USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 914 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 125 ASN : amide:sc= 0.779 K(o=1.6,f=-1.9) USER MOD Set 1.2: A 137 ASN : amide:sc= 0.848 K(o=1.6,f=-1.2) USER MOD Set 2.1: A 129 LYS NZ :NH3+ -175:sc= 1.15 (180deg=-0.017) USER MOD Set 2.2: A 135 THR OG1 : rot 21:sc= 1.98 USER MOD Set 3.1: A 77 THR OG1 : rot 147:sc= 1.75 USER MOD Set 3.2: A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.125 K(o=-0.12,f=-2.9) USER MOD Single : A 34 THR OG1 : rot -41:sc= 0.974 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot -165:sc= 1.16 USER MOD Single : A 48 TYR OH : rot 150:sc= 1.16 USER MOD Single : A 49 MET CE :methyl -133:sc= 0 (180deg=-0.196) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.027 USER MOD Single : A 52 THR OG1 : rot 139:sc= 1.06 USER MOD Single : A 53 ASN : amide:sc= 0.438 K(o=0.44,f=-3.1) USER MOD Single : A 54 LYS NZ :NH3+ 160:sc= 0.627 (180deg=-1.23!) USER MOD Single : A 55 SER OG : rot 60:sc= 1.16 USER MOD Single : A 57 GLN : amide:sc= 1.18 K(o=1.2,f=-0.011) USER MOD Single : A 60 LYS NZ :NH3+ 179:sc= 1.05 (180deg=1.03) USER MOD Single : A 66 THR OG1 : rot 84:sc= 1.04 USER MOD Single : A 70 THR OG1 : rot 78:sc= 1.12 USER MOD Single : A 71 SER OG : rot 180:sc= -0.0106 USER MOD Single : A 73 MET CE :methyl 173:sc= -0.0268 (180deg=-0.0767) USER MOD Single : A 75 MET CE :methyl -160:sc= -0.586 (180deg=-1.75) USER MOD Single : A 76 THR OG1 : rot 28:sc= 0.577 USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl -172:sc= 0 (180deg=-0.0789) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.201 USER MOD Single : A 99 THR OG1 : rot 90:sc= 1.28 USER MOD Single : A 101 THR OG1 : rot 180:sc= -0.142 USER MOD Single : A 103 GLN : amide:sc= 1.15 K(o=1.1,f=-1.1) USER MOD Single : A 108 HIS : no HD1:sc= -1.52 K(o=-1.5,f=-5!) USER MOD Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 MET CE :methyl 177:sc= -0.0539 (180deg=-0.0656) USER MOD Single : A 115 LYS NZ :NH3+ 164:sc= 2.5 (180deg=2.04) USER MOD Single : A 119 LYS NZ :NH3+ 179:sc= 0.605 (180deg=0.534) USER MOD Single : A 123 THR OG1 : rot 7:sc= 0.482 USER MOD Single : A 127 THR OG1 : rot 75:sc= 0.95 USER MOD Single : A 131 THR OG1 : rot -27:sc= 0.177 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 158:sc= 1.29 (180deg=1.06) USER MOD Single : A 144 LYS NZ :NH3+ 154:sc= 1.25 (180deg=1.22) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 -5.580 8.429 -9.148 1.00 10.00 N ATOM 370 CA VAL A 28 -4.319 7.915 -9.679 1.00 10.00 C ATOM 371 C VAL A 28 -3.679 6.931 -8.690 1.00 10.00 C ATOM 372 O VAL A 28 -2.541 7.090 -8.254 1.00 10.00 O