 -3.296 1.00 0.14 C ATOM 0 H LEU A 372 0.909 -8.902 -2.518 1.00 0.13 H new ATOM 0 HA LEU A 372 -0.309 -6.957 -4.176 1.00 0.12 H new ATOM 0 HB2 LEU A 372 -0.710 -7.990 -1.697 1.00 0.12 H new ATOM 0 HB3 LEU A 372 0.062 -6.479 -1.260 1.00 0.12 H new ATOM 0 HG LEU A 372 -2.393 -6.345 -1.240 1.00 0.11 H new ATOM 0 HD11 LEU A 372 -2.635 -4.279 -2.547 1.00 0.11 H new ATOM 0 HD12 LEU A 372 -1.114 -4.310 -1.624 1.00 0.11 H new ATOM 0 HD13 LEU A 372 -1.099 -4.628 -3.375 1.00 0.11 H new ATOM 0 HD21 LEU A 372 -3.620 -6.360 -3.393 1.00 0.14 H new ATOM 0 HD22 LEU A 372 -2.118 -6.809 -4.234 1.00 0.14 H new ATOM 0 HD23 LEU A 372 -2.851 -7.930 -3.062 1.00 0.14 H new ATOM 723 N ALA A 373 2.403 -6.049 -2.528 1.00 0.13 N ATOM 724 CA ALA A 373 3.516 -5.109 -2.505 1.00 0.16 C ATOM 725 C ALA A 373 4.242 -5.109 -3.851 1.00 0.18 C ATOM 726 O ALA A 373 4.701 -4.067 -4.328 1.00 0.22 O ATOM 727 CB ALA A 373 4.466 -5.487 -1.387 1.00 0.18 C ATOM 0 H ALA A 373 2.498 -6.820 -1.867 1.00 0.13 H new ATOM 0 HA ALA A 373 3.136 -4.103 -2.327 1.00 0.16 H new ATOM 0 HB1 ALA A 373 5.301 -4.786 -1.366 1.00 0.18 H new ATOM 0 HB2 ALA A 373 3.939 -5.452 -0.434 1.00 0.18 H new ATOM 0 HB3 ALA A 373 4.843 -6.496 -1.556 1.00 0.18 H new ATOM 733 N ARG A 374 4.347 -6.293 -4.452 1.00 0.19 N ATOM 734 CA ARG A 374 4.927 -6.444 -5.782 1.00 0.24 C ATOM 735 C ARG A 374 4.147 -5.627 -6.806 1.00 0.19 C ATOM 736 O ARG A 374 4.723 -4.832 -7.549 1.00 0.21 O ATOM 737 CB ARG A 374 4.925 -7.913 -6.191 1.00 0.33 C ATOM 738 CG ARG A 374 5.942 -8.751 -5.443 1.00 0.67 C ATOM 739 CD ARG A 374 7.351 -8.455 -5.919 1.00 0.92 C ATOM 740 NE ARG A 374 7.520 -8.758 -7.342 1.00 1.47 N ATOM 741 CZ ARG A 374 8.699 -8.816 -7.956 1.00 1.99 C ATOM 742 NH1 ARG A 374 9.822 -8.657 -7.265 1.00 2.45 N ATOM 743 NH2 ARG A 374 8.759 -9.056 -9.260 1.00 2.67 N ATOM 0 H ARG A 374 4.034 -7.169 -4.033 1.00 0.19 H new ATOM 0 HA ARG A 374 5.953 -6.079 -5.750 1.00 0.24 H new ATOM 0 HB2 ARG A 374 3.931 -8.327 -6.023 1.00 0.33 H new ATOM 0 HB3 ARG A 374 5.123 -7.984 -7.260 1.00 0.33 H new ATOM 0 HG2 ARG A 374 5.867 -8.551 -4.374 1.00 0.67 H new ATOM 0 HG3 ARG A 374 5.721 -9.809 -5.586 1.00 0.67 H new ATOM 0 HD2 ARG A 374 7.581 -7.405 -5.741 1.00 0.92 H new ATOM 0 HD3 ARG A 374 8.062 -9.040 -5.336 1.00 0.92 H new ATOM 0 HE ARG A 374 6.682 -8.935 -7.896 1.00 1.47 H new ATOM 0 HH11 ARG A 374 9.783 -8.490 -6.260 1.00 2.45 H new ATOM 0 HH12 ARG A 374 10.724 -8.702 -7.740 1.00 2.45 H new ATOM 0 HH21 ARG A 374 7.901 -9.196 -9.793 1.00 2.67 H new ATOM 0 HH22 ARG A 374 9.664 -9.100 -9.729 1.00 2.67 H new ATOM 757 N LEU A 375 2.836 -5.822 -6.821 1.00 0.17 N ATOM 758 CA LEU A 375 1.952 -5.096 -7.721 1.00 0.18 C ATOM 759 C LEU A 375 2.057 -3.595 -7.489 1.00 0.19 C ATOM 760 O LEU A 375 2.258 -2.824 -8.427 1.00 0.22 O ATOM 761 CB LEU A 375 0.502 -5.546 -7.515 1.00 0.18 C ATOM 762 CG LEU A 375 0.177 -6.973 -7.952 1.00 0.21 C ATOM 763 CD1 LEU A 375 -1.252 -7.325 -7.578 1.00 0.23 C ATOM 764 CD2 LEU A 375 0.373 -7.128 -9.450 1.00 0.26 C ATOM 0 H LEU A 375 2.357 -6.485 -6.212 1.00 0.17 H new ATOM 0 HA LEU A 375 2.257 -5.315 -8.744 1.00 0.18 H new ATOM 0 HB2 LEU A 375 0.258 -5.446 -6.457 1.00 0.18 H new ATOM 0 HB3 LEU A 375 -0.151 -4.863 -8.059 1.00 0.18 H new ATOM 0 HG LEU A 375 0.856 -7.653 -7.438 1.00 0.21 H new ATOM 0 HD11 LEU A 375 -1.470 -8.345 -7.895 1.00 0.23 H new ATOM 0 HD12 LEU A 375 -1.375 -7.247 -6.498 1.00 0.23 H new ATOM 0 HD13 LEU A 375 -1.938 -6.637 -8.072 1.00 0.23 H new ATOM 0 HD21 LEU A 375 0.137 -8.151 -9.744 1.00 0.26 H new ATOM 0 HD22 LEU A 375 -0.286 -6.438 -9.977 1.00 0.26 H new ATOM 0 HD23 LEU A 375 1.409 -6.907 -9.706 1.00 0.26 H new ATOM 776 N TRP A 376 1.929 -3.192 -6.231 1.00 0.18 N ATOM 777 CA TRP A 376 1.959 -1.781 -5.865 1.00 0.20 C ATOM 778 C TRP A 376 3.257 -1.118 -6.326 1.00 0.25 C ATOM 779 O TRP A 376 3.259 0.025 -6.788 1.00 0.30 O ATOM 780 CB TRP A 376 1.793 -1.630 -4.353 1.00 0.20 C ATOM 781 CG TRP A 376 1.851 -0.209 -3.898 1.00 0.20 C ATOM 782 CD1 TRP A 376 1.049 0.814 -4.309 1.00 0.20 C ATOM 783 CD2 TRP A 376 2.749 0.342 -2.932 1.00 0.24 C ATOM 784 NE1 TRP A 376 1.421 1.978 -3.681 1.00 0.23 N ATOM 785 CE2 TRP A 376 2.454 1.711 -2.824 1.00 0.26 C ATOM 786 CE3 TRP A 376 3.778 -0.190 -2.156 1.00 0.29 C ATOM 787 CZ2 TRP A 376 3.150 2.557 -1.966 1.00 0.31 C ATOM 788 CZ3 TRP A 376 4.465 0.647 -1.303 1.00 0.34 C ATOM 789 CH2 TRP A 376 4.150 2.008 -1.213 1.00 0.35 C ATOM 0 H TRP A 376 1.803 -3.827 -5.442 1.00 0.18 H new ATOM 0 HA TRP A 376 1.131 -1.280 -6.367 1.00 0.20 H new ATOM 0 HB2 TRP A 376 0.839 -2.063 -4.053 1.00 0.20 H new ATOM 0 HB3 TRP A 376 2.574 -2.199 -3.849 1.00 0.20 H new ATOM 0 HD1 TRP A 376 0.242 0.723 -5.021 1.00 0.20 H new ATOM 0 HE1 TRP A 376 0.996 2.893 -3.830 1.00 0.23 H new ATOM 0 HE3 TRP A 376 4.032 -1.238 -2.222 1.00 0.29 H new ATOM 0 HZ2 TRP A 376 2.909 3.608 -1.898 1.00 0.31 H new ATOM 0 HZ3 TRP A 376 5.261 0.245 -0.693 1.00 0.34 H new ATOM 0 HH2 TRP A 376 4.708 2.637 -0.535 1.00 0.35 H new ATOM 800 N GLY A 377 4.351 -1.852 -6.211 1.00 0.27 N ATOM 801 CA GLY A 377 5.638 -1.351 -6.647 1.00 0.33 C ATOM 802 C GLY A 377 5.691 -1.072 -8.134 1.00 0.38 C ATOM 803 O GLY A 377 6.429 -0.195 -8.573 1.00 0.41 O ATOM 0 H GLY A 377 4.371 -2.794 -5.820 1.00 0.27 H new ATOM 0 HA2 GLY A 377 5.869 -0.435 -6.103 1.00 0.33 H new ATOM 0 HA3 GLY A 377 6.410 -2.077 -6.391 1.00 0.33 H new ATOM 807 N ASN A 378 4.915 -1.825 -8.903 1.00 0.41 N ATOM 808 CA ASN A 378 4.825 -1.629 -10.350 1.00 0.50 C ATOM 809 C ASN A 378 4.183 -0.277 -10.658 1.00 0.51 C ATOM 810 O ASN A 378 4.549 0.407 -11.617 1.00 0.62 O ATOM 811 CB ASN A 378 4.008 -2.763 -10.981 1.00 0.54 C ATOM 812 CG ASN A 378 3.877 -2.633 -12.489 1.00 0.72 C ATOM 813 OD1 ASN A 378 4.760 -2.101 -13.159 1.00 0.89 O ATOM 814 ND2 ASN A 378 2.772 -3.124 -13.033 1.00 1.06 N ATOM 0 H ASN A 378 4.333 -2.584 -8.548 1.00 0.41 H new ATOM 0 HA ASN A 378 5.829 -1.642 -10.774 1.00 0.50 H new ATOM 0 HB2 ASN A 378 4.478 -3.717 -10.744 1.00 0.54 H new ATOM 0 HB3 ASN A 378 3.013 -2.778 -10.535 1.00 0.54 H new ATOM 0 HD21 ASN A 378 2.632 -3.068 -14.042 1.00 1.06 H new ATOM 0 HD22 ASN A 378 2.062 -3.558 -12.443 1.00 1.06 H new ATOM 821 N HIS A 379 3.250 0.113 -9.804 1.00 0.44 N ATOM 822 CA HIS A 379 2.496 1.355 -9.966 1.00 0.49 C ATOM 823 C HIS A 379 3.367 2.570 -9.641 1.00 0.53 C ATOM 824 O HIS A 379 3.151 3.668 -10.159 1.00 0.67 O ATOM 825 CB HIS A 379 1.273 1.298 -9.046 1.00 0.51 C ATOM 826 CG HIS A 379 0.304 2.437 -9.165 1.00 0.61 C ATOM 827 ND1 HIS A 379 -0.411 2.653 -10.314 1.00 0.70 N ATOM 828 CD2 HIS A 379 -0.099 3.320 -8.221 1.00 0.78 C ATOM 829 CE1 HIS A 379 -1.239 3.649 -10.039 1.00 0.84 C ATOM 830 NE2 HIS A 379 -1.091 4.088 -8.781 1.00 0.89 N ATOM 0 H HIS A 379 2.990 -0.422 -8.975 1.00 0.44 H new ATOM 0 HA HIS A 379 2.175 1.459 -11.002 1.00 0.49 H new ATOM 0 HB2 HIS A 379 0.737 0.370 -9.245 1.00 0.51 H new ATOM 0 HB3 HIS A 379 1.622 1.251 -8.014 1.00 0.51 H new ATOM 0 HD2 HIS A 379 0.287 3.405 -7.216 1.00 0.78 H new ATOM 0 HE1 HIS A 379 -1.948 4.058 -10.743 1.00 0.84 H new ATOM 0 HE2 HIS A 379 -1.611 4.841 -8.330 1.00 0.89 H new ATOM 838 N LYS A 380 4.361 2.365 -8.788 1.00 0.47 N ATOM 839 CA LYS A 380 5.237 3.452 -8.369 1.00 0.55 C ATOM 840 C LYS A 380 6.654 3.290 -8.909 1.00 0.56 C ATOM 841 O LYS A 380 7.546 4.071 -8.580 1.00 0.70 O ATOM 842 CB LYS A 380 5.259 3.566 -6.845 1.00 0.62 C ATOM 843 CG LYS A 380 4.006 4.207 -6.266 1.00 0.79 C ATOM 844 CD LYS A 380 3.879 5.670 -6.682 1.00 0.75 C ATOM 845 CE LYS A 380 5.018 6.521 -6.129 1.00 0.84 C ATOM 846 NZ LYS A 380 4.935 7.936 -6.589 1.00 1.36 N ATOM 0 H LYS A 380 4.581 1.459 -8.373 1.00 0.47 H new ATOM 0 HA LYS A 380 4.832 4.372 -8.790 1.00 0.55 H new ATOM 0 HB2 LYS A 380 5.380 2.571 -6.416 1.00 0.62 H new ATOM 0 HB3 LYS A 380 6.129 4.151 -6.545 1.00 0.62 H new ATOM 0 HG2 LYS A 