USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 581 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 429 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 430 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 396 HIS : no HD1:sc= 0.689 K(o=1.3,f=-4.2!) USER MOD Set 2.2: A 405 THR OG1 : rot 140:sc= 0.608 USER MOD Set 3.1: A 377 THR OG1 : rot 180:sc= 0.603 USER MOD Set 3.2: A 380 SER OG : rot 82:sc= 0.678 USER MOD Set 4.1: A 362 THR OG1 : rot 140:sc= -1.05 USER MOD Set 4.2: A 364 LYS NZ :NH3+ -139:sc= -3.12! (180deg=-5.68!) USER MOD Set 4.3: A 373 GLN : amide:sc= -0.227 K(o=-4.4,f=-6.7) USER MOD Single : A 355 SER OG : rot 180:sc= 0 USER MOD Single : A 356 HIS : no HD1:sc= -0.366 K(o=-0.37,f=-1.2) USER MOD Single : A 357 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 363 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 365 HIS : no HD1:sc= -0.116 X(o=-0.12,f=0) USER MOD Single : A 366 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 370 SER OG : rot -11:sc= 0.722 USER MOD Single : A 371 GLN : amide:sc= -0.732 K(o=-0.73,f=-3.3!) USER MOD Single : A 372 GLN :FLIP amide:sc= -1.46! C(o=-3.3!,f=-1.5!) USER MOD Single : A 382 ASN :FLIP amide:sc= -1.06 F(o=-4.6!,f=-1.1) USER MOD Single : A 383 LYS NZ :NH3+ 163:sc= -0.0372 (180deg=-0.341) USER MOD Single : A 384 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 386 GLN : amide:sc= -1.86! C(o=-1.9!,f=-1.9!) USER MOD Single : A 387 ASN : amide:sc= -0.311 X(o=-0.31,f=-0.31) USER MOD Single : A 390 LYS NZ :NH3+ -165:sc= -0.048 (180deg=-0.277) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 394 LYS NZ :NH3+ -105:sc= 0.712 (180deg=0.0136) USER MOD Single : A 397 ASN : amide:sc= 0.448 K(o=0.45,f=-3.6!) USER MOD Single : A 401 ASN : amide:sc= -2.11 X(o=-2.1,f=-2.2) USER MOD Single : A 402 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 403 LYS NZ :NH3+ -170:sc= -0.0142 (180deg=-0.159) USER MOD Single : A 408 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 412 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 413 LYS NZ :NH3+ -165:sc= -0.0426 (180deg=-0.287) USER MOD Single : A 418 THR OG1 : rot -73:sc= 1.24 USER MOD Single : A 420 LYS NZ :NH3+ -165:sc= -0.0635 (180deg=-0.322) USER MOD Single : A 423 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 424 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 ASN : amide:sc= -0.618 K(o=-0.62,f=-2.9!) USER MOD Single : A 427 THR OG1 : rot 180:sc= 0 USER MOD Single : A 428 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 432 SER OG : rot -61:sc= 0.311 USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 5.402 38.076 -5.220 1.00 0.00 N ATOM 2 CA GLY A 354 4.172 37.657 -4.495 1.00 0.00 C ATOM 3 C GLY A 354 3.447 36.522 -5.191 1.00 0.00 C ATOM 4 O GLY A 354 2.227 36.561 -5.351 1.00 0.00 O ATOM 0 HA2 GLY A 354 4.437 37.349 -3.484 1.00 0.00 H new ATOM 0 HA3 GLY A 354 3.500 38.510 -4.402 1.00 0.00 H new ATOM 10 N SER A 355 4.203 35.511 -5.608 1.00 0.00 N ATOM 11 CA SER A 355 3.631 34.358 -6.295 1.00 0.00 C ATOM 12 C SER A 355 2.767 33.527 -5.345 1.00 0.00 C ATOM 13 O SER A 355 2.040 34.074 -4.515 1.00 0.00 O ATOM 14 CB SER A 355 4.746 33.496 -6.893 1.00 0.00 C ATOM 15 OG SER A 355 5.510 34.232 -7.833 1.00 0.00 O ATOM 0 H SER A 355 5.214 35.467 -5.482 1.00 0.00 H new ATOM 0 HA SER A 355 2.993 34.721 -7.101 1.00 0.00 H new ATOM 0 HB2 SER A 355 5.395 33.132 -6.097 1.00 0.00 H new ATOM 0 HB3 SER A 355 4.313 32.620 -7.377 1.00 0.00 H new ATOM 0 HG SER A 355 6.217 33.660 -8.199 1.00 0.00 H new ATOM 21 N HIS A 356 2.848 32.203 -5.469 1.00 0.00 N ATOM 22 CA HIS A 356 2.072 31.308 -4.620 1.00 0.00 C ATOM 23 C HIS A 356 2.490 31.444 -3.160 1.00 0.00 C ATOM 24 O HIS A 356 3.681 31.501 -2.848 1.00 0.00 O ATOM 25 CB HIS A 356 2.235 29.857 -5.084 1.00 0.00 C ATOM 26 CG HIS A 356 1.742 29.609 -6.479 1.00 0.00 C ATOM 27 ND1 HIS A 356 1.787 28.370 -7.083 1.00 0.00 N ATOM 28 CD2 HIS A 356 1.189 30.447 -7.390 1.00 0.00 C ATOM 29 CE1 HIS A 356 1.286 28.456 -8.302 1.00 0.00 C ATOM 30 NE2 HIS A 356 0.915 29.705 -8.513 1.00 0.00 N ATOM 0 H HIS A 356 3.443 31.729 -6.149 1.00 0.00 H new ATOM 0 HA HIS A 356 1.022 31.588 -4.703 1.00 0.00 H new ATOM 0 HB2 HIS A 356 3.288 29.583 -5.027 1.00 0.00 H new ATOM 0 HB3 HIS A 356 1.698 29.203 -4.397 1.00 0.00 H new ATOM 0 HD2 HIS A 356 0.999 31.502 -7.257 1.00 0.00 H new ATOM 0 HE1 HIS A 356 1.195 27.642 -9.007 1.00 0.00 H new ATOM 0 HE2 HIS A 356 0.493 30.061 -9.371 1.00 0.00 H new ATOM 39 N MET A 357 1.504 31.501 -2.270 1.00 0.00 N ATOM 40 CA MET A 357 1.763 31.635 -0.840 1.00 0.00 C ATOM 41 C MET A 357 2.602 30.471 -0.324 1.00 0.00 C ATOM 42 O MET A 357 2.330 29.311 -0.635 1.00 0.00 O ATOM 43 CB MET A 357 0.444 31.711 -0.071 1.00 0.00 C ATOM 44 CG MET A 357 -0.439 32.870 -0.501 1.00 0.00 C ATOM 45 SD MET A 357 -1.998 32.931 0.402 1.00 0.00 S ATOM 46 CE MET A 357 -2.768 34.357 -0.358 1.00 0.00 C ATOM 0 H MET A 357 0.515 31.456 -2.515 1.00 0.00 H new ATOM 0 HA MET A 357 2.324 32.556 -0.682 1.00 0.00 H new ATOM 0 HB2 MET A 357 -0.102 30.778 -0.208 1.00 0.00 H new ATOM 0 HB3 MET A 357 0.658 31.802 0.994 1.00 0.00 H new ATOM 0 HG2 MET A 357 0.099 33.806 -0.352 1.00 0.00 H new ATOM 0 HG3 MET A 357 -0.645 32.788 -1.568 1.00 0.00 H new ATOM 0 HE1 MET A 357 -3.745 34.527 0.094 1.00 0.00 H new ATOM 0 HE2 MET A 357 -2.140 35.234 -0.205 1.00 0.00 H new ATOM 0 HE3 MET A 357 -2.889 34.179 -1.427 1.00 0.00 H new ATOM 56 N LEU A 358 3.626 30.792 0.465 1.00 0.00 N ATOM 57 CA LEU A 358 4.513 29.778 1.028 1.00 0.00 C ATOM 58 C LEU A 358 5.115 28.916 -0.082 1.00 0.00 C ATOM 59 O LEU A 358 5.434 29.420 -1.159 1.00 0.00 O ATOM 60 CB LEU A 358 3.751 28.905 2.032 1.00 0.00 C ATOM 61 CG LEU A 358 3.131 29.659 3.212 1.00 0.00 C ATOM 62 CD1 LEU A 358 2.324 28.710 4.084 1.00 0.00 C ATOM 63 CD2 LEU A 358 4.210 30.347 4.036 1.00 0.00 C ATOM 0 H LEU A 358 3.861 31.749 0.729 1.00 0.00 H new ATOM 0 HA LEU A 358 5.327 30.280 1.551 1.00 0.00 H new ATOM 0 HB2 LEU A 358 2.958 28.377 1.502 1.00 0.00 H new ATOM 0 HB3 LEU A 358 4.432 28.149 2.422 1.00 0.00 H new ATOM 0 HG LEU A 358 2.461 30.422 2.816 1.00 0.00 H new ATOM 0 HD11 LEU A 358 1.890 29.262 4.918 1.00 0.00 H new ATOM 0 HD12 LEU A 358 1.526 28.261 3.492 1.00 0.00 H new ATOM 0 HD13 LEU A 358 2.976 27.926 4.468 1.00 0.00 H new ATOM 0 HD21 LEU A 358 3.749 30.877 4.869 1.00 0.00 H new ATOM 0 HD22 LEU A 358 4.905 29.601 4.421 1.00 0.00 H new ATOM 0 HD23 LEU A 358 4.750 31.057 3.409 1.00 0.00 H new ATOM 75 N GLU A 359 5.269 27.620 0.181 1.00 0.00 N ATOM 76 CA GLU A 359 5.830 26.705 -0.807 1.00 0.00 C ATOM 77 C GLU A 359 4.923 26.606 -2.028 1.00 0.00 C ATOM 78 O GLU A 359 3.723 26.363 -1.904 1.00 0.00 O ATOM 79 CB GLU A 359 6.034 25.318 -0.190 1.00 0.00 C ATOM 80 CG GLU A 359 6.615 24.295 -1.154 1.00 0.00 C ATOM 81 CD GLU A 359 8.025 24.638 -1.605 1.00 0.00 C ATOM 82 OE1 GLU A 359 8.577 25.647 -1.119 1.00 0.00 O ATOM 83 OE2 GLU A 359 8.577 23.890 -2.438 1.00 0.00 O ATOM 0 H GLU A 359 5.014 27.182 1.066 1.00 0.00 H new ATOM 0 HA GLU A 359 6.796 27.097 -1.125 1.00 0.00 H new ATOM 0 HB2 GLU A 359 6.696 25.408 0.671 1.00 0.00 H new ATOM 0 HB3 GLU A 359 5.077 24.951 0.180 1.00 0.00 H new ATOM 0 HG2 GLU A 359 6.621 23.316 -0.676 1.00 0.00 H new ATOM 0 HG3 GLU A 359 5.968 24.219 -2.028 1.00 0.00 H new ATOM 90 N VAL A 360 5.504 26.796 -3.209 1.00 0.00 N ATOM 91 CA VAL A 360 4.745 26.729 -4.452 1.00 0.00 C ATOM 92 C VAL A 360 4.201 25.324 -4.695 1.00 0.00 C ATOM 93 O VAL A 360 4.925 24.336 -4.571 1.00 0.00 O ATOM 94 CB VAL A 360 5.601 27.165 -5.659 1.00 0.00 C ATOM 95 CG1 VAL A 360 5.997 28.628 -5.530 1.00 0.00 C ATOM 96 CG2 VAL A 360 6.837 26.286 -5.792 1.00 0.00 C ATOM 0 H VAL A 360 6.497 26.997 -3.331 1.00 0.00 H new ATOM 0 HA VAL A 360 3.907 27.419 -4.348 1.00 0.00 H new ATOM 0 HB VAL A 360 5.002 27.047 -6.562 1.00 0.00 H new ATOM 0 HG11 VAL A 360 6.600 28.919 -6.390 1.00 0.00 H new ATOM 0 HG12 VAL A 360 5.100 29.246 -5.491 1.00 0.00 H new ATOM 0 HG13 VAL A 360 6.575 28.769 -4.617 1.00 0.00 H new ATOM 0 HG21 VAL A 360 7.425 26.612 -6.650 1.00 0.00 H new ATOM 0 HG22 VAL A 360 7.440 26.366 -4.887 1.00 0.00 H new ATOM 0 HG23 VAL A 360 6.532 25.249 -5.934 1.00 0.00 H new ATOM 106 N LEU A 361 2.918 25.244 -5.038 1.00 0.00 N ATOM 107 CA LEU A 361 2.273 23.961 -5.296 1.00 0.00 C ATOM 108 C LEU A 361 2.884 23.276 -6.515 1.00 0.00 C ATOM 109 O LEU A 361 3.286 23.935 -7.476 1.00 0.00 O ATOM 110 CB LEU A 361 0.760 24.150 -5.473 1.00 0.00 C ATOM 111 CG LEU A 361 0.331 25.129 -6.572 1.00 0.00 C ATOM 112 CD1 LEU A 361 0.476 24.497 -7.947 1.00 0.00 C ATOM 113 CD2 LEU A 361 -1.102 25.585 -6.343 1.00 0.00 C ATOM 0 H LEU A 361 2.305 26.053 -5.144 1.00 0.00 H new ATOM 0 HA LEU A 361 2.440 23.314 -4.435 1.00 0.00 H new ATOM 0 HB2 LEU A 361 0.314 23.178 -5.685 1.00 0.00 H new ATOM 0 HB3 LEU A 361 0.343 24.492 -4.526 1.00 0.00 H new ATOM 0 HG LEU A 361 0.985 26.000 -6.529 1.00 0.00 H new ATOM 0 HD11 LEU A 361 0.166 25.211 -8.710 1.00 0.00 H new ATOM 0 HD12 LEU A 361 1.517 24.219 -8.112 1.00 0.00 H new ATOM 0 HD13 LEU A 361 -0.151 23.607 -8.006 1.00 0.00 H new ATOM 0 HD21 LEU A 