ATOM 373 CB VAL A 28 -3.396 9.103 -10.018 1.00 10.00 C ATOM 374 CG1 VAL A 28 -4.013 9.984 -11.113 1.00 10.00 C ATOM 375 CG2 VAL A 28 -3.105 10.013 -8.818 1.00 10.00 C ATOM 0 HA VAL A 28 -4.497 7.355 -10.597 1.00 10.00 H new ATOM 0 HB VAL A 28 -2.464 8.647 -10.350 1.00 10.00 H new ATOM 0 HG11 VAL A 28 -3.342 10.814 -11.333 1.00 10.00 H new ATOM 0 HG12 VAL A 28 -4.164 9.391 -12.015 1.00 10.00 H new ATOM 0 HG13 VAL A 28 -4.971 10.373 -10.770 1.00 10.00 H new ATOM 0 HG21 VAL A 28 -2.450 10.827 -9.129 1.00 10.00 H new ATOM 0 HG22 VAL A 28 -4.040 10.425 -8.438 1.00 10.00 H new ATOM 0 HG23 VAL A 28 -2.618 9.435 -8.033 1.00 10.00 H new ATOM 385 N THR A 29 -4.440 5.899 -8.329 1.00 10.00 N ATOM 386 CA THR A 29 -4.140 5.011 -7.219 1.00 10.00 C ATOM 387 C THR A 29 -4.816 3.662 -7.471 1.00 10.00 C ATOM 388 O THR A 29 -5.602 3.183 -6.657 1.00 10.00 O ATOM 389 CB THR A 29 -4.585 5.655 -5.887 1.00 10.00 C ATOM 390 OG1 THR A 29 -5.842 6.287 -6.025 1.00 10.00 O ATOM 391 CG2 THR A 29 -3.600 6.705 -5.363 1.00 10.00 C ATOM 0 H THR A 29 -5.303 5.656 -8.816 1.00 10.00 H new ATOM 0 HA THR A 29 -3.066 4.843 -7.143 1.00 10.00 H new ATOM 0 HB THR A 29 -4.633 4.831 -5.175 1.00 10.00 H new ATOM 0 HG1 THR A 29 -6.103 6.686 -5.169 1.00 10.00 H new ATOM 0 HG21 THR A 29 -3.973 7.118 -4.425 1.00 10.00 H new ATOM 0 HG22 THR A 29 -2.629 6.240 -5.194 1.00 10.00 H new ATOM 0 HG23 THR A 29 -3.497 7.505 -6.096 1.00 10.00 H new ATOM 399 N VAL A 30 -4.480 3.035 -8.600 1.00 10.00 N ATOM 400 CA VAL A 30 -4.909 1.686 -8.932 1.00 10.00 C ATOM 401 C VAL A 30 -3.667 0.800 -9.021 1.00 10.00 C ATOM 402 O VAL A 30 -3.084 0.595 -10.086 1.00 10.00 O ATOM 403 CB VAL A 30 -5.849 1.684 -10.151 1.00 10.00 C ATOM 404 CG1 VAL A 30 -5.255 2.279 -11.432 1.00 10.00 C ATOM 405 CG2 VAL A 30 -6.380 0.273 -10.436 1.00 10.00 C ATOM 0 H VAL A 30 -3.893 3.462 -9.317 1.00 10.00 H new ATOM 0 HA VAL A 30 -5.533 1.251 -8.151 1.00 10.00 H new ATOM 0 HB VAL A 30 -6.665 2.347 -9.863 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -5.994 2.232 -12.232 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -4.977 3.318 -11.256 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -4.371 1.711 -11.721 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -7.041 0.301 -11.302 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.544 -0.396 -10.639 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -6.932 -0.090 -9.569 1.00 10.00 H new ATOM 415 N GLN A 31 -3.259 0.299 -7.857 1.00 10.00 N ATOM 416 CA GLN A 31 -2.188 -0.653 -7.668 1.00 10.00 C ATOM 417 C GLN A 31 -2.577 -1.560 -6.501 1.00 10.00 C ATOM 418 O GLN A 31 -3.398 -1.168 -5.672 1.00 10.00 