380 3.127 3.656 -6.600 1.00 0.79 H new ATOM 0 HG3 LYS A 380 4.031 4.138 -5.178 1.00 0.79 H new ATOM 0 HD2 LYS A 380 3.870 5.738 -7.770 1.00 0.75 H new ATOM 0 HD3 LYS A 380 2.926 6.066 -6.330 1.00 0.75 H new ATOM 0 HE2 LYS A 380 4.995 6.493 -5.040 1.00 0.84 H new ATOM 0 HE3 LYS A 380 5.972 6.095 -6.439 1.00 0.84 H new ATOM 0 HZ1 LYS A 380 5.688 8.493 -6.136 1.00 1.36 H new ATOM 0 HZ2 LYS A 380 5.051 7.973 -7.622 1.00 1.36 H new ATOM 0 HZ3 LYS A 380 4.009 8.331 -6.330 1.00 1.36 H new ATOM 860 N ASN A 381 6.840 2.263 -9.738 1.00 0.52 N ATOM 861 CA ASN A 381 8.124 1.980 -10.388 1.00 0.60 C ATOM 862 C ASN A 381 9.260 1.893 -9.359 1.00 0.59 C ATOM 863 O ASN A 381 10.351 2.428 -9.550 1.00 0.76 O ATOM 864 CB ASN A 381 8.407 3.038 -11.467 1.00 0.76 C ATOM 865 CG ASN A 381 9.602 2.704 -12.346 1.00 1.50 C ATOM 866 OD1 ASN A 381 10.696 3.240 -12.162 1.00 2.30 O ATOM 867 ND2 ASN A 381 9.402 1.807 -13.298 1.00 2.17 N ATOM 0 H ASN A 381 6.103 1.600 -9.980 1.00 0.52 H new ATOM 0 HA ASN A 381 8.067 1.006 -10.874 1.00 0.60 H new ATOM 0 HB2 ASN A 381 7.524 3.149 -12.096 1.00 0.76 H new ATOM 0 HB3 ASN A 381 8.579 4.000 -10.985 1.00 0.76 H new ATOM 0 HD21 ASN A 381 10.170 1.536 -13.913 1.00 2.17 H new ATOM 0 HD22 ASN A 381 8.480 1.387 -13.417 1.00 2.17 H new ATOM 874 N ARG A 382 8.981 1.223 -8.248 1.00 0.49 N ATOM 875 CA ARG A 382 9.965 1.051 -7.186 1.00 0.55 C ATOM 876 C ARG A 382 10.880 -0.157 -7.447 1.00 0.67 C ATOM 877 O ARG A 382 10.698 -0.874 -8.432 1.00 0.79 O ATOM 878 CB ARG A 382 9.259 0.976 -5.836 1.00 0.51 C ATOM 879 CG ARG A 382 8.335 -0.158 -5.684 1.00 0.70 C ATOM 880 CD ARG A 382 9.094 -1.447 -5.574 1.00 1.09 C ATOM 881 NE ARG A 382 8.242 -2.625 -5.723 1.00 1.88 N ATOM 882 CZ ARG A 382 8.233 -3.410 -6.803 1.00 2.39 C ATOM 883 NH1 ARG A 382 8.976 -3.112 -7.859 1.00 2.40 N ATOM 884 NH2 ARG A 382 7.466 -4.489 -6.835 1.00 3.26 N ATOM 0 H ARG A 382 8.078 0.788 -8.058 1.00 0.49 H new ATOM 0 HA ARG A 382 10.623 1.920 -7.170 1.00 0.55 H new ATOM 0 HB2 ARG A 382 10.013 0.920 -5.051 1.00 0.51 H new ATOM 0 HB3 ARG A 382 8.705 1.901 -5.680 1.00 0.51 H new ATOM 0 HG2 ARG A 382 7.719 -0.016 -4.796 1.00 0.70 H new ATOM 0 HG3 ARG A 382 7.659 -0.200 -6.538 1.00 0.70 H new ATOM 0 HD2 ARG A 382 9.873 -1.470 -6.336 1.00 1.09 H new ATOM 0 HD3 ARG A 382 9.594 -1.487 -4.606 1.00 1.09 H new ATOM 0 HE ARG A 382 7.615 -2.862 -4.954 1.00 1.88 H new ATOM 0 HH11 ARG A 382 9.561 -2.277 -7.851 1.00 2.40 H new ATOM 0 HH12 ARG A 382 8.962 -3.718 -8.679 1.00 2.40 H new ATOM 0 HH21 ARG A 382 6.880 -4.722 -6.033 1.00 3.26 H new ATOM 0 HH22 ARG A 382 7.461 -5.087 -7.661 1.00 3.26 H new ATOM 943 N THR A 386 8.090 -5.613 -0.674 1.00 0.33 N ATOM 944 CA THR A 386 7.550 -6.719 0.086 1.00 0.28 C ATOM 945 C THR A 386 6.525 -6.123 1.044 1.00 0.21 C ATOM 946 O THR A 386 6.614 -4.936 1.323 1.00 0.24 O ATOM 947 CB THR A 386 8.685 -7.445 0.844 1.00 0.33 C ATOM 948 OG1 THR A 386 9.385 -8.324 -0.043 1.00 0.54 O ATOM 949 CG2 THR A 386 8.175 -8.212 2.046 1.00 0.26 C ATOM 0 HA THR A 386 7.079 -7.462 -0.557 1.00 0.28 H new ATOM 0 HB THR A 386 9.368 -6.681 1.215 1.00 0.33 H new ATOM 0 HG1 THR A 386 8.742 -8.898 -0.510 1.00 0.54 H new ATOM 0 HG21 THR A 386 9.010 -8.704 2.545 1.00 0.26 H new ATOM 0 HG22 THR A 386 7.693 -7.523 2.740 1.00 0.26 H new ATOM 0 HG23 THR A 386 7.454 -8.962 1.720 1.00 0.26 H new ATOM 957 N TYR A 387 5.534 -6.880 1.510 1.00 0.19 N ATOM 958 CA TYR A 387 4.468 -6.276 2.315 1.00 0.17 C ATOM 959 C TYR A 387 5.028 -5.517 3.515 1.00 0.16 C ATOM 960 O TYR A 387 4.585 -4.408 3.806 1.00 0.18 O ATOM 961 CB TYR A 387 3.452 -7.292 2.799 1.00 0.19 C ATOM 962 CG TYR A 387 2.207 -6.609 3.302 1.00 0.20 C ATOM 963 CD1 TYR A 387 2.165 -6.027 4.562 1.00 0.21 C ATOM 964 CD2 TYR A 387 1.080 -6.531 2.507 1.00 0.22 C ATOM 965 CE1 TYR A 387 1.033 -5.387 5.010 1.00 0.24 C ATOM 966 CE2 TYR A 387 -0.059 -5.901 2.949 1.00 0.25 C ATOM 967 CZ TYR A 387 -0.075 -5.326 4.203 1.00 0.26 C ATOM 968 OH TYR A 387 -1.210 -4.702 4.658 1.00 0.30 O ATOM 0 H TYR A 387 5.444 -7.884 1.352 1.00 0.19 H new ATOM 0 HA TYR A 387 3.961 -5.577 1.650 1.00 0.17 H new ATOM 0 HB2 TYR A 387 3.196 -7.972 1.986 1.00 0.19 H new ATOM 0 HB3 TYR A 387 3.887 -7.897 3.595 1.00 0.19 H new ATOM 0 HD1 TYR A 387 3.035 -6.078 5.200 1.00 0.21 H new ATOM 0 HD2 TYR A 387 1.094 -6.972 1.521 1.00 0.22 H new ATOM 0 HE1 TYR A 387 1.016 -4.935 5.991 1.00 0.24 H new ATOM 0 HE2 TYR A 387 -0.935 -5.856 2.319 1.00 0.25 H new ATOM 0 HH TYR A 387 -1.961 -5.332 4.636 1.00 0.30 H new ATOM 978 N GLU A 388 5.997 -6.112 4.198 1.00 0.20 N ATOM 979 CA GLU A 388 6.662 -5.458 5.324 1.00 0.26 C ATOM 980 C GLU A 388 7.122 -4.059 4.921 1.00 0.25 C ATOM 981 O GLU A 388 7.018 -3.095 5.678 1.00 0.31 O ATOM 982 CB GLU A 388 7.869 -6.278 5.759 1.00 0.38 C ATOM 983 CG GLU A 388 7.617 -7.780 5.835 1.00 1.00 C ATOM 984 CD GLU A 388 6.372 -8.138 6.622 1.00 1.78 C ATOM 985 OE1 GLU A 388 6.471 -8.281 7.856 1.00 2.34 O ATOM 986 OE2 GLU A 388 5.288 -8.254 6.015 1.00 2.37 O ATOM 0 H GLU A 388 6.343 -7.049 3.993 1.00 0.20 H new ATOM 0 HA GLU A 388 5.956 -5.381 6.151 1.00 0.26 H new ATOM 0 HB2 GLU A 388 8.688 -6.094 5.063 1.00 0.38 H new ATOM 0 HB3 GLU A 388 8.198 -5.927 6.737 1.00 0.38 H new ATOM 0 HG2 GLU A 388 7.527 -8.178 4.824 1.00 1.00 H new ATOM 0 HG3 GLU A 388 8.480 -8.264 6.293 1.00 1.00 H new ATOM 993 N LYS A 389 7.618 -3.982 3.701 1.00 0.24 N ATOM 994 CA LYS A 389 8.040 -2.735 3.085 1.00 0.28 C ATOM 995 C LYS A 389 6.824 -1.869 2.702 1.00 0.26 C ATOM 996 O LYS A 389 6.799 -0.670 2.972 1.00 0.32 O ATOM 997 CB LYS A 389 8.884 -3.063 1.842 1.00 0.34 C ATOM 998 CG LYS A 389 10.080 -3.959 2.132 1.00 0.46 C ATOM 999 CD LYS A 389 10.712 -4.470 0.846 1.00 0.52 C ATOM 1000 CE LYS A 389 11.816 -5.480 1.126 1.00 0.72 C ATOM 1001 NZ LYS A 389 12.547 -5.878 -0.108 1.00 1.62 N ATOM 0 H LYS A 389 7.742 -4.796 3.099 1.00 0.24 H new ATOM 0 HA LYS A 389 8.636 -2.163 3.796 1.00 0.28 H new ATOM 0 HB2 LYS A 389 8.249 -3.548 1.101 1.00 0.34 H new ATOM 0 HB3 LYS A 389 9.238 -2.132 1.398 1.00 0.34 H new ATOM 0 HG2 LYS A 389 10.821 -3.405 2.709 1.00 0.46 H new ATOM 0 HG3 LYS A 389 9.765 -4.803 2.745 1.00 0.46 H new ATOM 0 HD2 LYS A 389 9.946 -4.931 0.222 1.00 0.52 H new ATOM 0 HD3 LYS A 389 11.120 -3.631 0.282 1.00 0.52 H new ATOM 0 HE2 LYS A 389 12.520 -5.055 1.841 1.00 0.72 H new ATOM 0 HE3 LYS A 389 11.385 -6.366 1.591 1.00 0.72 H new ATOM 0 HZ1 LYS A 389 13.288 -6.566 0.134 1.00 1.62 H new ATOM 0 HZ2 LYS A 389 11.882 -6.308 -0.782 1.00 1.62 H new ATOM 0 HZ3 LYS A 389 12.983 -5.038 -0.540 1.00 1.62 H new ATOM 1015 N MET A 390 5.810 -2.497 2.095 1.00 0.19 N ATOM 1016 CA MET A 390 4.621 -1.790 1.597 1.00 0.20 C ATOM 1017 C MET A 390 3.812 -1.173 2.736 1.00 0.20 C ATOM 1018 O MET A 390 3.185 -0.125 2.569 1.00 0.22 O ATOM 1019 CB MET A 390 3.732 -2.744 0.790 1.00 0.18 C ATOM 1020 CG MET A 390 2.336 -2.935 1.374 1.00 0.23 C ATOM 1021 SD MET A 390 1.284 -3.976 0.347 1.00 0.68 S ATOM 1022 CE MET A 390 1.101 -2.930 -1.092 1.00 1.18 C ATOM 0 H MET A 390 5.789 -3.504 1.935 1.00 0.19 H new ATOM 0 HA MET A 390 4.968 -0.983 0.952 1.00 0.20 H new ATOM 0 HB2 MET A 390 3.640 -2.365 -0.228 1.00 0.18 H new ATOM 0 HB3 MET A 390 4.223 -3.715 0.725 1.00 0.18 H new ATOM 0 HG2 MET A 390 2.420 -3.378 2.366 1.00 0.23 H new ATOM 0 HG3 MET A 390 1.863 -1.961 1.499 1.00 0.23 H new ATOM 0 HE1 MET A 390 1.218 -3.529 -1.995 1.00 1.18 H new ATOM 0 HE2 MET A 390 0.112 -2.473 -1.086 1.00 1.18 H new ATOM 0 HE3 MET A 390 1.862 -2.149 -1.074 1.00 1.18 H new ATOM 1032 N SER A 391 3.835 -1.830 3.895 1.00 0.20 N ATOM 1033 CA SER A 391 3.016 -1.434 5.033 1.00 0.21 C ATOM 1034 C SER A 391 3.294 0.002 5.449 1.00 0.18 C ATOM 1035 O SER A 391 2.461 0.638 6.083 1.00 0.18 O ATOM 1036 CB SER A 391 3.262 -2.361 6.216 1.00 0.26 C ATOM 1037 OG SER A 391 4.598 -2.259 6.678 1.00 0.64 O ATOM 0 H SER