361 -1.393 26.280 -7.131 1.00 0.00 H new ATOM 0 HD22 LEU A 361 -1.766 24.721 -6.358 1.00 0.00 H new ATOM 0 HD23 LEU A 361 -1.175 26.082 -5.376 1.00 0.00 H new ATOM 125 N THR A 362 2.961 21.951 -6.464 1.00 0.00 N ATOM 126 CA THR A 362 3.528 21.175 -7.560 1.00 0.00 C ATOM 127 C THR A 362 2.659 21.274 -8.809 1.00 0.00 C ATOM 128 O THR A 362 1.439 21.117 -8.743 1.00 0.00 O ATOM 129 CB THR A 362 3.690 19.692 -7.175 1.00 0.00 C ATOM 130 OG1 THR A 362 2.415 19.129 -6.847 1.00 0.00 O ATOM 131 CG2 THR A 362 4.633 19.543 -5.991 1.00 0.00 C ATOM 0 H THR A 362 2.638 21.392 -5.675 1.00 0.00 H new ATOM 0 HA THR A 362 4.511 21.596 -7.770 1.00 0.00 H new ATOM 0 HB THR A 362 4.113 19.161 -8.028 1.00 0.00 H new ATOM 0 HG1 THR A 362 2.354 18.222 -7.212 1.00 0.00 H new ATOM 0 HG21 THR A 362 4.733 18.488 -5.736 1.00 0.00 H new ATOM 0 HG22 THR A 362 5.611 19.948 -6.252 1.00 0.00 H new ATOM 0 HG23 THR A 362 4.232 20.087 -5.136 1.00 0.00 H new ATOM 139 N GLN A 363 3.295 21.538 -9.947 1.00 0.00 N ATOM 140 CA GLN A 363 2.581 21.659 -11.213 1.00 0.00 C ATOM 141 C GLN A 363 1.921 20.335 -11.589 1.00 0.00 C ATOM 142 O GLN A 363 2.585 19.301 -11.667 1.00 0.00 O ATOM 143 CB GLN A 363 3.541 22.104 -12.319 1.00 0.00 C ATOM 144 CG GLN A 363 2.878 22.278 -13.675 1.00 0.00 C ATOM 145 CD GLN A 363 3.851 22.739 -14.742 1.00 0.00 C ATOM 146 OE1 GLN A 363 4.466 23.798 -14.621 1.00 0.00 O ATOM 147 NE2 GLN A 363 3.995 21.943 -15.794 1.00 0.00 N ATOM 0 H GLN A 363 4.304 21.672 -10.018 1.00 0.00 H new ATOM 0 HA GLN A 363 1.801 22.411 -11.098 1.00 0.00 H new ATOM 0 HB2 GLN A 363 4.003 23.047 -12.028 1.00 0.00 H new ATOM 0 HB3 GLN A 363 4.342 21.370 -12.408 1.00 0.00 H new ATOM 0 HG2 GLN A 363 2.430 21.333 -13.981 1.00 0.00 H new ATOM 0 HG3 GLN A 363 2.068 23.002 -13.589 1.00 0.00 H new ATOM 0 HE21 GLN A 363 3.464 21.074 -15.852 1.00 0.00 H new ATOM 0 HE22 GLN A 363 4.636 22.200 -16.544 1.00 0.00 H new ATOM 156 N LYS A 364 0.612 20.372 -11.816 1.00 0.00 N ATOM 157 CA LYS A 364 -0.132 19.172 -12.180 1.00 0.00 C ATOM 158 C LYS A 364 -1.440 19.518 -12.892 1.00 0.00 C ATOM 159 O LYS A 364 -2.508 19.537 -12.278 1.00 0.00 O ATOM 160 CB LYS A 364 -0.412 18.326 -10.933 1.00 0.00 C ATOM 161 CG LYS A 364 -1.104 19.092 -9.813 1.00 0.00 C ATOM 162 CD LYS A 364 -1.437 18.194 -8.628 1.00 0.00 C ATOM 163 CE LYS A 364 -0.192 17.772 -7.857 1.00 0.00 C ATOM 164 NZ LYS A 364 0.703 16.894 -8.662 1.00 0.00 N ATOM 0 H LYS A 364 0.046 21.218 -11.754 1.00 0.00 H new ATOM 0 HA LYS A 364 0.480 18.595 -12.873 1.00 0.00 H new ATOM 0 HB2 LYS A 364 -1.031 17.474 -11.215 1.00 0.00 H new ATOM 0 HB3 LYS A 364 0.530 17.925 -10.558 1.00 0.00 H new ATOM 0 HG2 LYS A 364 -0.461 19.907 -9.481 1.00 0.00 H new ATOM 0 HG3 LYS A 364 -2.020 19.543 -10.195 1.00 0.00 H new ATOM 0 HD2 LYS A 364 -2.117 18.718 -7.957 1.00 0.00 H new ATOM 0 HD3 LYS A 364 -1.961 17.306 -8.983 1.00 0.00 H new ATOM 0 HE2 LYS A 364 0.358 18.660 -7.546 1.00 0.00 H new ATOM 0 HE3 LYS A 364 -0.490 17.248 -6.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 1.071 16.129 -8.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 0.167 16.485 -9.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 1.497 17.454 -9.033 1.00 0.00 H new ATOM 178 N HIS A 365 -1.349 19.785 -14.193 1.00 0.00 N ATOM 179 CA HIS A 365 -2.527 20.122 -14.990 1.00 0.00 C ATOM 180 C HIS A 365 -3.243 21.349 -14.417 1.00 0.00 C ATOM 181 O HIS A 365 -2.632 22.405 -14.251 1.00 0.00 O ATOM 182 CB HIS A 365 -3.478 18.922 -15.059 1.00 0.00 C ATOM 183 CG HIS A 365 -2.884 17.715 -15.723 1.00 0.00 C ATOM 184 ND1 HIS A 365 -3.563 16.522 -15.856 1.00 0.00 N ATOM 185 CD2 HIS A 365 -1.672 17.519 -16.298 1.00 0.00 C ATOM 186 CE1 HIS A 365 -2.796 15.647 -16.482 1.00 0.00 C ATOM 187 NE2 HIS A 365 -1.645 16.228 -16.761 1.00 0.00 N ATOM 0 H HIS A 365 -0.474 19.775 -14.717 1.00 0.00 H new ATOM 0 HA HIS A 365 -2.201 20.368 -16.001 1.00 0.00 H new ATOM 0 HB2 HIS A 365 -3.784 18.655 -14.048 1.00 0.00 H new ATOM 0 HB3 HIS A 365 -4.379 19.215 -15.598 1.00 0.00 H new ATOM 0 HD2 HIS A 365 -0.876 18.244 -16.377 1.00 0.00 H new ATOM 0 HE1 HIS A 365 -3.065 14.630 -16.724 1.00 0.00 H new ATOM 0 HE2 HIS A 365 -0.861 15.788 -17.243 1.00 0.00 H new ATOM 196 N LYS A 366 -4.537 21.205 -14.117 1.00 0.00 N ATOM 197 CA LYS A 366 -5.326 22.303 -13.564 1.00 0.00 C ATOM 198 C LYS A 366 -4.602 22.955 -12.387 1.00 0.00 C ATOM 199 O LYS A 366 -4.047 22.262 -11.534 1.00 0.00 O ATOM 200 CB LYS A 366 -6.699 21.791 -13.116 1.00 0.00 C ATOM 201 CG LYS A 366 -7.585 22.865 -12.503 1.00 0.00 C ATOM 202 CD LYS A 366 -8.943 22.310 -12.099 1.00 0.00 C ATOM 203 CE LYS A 366 -9.726 21.814 -13.304 1.00 0.00 C ATOM 204 NZ LYS A 366 -11.050 21.255 -12.916 1.00 0.00 N ATOM 0 H LYS A 366 -5.058 20.338 -14.249 1.00 0.00 H new ATOM 0 HA LYS A 366 -5.460 23.053 -14.343 1.00 0.00 H new ATOM 0 HB2 LYS A 366 -7.212 21.356 -13.974 1.00 0.00 H new ATOM 0 HB3 LYS A 366 -6.559 20.991 -12.389 1.00 0.00 H new ATOM 0 HG2 LYS A 366 -7.091 23.290 -11.629 1.00 0.00 H new ATOM 0 HG3 LYS A 366 -7.721 23.676 -13.218 1.00 0.00 H new ATOM 0 HD2 LYS A 366 -8.807 21.492 -11.391 1.00 0.00 H new ATOM 0 HD3 LYS A 366 -9.515 23.083 -11.586 1.00 0.00 H new ATOM 0 HE2 LYS A 366 -9.871 22.635 -14.006 1.00 0.00 H new ATOM 0 HE3 LYS A 366 -9.148 21.050 -13.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 -11.552 20.928 -13.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 -10.912 20.455 -12.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 -11.613 21.991 -12.444 1.00 0.00 H new ATOM 218 N PRO A 367 -4.592 24.301 -12.325 1.00 0.00 N ATOM 219 CA PRO A 367 -3.928 25.035 -11.247 1.00 0.00 C ATOM 220 C PRO A 367 -4.732 25.032 -9.951 1.00 0.00 C ATOM 221 O PRO A 367 -4.755 26.024 -9.222 1.00 0.00 O ATOM 222 CB PRO A 367 -3.819 26.446 -11.807 1.00 0.00 C ATOM 223 CG PRO A 367 -4.982 26.580 -12.720 1.00 0.00 C ATOM 224 CD PRO A 367 -5.227 25.212 -13.299 1.00 0.00 C ATOM 0 HA PRO A 367 -2.970 24.589 -10.979 1.00 0.00 H new ATOM 0 HB2 PRO A 367 -3.852 27.191 -11.012 1.00 0.00 H new ATOM 0 HB3 PRO A 367 -2.879 26.589 -12.340 1.00 0.00 H new ATOM 0 HG2 PRO A 367 -5.860 26.937 -12.181 1.00 0.00 H new ATOM 0 HG3 PRO A 367 -4.776 27.304 -13.508 1.00 0.00 H new ATOM 0 HD2 PRO A 367 -6.292 25.006 -13.404 1.00 0.00 H new ATOM 0 HD3 PRO A 367 -4.784 25.111 -14.290 1.00 0.00 H new ATOM 232 N ALA A 368 -5.381 23.909 -9.666 1.00 0.00 N ATOM 233 CA ALA A 368 -6.177 23.774 -8.453 1.00 0.00 C ATOM 234 C ALA A 368 -5.277 23.641 -7.231 1.00 0.00 C ATOM 235 O ALA A 368 -4.375 22.803 -7.204 1.00 0.00 O ATOM 236 CB ALA A 368 -7.106 22.574 -8.563 1.00 0.00 C ATOM 0 H ALA A 368 -5.371 23.079 -10.259 1.00 0.00 H new ATOM 0 HA ALA A 368 -6.781 24.673 -8.335 1.00 0.00 H new ATOM 0 HB1 ALA A 368 -7.695 22.485 -7.650 1.00 0.00 H new ATOM 0 HB2 ALA A 368 -7.774 22.708 -9.414 1.00 0.00 H new ATOM 0 HB3 ALA A 368 -6.516 21.669 -8.704 1.00 0.00 H new ATOM 242 N GLU A 369 -5.522 24.471 -6.224 1.00 0.00 N ATOM 243 CA GLU A 369 -4.725 24.439 -5.006 1.00 0.00 C ATOM 244 C GLU A 369 -5.010 23.175 -4.201 1.00 0.00 C ATOM 245 O GLU A 369 -6.158 22.887 -3.864 1.00 0.00 O ATOM 246 CB GLU A 369 -5.006 25.678 -4.153 1.00 0.00 C ATOM 247 CG GLU A 369 -4.174 25.743 -2.882 1.00 0.00 C ATOM 248 CD GLU A 369 -4.449 26.993 -2.069 1.00 0.00 C ATOM 249 OE1 GLU A 369 -5.610 27.186 -1.651 1.00 0.00 O ATOM 250 OE2 GLU A 369 -3.503 27.778 -1.849 1.00 0.00 O ATOM 0 H GLU A 369 -6.263 25.171 -6.227 1.00 0.00 H new ATOM 0 HA GLU A 369 -3.673 24.436 -5.291 1.00 0.00 H new ATOM 0 HB2 GLU A 369 -4.814 26.570 -4.749 1.00 0.00 H new ATOM 0 HB3 GLU A 369 -6.063 25.694 -3.887 1.00 0.00 H new ATOM 0 HG2 GLU A 369 -4.381 24.864 -2.271 1.00 0.00 H new ATOM 0 HG3 GLU A 369 -3.116 25.709 -3.142 1.00 0.00 H new ATOM 257 N SER A 370 -3.952 22.432 -3.893 1.00 0.00 N ATOM 258 CA SER A 370 -4.070 21.198 -3.121 1.00 0.00 C ATOM 259 C SER A 370 -2.704 20.771 -2.597 1.00 0.00 C ATOM 260 O SER A 370 -1.747 20.645 -3.361 1.00 0.00 O ATOM 261 CB SER A 370 -4.666 20.078 -3.979 1.00 0.00 C ATOM 262 OG SER A 370 -5.975 20.402 -4.413 1.00 0.00 O ATOM 0 H SER A 370 -2.997 22.664 -4.168 1.00 0.00 H new ATOM 0 HA SER A 370 -4.735 21.386 -2.278 1.00 0.00 H new ATOM 0 HB2 SER A 370 -4.027 19.901 -4.844 1.00 0.00 H new ATOM 0 HB3 SER A 370 -4.690 19.151 -3.406 1.00 0.00 H new ATOM 0 HG SER A 370 -6.295 21.190 -3.926 1.00 0.00 H new ATOM 268 N GLN A 371 -2.618 20.560 -1.289 1.00 0.00 N ATOM 269 CA GLN A 371 -1.365 20.157 -0.664 1.00 0.00 C ATOM 270 C GLN A 371 -1.251 18.637 -0.575 1.00 0.00 C ATOM 271 O GLN A 371 -0.277 18.049 -1.044 1.00 0.00 O ATOM 272 CB GLN A 371 -1.255 20.768 0.734 1.00 0.00 C ATOM 273 CG GLN A 371 -1.391 22.284 0.753 1.00 0.00 C ATOM 274 CD GLN A 371 -0.297 22.987 -0.030 1.00 0.00 C ATOM 275 OE1 GLN A 371 -0.151 22.786 -1.235 1.00 0.00 O ATOM 276 NE2 GLN A 371 0.476 23.823 0.654 1.00 0.00 N ATOM 0 H GLN A 371 -3.400 20.661 -0.642 1.00 0.00 H new ATOM 0 HA GLN A 371 -0.548 20.523 -1.286 1.00 0.00 H new ATOM 0 HB2 GLN A 371 -2.026 20.335 1.371 1.00 0.00 H new ATOM 0 HB3 GLN A 371 -0.293 20.493 1.166 1.00 0.00 H new ATOM 0 HG2 GLN A 371 -2.361 22.562 0.341 1.00 0.00 H new ATOM 0 HG3 GLN A 371 -1.372 22.632 1.786 1.00 0.00 H new ATOM 0 HE21 GLN A 371 0.320 23.960 1.653 1.00 0.00 H new ATOM 0 HE22 GLN A 371 1.225 24.328 0.181 1.00 0.00 H new ATOM 285 N GLN A 372 -2.249 18.011 0.041 1.00 0.00 N ATOM 286 CA GLN A 372 -2.259 16.562 0.207 1.00 0.00 C ATOM 287 C GLN A 372 -2.729 15.848 -1.057 1.00 0.00 C ATOM 288 O GLN A 372 -3.722 16.237 -1.672 1.00 0.00 O ATOM 289 CB GLN A 372 -3.157 16.169 1.379 1.00 0.00 C ATOM 290 CG GLN A 372 -2.723 16.764 2.710 1.00 0.00 C ATOM 291 CD GLN A 372 -3.628 16.363 3.863 1.00 0.00 C ATOM 292 OE1 GLN A 372 -4.650 15.561 3.575 1.00 0.00 O flip ATOM 293 NE2 GLN A 372 -3.411 16.771 5.003 1.00 0.00 N flip ATOM 0 H GLN A 372 -3.062 18.485 0.434 1.00 0.00 H new ATOM 0 HA GLN A 372 -1.234 16.252 0.409 1.00 0.00 H new ATOM 0 HB2 GLN A 372 -4.178 16.486 1.165 1.00 0.00 H new ATOM 0 HB3 GLN A 372 -3.172 15.082 1.465 1.00 0.00 H new ATOM 0 HG2 GLN A 372 -1.703 16.447 2.928 1.00 0.00 H new ATOM 0 HG3 GLN A 372 -2.708 17.851 2.628 1.00 0.00 H new ATOM 0 HE21 GLN A 372 -2.616 17.385 5.182 1.00 0.00 H new ATOM 0 HE22 GLN A 372 -4.026 16.496 5.769 1.00 0.00 H new ATOM 302 N GLN A 373 -2.018 14.784 -1.419 1.00 0.00 N ATOM 303 CA GLN A 373 -2.362 13.989 -2.587 1.00 0.00 C ATOM 304 C GLN A 373 -2.335 12.505 -2.240 1.00 0.00 C ATOM 305 O GLN A 373 -1.345 12.004 -1.705 1.00 0.00 O ATOM 306 CB GLN A 373 -1.399 14.274 -3.742 1.00 0.00 C ATOM 307 CG GLN A 373 -1.722 13.487 -5.003 1.00 0.00 C ATOM 308 CD GLN A 373 -0.729 13.735 -6.121 1.00 0.00 C ATOM 309 OE1 GLN A 373 -0.544 14.868 -6.564 1.00 0.00 O ATOM 310 NE2 GLN A 373 -0.085 12.670 -6.586 1.00 0.00 N ATOM 0 H GLN A 373 -1.195 14.453 -0.915 1.00 0.00 H new ATOM 0 HA GLN A 373 -3.369 14.263 -2.902 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -1.423 15.339 -3.971 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -0.383 14.038 -3.425 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -1.738 12.423 -4.767 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -2.722 13.753 -5.346 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -0.270 11.749 -6.189 1.00 0.00 H new ATOM 0 HE22 GLN A 373 0.594 12.774 -7.340 1.00 0.00 H new ATOM 319 N ALA A 374 -3.421 11.802 -2.548 1.00 0.00 N ATOM 320 CA ALA A 374 -3.508 10.378 -2.267 1.00 0.00 C ATOM 321 C ALA A 374 -2.684 9.580 -3.265 1.00 0.00 C ATOM 322 O ALA A 374 -2.783 9.794 -4.474 1.00 0.00 O ATOM 323 CB ALA A 374 -4.960 9.925 -2.294 1.00 0.00 C ATOM 0 H ALA A 374 -4.250 12.197 -2.991 1.00 0.00 H new ATOM 0 HA ALA A 374 -3.103 10.198 -1.271 1.00 0.00 H new ATOM 0 HB1 ALA A 374 -5.012 8.857 -2.082 1.00 0.00 H new ATOM 0 HB2 ALA A 374 -5.526 10.472 -1.540 1.00 0.00 H new ATOM 0 HB3 ALA A 374 -5.384 10.121 -3.279 1.00 0.00 H new ATOM 329 N ALA A 375 -1.879 8.653 -2.758 1.00 0.00 N ATOM 330 CA ALA A 375 -1.052 7.818 -3.615 1.00 0.00 C ATOM 331 C ALA A 375 -1.918 7.053 -4.594 1.00 0.00 C ATOM 332 O ALA A 375 -1.467 6.631 -5.659 1.00 0.00 O ATOM 333 CB ALA A 375 -0.208 6.864 -2.783 1.00 0.00 C ATOM 0 H ALA A 375 -1.783 8.463 -1.761 1.00 0.00 H new ATOM 0 HA ALA A 375 -0.377 8.461 -4.179 1.00 0.00 H new ATOM 0 HB1 ALA A 375 0.403 6.249 -3.443 1.00 0.00 H new ATOM 0 HB2 ALA A 375 0.439 7.436 -2.118 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -0.861 6.223 -2.191 1.00 0.00 H new ATOM 339 N GLU A 376 -3.164 6.864 -4.203 1.00 0.00 N ATOM 340 CA GLU A 376 -4.125 6.133 -5.001 1.00 0.00 C ATOM 341 C GLU A 376 -5.370 6.968 -5.269 1.00 0.00 C ATOM 342 O GLU A 376 -5.768 7.796 -4.448 1.00 0.00 O ATOM 343 CB GLU A 376 -4.479 4.867 -4.254 1.00 0.00 C ATOM 344 CG GLU A 376 -3.240 4.147 -3.765 1.00 0.00 C ATOM 345 CD GLU A 376 -2.627 3.245 -4.818 1.00 0.00 C ATOM 346 OE1 GLU A 376 -3.179 3.174 -5.937 1.00 0.00 O ATOM 347 OE2 GLU A 376 -1.593 2.609 -4.525 1.00 0.00 O ATOM 0 H GLU A 376 -3.537 7.215 -3.321 1.00 0.00 H new ATOM 0 HA GLU A 376 -3.692 5.892 -5.972 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -5.118 5.111 -3.405 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -5.052 4.207 -4.905 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -2.500 4.882 -3.448 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -3.494 3.552 -2.888 1.00 0.00 H new ATOM 354 N THR A 377 -5.974 6.750 -6.429 1.00 0.00 N ATOM 355 CA THR A 377 -7.170 7.484 -6.822 1.00 0.00 C ATOM 356 C THR A 377 -8.423 6.645 -6.628 1.00 0.00 C ATOM 357 O THR A 377 -8.381 5.419 -6.721 1.00 0.00 O ATOM 358 CB THR A 377 -7.091 7.943 -8.290 1.00 0.00 C ATOM 359 OG1 THR A 377 -6.969 6.807 -9.154 1.00 0.00 O ATOM 360 CG2 THR A 377 -5.905 8.874 -8.499 1.00 0.00 C ATOM 0 H THR A 377 -5.654 6.068 -7.117 1.00 0.00 H new ATOM 0 HA THR A 377 -7.225 8.362 -6.178 1.00 0.00 H new ATOM 0 HB THR A 377 -8.007 8.483 -8.530 1.00 0.00 H new ATOM 0 HG1 THR A 377 -6.921 7.108 -10.085 1.00 0.00 H new ATOM 0 HG21 THR A 377 -5.867 9.187 -9.543 1.00 0.00 H new ATOM 0 HG22 THR A 377 -6.014 9.751 -7.861 1.00 0.00 H new ATOM 0 HG23 THR A 377 -4.983 8.352 -8.243 1.00 0.00 H new ATOM 368 N GLU A 378 -9.537 7.319 -6.355 1.00 0.00 N ATOM 369 CA GLU A 378 -10.811 6.645 -6.146 1.00 0.00 C ATOM 370 C GLU A 378 -11.068 5.634 -7.252 1.00 0.00 C ATOM 371 O GLU A 378 -11.522 4.519 -6.996 1.00 0.00 O ATOM 372 CB GLU A 378 -11.941 7.672 -6.088 1.00 0.00 C ATOM 373 CG GLU A 378 -13.312 7.061 -5.857 1.00 0.00 C ATOM 374 CD GLU A 378 -14.411 8.104 -5.783 1.00 0.00 C ATOM 375 OE1 GLU A 378 -14.599 8.840 -6.774 1.00 0.00 O ATOM 376 OE2 GLU A 378 -15.081 8.185 -4.732 1.00 0.00 O ATOM 0 H GLU A 378 -9.581 8.335 -6.274 1.00 0.00 H new ATOM 0 HA GLU A 378 -10.773 6.110 -5.197 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -11.732 8.384 -5.290 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -11.957 8.235 -7.021 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -13.534 6.361 -6.663 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -13.298 6.487 -4.931 1.00 0.00 H new ATOM 383 N GLY A 379 -10.763 6.027 -8.480 1.00 0.00 N ATOM 384 CA GLY A 379 -10.956 5.142 -9.611 1.00 0.00 C ATOM 385 C GLY A 379 -10.169 3.854 -9.473 1.00 0.00 C ATOM 386 O GLY A 379 -10.664 2.779 -9.813 1.00 0.00 O ATOM 0 H GLY A 379 -10.385 6.945 -8.714 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -12.016 4.909 -9.711 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -10.655 5.653 -10.525 1.00 0.00 H new ATOM 390 N SER A 380 -8.943 3.963 -8.972 1.00 0.00 N ATOM 391 CA SER A 380 -8.087 2.797 -8.788 1.00 0.00 C ATOM 392 C SER A 380 -8.650 1.861 -7.723 1.00 0.00 C ATOM 393 O SER A 380 -8.766 0.653 -7.942 1.00 0.00 O ATOM 394 CB SER A 380 -6.679 3.231 -8.401 1.00 0.00 C ATOM 395 OG SER A 380 -6.089 4.025 -9.415 1.00 0.00 O ATOM 0 H SER A 380 -8.520 4.846 -8.686 1.00 0.00 H new ATOM 0 HA SER A 380 -8.051 2.257 -9.734 1.00 0.00 H new ATOM 0 HB2 SER A 380 -6.713 3.794 -7.468 1.00 0.00 H new ATOM 0 HB3 SER A 380 -6.062 2.351 -8.220 1.00 0.00 H new ATOM 0 HG SER A 380 -6.403 4.950 -9.331 1.00 0.00 H new ATOM 401 N CYS A 381 -8.994 2.426 -6.569 1.00 0.00 N ATOM 402 CA CYS A 381 -9.543 1.638 -5.466 1.00 0.00 C ATOM 403 C CYS A 381 -10.786 0.867 -5.900 1.00 0.00 C ATOM 404 O CYS A 381 -10.954 -0.302 -5.552 1.00 0.00 O ATOM 405 CB CYS A 381 -9.884 2.538 -4.278 1.00 0.00 C ATOM 406 SG CYS A 381 -8.444 3.355 -3.519 1.00 0.00 S ATOM 0 H CYS A 381 -8.903 3.423 -6.372 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.780 0.921 -5.164 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -10.589 3.302 -4.606 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.391 1.942 -3.519 1.00 0.00 H new ATOM 411 N ASN A 382 -11.655 1.526 -6.661 1.00 0.00 N ATOM 412 CA ASN A 382 -12.883 0.897 -7.141 1.00 0.00 C ATOM 413 C ASN A 382 -12.569 -0.392 -7.885 1.00 0.00 C ATOM 414 O ASN A 382 -13.298 -1.379 -7.781 1.00 0.00 O ATOM 415 CB ASN A 382 -13.647 1.849 -8.062 1.00 0.00 C ATOM 416 CG ASN A 382 -14.028 3.148 -7.378 1.00 0.00 C ATOM 417 OD1 ASN A 382 -13.684 3.274 -6.102 1.00 0.00 O flip ATOM 418 ND2 ASN A 382 -14.629 4.031 -7.992 1.00 0.00 N flip ATOM 0 H ASN A 382 -11.533 2.494 -6.959 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.504 0.664 -6.276 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -13.035 2.070 -8.937 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.549 1.354 -8.421 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -14.875 3.894 -8.972 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -14.881 4.899 -7.520 1.00 0.00 H new ATOM 425 N LYS A 383 -11.476 -0.370 -8.634 1.00 0.00 N ATOM 426 CA LYS A 383 -11.050 -1.527 -9.402 1.00 0.00 C ATOM 427 C LYS A 383 -10.581 -2.645 -8.479 1.00 0.00 C ATOM 428 O LYS A 383 -10.784 -3.825 -8.765 1.00 0.00 O ATOM 429 CB LYS A 383 -9.929 -1.131 -10.363 1.00 0.00 C ATOM 430 CG LYS A 383 -10.281 0.057 -11.247 1.00 0.00 C ATOM 431 CD LYS A 383 -11.524 -0.213 -12.081 1.00 0.00 C ATOM 432 CE LYS A 383 -11.809 0.930 -13.042 1.00 0.00 C ATOM 433 NZ LYS A 383 -10.694 1.135 -14.008 1.00 0.00 N ATOM 0 H LYS A 383 -10.866 0.442 -8.725 1.00 0.00 H new ATOM 0 HA LYS A 383 -11.900 -1.893 -9.977 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -9.034 -0.893 -9.787 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -9.684 -1.985 -10.995 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -10.444 0.938 -10.626 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -9.442 0.282 -11.906 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -11.393 -1.138 -12.643 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -12.381 -0.359 -11.423 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -12.729 0.724 -13.588 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -11.973 1.847 -12.