O ATOM 419 CB GLN A 31 -0.880 0.090 -7.372 1.00 10.00 C ATOM 420 CG GLN A 31 -0.976 1.121 -6.235 1.00 10.00 C ATOM 421 CD GLN A 31 -1.291 2.547 -6.690 1.00 10.00 C ATOM 422 OE1 GLN A 31 -1.616 2.817 -7.845 1.00 10.00 O ATOM 423 NE2 GLN A 31 -1.187 3.501 -5.769 1.00 10.00 N ATOM 0 H GLN A 31 -3.698 0.567 -6.976 1.00 10.00 H new ATOM 0 HA GLN A 31 -2.033 -1.251 -8.566 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -0.111 -0.640 -7.119 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -0.552 0.598 -8.279 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -1.747 0.799 -5.535 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -0.033 1.128 -5.689 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -0.916 3.262 -4.815 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -1.378 4.472 -6.017 1.00 10.00 H new ATOM 432 N GLY A 32 -1.976 -2.750 -6.426 1.00 10.00 N ATOM 433 CA GLY A 32 -1.951 -3.529 -5.196 1.00 10.00 C ATOM 434 C GLY A 32 -0.812 -3.010 -4.318 1.00 10.00 C ATOM 435 O GLY A 32 -0.280 -1.931 -4.575 1.00 10.00 O ATOM 0 H GLY A 32 -1.499 -3.193 -7.211 1.00 10.00 H new ATOM 0 HA2 GLY A 32 -2.903 -3.442 -4.673 1.00 10.00 H new ATOM 0 HA3 GLY A 32 -1.806 -4.586 -5.420 1.00 10.00 H new ATOM 439 N ALA A 33 -0.390 -3.785 -3.316 1.00 10.00 N ATOM 440 CA ALA A 33 0.823 -3.487 -2.572 1.00 10.00 C ATOM 441 C ALA A 33 1.365 -4.756 -1.933 1.00 10.00 C ATOM 442 O ALA A 33 0.596 -5.653 -1.584 1.00 10.00 O ATOM 443 CB ALA A 33 0.559 -2.408 -1.515 1.00 10.00 C ATOM 0 H ALA A 33 -0.877 -4.626 -3.005 1.00 10.00 H new ATOM 0 HA ALA A 33 1.573 -3.100 -3.262 1.00 10.00 H new ATOM 0 HB1 ALA A 33 1.480 -2.200 -0.970 1.00 10.00 H new ATOM 0 HB2 ALA A 33 0.213 -1.497 -2.003 1.00 10.00 H new ATOM 0 HB3 ALA A 33 -0.203 -2.759 -0.819 1.00 10.00 H new ATOM 449 N THR A 34 2.688 -4.826 -1.775 1.00 10.00 N ATOM 450 CA THR A 34 3.344 -5.863 -1.005 1.00 10.00 C ATOM 451 C THR A 34 4.381 -5.204 -0.099 1.00 10.00 C ATOM 452 O THR A 34 4.856 -4.119 -0.437 1.00 10.00 O ATOM 453 CB THR A 34 3.985 -6.888 -1.947 1.00 10.00 C ATOM 454 OG1 THR A 34 5.023 -6.289 -2.688 1.00 10.00 O ATOM 455 CG2 THR A 34 2.970 -7.449 -2.943 1.00 10.00 C ATOM 0 H THR A 34 3.334 -4.152 -2.186 1.00 10.00 H new ATOM 0 HA THR A 34 2.623 -6.398 -0.387 1.00 10.00 H new ATOM 0 HB THR A 34 4.368 -7.695 -1.322 1.00 10.00 H new ATOM 0 HG1 THR A 34 4.746 -5.394 -2.975 1.00 10.00 H new ATOM 0 HG21 THR A 34 3.461 -8.172 -3.594 1.00 10.00 H new ATOM 0 HG22 THR A 34 2.161 -7.939 -2.401 1.00 10.00 H new ATOM 0 HG23 THR A 34 2.563 -6.636 -3.545 1.00 10.00 H new ATOM 463 N VAL A 35 4.723 -5.830 1.034 1.00 10.00 N ATOM 464 CA VAL A 35 