A 391 4.420 -2.647 4.068 1.00 0.20 H new ATOM 0 HA SER A 391 1.973 -1.507 4.723 1.00 0.21 H new ATOM 0 HB2 SER A 391 2.575 -2.113 7.025 1.00 0.26 H new ATOM 0 HB3 SER A 391 3.053 -3.390 5.925 1.00 0.26 H new ATOM 0 HG SER A 391 5.203 -2.660 6.020 1.00 0.64 H new ATOM 1043 N ARG A 392 4.470 0.502 5.085 1.00 0.19 N ATOM 1044 CA ARG A 392 4.875 1.846 5.408 1.00 0.20 C ATOM 1045 C ARG A 392 3.902 2.872 4.846 1.00 0.19 C ATOM 1046 O ARG A 392 3.595 3.866 5.501 1.00 0.23 O ATOM 1047 CB ARG A 392 6.257 2.091 4.863 1.00 0.24 C ATOM 1048 CG ARG A 392 7.357 1.983 5.890 1.00 0.52 C ATOM 1049 CD ARG A 392 7.937 0.588 5.938 1.00 0.67 C ATOM 1050 NE ARG A 392 9.120 0.534 6.786 1.00 1.31 N ATOM 1051 CZ ARG A 392 9.496 -0.537 7.471 1.00 1.66 C ATOM 1052 NH1 ARG A 392 8.797 -1.661 7.398 1.00 1.88 N ATOM 1053 NH2 ARG A 392 10.582 -0.482 8.227 1.00 2.48 N ATOM 0 H ARG A 392 5.165 -0.024 4.555 1.00 0.19 H new ATOM 0 HA ARG A 392 4.878 1.955 6.493 1.00 0.20 H new ATOM 0 HB2 ARG A 392 6.451 1.377 4.063 1.00 0.24 H new ATOM 0 HB3 ARG A 392 6.288 3.085 4.417 1.00 0.24 H new ATOM 0 HG2 ARG A 392 8.146 2.698 5.656 1.00 0.52 H new ATOM 0 HG3 ARG A 392 6.966 2.249 6.872 1.00 0.52 H new ATOM 0 HD2 ARG A 392 7.186 -0.107 6.313 1.00 0.67 H new ATOM 0 HD3 ARG A 392 8.195 0.265 4.930 1.00 0.67 H new ATOM 0 HE ARG A 392 9.695 1.373 6.857 1.00 1.31 H new ATOM 0 HH11 ARG A 392 7.963 -1.706 6.812 1.00 1.88 H new ATOM 0 HH12 ARG A 392 9.093 -2.481 7.928 1.00 1.88 H new ATOM 0 HH21 ARG A 392 11.124 0.381 8.280 1.00 2.48 H new ATOM 0 HH22 ARG A 392 10.877 -1.302 8.757 1.00 2.48 H new ATOM 1067 N ALA A 393 3.406 2.618 3.640 1.00 0.16 N ATOM 1068 CA ALA A 393 2.429 3.508 3.027 1.00 0.16 C ATOM 1069 C ALA A 393 1.118 3.426 3.804 1.00 0.16 C ATOM 1070 O ALA A 393 0.464 4.431 4.071 1.00 0.19 O ATOM 1071 CB ALA A 393 2.221 3.155 1.556 1.00 0.19 C ATOM 0 H ALA A 393 3.662 1.810 3.072 1.00 0.16 H new ATOM 0 HA ALA A 393 2.800 4.532 3.065 1.00 0.16 H new ATOM 0 HB1 ALA A 393 1.487 3.833 1.119 1.00 0.19 H new ATOM 0 HB2 ALA A 393 3.166 3.250 1.022 1.00 0.19 H new ATOM 0 HB3 ALA A 393 1.861 2.129 1.475 1.00 0.19 H new ATOM 1077 N LEU A 394 0.778 2.206 4.211 1.00 0.15 N ATOM 1078 CA LEU A 394 -0.427 1.946 4.991 1.00 0.18 C ATOM 1079 C LEU A 394 -0.350 2.585 6.375 1.00 0.18 C ATOM 1080 O LEU A 394 -1.376 2.951 6.947 1.00 0.20 O ATOM 1081 CB LEU A 394 -0.653 0.439 5.123 1.00 0.22 C ATOM 1082 CG LEU A 394 -1.013 -0.269 3.818 1.00 0.25 C ATOM 1083 CD1 LEU A 394 -0.888 -1.771 3.977 1.00 0.35 C ATOM 1084 CD2 LEU A 394 -2.423 0.097 3.383 1.00 0.24 C ATOM 0 H LEU A 394 1.329 1.372 4.010 1.00 0.15 H new ATOM 0 HA LEU A 394 -1.268 2.394 4.462 1.00 0.18 H new ATOM 0 HB2 LEU A 394 0.250 -0.016 5.530 1.00 0.22 H new ATOM 0 HB3 LEU A 394 -1.450 0.267 5.846 1.00 0.22 H new ATOM 0 HG LEU A 394 -0.315 0.059 3.048 1.00 0.25 H new ATOM 0 HD11 LEU A 394 -1.148 -2.259 3.038 1.00 0.35 H new ATOM 0 HD12 LEU A 394 0.138 -2.024 4.246 1.00 0.35 H new ATOM 0 HD13 LEU A 394 -1.563 -2.111 4.762 1.00 0.35 H new ATOM 0 HD21 LEU A 394 -2.661 -0.417 2.452 1.00 0.24 H new ATOM 0 HD22 LEU A 394 -3.131 -0.204 4.155 1.00 0.24 H new ATOM 0 HD23 LEU A 394 -2.488 1.174 3.230 1.00 0.24 H new ATOM 1096 N ARG A 395 0.867 2.716 6.906 1.00 0.20 N ATOM 1097 CA ARG A 395 1.078 3.304 8.229 1.00 0.26 C ATOM 1098 C ARG A 395 0.399 4.663 8.319 1.00 0.21 C ATOM 1099 O ARG A 395 -0.233 4.989 9.325 1.00 0.22 O ATOM 1100 CB ARG A 395 2.574 3.460 8.537 1.00 0.36 C ATOM 1101 CG ARG A 395 3.369 2.164 8.466 1.00 0.94 C ATOM 1102 CD ARG A 395 2.969 1.181 9.554 1.00 0.94 C ATOM 1103 NE ARG A 395 3.502 -0.158 9.296 1.00 1.59 N ATOM 1104 CZ ARG A 395 4.427 -0.764 10.048 1.00 1.91 C ATOM 1105 NH1 ARG A 395 4.977 -0.135 11.080 1.00 1.87 N ATOM 1106 NH2 ARG A 395 4.813 -2.000 9.750 1.00 2.78 N ATOM 0 H ARG A 395 1.724 2.421 6.438 1.00 0.20 H new ATOM 0 HA ARG A 395 0.640 2.628 8.964 1.00 0.26 H new ATOM 0 HB2 ARG A 395 3.004 4.175 7.836 1.00 0.36 H new ATOM 0 HB3 ARG A 395 2.685 3.886 9.534 1.00 0.36 H new ATOM 0 HG2 ARG A 395 3.220 1.702 7.490 1.00 0.94 H new ATOM 0 HG3 ARG A 395 4.432 2.387 8.554 1.00 0.94 H new ATOM 0 HD2 ARG A 395 3.332 1.538 10.518 1.00 0.94 H new ATOM 0 HD3 ARG A 395 1.882 1.134 9.620 1.00 0.94 H new ATOM 0 HE ARG A 395 3.143 -0.664 8.486 1.00 1.59 H new ATOM 0 HH11 ARG A 395 4.695 0.819 11.305 1.00 1.87 H new ATOM 0 HH12 ARG A 395 5.682 -0.606 11.648 1.00 1.87 H new ATOM 0 HH21 ARG A 395 4.404 -2.483 8.950 1.00 2.78 H new ATOM 0 HH22 ARG A 395 5.518 -2.466 10.321 1.00 2.78 H new ATOM 1120 N HIS A 396 0.515 5.443 7.250 1.00 0.20 N ATOM 1121 CA HIS A 396 -0.101 6.755 7.204 1.00 0.19 C ATOM 1122 C HIS A 396 -1.611 6.627 7.094 1.00 0.16 C ATOM 1123 O HIS A 396 -2.352 7.337 7.773 1.00 0.22 O ATOM 1124 CB HIS A 396 0.470 7.575 6.042 1.00 0.24 C ATOM 1125 CG HIS A 396 1.938 7.842 6.185 1.00 0.58 C ATOM 1126 ND1 HIS A 396 2.411 8.893 6.936 1.00 1.29 N ATOM 1127 CD2 HIS A 396 2.988 7.140 5.702 1.00 0.53 C ATOM 1128 CE1 HIS A 396 3.732 8.800 6.898 1.00 1.63 C ATOM 1129 NE2 HIS A 396 4.125 7.753 6.163 1.00 1.17 N ATOM 0 H HIS A 396 1.030 5.186 6.408 1.00 0.20 H new ATOM 0 HA HIS A 396 0.127 7.282 8.131 1.00 0.19 H new ATOM 0 HB2 HIS A 396 0.291 7.044 5.107 1.00 0.24 H new ATOM 0 HB3 HIS A 396 -0.062 8.524 5.977 1.00 0.24 H new ATOM 0 HD2 HIS A 396 2.940 6.263 5.073 1.00 0.53 H new ATOM 0 HE1 HIS A 396 4.405 9.482 7.396 1.00 1.63 H new ATOM 0 HE2 HIS A 396 5.087 7.466 5.980 1.00 1.17 H new ATOM 1137 N TYR A 397 -2.061 5.675 6.282 1.00 0.15 N ATOM 1138 CA TYR A 397 -3.486 5.510 5.991 1.00 0.15 C ATOM 1139 C TYR A 397 -4.269 5.179 7.252 1.00 0.18 C ATOM 1140 O TYR A 397 -5.424 5.582 7.393 1.00 0.19 O ATOM 1141 CB TYR A 397 -3.719 4.404 4.954 1.00 0.18 C ATOM 1142 CG TYR A 397 -3.102 4.667 3.595 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -2.182 5.690 3.393 1.00 0.20 C ATOM 1144 CD2 TYR A 397 -3.447 3.883 2.505 1.00 0.26 C ATOM 1145 CE1 TYR A 397 -1.631 5.922 2.156 1.00 0.22 C ATOM 1146 CE2 TYR A 397 -2.899 4.106 1.264 1.00 0.32 C ATOM 1147 CZ TYR A 397 -1.990 5.128 1.091 1.00 0.25 C ATOM 1148 OH TYR A 397 -1.456 5.366 -0.153 1.00 0.35 O ATOM 0 H TYR A 397 -1.457 5.001 5.810 1.00 0.15 H new ATOM 0 HA TYR A 397 -3.838 6.459 5.587 1.00 0.15 H new ATOM 0 HB2 TYR A 397 -3.318 3.469 5.345 1.00 0.18 H new ATOM 0 HB3 TYR A 397 -4.793 4.263 4.829 1.00 0.18 H new ATOM 0 HD1 TYR A 397 -1.895 6.315 4.226 1.00 0.20 H new ATOM 0 HD2 TYR A 397 -4.160 3.082 2.633 1.00 0.26 H new ATOM 0 HE1 TYR A 397 -0.920 6.723 2.020 1.00 0.22 H new ATOM 0 HE2 TYR A 397 -3.180 3.483 0.428 1.00 0.32 H new ATOM 0 HH TYR A 397 -0.485 5.239 -0.122 1.00 0.35 H new ATOM 1158 N TYR A 398 -3.638 4.441 8.161 1.00 0.24 N ATOM 1159 CA TYR A 398 -4.265 4.087 9.429 1.00 0.29 C ATOM 1160 C TYR A 398 -4.550 5.334 10.253 1.00 0.31 C ATOM 1161 O TYR A 398 -5.559 5.414 10.954 1.00 0.39 O ATOM 1162 CB TYR A 398 -3.378 3.112 10.211 1.00 0.33 C ATOM 1163 CG TYR A 398 -3.265 1.763 9.544 1.00 0.35 C ATOM 1164 CD1 TYR A 398 -4.404 1.104 9.116 1.00 0.41 C ATOM 1165 CD2 TYR A 398 -2.035 1.159 9.322 1.00 0.43 C ATOM 1166 CE1 TYR A 398 -4.331 -0.117 8.489 1.00 0.48 C ATOM 1167 CE2 TYR A 398 -1.951 -0.069 8.686 1.00 0.49 C ATOM 1168 CZ TYR A 398 -3.106 -0.702 8.270 1.00 0.50 C ATOM 1169 OH TYR A 398 -3.040 -1.920 7.629 1.00 0.60 O ATOM 0 H TYR A 398 -2.693 4.077 8.042 1.00 0.24 H new ATOM 0 HA TYR A 398 -5.214 3.595 9.218 1.00 0.29 H new ATOM 0 HB2 TYR A 398 -2.383 3.542 10.322 1.00 0.33 H new ATOM 0 HB3 TYR A 398 -3.784 2.984 11.215 1.00 0.33 H new ATOM 0 HD1 TYR A 398 -5.370 1.558 9.278 1.00 0.41 H new ATOM 0 HD2 TYR A 398 -1.132 1.653 9.649 1.00 0.43 H new ATOM 0 HE1 TYR A 398 -5.234 -0.616 8.169 1.00 0.48 H new ATOM 0 HE2 TYR A 398 -0.988 -0.528 8.517 1.00 0.49 H new ATOM 0 HH TYR A 398 -2.119 -2.086 7.337 1.00 0.60 H new ATOM 1179 N LYS