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -11.030 1.707 -14.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -9.911 1.629 -13.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -10.362 0.213 -14.356 1.00 0.00 H new ATOM 447 N LYS A 384 -9.938 -2.262 -7.376 1.00 0.00 N ATOM 448 CA LYS A 384 -9.423 -3.214 -6.414 1.00 0.00 C ATOM 449 C LYS A 384 -10.505 -4.146 -5.889 1.00 0.00 C ATOM 450 O LYS A 384 -11.641 -4.152 -6.360 1.00 0.00 O ATOM 451 CB LYS A 384 -8.792 -2.457 -5.252 1.00 0.00 C ATOM 452 CG LYS A 384 -7.828 -1.375 -5.697 1.00 0.00 C ATOM 453 CD LYS A 384 -6.685 -1.937 -6.525 1.00 0.00 C ATOM 454 CE LYS A 384 -7.013 -1.960 -8.011 1.00 0.00 C ATOM 455 NZ LYS A 384 -5.829 -2.326 -8.837 1.00 0.00 N ATOM 0 H LYS A 384 -9.764 -1.287 -7.132 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.680 -3.831 -6.919 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -9.581 -2.006 -4.649 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -8.265 -3.163 -4.611 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -8.366 -0.628 -6.281 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -7.425 -0.866 -4.821 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -5.790 -1.337 -6.361 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -6.457 -2.948 -6.189 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -7.817 -2.673 -8.194 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -7.380 -0.980 -8.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -6.095 -2.330 -9.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -5.070 -1.632 -8.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -5.494 -3.272 -8.564 1.00 0.00 H new ATOM 469 N ASP A 385 -10.122 -4.920 -4.892 1.00 0.00 N ATOM 470 CA ASP A 385 -11.016 -5.870 -4.250 1.00 0.00 C ATOM 471 C ASP A 385 -10.622 -6.039 -2.790 1.00 0.00 C ATOM 472 O ASP A 385 -9.979 -5.166 -2.217 1.00 0.00 O ATOM 473 CB ASP A 385 -10.960 -7.217 -4.970 1.00 0.00 C ATOM 474 CG ASP A 385 -11.464 -7.135 -6.397 1.00 0.00 C ATOM 475 OD1 ASP A 385 -12.640 -6.762 -6.589 1.00 0.00 O ATOM 476 OD2 ASP A 385 -10.683 -7.442 -7.322 1.00 0.00 O ATOM 0 H ASP A 385 -9.180 -4.909 -4.502 1.00 0.00 H new ATOM 0 HA ASP A 385 -12.036 -5.490 -4.302 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -9.933 -7.582 -4.972 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -11.556 -7.945 -4.419 1.00 0.00 H new ATOM 481 N GLN A 386 -10.993 -7.161 -2.186 1.00 0.00 N ATOM 482 CA GLN A 386 -10.651 -7.406 -0.790 1.00 0.00 C ATOM 483 C GLN A 386 -9.136 -7.450 -0.619 1.00 0.00 C ATOM 484 O GLN A 386 -8.561 -6.668 0.138 1.00 0.00 O ATOM 485 CB GLN A 386 -11.284 -8.719 -0.316 1.00 0.00 C ATOM 486 CG GLN A 386 -11.215 -8.937 1.191 1.00 0.00 C ATOM 487 CD GLN A 386 -9.801 -9.145 1.699 1.00 0.00 C ATOM 488 OE1 GLN A 386 -9.116 -10.085 1.296 1.00 0.00 O ATOM 489 NE2 GLN A 386 -9.359 -8.266 2.591 1.00 0.00 N ATOM 0 H GLN A 386 -11.524 -7.908 -2.634 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.044 -6.591 -0.181 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.328 -8.739 -0.627 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -10.786 -9.550 -0.815 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -11.653 -8.077 1.697 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -11.820 -9.804 1.455 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -9.962 -7.502 2.896 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -8.416 -8.355 2.971 1.00 0.00 H new ATOM 498 N ASN A 387 -8.498 -8.370 -1.334 1.00 0.00 N ATOM 499 CA ASN A 387 -7.050 -8.531 -1.272 1.00 0.00 C ATOM 500 C ASN A 387 -6.333 -7.402 -2.009 1.00 0.00 C ATOM 501 O ASN A 387 -5.102 -7.363 -2.052 1.00 0.00 O ATOM 502 CB ASN A 387 -6.653 -9.880 -1.873 1.00 0.00 C ATOM 503 CG ASN A 387 -5.176 -10.170 -1.735 1.00 0.00 C ATOM 504 OD1 ASN A 387 -4.629 -10.166 -0.633 1.00 0.00 O ATOM 505 ND2 ASN A 387 -4.523 -10.434 -2.857 1.00 0.00 N ATOM 0 H ASN A 387 -8.965 -9.020 -1.967 1.00 0.00 H new ATOM 0 HA ASN A 387 -6.749 -8.494 -0.225 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.221 -10.672 -1.385 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -6.925 -9.897 -2.928 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -3.526 -10.645 -2.829 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -5.018 -10.426 -3.749 1.00 0.00 H new ATOM 512 N GLU A 388 -7.102 -6.490 -2.596 1.00 0.00 N ATOM 513 CA GLU A 388 -6.521 -5.374 -3.334 1.00 0.00 C ATOM 514 C GLU A 388 -6.935 -4.035 -2.741 1.00 0.00 C ATOM 515 O GLU A 388 -6.469 -2.985 -3.184 1.00 0.00 O ATOM 516 CB GLU A 388 -6.924 -5.441 -4.808 1.00 0.00 C ATOM 517 CG GLU A 388 -6.440 -6.697 -5.513 1.00 0.00 C ATOM 518 CD GLU A 388 -6.832 -6.733 -6.977 1.00 0.00 C ATOM 519 OE1 GLU A 388 -8.047 -6.696 -7.267 1.00 0.00 O ATOM 520 OE2 GLU A 388 -5.926 -6.797 -7.833 1.00 0.00 O ATOM 0 H GLU A 388 -8.122 -6.501 -2.576 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.437 -5.456 -3.255 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -8.010 -5.388 -4.882 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.526 -4.568 -5.325 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.355 -6.760 -5.430 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.850 -7.572 -5.009 1.00 0.00 H new ATOM 527 N CYS A 389 -7.801 -4.068 -1.733 1.00 0.00 N ATOM 528 CA CYS A 389 -8.246 -2.839 -1.094 1.00 0.00 C ATOM 529 C CYS A 389 -7.060 -2.194 -0.389 1.00 0.00 C ATOM 530 O CYS A 389 -6.666 -2.611 0.701 1.00 0.00 O ATOM 531 CB CYS A 389 -9.385 -3.125 -0.110 1.00 0.00 C ATOM 532 SG CYS A 389 -10.376 -1.659 0.328 1.00 0.00 S ATOM 0 H CYS A 389 -8.203 -4.922 -1.346 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.632 -2.152 -1.847 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -10.043 -3.879 -0.542 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -8.965 -3.552 0.801 1.00 0.00 H new ATOM 537 N LYS A 390 -6.469 -1.203 -1.045 1.00 0.00 N ATOM 538 CA LYS A 390 -5.292 -0.522 -0.517 1.00 0.00 C ATOM 539 C LYS A 390 -5.615 0.340 0.700 1.00 0.00 C ATOM 540 O LYS A 390 -6.764 0.719 0.927 1.00 0.00 O ATOM 541 CB LYS A 390 -4.642 0.309 -1.614 1.00 0.00 C ATOM 542 CG LYS A 390 -4.241 -0.521 -2.825 1.00 0.00 C ATOM 543 CD LYS A 390 -3.577 0.329 -3.894 1.00 0.00 C ATOM 544 CE LYS A 390 -3.150 -0.510 -5.088 1.00 0.00 C ATOM 545 NZ LYS A 390 -2.159 -1.555 -4.709 1.00 0.00 N ATOM 0 H LYS A 390 -6.787 -0.851 -1.948 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.591 -1.285 -0.179 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -5.333 1.091 -1.928 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -3.759 0.806 -1.212 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -3.559 -1.313 -2.514 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -5.124 -1.006 -3.242 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -4.267 1.106 -4.222 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -2.707 0.832 -3.472 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -4.026 -0.984 -5.530 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -2.720 0.138 -5.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -1.706 -1.931 -5.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -1.435 -1.138 -4.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -2.643 -2.326 -4.206 1.00 0.00 H new ATOM 559 N SER A 391 -4.581 0.616 1.491 1.00 0.00 N ATOM 560 CA SER A 391 -4.710 1.400 2.710 1.00 0.00 C ATOM 561 C SER A 391 -5.433 2.731 2.481 1.00 0.00 C ATOM 562 O SER A 391 -6.415 3.017 3.165 1.00 0.00 O ATOM 563 CB SER A 391 -3.327 1.641 3.313 1.00 0.00 C ATOM 564 OG SER A 391 -2.683 0.417 3.621 1.00 0.00 O ATOM 0 H SER A 391 -3.630 0.300 1.302 1.00 0.00 H new ATOM 0 HA SER A 391 -5.323 0.827 3.406 1.00 0.00 H new ATOM 0 HB2 SER A 391 -2.716 2.210 2.613 1.00 0.00 H new ATOM 0 HB3 SER A 391 -3.421 2.243 4.217 1.00 0.00 H new ATOM 0 HG SER A 391 -1.799 0.599 4.004 1.00 0.00 H new ATOM 570 N PRO A 392 -4.981 3.568 1.520 1.00 0.00 N ATOM 571 CA PRO A 392 -5.627 4.849 1.243 1.00 0.00 C ATOM 572 C PRO A 392 -7.108 4.666 0.958 1.00 0.00 C ATOM 573 O PRO A 392 -7.931 5.523 1.284 1.00 0.00 O ATOM 574 CB PRO A 392 -4.900 5.366 -0.003 1.00 0.00 C ATOM 575 CG PRO A 392 -4.168 4.198 -0.551 1.00 0.00 C ATOM 576 CD PRO A 392 -3.836 3.350 0.627 1.00 0.00 C ATOM 0 HA PRO A 392 -5.566 5.536 2.087 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.606 5.763 -0.732 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -4.214 6.175 0.250 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -4.781 3.652 -1.268 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.266 4.511 -1.076 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -3.731 2.300 0.353 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -2.898 3.653 1.092 1.00 0.00 H new ATOM 584 N CYS A 393 -7.436 3.533 0.348 1.00 0.00 N ATOM 585 CA CYS A 393 -8.814 3.212 0.015 1.00 0.00 C ATOM 586 C CYS A 393 -9.634 2.990 1.283 1.00 0.00 C ATOM 587 O CYS A 393 -9.254 3.429 2.369 1.00 0.00 O ATOM 588 CB CYS A 393 -8.856 1.950 -0.851 1.00 0.00 C ATOM 589 SG CYS A 393 -7.698 1.953 -2.260 1.00 0.00 S ATOM 0 H CYS A 393 -6.761 2.819 0.074 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.242 4.049 -0.537 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.639 1.087 -0.222 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -9.869 1.820 -1.231 1.00 0.00 H new ATOM 594 N LYS A 394 -10.749 2.288 1.136 1.00 0.00 N ATOM 595 CA LYS A 394 -11.618 1.980 2.264 1.00 0.00 C ATOM 596 C LYS A 394 -12.535 0.813 1.927 1.00 0.00 C ATOM 597 O LYS A 394 -13.309 0.868 0.970 1.00 0.00 O ATOM 598 CB LYS A 394 -12.443 3.205 2.667 1.00 0.00 C ATOM 599 CG LYS A 394 -13.376 2.945 3.840 1.00 0.00 C ATOM 600 CD LYS A 394 -14.091 4.210 4.286 1.00 0.00 C ATOM 601 CE LYS A 394 -13.117 5.235 4.846 1.00 0.00 C ATOM 602 NZ LYS A 394 -13.817 6.448 5.355 1.00 0.00 N ATOM 0 H LYS A 394 -11.074 1.919 0.242 1.00 0.00 H new ATOM 0 HA LYS A 394 -10.990 1.698 3.109 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -11.767 4.021 2.924 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.031 3.536 1.811 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -14.112 2.192 3.559 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -12.805 2.537 4.674 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -14.629 4.642 3.442 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -14.834 3.961 5.044 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -12.540 4.784 5.653 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -12.408 5.524 4.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -13.686 7.232 4.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -14.832 6.246 5.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -13.422 6.714 6.280 1.00 0.00 H new ATOM 616 N TRP A 395 -12.426 -0.248 2.715 1.00 0.00 N ATOM 617 CA TRP A 395 -13.226 -1.445 2.506 1.00 0.00 C ATOM 618 C TRP A 395 -14.650 -1.259 3.021 1.00 0.00 C ATOM 619 O TRP A 395 -14.859 -0.858 4.166 1.00 0.00 O ATOM 620 CB TRP A 395 -12.570 -2.635 3.210 1.00 0.00 C ATOM 621 CG TRP A 395 -13.209 -3.953 2.894 1.00 0.00 C ATOM 622 CD1 TRP A 395 -13.761 -4.831 3.783 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.346 -4.552 1.601 1.00 0.00 C ATOM 624 NE1 TRP A 395 -14.240 -5.935 3.120 1.00 0.00 N ATOM 625 CE2 TRP A 395 -13.996 -5.789 1.780 1.00 0.00 C ATOM 626 CE3 TRP A 395 -12.986 -4.164 0.306 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.291 -6.637 0.716 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.280 -5.007 -0.749 1.00 0.00 C ATOM 629 CH2 TRP A 395 -13.927 -6.231 -0.538 1.00 0.00 C ATOM 0 H TRP A 395 -11.788 -0.303 3.509 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.277 -1.635 1.434 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -11.517 -2.676 2.930 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -12.607 -2.473 4.287 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -13.813 -4.680 4.851 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -14.702 -6.734 3.555 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.487 -3.222 0.134 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -14.790 -7.582 0.875 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.006 -4.717 -1.753 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.143 -6.868 -1.383 1.00 0.00 H new ATOM 640 N HIS A 396 -15.627 -1.570 2.173 1.00 0.00 N ATOM 641 CA HIS A 396 -17.032 -1.456 2.551 1.00 0.00 C ATOM 642 C HIS A 396 -17.657 -2.839 2.674 1.00 0.00 C ATOM 643 O HIS A 396 -17.808 -3.555 1.681 1.00 0.00 O ATOM 644 CB HIS A 396 -17.802 -0.617 1.528 1.00 0.00 C ATOM 645 CG HIS A 396 -17.346 0.808 1.454 1.00 0.00 C ATOM 646 ND1 HIS A 396 -17.370 1.663 2.534 1.00 0.00 N ATOM 647 CD2 HIS A 396 -16.856 1.529 0.417 1.00 0.00 C ATOM 648 CE1 HIS A 396 -16.919 2.849 2.166 1.00 0.00 C ATOM 649 NE2 HIS A 396 -16.599 2.794 0.886 1.00 0.00 N ATOM 0 H HIS A 396 -15.472 -1.902 1.221 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.088 -0.955 3.518 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -17.698 -1.074 0.544 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -18.863 -0.638 1.779 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -16.697 1.175 -0.591 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -16.828 3.716 2.804 1.00 0.00 H new ATOM 0 HE2 HIS A 396 -16.222 3.565 0.335 1.00 0.00 H new ATOM 658 N ASN A 397 -18.006 -3.210 3.901 1.00 0.00 N ATOM 659 CA ASN A 397 -18.604 -4.512 4.177 1.00 0.00 C ATOM 660 C ASN A 397 -20.085 -4.539 3.818 1.00 0.00 C ATOM 661 O ASN A 397 -20.815 -3.577 4.063 1.00 0.00 O ATOM 662 CB ASN A 397 -18.421 -4.875 5.650 1.00 0.00 C ATOM 663 CG ASN A 397 -19.051 -3.856 6.579 1.00 0.00 C ATOM 664 OD1 ASN A 397 -18.685 -2.680 6.569 1.00 0.00 O ATOM 665 ND2 ASN A 397 -20.002 -4.302 7.389 1.00 0.00 N ATOM 0 H ASN A 397 -17.884 -2.623 4.726 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.094 -5.247 3.555 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -18.861 -5.854 5.837 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -17.357 -4.956 5.872 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -20.461 -3.662 8.037 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -20.274 -5.285 7.364 1.00 0.00 H new ATOM 672 N ASP A 398 -20.519 -5.658 3.248 1.00 0.00 N ATOM 673 CA ASP A 398 -21.913 -5.846 2.860 1.00 0.00 C ATOM 674 C ASP A 398 -22.369 -4.747 1.901 1.00 0.00 C ATOM 675 O ASP A 398 -23.492 -4.251 1.992 1.00 0.00 O ATOM 676 CB ASP A 398 -22.808 -5.876 4.102 1.00 0.00 C ATOM 677 CG ASP A 398 -24.161 -6.511 3.837 1.00 0.00 C ATOM 678 OD1 ASP A 398 -24.922 -5.975 3.004 1.00 0.00 O ATOM 679 OD2 ASP A 398 -24.460 -7.549 4.463 1.00 0.00 O ATOM 0 H ASP A 398 -19.918 -6.456 3.043 1.00 0.00 H new ATOM 0 HA ASP A 398 -21.997 -6.801 2.342 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -22.302 -6.427 4.895 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -22.954 -4.858 4.464 1.00 0.00 H new ATOM 684 N ALA A 399 -21.495 -4.380 0.970 1.00 0.00 N ATOM 685 CA ALA A 399 -21.818 -3.357 -0.018 1.00 0.00 C ATOM 686 C ALA A 399 -22.545 -3.981 -1.201 1.00 0.00 C ATOM 687 O ALA A 399 -22.311 -3.614 -2.352 1.00 0.00 O ATOM 688 CB ALA A 399 -20.553 -2.658 -0.484 1.00 0.00 C ATOM 0 H ALA A 399 -20.559 -4.775 0.879 1.00 0.00 H new ATOM 0 HA ALA A 399 -22.473 -2.618 0.443 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -20.808 -1.897 -1.221 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.062 -2.188 0.368 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -19.879 -3.387 -0.934 1.00 0.00 H new ATOM 694 N GLU A 400 -23.405 -4.950 -0.891 1.00 0.00 N ATOM 695 CA GLU A 400 -24.173 -5.686 -1.893 1.00 0.00 C ATOM 696 C GLU A 400 -23.286 -6.726 -2.565 1.00 0.00 C ATOM 697 O GLU A 400 -23.757 -7.774 -3.005 1.00 0.00 O ATOM 698 CB GLU A 400 -24.781 -4.744 -2.937 1.00 0.00 C ATOM 699 CG GLU A 400 -25.748 -3.729 -2.351 1.00 0.00 C ATOM 700 CD GLU A 400 -26.350 -2.819 -3.404 1.00 0.00 C ATOM 701 OE1 GLU A 400 -25.580 -2.098 -4.073 1.00 0.00 O ATOM 702 OE2 GLU A 400 -27.588 -2.830 -3.561 1.00 0.00 O ATOM 0 H GLU A 400 -23.589 -5.248 0.067 1.00 0.00 H new ATOM 0 HA GLU A 400 -24.996 -6.190 -1.387 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -23.977 -4.214 -3.448 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -25.301 -5.337 -3.690 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -26.548 -4.254 -1.830 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -25.228 -3.124 -1.608 1.00 0.00 H new ATOM 709 N ASN A 401 -21.994 -6.418 -2.622 1.00 0.00 N ATOM 710 CA ASN A 401 -20.999 -7.295 -3.222 1.00 0.00 C ATOM 711 C ASN A 401 -19.608 -6.876 -2.768 1.00 0.00 C ATOM 712 O ASN A 401 -18.607 -7.206 -3.406 1.00 0.00 O ATOM 713 CB ASN A 401 -21.077 -7.207 -4.743 1.00 0.00 C ATOM 714 CG ASN A 401 -22.348 -7.803 -5.305 1.00 0.00 C ATOM 715 OD1 ASN A 401 -22.565 -9.013 -5.244 1.00 0.00 O ATOM 716 ND2 ASN A 401 -23.207 -6.946 -5.839 1.00 0.00 N ATOM 0 H ASN A 401 -21.608 -5.550 -2.251 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.195 -8.320 -2.908 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -21.008 -6.162 -5.045 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -20.219 -7.721 -5.176 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -24.091 -7.282 -6.221 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -22.984 -5.951 -5.867 1.00 0.00 H new ATOM 723 N LYS A 402 -19.566 -6.126 -1.668 1.00 0.00 N ATOM 724 CA LYS A 402 -18.310 -5.622 -1.114 1.00 0.00 C ATOM 725 C LYS A 402 -17.676 -4.629 -2.082 1.00 0.00 C ATOM 726 O LYS A 402 -17.519 -4.922 -3.267 1.00 0.00 O ATOM 727 CB LYS A 402 -17.338 -6.769 -0.816 1.00 0.00 C ATOM 728 CG LYS A 402 -17.761 -7.658 0.346 1.00 0.00 C ATOM 729 CD LYS A 402 -19.014 -8.457 0.023 1.00 0.00 C ATOM 730 CE LYS A 402 -19.436 -9.329 1.193 1.00 0.00 C ATOM 731 NZ LYS A 402 -20.647 -10.135 0.877 1.00 0.00 N ATOM 0 H LYS A 402 -20.394 -5.852 -1.139 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.529 -5.115 -0.174 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -17.233 -7.384 -1.710 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.355 -6.351 -0.600 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -16.949 -8.341 0.594 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -17.940 -7.042 1.227 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -19.825 -7.776 -0.235 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -18.833 -9.082 -0.851 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -18.617 -9.995 1.463 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -19.635 -8.700 2.