A 399 -3.675 6.321 10.134 1.00 0.28 N ATOM 1180 CA LYS A 399 -3.808 7.554 10.888 1.00 0.32 C ATOM 1181 C LYS A 399 -4.752 8.514 10.173 1.00 0.29 C ATOM 1182 O LYS A 399 -5.441 9.313 10.803 1.00 0.31 O ATOM 1183 CB LYS A 399 -2.434 8.191 11.081 1.00 0.37 C ATOM 1184 CG LYS A 399 -1.350 7.190 11.471 1.00 0.53 C ATOM 1185 CD LYS A 399 -1.800 6.247 12.581 1.00 0.68 C ATOM 1186 CE LYS A 399 -2.123 6.984 13.874 1.00 1.31 C ATOM 1187 NZ LYS A 399 -0.925 7.643 14.458 1.00 1.98 N ATOM 0 H LYS A 399 -2.862 6.290 9.519 1.00 0.28 H new ATOM 0 HA LYS A 399 -4.231 7.330 11.867 1.00 0.32 H new ATOM 0 HB2 LYS A 399 -2.141 8.691 10.158 1.00 0.37 H new ATOM 0 HB3 LYS A 399 -2.503 8.959 11.851 1.00 0.37 H new ATOM 0 HG2 LYS A 399 -1.067 6.606 10.595 1.00 0.53 H new ATOM 0 HG3 LYS A 399 -0.461 7.730 11.796 1.00 0.53 H new ATOM 0 HD2 LYS A 399 -2.680 5.696 12.251 1.00 0.68 H new ATOM 0 HD3 LYS A 399 -1.017 5.513 12.770 1.00 0.68 H new ATOM 0 HE2 LYS A 399 -2.890 7.734 13.681 1.00 1.31 H new ATOM 0 HE3 LYS A 399 -2.538 6.282 14.597 1.00 1.31 H new ATOM 0 HZ1 LYS A 399 -1.163 8.031 15.393 1.00 1.98 H new ATOM 0 HZ2 LYS A 399 -0.159 6.946 14.557 1.00 1.98 H new ATOM 0 HZ3 LYS A 399 -0.613 8.414 13.833 1.00 1.98 H new ATOM 1201 N LEU A 400 -4.786 8.411 8.851 1.00 0.25 N ATOM 1202 CA LEU A 400 -5.676 9.215 8.025 1.00 0.23 C ATOM 1203 C LEU A 400 -7.095 8.672 8.074 1.00 0.22 C ATOM 1204 O LEU A 400 -8.030 9.289 7.565 1.00 0.26 O ATOM 1205 CB LEU A 400 -5.190 9.181 6.586 1.00 0.22 C ATOM 1206 CG LEU A 400 -3.732 9.552 6.397 1.00 0.25 C ATOM 1207 CD1 LEU A 400 -3.174 8.890 5.163 1.00 0.23 C ATOM 1208 CD2 LEU A 400 -3.593 11.046 6.288 1.00 0.36 C ATOM 0 H LEU A 400 -4.197 7.768 8.321 1.00 0.25 H new ATOM 0 HA LEU A 400 -5.673 10.236 8.406 1.00 0.23 H new ATOM 0 HB2 LEU A 400 -5.350 8.179 6.187 1.00 0.22 H new ATOM 0 HB3 LEU A 400 -5.803 9.861 5.994 1.00 0.22 H new ATOM 0 HG LEU A 400 -3.169 9.203 7.262 1.00 0.25 H new ATOM 0 HD11 LEU A 400 -2.127 9.168 5.043 1.00 0.23 H new ATOM 0 HD12 LEU A 400 -3.253 7.808 5.263 1.00 0.23 H new ATOM 0 HD13 LEU A 400 -3.738 9.216 4.289 1.00 0.23 H new ATOM 0 HD21 LEU A 400 -2.543 11.305 6.152 1.00 0.36 H new ATOM 0 HD22 LEU A 400 -4.168 11.404 5.434 1.00 0.36 H new ATOM 0 HD23 LEU A 400 -3.967 11.514 7.199 1.00 0.36 H new ATOM 1220 N ASN A 401 -7.224 7.492 8.678 1.00 0.22 N ATOM 1221 CA ASN A 401 -8.489 6.771 8.738 1.00 0.24 C ATOM 1222 C ASN A 401 -8.987 6.466 7.336 1.00 0.19 C ATOM 1223 O ASN A 401 -10.175 6.533 7.051 1.00 0.23 O ATOM 1224 CB ASN A 401 -9.540 7.543 9.541 1.00 0.33 C ATOM 1225 CG ASN A 401 -9.433 7.295 11.038 1.00 1.01 C ATOM 1226 OD1 ASN A 401 -10.429 7.345 11.758 1.00 1.77 O ATOM 1227 ND2 ASN A 401 -8.231 7.018 11.519 1.00 1.24 N ATOM 0 H ASN A 401 -6.452 7.011 9.139 1.00 0.22 H new ATOM 0 HA ASN A 401 -8.316 5.828 9.258 1.00 0.24 H new ATOM 0 HB2 ASN A 401 -9.430 8.610 9.345 1.00 0.33 H new ATOM 0 HB3 ASN A 401 -10.535 7.257 9.200 1.00 0.33 H new ATOM 0 HD21 ASN A 401 -8.110 6.838 12.516 1.00 1.24 H new ATOM 0 HD22 ASN A 401 -7.426 6.985 10.893 1.00 1.24 H new ATOM 1234 N ILE A 402 -8.047 6.164 6.456 1.00 0.15 N ATOM 1235 CA ILE A 402 -8.369 5.693 5.118 1.00 0.13 C ATOM 1236 C ILE A 402 -8.606 4.200 5.168 1.00 0.13 C ATOM 1237 O ILE A 402 -9.527 3.673 4.546 1.00 0.15 O ATOM 1238 CB ILE A 402 -7.216 6.003 4.136 1.00 0.12 C ATOM 1239 CG1 ILE A 402 -7.095 7.516 3.958 1.00 0.13 C ATOM 1240 CG2 ILE A 402 -7.421 5.303 2.790 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.819 7.949 3.278 1.00 0.14 C ATOM 0 H ILE A 402 -7.047 6.237 6.646 1.00 0.15 H new ATOM 0 HA ILE A 402 -9.265 6.205 4.767 1.00 0.13 H new ATOM 0 HB ILE A 402 -6.286 5.617 4.555 1.00 0.12 H new ATOM 0 HG12 ILE A 402 -7.945 7.873 3.376 1.00 0.13 H new ATOM 0 HG13 ILE A 402 -7.155 7.993 4.936 1.00 0.13 H new ATOM 0 HG21 ILE A 402 -6.592 5.543 2.125 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -7.462 4.225 2.943 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -8.355 5.642 2.342 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -5.805 9.035 3.187 1.00 0.14 H new ATOM 0 HD12 ILE A 402 -4.963 7.624 3.869 1.00 0.14 H new ATOM 0 HD13 ILE A 402 -5.766 7.501 2.286 1.00 0.14 H new ATOM 1253 N ILE A 403 -7.782 3.536 5.954 1.00 0.14 N ATOM 1254 CA ILE A 403 -7.818 2.097 6.074 1.00 0.14 C ATOM 1255 C ILE A 403 -7.691 1.695 7.537 1.00 0.17 C ATOM 1256 O ILE A 403 -6.934 2.304 8.288 1.00 0.26 O ATOM 1257 CB ILE A 403 -6.680 1.453 5.246 1.00 0.16 C ATOM 1258 CG1 ILE A 403 -6.922 1.676 3.749 1.00 0.16 C ATOM 1259 CG2 ILE A 403 -6.554 -0.029 5.548 1.00 0.18 C ATOM 1260 CD1 ILE A 403 -5.764 1.253 2.873 1.00 0.20 C ATOM 0 H ILE A 403 -7.067 3.983 6.528 1.00 0.14 H new ATOM 0 HA ILE A 403 -8.772 1.740 5.686 1.00 0.14 H new ATOM 0 HB ILE A 403 -5.743 1.933 5.527 1.00 0.16 H new ATOM 0 HG12 ILE A 403 -7.813 1.125 3.449 1.00 0.16 H new ATOM 0 HG13 ILE A 403 -7.128 2.732 3.577 1.00 0.16 H new ATOM 0 HG21 ILE A 403 -5.747 -0.454 4.952 1.00 0.18 H new ATOM 0 HG22 ILE A 403 -6.335 -0.167 6.607 1.00 0.18 H new ATOM 0 HG23 ILE A 403 -7.490 -0.531 5.303 1.00 0.18 H new ATOM 0 HD11 ILE A 403 -6.010 1.442 1.828 1.00 0.20 H new ATOM 0 HD12 ILE A 403 -4.875 1.822 3.145 1.00 0.20 H new ATOM 0 HD13 ILE A 403 -5.571 0.190 3.014 1.00 0.20 H new ATOM 1272 N ARG A 404 -8.467 0.703 7.937 1.00 0.14 N ATOM 1273 CA ARG A 404 -8.397 0.151 9.283 1.00 0.18 C ATOM 1274 C ARG A 404 -8.444 -1.367 9.218 1.00 0.20 C ATOM 1275 O ARG A 404 -9.006 -1.927 8.285 1.00 0.28 O ATOM 1276 CB ARG A 404 -9.547 0.677 10.142 1.00 0.27 C ATOM 1277 CG ARG A 404 -10.874 0.734 9.419 1.00 0.45 C ATOM 1278 CD ARG A 404 -12.037 0.569 10.368 1.00 0.76 C ATOM 1279 NE ARG A 404 -12.253 -0.830 10.729 1.00 1.16 N ATOM 1280 CZ ARG A 404 -12.840 -1.230 11.855 1.00 1.23 C ATOM 1281 NH1 ARG A 404 -13.225 -0.345 12.768 1.00 1.04 N ATOM 1282 NH2 ARG A 404 -13.052 -2.523 12.060 1.00 2.08 N ATOM 0 H ARG A 404 -9.163 0.256 7.340 1.00 0.14 H new ATOM 0 HA ARG A 404 -7.458 0.462 9.741 1.00 0.18 H new ATOM 0 HB2 ARG A 404 -9.650 0.042 11.022 1.00 0.27 H new ATOM 0 HB3 ARG A 404 -9.295 1.676 10.498 1.00 0.27 H new ATOM 0 HG2 ARG A 404 -10.963 1.687 8.897 1.00 0.45 H new ATOM 0 HG3 ARG A 404 -10.909 -0.049 8.661 1.00 0.45 H new ATOM 0 HD2 ARG A 404 -11.854 1.152 11.270 1.00 0.76 H new ATOM 0 HD3 ARG A 404 -12.941 0.968 9.907 1.00 0.76 H new ATOM 0 HE ARG A 404 -11.934 -1.546 10.077 1.00 1.16 H new ATOM 0 HH11 ARG A 404 -13.072 0.651 12.609 1.00 1.04 H new ATOM 0 HH12 ARG A 404 -13.674 -0.661 13.628 1.00 1.04 H new ATOM 0 HH21 ARG A 404 -12.766 -3.204 11.357 1.00 2.08 H new ATOM 0 HH22 ARG A 404 -13.501 -2.836 12.921 1.00 2.08 H new ATOM 1296 N LYS A 405 -7.836 -2.027 10.191 1.00 0.24 N ATOM 1297 CA LYS A 405 -7.824 -3.484 10.226 1.00 0.26 C ATOM 1298 C LYS A 405 -9.090 -4.022 10.879 1.00 0.27 C ATOM 1299 O LYS A 405 -9.478 -3.575 11.961 1.00 0.34 O ATOM 1300 CB LYS A 405 -6.599 -3.993 10.988 1.00 0.31 C ATOM 1301 CG LYS A 405 -5.281 -3.692 10.304 1.00 0.58 C ATOM 1302 CD LYS A 405 -4.112 -4.265 11.086 1.00 0.69 C ATOM 1303 CE LYS A 405 -2.773 -3.896 10.464 1.00 1.31 C ATOM 1304 NZ LYS A 405 -2.608 -4.459 9.099 1.00 1.73 N ATOM 0 H LYS A 405 -7.345 -1.580 10.966 1.00 0.24 H new ATOM 0 HA LYS A 405 -7.780 -3.841 9.197 1.00 0.26 H new ATOM 0 HB2 LYS A 405 -6.591 -3.547 11.983 1.00 0.31 H new ATOM 0 HB3 LYS A 405 -6.689 -5.071 11.123 1.00 0.31 H new ATOM 0 HG2 LYS A 405 -5.287 -4.109 9.297 1.00 0.58 H new ATOM 0 HG3 LYS A 405 -5.160 -2.614 10.202 1.00 0.58 H new ATOM 0 HD2 LYS A 405 -4.148 -3.899 12.112 1.00 0.69 H new ATOM 0 HD3 LYS A 405 -4.204 -5.350 11.132 1.00 0.69 H new ATOM 0 HE2 LYS A 405 -2.683 -2.811 10.420 1.00 1.31 H new ATOM 0 HE3 LYS A 405 -1.967 -4.257 11.103 1.00 1.31 H new ATOM 0 HZ1 LYS A 405 -1.723 -5.004 9.053 1.00 1.73 H new ATOM 0 HZ2 LYS A 405 -3.411 -5.083 8.882 1.00 1.73 H new ATOM 0 HZ3 LYS A 405 -2.574 -3.684 8.406 1.00 1.73 H new ATOM 1318 N GLU A 406 -9.732 -4.976 10.216 1.00 0.26 N ATOM 1319 CA GLU A 406 -10.918 -5.611 10.753 1.00 0.27 C ATOM 1320 C GLU A 406 -10.615 -6.409 12.021 1.00 0.29 C ATOM 1321 O GLU A 406 -9.527 -6.970 12.176 1.00 0.33 O ATOM 1322 CB GLU A 406 -11.547 -6.486 9.701 1.00 0.26 C ATOM 1323 CG GLU A 406 -12.361 -5.679 8.716 1.00 0.28 C ATOM 1324 CD GLU A 406 -13.047 -4.482 9.355 1.00 0.56 C ATOM 1325 OE1 GLU A 406 -14.159 -4.653 9.891 1.00 0.84 O ATOM 1326 OE2 GLU A 406 -12.482 -3.366 9.330 1.00 0.81 O ATOM 0 H GLU A 406 -9.445 -5.325 9.301 1.00 0.26 H new ATOM 0 HA GLU A 406 -11.623 -4.829 11.035 1.00 0.27 H new ATOM 0 HB2 GLU A 406 -10.768 -7.032 9.168 1.00 0.26 H new ATOM 0 HB3 GLU A 406 -12.186 -7.228 10.179 1.00 0.26 H new ATOM 0 HG2 GLU A 406 -11.711 -5.332 7.913 1.00 0.28 H new ATOM 0 HG3 GLU A 406 -13.114 -6.323 8.261 1.00 0.28 H new ATOM 1333 N PRO A 407 -11.594 -6.465 12.941 1.00 0.34 N ATOM 1334 CA PRO A 407 -11.437 -7.093 14.261 1.00 0.38 C ATOM 1335 C PRO A 407 -11.210 -8.601 14.190 1.00 0.41 C ATOM 1336 O PRO A 407 -12.010 -9.335 13.602 1.00 0.44 O ATOM 1337 CB PRO A 407 -12.773 -6.784 14.944 1.00 0.43 C ATOM 1338 CG PRO A 407 -13.732 -6.632 13.824 1.00 0.48 C ATOM 1339 CD PRO A 407 -12.953 -5.929 12.758 1.00 0.45 C ATOM 0 HA PRO A 407 -10.561 -6.714 14.787 1.00 0.38 H new ATOM 0 HB2 PRO A 407 -13.071 -7.588 15.616 1.00 0.43 H new ATOM 0 HB3 PRO A 407 -12.713 -5.875 15.542 1.00 0.43 H new ATOM 0 HG2 PRO A 407 -14.095 -7.600 13.478 1.00 0.48 H new ATOM 0 HG3 PRO A 407 -14.605 -6.053 14.125 1.00 0.48 H new ATOM 0 HD2 PRO A 407 -13.343 -6.145 11.763 1.00 0.45 H new ATOM 0 HD3 PRO A 407 -12.981 -4.847 12.883 1.00 0.45 H new ATOM 1347 N GLY A 408 -10.111 -9.046 14.789 1.00 0.51 N ATOM 1348 CA GLY A 408 -9.805 -10.464 14.844 1.00 0.60 C ATOM 1349 C GLY A 408 -9.472 -11.032 13.483 1.00 0.56 C ATOM 1350 O GLY A 408 -9.791 -12.186 13.184 1.00 0.66 O ATOM 0 H GLY A 408 -9.422 -8.445 15.241 1.00 0.51 H new ATOM 0 HA2 GLY A 408 -8.964 -10.626 15.519 1.00 0.60 H new ATOM 0 HA3 GLY A 408 -10.657 -11.001 15.261 1.00 0.60 H new ATOM 1354 N GLN A 409 -8.834 -10.221 12.654 1.00 0.53 N ATOM 1355 CA GLN A 409 -8.504 -10.621 11.298 1.00 0.52 C ATOM 1356 C GLN A 409 -7.017 -10.454 11.020 1.00 0.48 C ATOM 1357 O GLN A 409 -6.315 -9.761 11.759 1.00 0.62 O ATOM 1358 CB GLN A 409 -9.324 -9.804 10.302 1.00 0.67 C ATOM 1359 CG GLN A 409 -10.787 -10.208 10.240 1.00 0.77 C ATOM 1360 CD GLN A 409 -10.994 -11.508 9.506 1.00 0.90 C ATOM 1361 OE1 GLN A 409 -10.129 -12.384 9.491 1.00 1.81 O ATOM 1362 NE2 GLN A 409 -12.148 -11.636 8.882 1.00 1.10 N ATOM 0 H GLN A 409 -8.534 -9.278 12.899 1.00 0.53 H new ATOM 0 HA GLN A 409 -8.748 -11.677 11.184 1.00 0.52 H new ATOM 0 HB2 GLN A 409 -9.258 -8.749 10.569 1.00 0.67 H new ATOM 0 HB3 GLN A 409 -8.885 -9.909 9.310 1.00 0.67 H new ATOM 0 HG2 GLN A 409 -11.179 -10.300 11.253 1.00 0.77 H new ATOM 0 HG3 GLN A 409 -11.358 -9.421 9.747 1.00 0.77 H new ATOM 0 HE21 GLN A 409 -12.836 -10.884 8.922 1.00 1.10 H new ATOM 0 HE22 GLN A 409 -12.353 -12.487 8.359 1.00 1.10 H new ATOM 1371 N ARG A 410 -6.540 -11.111 9.971 1.00 0.44 N ATOM 1372 CA ARG A 410 -5.146 -10.983 9.560 1.00 0.41 C ATOM 1373 C ARG A 410 -4.944 -9.727 8.714 1.00 0.34 C ATOM 1374 O ARG A 410 -4.853 -8.619 9.240 1.00 0.49 O ATOM 1375 CB ARG A 410 -4.658 -12.228 8.792 1.00 0.45 C ATOM 1376 CG ARG A 410 -5.736 -13.258 8.450 1.00 0.57 C ATOM 1377 CD ARG A 410 -6.694 -12.794 7.348 1.00 0.62 C ATOM 1378 NE ARG A 410 -6.019 -12.508 6.070 1.00 0.96 N ATOM 1379 CZ ARG A 410 -5.355 -13.416 5.342 1.00 1.65 C ATOM 1380 NH1 ARG A 410 -5.295 -14.683 5.733 1.00 2.14 N ATOM 1381 NH2 ARG A 410 -4.767 -13.060 4.204 1.00 2.29 N ATOM 0 H ARG A 410 -7.096 -11.738 9.389 1.00 0.44 H new ATOM 0 HA ARG A 410 -4.549 -10.897 10.468 1.00 0.41 H new ATOM 0 HB2 ARG A 410 -4.187 -11.900 7.865 1.00 0.45 H new ATOM 0 HB3 ARG A 410 -3.886 -12.719 9.385 1.00 0.45 H new ATOM 0 HG2 ARG A 410 -5.256 -14.185 8.137 1.00 0.57 H new ATOM 0 HG3 ARG A 410 -6.310 -13.484 9.349 1.00 0.57 H new ATOM 0 HD2 ARG A 410 -7.451 -13.562 7.187 1.00 0.62 H new ATOM 0 HD3 ARG A 410 -7.216 -11.898 7.684 1.00 0.62 H new ATOM 0 HE ARG A 410 -6.060 -11.553 5.715 1.00 0.96 H new ATOM 0 HH11 ARG A 410 -5.757 -14.973 6.595 1.00 2.14 H new ATOM 0 HH12 ARG A 410 -4.787 -15.366 5.172 1.00 2.14 H new ATOM 0 HH21 ARG A 410 -4.821 -12.093 3.883 1.00 2.29 H new ATOM 0 HH22 ARG A 410 -4.262 -13.754 3.652 1.00 2.29 H new ATOM 1395 N LEU A 411 -4.900 -9.908 7.401 1.00 0.21 N ATOM 1396 CA LEU A 411 -4.744 -8.796 6.474 1.00 0.15 C ATOM 1397 C LEU A 411 -6.097 -8.313 5.971 1.00 0.11 C ATOM 1398 O LEU A 411 -6.227 -7.869 4.829 1.00 0.12 O ATOM 1399 CB LEU A 411 -3.837 -9.175 5.302 1.00 0.14 C ATOM 1400 CG LEU A 411 -2.378 -9.429 5.677 1.00 0.17 C ATOM 1401 CD1 LEU A 411 -1.952 -10.841 5.301 1.00 0.20 C ATOM 1402 CD2 LEU A 411 -1.489 -8.406 4.996 1.00 0.16 C ATOM 0 H LEU A 411 -4.971 -10.821 6.952 1.00 0.21 H new ATOM 0 HA LEU A 411 -4.269 -7.978 7.016 1.00 0.15 H new ATOM 0 HB2 LEU A 411 -4.237 -10.071 4.827 1.00 0.14 H new ATOM 0 HB3 LEU A 411 -3.873 -8.377 4.560 1.00 0.14 H new ATOM 0 HG LEU A 411 -2.276 -9.329 6.758 1.00 0.17 H new ATOM 0 HD11 LEU A 411 -0.909 -10.993 5.580 1.00 0.20 H new ATOM 0 HD12 LEU A 411 -2.577 -11.562 5.828 1.00 0.20 H new ATOM 0 HD13 LEU A 411 -2.064 -10.981 4.226 1.00 0.20 H new ATOM 0 HD21 LEU A 411 -0.449 -8.590 5.266 1.00 0.16 H new ATOM 0 HD22 LEU A 411 -1.603 -8.487 3.915 1.00 0.16 H new ATOM 0 HD23 LEU A 411 -1.775 -7.404 5.317 1.00 0.16 H new ATOM 1414 N LEU A 412 -7.111 -8.452 6.812 1.00 0.12 N ATOM 1415 CA LEU A 412 -8.441 -7.967 6.492 1.00 0.10 C ATOM 1416 C LEU A 412 -8.594 -6.533 6.956 1.00 0.09 C ATOM 1417 O LEU A 412 -8.435 -6.232 8.138 1.00 0.10 O ATOM 1418 CB LEU A 412 -9.501 -8.838 7.148 1.00 0.12 C ATOM 1419 CG LEU A 412 -10.627 -9.293 6.239 1.00 0.13 C ATOM 1420 CD1 LEU A 412 -10.921 -8.228 5.218 1.00 0.12 C ATOM 1421 CD2 LEU A 412 -10.263 -10.603 5.575 1.00 0.15 C ATOM 0 H LEU A 412 -7.035 -8.899 7.725 1.00 0.12 H new ATOM 0 HA LEU A 412 -8.574 -8.012 5.411 1.00 0.10 H new ATOM 0 HB2 LEU A 412 -9.015 -9.720 7.564 1.00 0.12 H new ATOM 0 HB3 LEU A 412 -9.932 -8.287 7.984 1.00 0.12 H new ATOM 0 HG LEU A 412 -11.527 -9.455 6.832 1.00 0.13 H new ATOM 0 HD11 LEU A 412 -11.730 -8.561 4.568 1.00 0.12 H new ATOM 0 HD12 LEU A 412 -11.217 -7.310 5.725 1.00 0.12 H new ATOM 0 HD13 LEU A 412 -10.029 -8.041 4.620 1.00 0.12 H new ATOM 0 HD21 LEU A 412 -11.078 -10.920 4.925 1.00 0.15 H new ATOM 0 HD22 LEU A 412 -9.357 -10.472 4.983 1.00 0.15 H new ATOM 0 HD23 LEU A 412 -10.091 -11.362 6.338 1.00 0.15 H new ATOM 1433 N PHE A 413 -8.899 -5.660 6.018 1.00 0.09 N ATOM 1434 CA PHE A 413 -8.926 -4.224 6.285 1.00 0.10 C ATOM 1435 C PHE A 413 -10.238 -3.609 5.813 1.00 0.09 C ATOM 1436 O PHE A 413 -11.108 -4.302 5.289 1.00 0.10 O ATOM 1437 CB PHE A 413 -7.767 -3.499 5.580 1.00 0.12 C ATOM 1438 CG PHE A 413 -6.408 -4.136 5.727 1.00 0.11 C ATOM 1439 CD1 PHE A 413 -6.080 -4.893 6.838 1.00 0.12 C ATOM 1440 CD2 PHE A 413 -5.459 -3.974 4.735 1.00 0.12 C ATOM 1441 CE1 PHE A 413 -4.837 -5.477 6.956 1.00 0.13 C ATOM 1442 CE2 PHE A 413 -4.214 -4.554 4.848 1.00 0.13 C ATOM 1443 CZ PHE A 413 -3.902 -5.305 5.960 1.00 0.14 C ATOM 0 H PHE A 413 -9.133 -5.914 5.058 1.00 0.09 H new ATOM 0 HA PHE A 413 -8.825 -4.101 7.363 1.00 0.10 H new ATOM 0 HB2 PHE A 413 -8.001 -3.427 4.518 1.00 0.12 H new ATOM 0 HB3 PHE A 413 -7.713 -2.480 5.964 1.00 0.12 H new ATOM 0 HD1 PHE A 413 -6.808 -5.028 7.624 1.00 0.12 H new ATOM 0 HD2 PHE A 413 -5.696 -3.386 3.861 1.00 0.12 H new ATOM 0 HE1 PHE A 413 -4.597 -6.068 7.828 1.00 0.13 H new ATOM 0 HE2 PHE A 413 -3.483 -4.420 4.065 1.00 0.13 H new ATOM 0 HZ PHE A 413 -2.926 -5.758 6.050 1.00 0.14 H new ATOM 1453 N ARG A 414 -10.358 -2.299 5.990 1.00 0.11 N ATOM 1454 CA ARG A 414 -11.550 -1.564 5.597 1.00 0.10 C ATOM 1455 C ARG A 414 -11.177 -0.206 5.010 1.00 0.09 C ATOM 1456 O ARG A 414 -10.360 0.516 5.584 1.00 0.12 O ATOM 1457 CB ARG A 414 -12.456 -1.352 6.811 1.00 0.16 C ATOM 1458 CG ARG A 414 -13.740 -0.612 6.495 1.00 0.22 C ATOM 1459 CD ARG A 414 -14.515 -0.283 7.759 1.00 0.35 C ATOM 1460 NE ARG A 414 -14.721 -1.454 8.615 1.00 0.99 N ATOM 1461 CZ ARG A 414 -15.668 -1.537 9.553 1.00 1.11 C ATOM 1462 NH1 ARG A 414 -16.523 -0.538 9.739 1.00 1.13 N ATOM 1463 NH2 ARG A 414 -15.764 -2.628 10.294 1.00 2.09 N ATOM 0 H ARG A 414 -9.632 -1.718 6.410 1.00 0.11 H new ATOM 0 HA ARG A 414 -12.075 -2.147 4.841 1.00 0.10 H new ATOM 0 HB2 ARG A 414 -12.704 -2.322 7.242 1.00 0.16 H new ATOM 0 HB3 ARG A 414 -11.906 -0.797 7.571 1.00 0.16 H new ATOM 0 HG2 ARG A 414 -13.509 0.308 5.958 1.00 0.22 H new ATOM 0 HG3 ARG A 414 -14.359 -1.219 5.835 1.00 0.22 H new ATOM 0 HD2 ARG A 414 -13.979 0.483 8.320 1.00 0.35 H new ATOM 0 HD3 ARG A 414 -15.483 0.139 7.488 1.00 0.35 H new ATOM 0 HE ARG A 414 -14.103 -2.255 8.487 1.00 0.99 H new ATOM 0 HH11 ARG A 414 -16.460 0.301 9.163 1.00 1.13 H new ATOM 0 HH12 ARG A 414 -17.243 -0.610 10.458 1.00 1.13 H new ATOM 0 HH21 ARG A 414 -15.116 -3.402 10.148 1.00 2.09 H new ATOM 0 HH22 ARG A 414 -16.486 -2.695 11.011 1.00 2.09 H new ATOM 1477 N PHE A 415 -11.772 0.129 3.873 1.00 0.10 N ATOM 1478 CA PHE A 415 -11.614 1.452 3.280 1.00 0.11 C ATOM 1479 C PHE A 415 -12.661 2.412 3.835 1.00 0.12 C ATOM 1480 O PHE A 415 -13.814 2.402 3.407 1.00 0.18 O ATOM 1481 CB PHE A 415 -11.745 1.394 1.755 1.00 0.14 C ATOM 1482 CG PHE A 415 -10.468 1.078 1.029 1.00 0.15 C ATOM 1483 CD1 PHE A 415 -9.500 2.055 0.862 1.00 0.17 C ATOM 1484 CD2 PHE A 415 -10.241 -0.183 0.498 1.00 0.17 C ATOM 1485 CE1 PHE A 415 -8.330 1.783 0.184 1.00 0.20 C ATOM 1486 CE2 PHE A 415 -9.068 -0.463 -0.182 1.00 0.20 C ATOM 1487 CZ PHE A 415 -8.111 0.523 -0.339 1.00 0.21 C ATOM 0 H PHE A 415 -12.372 -0.500 3.340 1.00 0.10 H new ATOM 0 HA PHE A 415 -10.616 1.810 3.535 1.00 0.11 H new ATOM 0 HB2 PHE A 415 -12.490 0.642 1.496 1.00 0.14 H new ATOM 0 HB3 PHE A 415 -12.122 2.353 1.399 1.00 0.14 H new ATOM 0 HD1 PHE A 415 -9.664 3.042 1.268 1.00 0.17 H new ATOM 0 HD2 PHE A 415 -10.987 -0.955 0.616 1.00 0.17 H new ATOM 0 HE1 PHE A 415 -7.585 2.555 0.062 1.00 0.20 H new ATOM 0 HE2 PHE A 415 -8.901 -1.449 -0.589 1.00 0.20 H new ATOM 0 HZ PHE A 415 -7.195 0.309 -0.869 1.00 0.21 H new ATOM 1497 N MET A 416 -12.261 3.245 4.782 1.00 0.14 N ATOM 1498 CA MET A 416 -13.188 4.182 5.411 1.00 0.17 C ATOM 1499 C MET A 416 -13.631 5.256 4.424 1.00 0.20 C ATOM 1500 O MET A 416 -14.754 5.759 4.496 1.00 0.29 O ATOM 1501 CB MET A 416 -12.550 4.837 6.634 1.00 0.23 C ATOM 1502 CG MET A 416 -12.200 3.865 7.747 1.00 0.30 C ATOM 1503 SD MET A 416 -13.654 3.058 8.447 1.00 1.30 S ATOM 1504 CE MET A 416 -14.553 4.466 9.096 1.00 1.23 C ATOM 0 H MET A 416 -11.305 3.294 5.134 1.00 0.14 H new ATOM 0 HA MET A 416 -14.064 3.617 5.730 1.00 0.17 H new ATOM 0 HB2 MET A 416 -11.644 5.358 6.323 1.00 0.23 H new ATOM 0 HB3 MET A 416 -13.232 5.591 7.026 1.00 0.23 H new ATOM 0 HG2 MET A 416 -11.519 3.107 7.361 1.00 0.30 H new ATOM 0 HG3 MET A 416 -11.670 4.398 8.536 1.00 0.30 H new ATOM 0 HE1 MET A 416 -14.975 4.212 10.068 1.00 1.23 H new ATOM 0 HE2 MET A 416 -13.874 5.312 9.205 1.00 1.23 H new ATOM 0 HE3 MET A 416 -15.357 4.732 8.410 1.00 1.23 H new ATOM 1514 N LYS A 417 -12.744 5.614 3.510 1.00 0.18 N ATOM 1515 CA LYS A 417 -13.062 6.581 2.477 1.00 0.21 C ATOM 1516 C LYS A 417 -12.394 6.205 1.163 1.00 0.22 C ATOM 1517 O LYS A 417 -11.420 5.451 1.137 1.00 0.26 O ATOM 1518 CB LYS A 417 -12.650 7.990 2.903 1.00 0.22 C ATOM 1519 CG LYS A 417 -11.240 8.090 3.449 1.00 0.18 C ATOM 1520 CD LYS A 417 -10.799 9.540 3.578 1.00 0.20 C ATOM 1521 CE LYS A 417 -9.656 9.694 4.563 1.00 0.36 C ATOM 1522 NZ LYS A 417 -10.142 9.779 5.965 1.00 0.61 N ATOM 0 H LYS A 417 -11.794 5.246 3.464 1.00 0.18 H new ATOM 0 HA LYS A 417 -14.142 6.572 2.329 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -12.743 8.658 2.046 1.00 0.22 H new ATOM 0 HB3 LYS A 417 -13.347 8.346 3.662 1.00 0.22 H new ATOM 0 HG2 LYS A 417 -11.190 7.604 4.424 1.00 0.18 H new ATOM 0 HG3 LYS A 417 -10.554 7.556 2.791 1.00 0.18 H new ATOM 0 HD2 LYS A 417 -10.491 9.915 2.602 1.00 0.20 H new ATOM 0 HD3 LYS A 417 -11.643 10.149 3.902 1.00 0.20 H new ATOM 0 HE2 LYS A 417 -8.976 8.848 4.465 1.00 0.36 H new ATOM 0 HE3 LYS A 417 -9.086 10.591 4.321 1.00 0.36 H new ATOM 0 HZ1 LYS A 417 -9.361 9.562 6.617 1.00 0.61 H new ATOM 0 HZ2 LYS A 417 -10.493 10.740 6.153 1.00 0.61 H new ATOM 0 HZ3 LYS A 417 -10.913 9.095 6.107 1.00 0.61 H new ATOM 1536 N THR A 418 -12.932 6.741 0.083 1.00 0.24 N ATOM 1537 CA THR A 418 -12.490 6.399 -1.261 1.00 0.26 C ATOM 1538 C THR A 418 -11.583 7.483 -1.846 1.00 0.23 C ATOM 1539 O THR A 418 -11.471 8.570 -1.274 1.00 0.21 O ATOM 1540 CB THR A 418 -13.707 6.191 -2.183 1.00 0.34 C ATOM 1541 OG1 THR A 418 -14.574 7.331 -2.117 1.00 0.37 O ATOM 1542 CG2 THR A 418 -14.471 4.932 -1.795 1.00 0.40 C ATOM 0 H THR A 418 -13.688 7.426 0.110 1.00 0.24 H new ATOM 0 HA THR A 418 -11.917 5.474 -1.195 1.00 0.26 H new ATOM 0 HB THR A 418 -13.347 6.073 -3.205 1.00 0.34 H new ATOM 0 HG1 THR A 418 -15.016 7.356 -1.243 1.00 0.37 H new ATOM 0 HG21 THR A 418 -15.326 4.806 -2.460 1.00 0.40 H new ATOM 0 HG22 THR A 418 -13.814 4.067 -1.881 1.00 0.40 H new ATOM 0 HG23 THR A 418 -14.821 5.021 -0.767 1.00 0.40 H new ATOM 1550 N PRO A 419 -10.911 7.189 -2.986 1.00 0.24 N ATOM 1551 CA PRO A 419 -10.039 8.137 -3.690 1.00 0.24 C ATOM 1552 C PRO A 419 -10.552 9.572 -3.687 1.00 0.28 C ATOM 1553 O PRO A 419 -9.858 10.474 -3.235 1.00 0.28 O ATOM 1554 CB PRO A 419 -10.046 7.585 -5.109 1.00 0.29 C ATOM 1555 CG PRO A 419 -10.119 6.110 -4.925 1.00 0.30 C ATOM 1556 CD PRO A 419 -10.927 5.878 -3.673 1.00 0.28 C ATOM 0 HA PRO A 419 -9.059 8.207 -3.218 1.00 0.24 H new ATOM 0 HB2 PRO A 419 -10.898 7.958 -5.678 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -9.147 7.875 -5.654 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -10.590 5.634 -5.785 1.00 0.30 H new ATOM 0 HG3 PRO A 419 -9.122 5.680 -4.829 1.00 0.30 H new ATOM 0 HD2 PRO A 419 -11.944 5.563 -3.907 1.00 0.28 H new ATOM 0 HD3 PRO A 419 -10.486 5.097 -3.053 1.00 0.28 H new ATOM 1564 N ASP A 420 -11.777 9.773 -4.165 1.00 0.34 N ATOM 1565 CA ASP A 420 -12.341 11.119 -4.297 1.00 0.43 C ATOM 1566 C ASP A 420 -12.369 11.845 -2.952 1.00 0.40 C ATOM 1567 O ASP A 420 -12.111 13.047 -2.876 1.00 0.44 O ATOM 1568 CB ASP A 420 -13.751 11.053 -4.888 1.00 0.55 C ATOM 1569 CG ASP A 420 -14.331 12.431 -5.148 1.00 0.73 C ATOM 1570 OD1 ASP A 420 -14.048 13.011 -6.215 1.00 0.84 O ATOM 1571 OD2 ASP A 420 -15.076 12.938 -4.282 1.00 0.85 O ATOM 0 H ASP A 420 -12.400 9.024 -4.468 1.00 0.34 H new ATOM 0 HA ASP A 420 -11.698 11.683 -4.973 1.00 0.43 H new ATOM 0 HB2 ASP A 420 -13.726 10.490 -5.821 1.00 0.55 H new ATOM 0 HB3 ASP A 420 -14.404 10.509 -4.205 1.00 0.55 H new ATOM 1576 N GLU A 421 -12.658 11.101 -1.892 1.00 0.35 N ATOM 1577 CA GLU A 421 -12.713 11.656 -0.549 1.00 0.35 C ATOM 1578 C GLU A 421 -11.314 11.994 -0.036 1.00 0.32 C ATOM 1579 O GLU A 421 -11.121 12.962 0.695 1.00 0.37 O ATOM 1580 CB GLU A 421 -13.386 10.664 0.389 1.00 0.34 C ATOM 1581 CG GLU A 421 -14.845 10.438 0.056 1.00 0.42 C ATOM 1582 CD GLU A 421 -15.446 9.271 0.813 1.00 0.42 C ATOM 1583 OE1 GLU A 421 -15.293 8.115 0.358 1.00 0.38 O ATOM 1584 OE2 GLU A 421 -16.069 9.502 1.868 1.00 0.51 O ATOM 0 H GLU A 421 -12.859 10.102 -1.940 1.00 0.35 H new ATOM 0 HA GLU A 421 -13.293 12.578 -0.581 1.00 0.35 H new ATOM 0 HB2 GLU A 421 -12.856 9.712 0.345 1.00 0.34 H new ATOM 0 HB3 GLU A 421 -13.304 11.027 1.414 1.00 