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -20.902 -10.716 1.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -21.436 -9.499 0.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -20.450 -10.754 0.065 1.00 0.00 H new ATOM 745 N LYS A 403 -17.332 -3.443 -1.585 1.00 0.00 N ATOM 746 CA LYS A 403 -16.745 -2.416 -2.440 1.00 0.00 C ATOM 747 C LYS A 403 -15.626 -1.646 -1.746 1.00 0.00 C ATOM 748 O LYS A 403 -15.756 -1.237 -0.593 1.00 0.00 O ATOM 749 CB LYS A 403 -17.831 -1.436 -2.889 1.00 0.00 C ATOM 750 CG LYS A 403 -18.950 -2.082 -3.689 1.00 0.00 C ATOM 751 CD LYS A 403 -18.454 -2.612 -5.029 1.00 0.00 C ATOM 752 CE LYS A 403 -17.877 -1.502 -5.895 1.00 0.00 C ATOM 753 NZ LYS A 403 -18.881 -0.441 -6.184 1.00 0.00 N ATOM 0 H LYS A 403 -17.448 -3.172 -0.608 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.310 -2.924 -3.300 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -18.258 -0.954 -2.010 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -17.373 -0.652 -3.492 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -19.384 -2.899 -3.113 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -19.744 -1.354 -3.857 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -17.693 -3.374 -4.860 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -19.277 -3.095 -5.556 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -17.017 -1.060 -5.392 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -17.516 -1.924 -6.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -18.506 0.204 -6.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -19.758 -0.879 -6.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -19.081 0.094 -5.315 1.00 0.00 H new ATOM 767 N CYS A 404 -14.536 -1.428 -2.477 1.00 0.00 N ATOM 768 CA CYS A 404 -13.395 -0.679 -1.965 1.00 0.00 C ATOM 769 C CYS A 404 -13.322 0.676 -2.668 1.00 0.00 C ATOM 770 O CYS A 404 -13.396 0.744 -3.895 1.00 0.00 O ATOM 771 CB CYS A 404 -12.096 -1.461 -2.189 1.00 0.00 C ATOM 772 SG CYS A 404 -10.620 -0.690 -1.447 1.00 0.00 S ATOM 0 H CYS A 404 -14.420 -1.763 -3.433 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.521 -0.525 -0.893 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.214 -2.464 -1.778 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -11.933 -1.573 -3.261 1.00 0.00 H new ATOM 777 N THR A 405 -13.195 1.753 -1.897 1.00 0.00 N ATOM 778 CA THR A 405 -13.138 3.092 -2.478 1.00 0.00 C ATOM 779 C THR A 405 -12.107 3.975 -1.783 1.00 0.00 C ATOM 780 O THR A 405 -11.935 3.914 -0.566 1.00 0.00 O ATOM 781 CB THR A 405 -14.508 3.790 -2.415 1.00 0.00 C ATOM 782 OG1 THR A 405 -14.919 3.943 -1.051 1.00 0.00 O ATOM 783 CG2 THR A 405 -15.556 2.994 -3.177 1.00 0.00 C ATOM 0 H THR A 405 -13.130 1.727 -0.879 1.00 0.00 H new ATOM 0 HA THR A 405 -12.843 2.957 -3.519 1.00 0.00 H new ATOM 0 HB THR A 405 -14.411 4.772 -2.878 1.00 0.00 H new ATOM 0 HG1 THR A 405 -15.338 4.821 -0.932 1.00 0.00 H new ATOM 0 HG21 THR A 405 -16.516 3.507 -3.118 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.256 2.903 -4.221 1.00 0.00 H new ATOM 0 HG23 THR A 405 -15.648 2.000 -2.738 1.00 0.00 H new ATOM 791 N LEU A 406 -11.428 4.797 -2.578 1.00 0.00 N ATOM 792 CA LEU A 406 -10.411 5.704 -2.070 1.00 0.00 C ATOM 793 C LEU A 406 -11.030 6.786 -1.198 1.00 0.00 C ATOM 794 O LEU A 406 -12.111 7.298 -1.490 1.00 0.00 O ATOM 795 CB LEU A 406 -9.643 6.331 -3.236 1.00 0.00 C ATOM 796 CG LEU A 406 -8.426 7.185 -2.870 1.00 0.00 C ATOM 797 CD1 LEU A 406 -8.841 8.609 -2.546 1.00 0.00 C ATOM 798 CD2 LEU A 406 -7.665 6.569 -1.708 1.00 0.00 C ATOM 0 H LEU A 406 -11.568 4.851 -3.587 1.00 0.00 H new ATOM 0 HA LEU A 406 -9.717 5.133 -1.453 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.312 5.530 -3.897 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.335 6.950 -3.807 1.00 0.00 H new ATOM 0 HG LEU A 406 -7.763 7.214 -3.734 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -7.959 9.196 -2.289 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -9.331 9.051 -3.413 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -9.531 8.604 -1.703 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -6.805 7.192 -1.465 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -8.320 6.501 -0.840 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -7.324 5.571 -1.985 1.00 0.00 H new ATOM 810 N ASP A 407 -10.330 7.124 -0.128 1.00 0.00 N ATOM 811 CA ASP A 407 -10.795 8.146 0.802 1.00 0.00 C ATOM 812 C ASP A 407 -9.655 9.092 1.169 1.00 0.00 C ATOM 813 O ASP A 407 -8.552 8.654 1.495 1.00 0.00 O ATOM 814 CB ASP A 407 -11.373 7.488 2.058 1.00 0.00 C ATOM 815 CG ASP A 407 -11.972 8.493 3.022 1.00 0.00 C ATOM 816 OD1 ASP A 407 -11.219 9.339 3.543 1.00 0.00 O ATOM 817 OD2 ASP A 407 -13.199 8.436 3.252 1.00 0.00 O ATOM 0 H ASP A 407 -9.434 6.705 0.121 1.00 0.00 H new ATOM 0 HA ASP A 407 -11.580 8.729 0.320 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -12.139 6.769 1.767 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -10.587 6.929 2.565 1.00 0.00 H new ATOM 822 N LYS A 408 -9.928 10.393 1.099 1.00 0.00 N ATOM 823 CA LYS A 408 -8.924 11.410 1.408 1.00 0.00 C ATOM 824 C LYS A 408 -8.467 11.326 2.861 1.00 0.00 C ATOM 825 O LYS A 408 -7.270 11.341 3.144 1.00 0.00 O ATOM 826 CB LYS A 408 -9.481 12.806 1.121 1.00 0.00 C ATOM 827 CG LYS A 408 -9.886 13.016 -0.330 1.00 0.00 C ATOM 828 CD LYS A 408 -10.456 14.409 -0.557 1.00 0.00 C ATOM 829 CE LYS A 408 -9.427 15.491 -0.273 1.00 0.00 C ATOM 830 NZ LYS A 408 -9.974 16.856 -0.511 1.00 0.00 N ATOM 0 H LYS A 408 -10.837 10.769 0.831 1.00 0.00 H new ATOM 0 HA LYS A 408 -8.059 11.224 0.771 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -10.347 12.980 1.760 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -8.731 13.549 1.391 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -9.020 12.867 -0.975 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -10.627 12.268 -0.613 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -10.802 14.497 -1.587 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -11.325 14.556 0.085 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -9.091 15.410 0.761 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -8.553 15.335 -0.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -9.241 17.564 -0.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -10.271 16.943 -1.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -10.793 17.015 0.110 1.00 0.00 H new ATOM 844 N GLU A 409 -9.425 11.248 3.777 1.00 0.00 N ATOM 845 CA GLU A 409 -9.123 11.172 5.202 1.00 0.00 C ATOM 846 C GLU A 409 -8.258 9.956 5.524 1.00 0.00 C ATOM 847 O GLU A 409 -7.357 10.029 6.360 1.00 0.00 O ATOM 848 CB GLU A 409 -10.418 11.122 6.013 1.00 0.00 C ATOM 849 CG GLU A 409 -10.190 11.090 7.515 1.00 0.00 C ATOM 850 CD GLU A 409 -11.484 11.058 8.305 1.00 0.00 C ATOM 851 OE1 GLU A 409 -12.564 11.043 7.677 1.00 0.00 O ATOM 852 OE2 GLU A 409 -11.417 11.049 9.552 1.00 0.00 O ATOM 0 H GLU A 409 -10.421 11.236 3.558 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.562 12.066 5.473 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -11.027 11.991 5.764 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -10.987 10.239 5.721 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -9.593 10.214 7.769 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -9.612 11.966 7.809 1.00 0.00 H new ATOM 859 N GLU A 410 -8.539 8.836 4.865 1.00 0.00 N ATOM 860 CA GLU A 410 -7.784 7.611 5.094 1.00 0.00 C ATOM 861 C GLU A 410 -6.382 7.714 4.498 1.00 0.00 C ATOM 862 O GLU A 410 -5.401 7.317 5.126 1.00 0.00 O ATOM 863 CB GLU A 410 -8.523 6.414 4.492 1.00 0.00 C ATOM 864 CG GLU A 410 -7.870 5.073 4.796 1.00 0.00 C ATOM 865 CD GLU A 410 -7.864 4.737 6.277 1.00 0.00 C ATOM 866 OE1 GLU A 410 -8.416 5.528 7.072 1.00 0.00 O ATOM 867 OE2 GLU A 410 -7.311 3.678 6.641 1.00 0.00 O ATOM 0 H GLU A 410 -9.282 8.752 4.171 1.00 0.00 H new ATOM 0 HA GLU A 410 -7.689 7.467 6.170 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -9.546 6.403 4.869 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -8.583 6.542 3.411 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -8.396 4.288 4.253 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -6.844 5.083 4.427 1.00 0.00 H new ATOM 874 N ALA A 411 -6.299 8.245 3.283 1.00 0.00 N ATOM 875 CA ALA A 411 -5.019 8.397 2.597 1.00 0.00 C ATOM 876 C ALA A 411 -4.074 9.308 3.372 1.00 0.00 C ATOM 877 O ALA A 411 -2.899 8.990 3.542 1.00 0.00 O ATOM 878 CB ALA A 411 -5.235 8.934 1.191 1.00 0.00 C ATOM 0 H ALA A 411 -7.103 8.578 2.752 1.00 0.00 H new ATOM 0 HA ALA A 411 -4.555 7.412 2.535 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -4.272 9.042 0.691 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -5.860 8.240 0.629 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -5.728 9.905 1.244 1.00 0.00 H new ATOM 884 N LYS A 412 -4.589 10.440 3.838 1.00 0.00 N ATOM 885 CA LYS A 412 -3.780 11.388 4.592 1.00 0.00 C ATOM 886 C LYS A 412 -3.314 10.774 5.909 1.00 0.00 C ATOM 887 O LYS A 412 -2.189 11.005 6.346 1.00 0.00 O ATOM 888 CB LYS A 412 -4.561 12.679 4.853 1.00 0.00 C ATOM 889 CG LYS A 412 -5.826 12.480 5.672 1.00 0.00 C ATOM 890 CD LYS A 412 -6.579 13.790 5.867 1.00 0.00 C ATOM 891 CE LYS A 412 -5.761 14.797 6.662 1.00 0.00 C ATOM 892 NZ LYS A 412 -6.488 16.084 6.845 1.00 0.00 N ATOM 0 H LYS A 412 -5.560 10.722 3.707 1.00 0.00 H new ATOM 0 HA LYS A 412 -2.901 11.631 3.995 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -3.912 13.386 5.371 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -4.826 13.131 3.897 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -6.473 11.758 5.174 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -5.569 12.059 6.644 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -6.831 14.213 4.895 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -7.519 13.596 6.384 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -5.517 14.377 7.637 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -4.817 14.983 6.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -5.896 16.742 7.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -6.699 16.499 5.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -7.377 15.911 7.357 1.00 0.00 H new ATOM 906 N LYS A 413 -4.184 9.987 6.533 1.00 0.00 N ATOM 907 CA LYS A 413 -3.861 9.338 7.789 1.00 0.00 C ATOM 908 C LYS A 413 -2.732 8.325 7.605 1.00 0.00 C ATOM 909 O LYS A 413 -1.791 8.280 8.398 1.00 0.00 O ATOM 910 CB LYS A 413 -5.109 8.653 8.341 1.00 0.00 C ATOM 911 CG LYS A 413 -4.828 7.722 9.498 1.00 0.00 C ATOM 912 CD LYS A 413 -4.264 8.466 10.699 1.00 0.00 C ATOM 913 CE LYS A 413 -4.020 7.530 11.871 1.00 0.00 C ATOM 914 NZ LYS A 413 -5.278 6.876 12.329 1.00 0.00 N ATOM 0 H LYS A 413 -5.121 9.785 6.184 1.00 0.00 H new ATOM 0 HA LYS A 413 -3.519 10.092 8.498 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -5.819 9.415 8.663 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -5.588 8.089 7.540 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -5.747 7.212 9.786 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -4.122 6.953 9.183 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -3.329 8.953 10.420 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -4.956 9.253 10.999 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -3.298 6.766 11.582 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -3.580 8.089 12.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -5.128 6.453 13.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -6.037 7.585 12.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -5.549 6.133 11.654 1.00 0.00 H new ATOM 928 N VAL A 414 -2.834 7.517 6.555 1.00 0.00 N ATOM 929 CA VAL A 414 -1.826 6.503 6.262 1.00 0.00 C ATOM 930 C VAL A 414 -0.502 7.138 5.843 1.00 0.00 C ATOM 931 O VAL A 414 0.565 6.714 6.278 1.00 0.00 O ATOM 932 CB VAL A 414 -2.301 5.550 5.147 1.00 0.00 C ATOM 933 CG1 VAL A 414 -1.233 4.513 4.830 1.00 0.00 C ATOM 934 CG2 VAL A 414 -3.605 4.874 5.546 1.00 0.00 C ATOM 0 H VAL A 414 -3.607 7.545 5.890 1.00 0.00 H new ATOM 0 HA VAL A 414 -1.674 5.936 7.180 1.00 0.00 H new ATOM 0 HB VAL A 414 -2.478 6.138 4.246 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -1.591 3.852 4.041 1.00 0.00 H new ATOM 0 HG12 VAL A 414 -0.325 5.016 4.498 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -1.018 3.927 5.724 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -3.927 4.205 4.748 1.00 0.00 H new ATOM 0 HG22 VAL A 414 -3.453 4.301 6.461 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -4.371 5.631 5.715 1.00 0.00 H new ATOM 944 N ALA A 415 -0.581 8.150 4.987 1.00 0.00 N ATOM 945 CA ALA A 415 0.610 8.839 4.499 1.00 0.00 C ATOM 946 C ALA A 415 1.330 9.583 5.621 1.00 0.00 C ATOM 947 O ALA A 415 2.559 9.628 5.658 1.00 0.00 O ATOM 948 CB ALA A 415 0.238 9.802 3.383 1.00 0.00 C ATOM 0 H ALA A 415 -1.459 8.513 4.615 1.00 0.00 H new ATOM 0 HA ALA A 415 1.294 8.085 4.110 1.00 0.00 H new ATOM 0 HB1 ALA A 415 1.134 10.310 3.027 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -0.216 9.248 2.561 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -0.471 10.539 3.760 1.00 0.00 H new ATOM 954 N ASP A 416 0.556 10.173 6.526 1.00 0.00 N ATOM 955 CA ASP A 416 1.120 10.927 7.643 1.00 0.00 C ATOM 956 C ASP A 416 1.584 10.009 8.770 1.00 0.00 C ATOM 957 O ASP A 416 1.459 10.344 9.948 1.00 0.00 O ATOM 958 CB ASP A 416 0.098 11.932 8.174 1.00 0.00 C ATOM 959 CG ASP A 416 -0.111 13.096 7.224 1.00 0.00 C ATOM 960 OD1 ASP A 416 -0.455 12.851 6.048 1.00 0.00 O ATOM 961 OD2 ASP A 416 0.067 14.254 7.656 1.00 0.00 O ATOM 0 H ASP A 416 -0.463 10.144 6.509 1.00 0.00 H new ATOM 0 HA ASP A 416 1.993 11.462 7.269 1.00 0.00 H new ATOM 0 HB2 ASP A 416 -0.853 11.426 8.340 1.00 0.00 H new ATOM 0 HB3 ASP A 416 0.431 12.310 9.140 1.00 0.00 H new ATOM 966 N GLU A 417 2.131 8.856 8.402 1.00 0.00 N ATOM 967 CA GLU A 417 2.628 7.900 9.383 1.00 0.00 C ATOM 968 C GLU A 417 3.526 6.852 8.727 1.00 0.00 C ATOM 969 O GLU A 417 4.630 6.587 9.202 1.00 0.00 O ATOM 970 CB GLU A 417 1.462 7.225 10.108 1.00 0.00 C ATOM 971 CG GLU A 417 0.553 6.414 9.198 1.00 0.00 C ATOM 972 CD GLU A 417 -0.575 5.737 9.952 1.00 0.00 C ATOM 973 OE1 GLU A 417 -1.385 6.453 10.578 1.00 0.00 O ATOM 974 OE2 GLU A 417 -0.648 4.490 9.919 1.00 0.00 O ATOM 0 H GLU A 417 2.241 8.561 7.432 1.00 0.00 H new ATOM 0 HA GLU A 417 3.226 8.446 10.112 1.00 0.00 H new ATOM 0 HB2 GLU A 417 1.860 6.571 10.883 1.00 0.00 H new ATOM 0 HB3 GLU A 417 0.868 7.989 10.610 1.00 0.00 H new ATOM 0 HG2 GLU A 417 0.133 7.068 8.434 1.00 0.00 H new ATOM 0 HG3 GLU A 417 1.144 5.658 8.681 1.00 0.00 H new ATOM 981 N THR A 418 3.054 6.262 7.633 1.00 0.00 N ATOM 982 CA THR A 418 3.829 5.253 6.918 1.00 0.00 C ATOM 983 C THR A 418 4.719 5.898 5.861 1.00 0.00 C ATOM 984 O THR A 418 4.892 5.358 4.767 1.00 0.00 O ATOM 985 CB THR A 418 2.917 4.211 6.242 1.00 0.00 C ATOM 986 OG1 THR A 418 2.093 4.845 5.256 1.00 0.00 O ATOM 987 CG2 THR A 418 2.039 3.512 7.269 1.00 0.00 C ATOM 0 H THR A 418 2.142 6.464 7.223 1.00 0.00 H new ATOM 0 HA THR A 418 4.450 4.748 7.658 1.00 0.00 H new ATOM 0 HB THR A 418 3.550 3.466 5.761 1.00 0.00 H new ATOM 0 HG1 THR A 418 1.401 5.378 5.701 1.00 0.00 H new ATOM 0 HG21 THR A 418 1.404 2.781 6.768 1.00 0.00 H new ATOM 0 HG22 THR A 418 2.668 3.005 8.001 1.00 0.00 H new ATOM 0 HG23 THR A 418 1.415 4.248 7.775 1.00 0.00 H new ATOM 995 N ALA A 419 5.280 7.055 6.197 1.00 0.00 N ATOM 996 CA ALA A 419 6.153 7.782 5.282 1.00 0.00 C ATOM 997 C ALA A 419 6.761 9.003 5.963 1.00 0.00 C ATOM 998 O ALA A 419 7.942 9.302 5.786 1.00 0.00 O ATOM 999 CB ALA A 419 5.385 8.202 4.036 1.00 0.00 C ATOM 0 H ALA A 419 5.145 7.511 7.100 1.00 0.00 H new ATOM 0 HA ALA A 419 6.964 7.116 4.987 1.00 0.00 H new ATOM 0 HB1 ALA A 419 6.051 8.743 3.364 1.00 0.00 H new ATOM 0 HB2 ALA A 419 5.000 7.317 3.530 1.00 0.00 H new ATOM 0 HB3 ALA A 419 4.554 8.847 4.321 1.00 0.00 H new ATOM 1005 N LYS A 420 5.942 9.709 6.740 1.00 0.00 N ATOM 1006 CA LYS A 420 6.388 10.898 7.447 1.00 0.00 C ATOM 1007 C LYS A 420 7.590 10.581 8.331 1.00 0.00 C ATOM 1008 O LYS A 420 8.578 11.316 8.341 1.00 0.00 O ATOM 1009 CB LYS A 420 5.236 11.458 8.288 1.00 0.00 C ATOM 1010 CG LYS A 420 5.455 12.879 8.779 1.00 0.00 C ATOM 1011 CD LYS A 420 6.488 12.950 9.892 1.00 0.00 C ATOM 1012 CE LYS A 420 6.689 14.378 10.374 1.00 0.00 C ATOM 1013 NZ LYS A 420 7.149 15.272 9.277 1.00 0.00 N ATOM 0 H LYS A 420 4.962 9.473 6.894 1.00 0.00 H new ATOM 0 HA LYS A 420 6.695 11.648 6.718 1.00 0.00 H new ATOM 0 HB2 LYS A 420 4.321 11.427 7.696 1.00 0.00 H new ATOM 0 HB3 LYS A 420 5.081 10.808 9.149 1.00 0.00 H new ATOM 0 HG2 LYS A 420 5.778 13.504 7.946 1.00 0.00 H new ATOM 0 HG3 LYS A 420 4.510 13.288 9.136 1.00 0.00 H new ATOM 0 HD2 LYS A 420 6.170 12.325 10.726 1.00 0.00 H new ATOM 0 HD3 LYS A 420 7.437 12.548 9.536 1.00 0.00 H new ATOM 0 HE2 LYS A 420 5.754 14.758 10.785 1.00 0.00 H new ATOM 0 HE3 LYS A 420 7.420 14.389 11.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 7.515 16.157 9.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 7.902 14.800 8.