0.34 H new ATOM 0 HG2 GLU A 421 -15.409 11.342 0.284 1.00 0.42 H new ATOM 0 HG3 GLU A 421 -14.945 10.261 -1.015 1.00 0.42 H new ATOM 1591 N ILE A 422 -10.347 11.169 -0.405 1.00 0.26 N ATOM 1592 CA ILE A 422 -8.968 11.351 0.031 1.00 0.24 C ATOM 1593 C ILE A 422 -8.260 12.452 -0.765 1.00 0.29 C ATOM 1594 O ILE A 422 -7.555 13.291 -0.197 1.00 0.32 O ATOM 1595 CB ILE A 422 -8.170 10.038 -0.103 1.00 0.19 C ATOM 1596 CG1 ILE A 422 -8.937 8.888 0.552 1.00 0.18 C ATOM 1597 CG2 ILE A 422 -6.796 10.188 0.532 1.00 0.24 C ATOM 1598 CD1 ILE A 422 -8.348 7.525 0.268 1.00 0.18 C ATOM 0 H ILE A 422 -10.492 10.361 -1.010 1.00 0.26 H new ATOM 0 HA ILE A 422 -9.007 11.649 1.079 1.00 0.24 H new ATOM 0 HB ILE A 422 -8.039 9.813 -1.161 1.00 0.19 H new ATOM 0 HG12 ILE A 422 -8.961 9.046 1.630 1.00 0.18 H new ATOM 0 HG13 ILE A 422 -9.970 8.907 0.204 1.00 0.18 H new ATOM 0 HG21 ILE A 422 -6.244 9.254 0.430 1.00 0.24 H new ATOM 0 HG22 ILE A 422 -6.250 10.988 0.033 1.00 0.24 H new ATOM 0 HG23 ILE A 422 -6.908 10.430 1.589 1.00 0.24 H new ATOM 0 HD11 ILE A 422 -8.945 6.760 0.765 1.00 0.18 H new ATOM 0 HD12 ILE A 422 -8.349 7.345 -0.807 1.00 0.18 H new ATOM 0 HD13 ILE A 422 -7.325 7.486 0.641 1.00 0.18 H new ATOM 1610 N MET A 423 -8.464 12.442 -2.083 1.00 0.36 N ATOM 1611 CA MET A 423 -7.759 13.339 -3.000 1.00 0.46 C ATOM 1612 C MET A 423 -8.175 14.792 -2.821 1.00 0.55 C ATOM 1613 O MET A 423 -7.580 15.691 -3.413 1.00 0.71 O ATOM 1614 CB MET A 423 -8.004 12.916 -4.450 1.00 0.56 C ATOM 1615 CG MET A 423 -7.486 11.528 -4.783 1.00 0.59 C ATOM 1616 SD MET A 423 -7.807 11.047 -6.493 1.00 0.83 S ATOM 1617 CE MET A 423 -6.839 12.268 -7.380 1.00 1.83 C ATOM 0 H MET A 423 -9.121 11.813 -2.544 1.00 0.36 H new ATOM 0 HA MET A 423 -6.698 13.263 -2.764 1.00 0.46 H new ATOM 0 HB2 MET A 423 -9.074 12.952 -4.652 1.00 0.56 H new ATOM 0 HB3 MET A 423 -7.530 13.639 -5.114 1.00 0.56 H new ATOM 0 HG2 MET A 423 -6.413 11.492 -4.597 1.00 0.59 H new ATOM 0 HG3 MET A 423 -7.950 10.803 -4.114 1.00 0.59 H new ATOM 0 HE1 MET A 423 -6.656 11.919 -8.396 1.00 1.83 H new ATOM 0 HE2 MET A 423 -7.385 13.211 -7.413 1.00 1.83 H new ATOM 0 HE3 MET A 423 -5.887 12.417 -6.871 1.00 1.83 H new ATOM 1627 N SER A 424 -9.192 15.025 -2.017 1.00 0.60 N ATOM 1628 CA SER A 424 -9.679 16.372 -1.789 1.00 0.72 C ATOM 1629 C SER A 424 -9.040 17.002 -0.550 1.00 0.74 C ATOM 1630 O SER A 424 -9.493 18.046 -0.073 1.00 0.94 O ATOM 1631 CB SER A 424 -11.202 16.347 -1.670 1.00 1.07 C ATOM 1632 OG SER A 424 -11.645 15.139 -1.075 1.00 1.70 O ATOM 0 H SER A 424 -9.698 14.299 -1.510 1.00 0.60 H new ATOM 0 HA SER A 424 -9.396 16.993 -2.639 1.00 0.72 H new ATOM 0 HB2 SER A 424 -11.538 17.195 -1.073 1.00 1.07 H new ATOM 0 HB3 SER A 424 -11.649 16.455 -2.658 1.00 1.07 H new ATOM 0 HG SER A 424 -11.785 14.464 -1.771 1.00 1.70 H new ATOM 1638 N GLY A 425 -7.979 16.385 -0.029 1.00 0.81 N ATOM 1639 CA GLY A 425 -7.317 16.958 1.126 1.00 1.23 C ATOM 1640 C GLY A 425 -6.016 16.274 1.512 1.00 0.79 C ATOM 1641 O GLY A 425 -4.944 16.863 1.389 1.00 1.10 O ATOM 0 H GLY A 425 -7.575 15.516 -0.380 1.00 0.81 H new ATOM 0 HA2 GLY A 425 -7.114 18.010 0.927 1.00 1.23 H new ATOM 0 HA3 GLY A 425 -7.999 16.920 1.976 1.00 1.23 H new ATOM 1645 N ARG A 426 -6.105 15.028 1.959 1.00 0.59 N ATOM 1646 CA ARG A 426 -4.989 14.376 2.653 1.00 0.47 C ATOM 1647 C ARG A 426 -3.906 13.855 1.710 1.00 0.40 C ATOM 1648 O ARG A 426 -2.860 13.383 2.162 1.00 0.47 O ATOM 1649 CB ARG A 426 -5.507 13.223 3.519 1.00 0.94 C ATOM 1650 CG ARG A 426 -6.418 13.670 4.645 1.00 1.03 C ATOM 1651 CD ARG A 426 -5.777 14.778 5.461 1.00 1.41 C ATOM 1652 NE ARG A 426 -6.678 15.315 6.477 1.00 1.79 N ATOM 1653 CZ ARG A 426 -6.683 16.590 6.862 1.00 2.26 C ATOM 1654 NH1 ARG A 426 -5.866 17.467 6.286 1.00 2.43 N ATOM 1655 NH2 ARG A 426 -7.508 16.991 7.819 1.00 2.85 N ATOM 0 H ARG A 426 -6.935 14.445 1.856 1.00 0.59 H new ATOM 0 HA ARG A 426 -4.528 15.144 3.274 1.00 0.47 H new ATOM 0 HB2 ARG A 426 -6.045 12.518 2.886 1.00 0.94 H new ATOM 0 HB3 ARG A 426 -4.657 12.687 3.942 1.00 0.94 H new ATOM 0 HG2 ARG A 426 -7.365 14.019 4.234 1.00 1.03 H new ATOM 0 HG3 ARG A 426 -6.644 12.822 5.292 1.00 1.03 H new ATOM 0 HD2 ARG A 426 -4.877 14.396 5.943 1.00 1.41 H new ATOM 0 HD3 ARG A 426 -5.465 15.582 4.795 1.00 1.41 H new ATOM 0 HE ARG A 426 -7.341 14.677 6.917 1.00 1.79 H new ATOM 0 HH11 ARG A 426 -5.232 17.164 5.546 1.00 2.43 H new ATOM 0 HH12 ARG A 426 -5.873 18.443 6.584 1.00 2.43 H new ATOM 0 HH21 ARG A 426 -8.139 16.323 8.261 1.00 2.85 H new ATOM 0 HH22 ARG A 426 -7.511 17.968 8.113 1.00 2.85 H new ATOM 1669 N THR A 427 -4.135 13.949 0.413 1.00 0.36 N ATOM 1670 CA THR A 427 -3.226 13.357 -0.551 1.00 0.33 C ATOM 1671 C THR A 427 -1.935 14.154 -0.716 1.00 0.37 C ATOM 1672 O THR A 427 -0.974 13.646 -1.280 1.00 0.38 O ATOM 1673 CB THR A 427 -3.900 13.188 -1.918 1.00 0.35 C ATOM 1674 OG1 THR A 427 -4.564 14.400 -2.292 1.00 0.48 O ATOM 1675 CG2 THR A 427 -4.897 12.043 -1.886 1.00 0.33 C ATOM 0 H THR A 427 -4.938 14.427 0.004 1.00 0.36 H new ATOM 0 HA THR A 427 -2.963 12.378 -0.151 1.00 0.33 H new ATOM 0 HB THR A 427 -3.130 12.959 -2.655 1.00 0.35 H new ATOM 0 HG1 THR A 427 -4.852 14.340 -3.227 1.00 0.48 H new ATOM 0 HG21 THR A 427 -5.364 11.940 -2.865 1.00 0.33 H new ATOM 0 HG22 THR A 427 -4.380 11.118 -1.631 1.00 0.33 H new ATOM 0 HG23 THR A 427 -5.663 12.248 -1.138 1.00 0.33 H new ATOM 1683 N ASP A 428 -1.895 15.381 -0.211 1.00 0.45 N ATOM 1684 CA ASP A 428 -0.702 16.223 -0.363 1.00 0.54 C ATOM 1685 C ASP A 428 0.490 15.609 0.365 1.00 0.55 C ATOM 1686 O ASP A 428 1.631 15.680 -0.102 1.00 0.59 O ATOM 1687 CB ASP A 428 -0.962 17.642 0.161 1.00 0.67 C ATOM 1688 CG ASP A 428 -1.097 17.701 1.674 1.00 1.23 C ATOM 1689 OD1 ASP A 428 -2.161 17.306 2.200 1.00 1.53 O ATOM 1690 OD2 ASP A 428 -0.145 18.145 2.346 1.00 1.76 O ATOM 0 H ASP A 428 -2.662 15.816 0.302 1.00 0.45 H new ATOM 0 HA ASP A 428 -0.470 16.282 -1.426 1.00 0.54 H new ATOM 0 HB2 ASP A 428 -0.146 18.294 -0.151 1.00 0.67 H new ATOM 0 HB3 ASP A 428 -1.873 18.031 -0.295 1.00 0.67 H new ATOM 1695 N ARG A 429 0.210 15.000 1.503 1.00 0.54 N ATOM 1696 CA ARG A 429 1.222 14.320 2.296 1.00 0.58 C ATOM 1697 C ARG A 429 1.526 12.954 1.706 1.00 0.45 C ATOM 1698 O ARG A 429 2.667 12.514 1.702 1.00 0.46 O ATOM 1699 CB ARG A 429 0.720 14.197 3.738 1.00 0.72 C ATOM 1700 CG ARG A 429 1.484 13.208 4.604 1.00 0.88 C ATOM 1701 CD ARG A 429 0.972 13.252 6.032 1.00 1.22 C ATOM 1702 NE ARG A 429 1.345 12.071 6.804 1.00 1.86 N ATOM 1703 CZ ARG A 429 0.997 11.881 8.077 1.00 2.48 C ATOM 1704 NH1 ARG A 429 0.322 12.817 8.734 1.00 2.68 N ATOM 1705 NH2 ARG A 429 1.332 10.759 8.691 1.00 3.43 N ATOM 0 H ARG A 429 -0.727 14.962 1.905 1.00 0.54 H new ATOM 0 HA ARG A 429 2.147 14.896 2.287 1.00 0.58 H new ATOM 0 HB2 ARG A 429 0.767 15.179 4.208 1.00 0.72 H new ATOM 0 HB3 ARG A 429 -0.329 13.903 3.717 1.00 0.72 H new ATOM 0 HG2 ARG A 429 1.373 12.201 4.202 1.00 0.88 H new ATOM 0 HG3 ARG A 429 2.548 13.444 4.585 1.00 0.88 H new ATOM 0 HD2 ARG A 429 1.363 14.142 6.526 1.00 1.22 H new ATOM 0 HD3 ARG A 429 -0.114 13.345 6.021 1.00 1.22 H new ATOM 0 HE ARG A 429 1.903 11.351 6.344 1.00 1.86 H new ATOM 0 HH11 ARG A 429 0.067 13.686 8.265 1.00 2.68 H new ATOM 0 HH12 ARG A 429 0.058 12.667 9.708 1.00 2.68 H new ATOM 0 HH21 ARG A 429 1.856 10.041 8.191 1.00 3.43 H new ATOM 0 HH22 ARG A 429 1.067 10.612 9.665 1.00 3.43 H new ATOM 1719 N LEU A 430 0.503 12.314 1.171 1.00 0.38 N ATOM 1720 CA LEU A 430 0.622 10.971 0.640 1.00 0.32 C ATOM 1721 C LEU A 430 1.341 10.968 -0.700 1.00 0.30 C ATOM 1722 O LEU A 430 2.222 10.158 -0.932 1.00 0.33 O ATOM 1723 CB LEU A 430 -0.762 10.376 0.488 1.00 0.31 C ATOM 1724 CG LEU A 430 -1.592 10.338 1.763 1.00 0.42 C ATOM 1725 CD1 LEU A 430 -3.013 9.925 1.427 1.00 0.70 C ATOM 1726 CD2 LEU A 430 -0.963 9.390 2.780 