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 6.351 15.484 8.645 1.00 0.00 H new ATOM 1027 N ASP A 421 7.497 9.480 9.068 1.00 0.00 N ATOM 1028 CA ASP A 421 8.576 9.060 9.955 1.00 0.00 C ATOM 1029 C ASP A 421 9.868 8.840 9.177 1.00 0.00 C ATOM 1030 O ASP A 421 9.866 8.214 8.117 1.00 0.00 O ATOM 1031 CB ASP A 421 8.190 7.779 10.697 1.00 0.00 C ATOM 1032 CG ASP A 421 6.981 7.968 11.590 1.00 0.00 C ATOM 1033 OD1 ASP A 421 7.045 8.821 12.502 1.00 0.00 O ATOM 1034 OD2 ASP A 421 5.971 7.265 11.382 1.00 0.00 O ATOM 0 H ASP A 421 6.686 8.862 9.069 1.00 0.00 H new ATOM 0 HA ASP A 421 8.742 9.855 10.682 1.00 0.00 H new ATOM 0 HB2 ASP A 421 7.983 6.992 9.972 1.00 0.00 H new ATOM 0 HB3 ASP A 421 9.034 7.444 11.300 1.00 0.00 H new ATOM 1039 N GLY A 422 10.968 9.361 9.712 1.00 0.00 N ATOM 1040 CA GLY A 422 12.255 9.216 9.056 1.00 0.00 C ATOM 1041 C GLY A 422 12.345 10.017 7.771 1.00 0.00 C ATOM 1042 O GLY A 422 11.409 10.027 6.970 1.00 0.00 O ATOM 0 H GLY A 422 10.991 9.881 10.589 1.00 0.00 H new ATOM 0 HA2 GLY A 422 13.044 9.536 9.736 1.00 0.00 H new ATOM 0 HA3 GLY A 422 12.431 8.163 8.837 1.00 0.00 H new ATOM 1046 N LYS A 423 13.475 10.689 7.576 1.00 0.00 N ATOM 1047 CA LYS A 423 13.688 11.499 6.381 1.00 0.00 C ATOM 1048 C LYS A 423 15.136 11.975 6.303 1.00 0.00 C ATOM 1049 O LYS A 423 15.715 12.400 7.303 1.00 0.00 O ATOM 1050 CB LYS A 423 12.740 12.701 6.376 1.00 0.00 C ATOM 1051 CG LYS A 423 12.828 13.539 5.111 1.00 0.00 C ATOM 1052 CD LYS A 423 11.874 14.723 5.159 1.00 0.00 C ATOM 1053 CE LYS A 423 11.923 15.529 3.871 1.00 0.00 C ATOM 1054 NZ LYS A 423 11.028 16.718 3.924 1.00 0.00 N ATOM 0 H LYS A 423 14.258 10.689 8.230 1.00 0.00 H new ATOM 0 HA LYS A 423 13.479 10.880 5.508 1.00 0.00 H new ATOM 0 HB2 LYS A 423 11.716 12.346 6.497 1.00 0.00 H new ATOM 0 HB3 LYS A 423 12.962 13.332 7.236 1.00 0.00 H new ATOM 0 HG2 LYS A 423 13.849 13.898 4.982 1.00 0.00 H new ATOM 0 HG3 LYS A 423 12.596 12.918 4.245 1.00 0.00 H new ATOM 0 HD2 LYS A 423 10.858 14.367 5.328 1.00 0.00 H new ATOM 0 HD3 LYS A 423 12.131 15.365 6.002 1.00 0.00 H new ATOM 0 HE2 LYS A 423 12.947 15.854 3.685 1.00 0.00 H new ATOM 0 HE3 LYS A 423 11.633 14.894 3.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 11.091 17.240 3.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 10.047 16.408 4.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 11.320 17.338 4.706 1.00 0.00 H new ATOM 1068 N THR A 424 15.715 11.894 5.108 1.00 0.00 N ATOM 1069 CA THR A 424 17.098 12.310 4.896 1.00 0.00 C ATOM 1070 C THR A 424 17.297 13.780 5.253 1.00 0.00 C ATOM 1071 O THR A 424 16.473 14.630 4.912 1.00 0.00 O ATOM 1072 CB THR A 424 17.535 12.087 3.435 1.00 0.00 C ATOM 1073 OG1 THR A 424 16.704 12.850 2.552 1.00 0.00 O ATOM 1074 CG2 THR A 424 17.457 10.614 3.065 1.00 0.00 C ATOM 0 H THR A 424 15.248 11.544 4.272 1.00 0.00 H new ATOM 0 HA THR A 424 17.713 11.694 5.552 1.00 0.00 H new ATOM 0 HB THR A 424 18.569 12.416 3.335 1.00 0.00 H new ATOM 0 HG1 THR A 424 16.990 12.704 1.626 1.00 0.00 H new ATOM 0 HG21 THR A 424 17.770 10.482 2.029 1.00 0.00 H new ATOM 0 HG22 THR A 424 18.113 10.039 3.719 1.00 0.00 H new ATOM 0 HG23 THR A 424 16.432 10.263 3.181 1.00 0.00 H new ATOM 1082 N GLY A 425 18.397 14.069 5.940 1.00 0.00 N ATOM 1083 CA GLY A 425 18.693 15.435 6.334 1.00 0.00 C ATOM 1084 C GLY A 425 18.861 16.358 5.144 1.00 0.00 C ATOM 1085 O GLY A 425 18.373 17.488 5.153 1.00 0.00 O ATOM 0 H GLY A 425 19.091 13.380 6.232 1.00 0.00 H new ATOM 0 HA2 GLY A 425 17.890 15.809 6.969 1.00 0.00 H new ATOM 0 HA3 GLY A 425 19.604 15.448 6.932 1.00 0.00 H new ATOM 1089 N ASN A 426 19.555 15.875 4.117 1.00 0.00 N ATOM 1090 CA ASN A 426 19.790 16.663 2.914 1.00 0.00 C ATOM 1091 C ASN A 426 18.470 17.092 2.282 1.00 0.00 C ATOM 1092 O ASN A 426 17.532 16.300 2.184 1.00 0.00 O ATOM 1093 CB ASN A 426 20.618 15.861 1.908 1.00 0.00 C ATOM 1094 CG ASN A 426 20.940 16.654 0.655 1.00 0.00 C ATOM 1095 OD1 ASN A 426 20.045 17.064 -0.084 1.00 0.00 O ATOM 1096 ND2 ASN A 426 22.227 16.874 0.410 1.00 0.00 N ATOM 0 H ASN A 426 19.964 14.941 4.095 1.00 0.00 H new ATOM 0 HA ASN A 426 20.345 17.558 3.195 1.00 0.00 H new ATOM 0 HB2 ASN A 426 21.547 15.541 2.380 1.00 0.00 H new ATOM 0 HB3 ASN A 426 20.073 14.958 1.632 1.00 0.00 H new ATOM 0 HD21 ASN A 426 22.506 17.401 -0.418 1.00 0.00 H new ATOM 0 HD22 ASN A 426 22.936 16.516 1.049 1.00 0.00 H new ATOM 1103 N THR A 427 18.406 18.351 1.859 1.00 0.00 N ATOM 1104 CA THR A 427 17.205 18.893 1.238 1.00 0.00 C ATOM 1105 C THR A 427 16.960 18.243 -0.130 1.00 0.00 C ATOM 1106 O THR A 427 16.928 17.017 -0.240 1.00 0.00 O ATOM 1107 CB THR A 427 17.302 20.426 1.094 1.00 0.00 C ATOM 1108 OG1 THR A 427 17.830 20.995 2.299 1.00 0.00 O ATOM 1109 CG2 THR A 427 15.936 21.038 0.814 1.00 0.00 C ATOM 0 H THR A 427 19.176 19.016 1.936 1.00 0.00 H new ATOM 0 HA THR A 427 16.360 18.663 1.887 1.00 0.00 H new ATOM 0 HB THR A 427 17.963 20.644 0.255 1.00 0.00 H new ATOM 0 HG1 THR A 427 17.891 21.968 2.202 1.00 0.00 H new ATOM 0 HG21 THR A 427 16.035 22.119 0.717 1.00 0.00 H new ATOM 0 HG22 THR A 427 15.536 20.626 -0.112 1.00 0.00 H new ATOM 0 HG23 THR A 427 15.259 20.808 1.636 1.00 0.00 H new ATOM 1117 N ASN A 428 16.785 19.058 -1.172 1.00 0.00 N ATOM 1118 CA ASN A 428 16.545 18.541 -2.511 1.00 0.00 C ATOM 1119 C ASN A 428 17.832 18.007 -3.127 1.00 0.00 C ATOM 1120 O ASN A 428 17.910 16.844 -3.525 1.00 0.00 O ATOM 1121 CB ASN A 428 15.952 19.632 -3.404 1.00 0.00 C ATOM 1122 CG ASN A 428 14.636 20.162 -2.871 1.00 0.00 C ATOM 1123 OD1 ASN A 428 13.669 19.416 -2.718 1.00 0.00 O ATOM 1124 ND2 ASN A 428 14.593 21.458 -2.584 1.00 0.00 N ATOM 0 H ASN A 428 16.806 20.076 -1.110 1.00 0.00 H new ATOM 0 HA ASN A 428 15.833 17.719 -2.433 1.00 0.00 H new ATOM 0 HB2 ASN A 428 16.663 20.453 -3.491 1.00 0.00 H new ATOM 0 HB3 ASN A 428 15.801 19.234 -4.407 1.00 0.00 H new ATOM 0 HD21 ASN A 428 13.734 21.872 -2.221 1.00 0.00 H new ATOM 0 HD22 ASN A 428 15.419 22.040 -2.726 1.00 0.00 H new ATOM 1131 N THR A 429 18.841 18.867 -3.192 1.00 0.00 N ATOM 1132 CA THR A 429 20.135 18.493 -3.747 1.00 0.00 C ATOM 1133 C THR A 429 21.235 19.401 -3.209 1.00 0.00 C ATOM 1134 O THR A 429 21.219 20.613 -3.432 1.00 0.00 O ATOM 1135 CB THR A 429 20.129 18.550 -5.289 1.00 0.00 C ATOM 1136 OG1 THR A 429 21.445 18.296 -5.797 1.00 0.00 O ATOM 1137 CG2 THR A 429 19.640 19.903 -5.786 1.00 0.00 C ATOM 0 H THR A 429 18.787 19.832 -2.866 1.00 0.00 H new ATOM 0 HA THR A 429 20.332 17.466 -3.440 1.00 0.00 H new ATOM 0 HB THR A 429 19.445 17.782 -5.651 1.00 0.00 H new ATOM 0 HG1 THR A 429 21.430 18.333 -6.776 1.00 0.00 H new ATOM 0 HG21 THR A 429 19.646 19.914 -6.876 1.00 0.00 H new ATOM 0 HG22 THR A 429 18.626 20.077 -5.427 1.00 0.00 H new ATOM 0 HG23 THR A 429 20.297 20.688 -5.411 1.00 0.00 H new ATOM 1145 N THR A 430 22.185 18.809 -2.494 1.00 0.00 N ATOM 1146 CA THR A 430 23.293 19.557 -1.913 1.00 0.00 C ATOM 1147 C THR A 430 22.776 20.771 -1.137 1.00 0.00 C ATOM 1148 O THR A 430 23.414 21.825 -1.103 1.00 0.00 O ATOM 1149 CB THR A 430 24.286 20.020 -3.000 1.00 0.00 C ATOM 1150 OG1 THR A 430 24.583 18.930 -3.881 1.00 0.00 O ATOM 1151 CG2 THR A 430 25.580 20.526 -2.379 1.00 0.00 C ATOM 0 H THR A 430 22.209 17.807 -2.302 1.00 0.00 H new ATOM 0 HA THR A 430 23.816 18.890 -1.228 1.00 0.00 H new ATOM 0 HB THR A 430 23.823 20.835 -3.556 1.00 0.00 H new ATOM 0 HG1 THR A 430 25.212 19.229 -4.570 1.00 0.00 H new ATOM 0 HG21 THR A 430 26.261 20.846 -3.167 1.00 0.00 H new ATOM 0 HG22 THR A 430 25.363 21.369 -1.723 1.00 0.00 H new ATOM 0 HG23 THR A 430 26.043 19.726 -1.801 1.00 0.00 H new ATOM 1159 N GLY A 431 21.610 20.613 -0.514 1.00 0.00 N ATOM 1160 CA GLY A 431 21.023 21.697 0.252 1.00 0.00 C ATOM 1161 C GLY A 431 20.711 22.913 -0.598 1.00 0.00 C ATOM 1162 O GLY A 431 20.230 22.784 -1.725 1.00 0.00 O ATOM 0 H GLY A 431 21.062 19.753 -0.527 1.00 0.00 H new ATOM 0 HA2 GLY A 431 20.107 21.346 0.727 1.00 0.00 H new ATOM 0 HA3 GLY A 431 21.707 21.983 1.051 1.00 0.00 H new ATOM 1166 N SER A 432 20.980 24.097 -0.055 1.00 0.00 N ATOM 1167 CA SER A 432 20.724 25.346 -0.765 1.00 0.00 C ATOM 1168 C SER A 432 21.824 25.641 -1.783 1.00 0.00 C ATOM 1169 O SER A 432 22.552 26.627 -1.655 1.00 0.00 O ATOM 1170 CB SER A 432 20.607 26.504 0.228 1.00 0.00 C ATOM 1171 OG SER A 432 20.351 27.727 -0.442 1.00 0.00 O ATOM 0 H SER A 432 21.376 24.218 0.877 1.00 0.00 H new ATOM 0 HA SER A 432 19.783 25.238 -1.304 1.00 0.00 H new ATOM 0 HB2 SER A 432 19.805 26.299 0.937 1.00 0.00 H new ATOM 0 HB3 SER A 432 21.528 26.587 0.804 1.00 0.00 H new ATOM 0 HG SER A 432 21.093 27.929 -1.049 1.00 0.00 H new ATOM 1177 N SER A 433 21.939 24.782 -2.793 1.00 0.00 N ATOM 1178 CA SER A 433 22.949 24.952 -3.833 1.00 0.00 C ATOM 1179 C SER A 433 22.766 23.922 -4.942 1.00 0.00 C ATOM 1180 O SER A 433 22.560 22.734 -4.617 1.00 0.00 O ATOM 1181 CB SER A 433 24.355 24.831 -3.239 1.00 0.00 C ATOM 1182 OG SER A 433 25.346 24.986 -4.239 1.00 0.00 O ATOM 1183 OXT SER A 433 22.831 24.311 -6.127 1.00 0.00 O ATOM 0 H SER A 433 21.345 23.961 -2.913 1.00 0.00 H new ATOM 0 HA SER A 433 22.827 25.948 -4.259 1.00 0.00 H new ATOM 0 HB2 SER A 433 24.493 25.587 -2.466 1.00 0.00 H new ATOM 0 HB3 SER A 433 24.468 23.859 -2.758 1.00 0.00 H new ATOM 0 HG SER A 433 26.235 24.906 -3.834 1.00 0.00 H new TER 1189 SER A 433