1.00 0.61 C ATOM 0 H LEU A 430 -0.433 12.711 1.093 1.00 0.38 H new ATOM 0 HA LEU A 430 1.212 10.372 1.333 1.00 0.32 H new ATOM 0 HB2 LEU A 430 -1.306 10.948 -0.264 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -0.664 9.360 0.106 1.00 0.31 H new ATOM 0 HG LEU A 430 -1.616 11.331 2.212 1.00 0.42 H new ATOM 0 HD11 LEU A 430 -3.609 9.897 2.339 1.00 0.70 H new ATOM 0 HD12 LEU A 430 -3.446 10.644 0.732 1.00 0.70 H new ATOM 0 HD13 LEU A 430 -3.006 8.936 0.968 1.00 0.70 H new ATOM 0 HD21 LEU A 430 -1.569 9.374 3.686 1.00 0.61 H new ATOM 0 HD22 LEU A 430 -0.914 8.386 2.359 1.00 0.61 H new ATOM 0 HD23 LEU A 430 0.043 9.732 3.022 1.00 0.61 H new ATOM 1738 N GLU A 431 0.961 11.882 -1.579 1.00 0.31 N ATOM 1739 CA GLU A 431 1.614 12.022 -2.875 1.00 0.35 C ATOM 1740 C GLU A 431 3.092 12.308 -2.698 1.00 0.39 C ATOM 1741 O GLU A 431 3.924 11.961 -3.537 1.00 0.44 O ATOM 1742 CB GLU A 431 0.941 13.123 -3.674 1.00 0.39 C ATOM 1743 CG GLU A 431 -0.210 12.604 -4.508 1.00 0.50 C ATOM 1744 CD GLU A 431 0.265 11.954 -5.795 1.00 1.35 C ATOM 1745 OE1 GLU A 431 0.951 10.909 -5.730 1.00 2.30 O ATOM 1746 OE2 GLU A 431 -0.023 12.505 -6.878 1.00 1.54 O ATOM 0 H GLU A 431 0.200 12.542 -1.419 1.00 0.31 H new ATOM 0 HA GLU A 431 1.518 11.085 -3.424 1.00 0.35 H new ATOM 0 HB2 GLU A 431 0.576 13.892 -2.993 1.00 0.39 H new ATOM 0 HB3 GLU A 431 1.675 13.597 -4.326 1.00 0.39 H new ATOM 0 HG2 GLU A 431 -0.781 11.881 -3.926 1.00 0.50 H new ATOM 0 HG3 GLU A 431 -0.885 13.426 -4.745 1.00 0.50 H new ATOM 1753 N HIS A 432 3.397 12.940 -1.585 1.00 0.39 N ATOM 1754 CA HIS A 432 4.760 13.219 -1.203 1.00 0.45 C ATOM 1755 C HIS A 432 5.389 11.969 -0.600 1.00 0.44 C ATOM 1756 O HIS A 432 6.541 11.632 -0.880 1.00 0.52 O ATOM 1757 CB HIS A 432 4.750 14.347 -0.168 1.00 0.50 C ATOM 1758 CG HIS A 432 5.979 15.187 -0.161 1.00 0.55 C ATOM 1759 ND1 HIS A 432 5.998 16.485 -0.623 1.00 0.87 N ATOM 1760 CD2 HIS A 432 7.225 14.925 0.273 1.00 0.70 C ATOM 1761 CE1 HIS A 432 7.210 16.983 -0.478 1.00 0.91 C ATOM 1762 NE2 HIS A 432 7.974 16.055 0.064 1.00 0.77 N ATOM 0 H HIS A 432 2.702 13.275 -0.918 1.00 0.39 H new ATOM 0 HA HIS A 432 5.342 13.518 -2.075 1.00 0.45 H new ATOM 0 HB2 HIS A 432 3.888 14.987 -0.355 1.00 0.50 H new ATOM 0 HB3 HIS A 432 4.616 13.913 0.823 1.00 0.50 H new ATOM 0 HD2 HIS A 432 7.571 13.998 0.705 1.00 0.70 H new ATOM 0 HE1 HIS A 432 7.523 17.979 -0.755 1.00 0.91 H new ATOM 0 HE2 HIS A 432 8.963 16.160 0.291 1.00 0.77 H new ATOM 1771 N LEU A 433 4.592 11.275 0.198 1.00 0.39 N ATOM 1772 CA LEU A 433 5.051 10.147 0.985 1.00 0.40 C ATOM 1773 C LEU A 433 5.256 8.906 0.132 1.00 0.36 C ATOM 1774 O LEU A 433 6.256 8.230 0.283 1.00 0.35 O ATOM 1775 CB LEU A 433 4.038 9.839 2.090 1.00 0.53 C ATOM 1776 CG LEU A 433 4.626 9.315 3.402 1.00 0.43 C ATOM 1777 CD1 LEU A 433 5.350 7.993 3.201 1.00 0.91 C ATOM 1778 CD2 LEU A 433 5.564 10.345 4.001 1.00 0.73 C ATOM 0 H LEU A 433 3.600 11.483 0.317 1.00 0.39 H new ATOM 0 HA LEU A 433 6.012 10.420 1.420 1.00 0.40 H new ATOM 0 HB2 LEU A 433 3.473 10.747 2.303 1.00 0.53 H new ATOM 0 HB3 LEU A 433 3.328 9.103 1.712 1.00 0.53 H new ATOM 0 HG LEU A 433 3.801 9.138 4.092 1.00 0.43 H new ATOM 0 HD11 LEU A 433 5.755 7.651 4.154 1.00 0.91 H new ATOM 0 HD12 LEU A 433 4.651 7.250 2.816 1.00 0.91 H new ATOM 0 HD13 LEU A 433 6.164 8.129 2.489 1.00 0.91 H new ATOM 0 HD21 LEU A 433 5.977 9.962 4.934 1.00 0.73 H new ATOM 0 HD22 LEU A 433 6.375 10.549 3.302 1.00 0.73 H new ATOM 0 HD23 LEU A 433 5.015 11.266 4.198 1.00 0.73 H new ATOM 1790 N GLU A 434 4.320 8.611 -0.759 1.00 0.40 N ATOM 1791 CA GLU A 434 4.322 7.335 -1.472 1.00 0.45 C ATOM 1792 C GLU A 434 5.589 7.105 -2.263 1.00 0.45 C ATOM 1793 O GLU A 434 5.993 5.972 -2.471 1.00 0.56 O ATOM 1794 CB GLU A 434 3.116 7.194 -2.360 1.00 0.66 C ATOM 1795 CG GLU A 434 1.841 7.152 -1.555 1.00 0.80 C ATOM 1796 CD GLU A 434 1.786 6.024 -0.555 1.00 1.20 C ATOM 1797 OE1 GLU A 434 2.458 6.138 0.489 1.00 1.75 O ATOM 1798 OE2 GLU A 434 1.112 5.015 -0.828 1.00 1.47 O ATOM 0 H GLU A 434 3.551 9.233 -1.007 1.00 0.40 H new ATOM 0 HA GLU A 434 4.279 6.564 -0.703 1.00 0.45 H new ATOM 0 HB2 GLU A 434 3.078 8.028 -3.060 1.00 0.66 H new ATOM 0 HB3 GLU A 434 3.204 6.284 -2.953 1.00 0.66 H new ATOM 0 HG2 GLU A 434 1.725 8.098 -1.027 1.00 0.80 H new ATOM 0 HG3 GLU A 434 0.995 7.062 -2.237 1.00 0.80 H new ATOM 1805 N SER A 435 6.212 8.166 -2.718 1.00 0.46 N ATOM 1806 CA SER A 435 7.504 8.057 -3.330 1.00 0.53 C ATOM 1807 C SER A 435 8.577 7.806 -2.277 1.00 0.50 C ATOM 1808 O SER A 435 9.508 7.021 -2.471 1.00 0.58 O ATOM 1809 CB SER A 435 7.786 9.337 -4.049 1.00 0.62 C ATOM 1810 OG SER A 435 7.090 9.414 -5.284 1.00 1.01 O ATOM 0 H SER A 435 5.840 9.115 -2.673 1.00 0.46 H new ATOM 0 HA SER A 435 7.513 7.218 -4.026 1.00 0.53 H new ATOM 0 HB2 SER A 435 7.500 10.179 -3.418 1.00 0.62 H new ATOM 0 HB3 SER A 435 8.857 9.424 -4.230 1.00 0.62 H new ATOM 0 HG SER A 435 6.297 9.980 -5.178 1.00 1.01 H new ATOM 1816 N GLN A 436 8.406 8.476 -1.158 1.00 0.43 N ATOM 1817 CA GLN A 436 9.380 8.477 -0.073 1.00 0.48 C ATOM 1818 C GLN A 436 9.375 7.169 0.703 1.00 0.45 C ATOM 1819 O GLN A 436 10.425 6.680 1.069 1.00 0.51 O ATOM 1820 CB GLN A 436 9.130 9.646 0.875 1.00 0.52 C ATOM 1821 CG GLN A 436 9.409 10.995 0.240 1.00 0.77 C ATOM 1822 CD GLN A 436 9.239 12.145 1.209 1.00 0.77 C ATOM 1823 OE1 GLN A 436 8.407 12.098 2.114 1.00 1.27 O ATOM 1824 NE2 GLN A 436 10.036 13.185 1.027 1.00 1.38 N ATOM 0 H GLN A 436 7.580 9.043 -0.968 1.00 0.43 H new ATOM 0 HA GLN A 436 10.364 8.588 -0.529 1.00 0.48 H new ATOM 0 HB2 GLN A 436 8.094 9.617 1.213 1.00 0.52 H new ATOM 0 HB3 GLN A 436 9.757 9.530 1.759 1.00 0.52 H new ATOM 0 HG2 GLN A 436 10.426 11.004 -0.152 1.00 0.77 H new ATOM 0 HG3 GLN A 436 8.739 11.138 -0.608 1.00 0.77 H new ATOM 0 HE21 GLN A 436 10.712 13.182 0.263 1.00 1.38 H new ATOM 0 HE22 GLN A 436 9.974 13.990 1.650 1.00 1.38 H new ATOM 1833 N VAL A 437 8.199 6.601 0.949 1.00 0.38 N ATOM 1834 CA VAL A 437 8.097 5.304 1.629 1.00 0.38 C ATOM 1835 C VAL A 437 8.909 4.242 0.886 1.00 0.42 C ATOM 1836 O VAL A 437 9.423 3.290 1.477 1.00 0.49 O ATOM 1837 CB VAL A 437 6.618 4.854 1.784 1.00 0.33 C ATOM 1838 CG1 VAL A 437 5.790 5.237 0.578 1.00 0.31 C ATOM 1839 CG2 VAL A 437 6.520 3.360 2.005 1.00 0.38 C ATOM 0 H VAL A 437 7.302 7.013 0.690 1.00 0.38 H new ATOM 0 HA VAL A 437 8.511 5.422 2.630 1.00 0.38 H new ATOM 0 HB VAL A 437 6.223 5.371 2.658 1.00 0.33 H new ATOM 0 HG11 VAL A 437 4.762 4.906 0.723 1.00 0.31 H new ATOM 0 HG12 VAL A 437 5.808 6.320 0.453 1.00 0.31 H new ATOM 0 HG13 VAL A 437 6.202 4.762 -0.312 1.00 0.31 H new ATOM 0 HG21 VAL A 437 5.473 3.076 2.110 1.00 0.38 H new ATOM 0 HG22 VAL A 437 6.955 2.837 1.153 1.00 0.38 H new ATOM 0 HG23 VAL A 437 7.062 3.090 2.911 1.00 0.38 H new ATOM 1849 N LEU A 438 9.058 4.456 -0.404 1.00 0.41 N ATOM 1850 CA LEU A 438 9.790 3.550 -1.267 1.00 0.48 C ATOM 1851 C LEU A 438 11.288 3.835 -1.209 1.00 0.55 C ATOM 1852 O LEU A 438 12.097 3.063 -1.724 1.00 0.62 O ATOM 1853 CB LEU A 438 9.275 3.734 -2.688 1.00 0.48 C ATOM 1854 CG LEU A 438 7.755 3.634 -2.817 1.00 0.47 C ATOM 1855 CD1 LEU A 438 7.303 3.946 -4.226 1.00 0.51 C ATOM 1856 CD2 LEU A 438 7.273 2.258 -2.404 1.00 0.54 C ATOM 0 H LEU A 438 8.673 5.268 -0.887 1.00 0.41 H new ATOM 0 HA LEU A 438 9.637 2.523 -0.937 1.00 0.48 H new ATOM 0 HB2 LEU A 438 9.597 4.708 -3.057 1.00 0.48 H new ATOM 0 HB3 LEU A 438 9.734 2.982 -3.330 1.00 0.48 H new ATOM 0 HG LEU A 438 7.316 4.374 -2.148 1.00 0.47 H new ATOM 0 HD11 LEU A 438 6.218 3.867 -4.286 1.00 0.51 H new ATOM 0 HD12 LEU A 438 7.608 4.959 -4.490 1.00 0.51 H new ATOM 0 HD13 LEU A 438 7.757 3.238 -4.919 1.00 0.51 H new ATOM 0 HD21 LEU A 438 6.189 2.207 -2.503 1.00 0.54 H new ATOM 0 HD22 LEU A 438 7.731 1.505 -3.044 1.00 0.54 H new ATOM 0 HD23 LEU A 438 7.552 2.071 -1.367 1.00 0.54 H new