5.776 -5.359 1.929 1.00 10.00 C ATOM 465 C VAL A 35 6.776 -6.474 2.184 1.00 10.00 C ATOM 466 O VAL A 35 6.381 -7.594 2.498 1.00 10.00 O ATOM 467 CB VAL A 35 5.205 -4.821 3.249 1.00 10.00 C ATOM 468 CG1 VAL A 35 6.341 -4.294 4.137 1.00 10.00 C ATOM 469 CG2 VAL A 35 4.187 -3.709 2.977 1.00 10.00 C ATOM 0 H VAL A 35 4.269 -6.686 1.354 1.00 10.00 H new ATOM 0 HA VAL A 35 6.287 -4.529 1.442 1.00 10.00 H new ATOM 0 HB VAL A 35 4.699 -5.635 3.768 1.00 10.00 H new ATOM 0 HG11 VAL A 35 5.927 -3.914 5.071 1.00 10.00 H new ATOM 0 HG12 VAL A 35 7.040 -5.103 4.352 1.00 10.00 H new ATOM 0 HG13 VAL A 35 6.865 -3.490 3.619 1.00 10.00 H new ATOM 0 HG21 VAL A 35 3.792 -3.338 3.923 1.00 10.00 H new ATOM 0 HG22 VAL A 35 4.674 -2.893 2.442 1.00 10.00 H new ATOM 0 HG23 VAL A 35 3.370 -4.103 2.372 1.00 10.00 H new ATOM 479 N ALA A 36 8.069 -6.164 2.091 1.00 10.00 N ATOM 480 CA ALA A 36 9.103 -7.123 2.405 1.00 10.00 C ATOM 481 C ALA A 36 9.167 -7.321 3.918 1.00 10.00 C ATOM 482 O ALA A 36 9.593 -6.431 4.649 1.00 10.00 O ATOM 483 CB ALA A 36 10.435 -6.658 1.822 1.00 10.00 C ATOM 0 H ALA A 36 8.416 -5.250 1.799 1.00 10.00 H new ATOM 0 HA ALA A 36 8.874 -8.089 1.954 1.00 10.00 H new ATOM 0 HB1 ALA A 36 11.211 -7.385 2.062 1.00 10.00 H new ATOM 0 HB2 ALA A 36 10.346 -6.566 0.740 1.00 10.00 H new ATOM 0 HB3 ALA A 36 10.700 -5.690 2.248 1.00 10.00 H new ATOM 489 N ALA A 37 8.763 -8.491 4.410 1.00 10.00 N ATOM 490 CA ALA A 37 9.098 -8.870 5.779 1.00 10.00 C ATOM 491 C ALA A 37 10.622 -8.846 5.948 1.00 10.00 C ATOM 492 O ALA A 37 11.335 -9.176 5.003 1.00 10.00 O ATOM 493 CB ALA A 37 8.532 -10.245 6.132 1.00 10.00 C ATOM 0 H ALA A 37 8.215 -9.179 3.893 1.00 10.00 H new ATOM 0 HA ALA A 37 8.646 -8.153 6.464 1.00 10.00 H new ATOM 0 HB1 ALA A 37 8.800 -10.496 7.158 1.00 10.00 H new ATOM 0 HB2 ALA A 37 7.447 -10.228 6.034 1.00 10.00 H new ATOM 0 HB3 ALA A 37 8.945 -10.993 5.456 1.00 10.00 H new ATOM 499 N VAL A 38 11.090 -8.449 7.139 1.00 10.00 N ATOM 500 CA VAL A 38 12.486 -8.184 7.508 1.00 10.00 C ATOM 501 C VAL A 38 13.507 -8.832 6.557 1.00 10.00 C ATOM 502 O VAL A 38 13.787 -10.029 6.693 1.00 10.00 O ATOM 503 CB VAL A 38 12.734 -8.608 8.971 1.00 10.00 C ATOM 504 CG1 VAL A 38 14.195 -8.387 9.387 1.00 10.00 C ATOM 505 CG2 VAL A 38 11.837 -7.814 9.932 1.00 10.00 C ATOM 0 H VAL A 38 10.458 -8.294 7.925 1.00 10.00 H new ATOM 0 HA VAL A 38 12.641 -7.109 7.412 1.00 10.00 H new ATOM 0 HB VAL A 38 12.499 -9.671 9.029 1.00 10.00 H new ATOM 0 HG11 VAL A 38 14.329 -8.697 10.423 1.00 10.00 H new ATOM 0 HG12 VAL A 38 14.849 -8.976 8.744 1.00 10.00 H new ATOM 0 HG13 VAL A 38 14.445 -7.331 9.289 1.00 10.00 H new ATOM 0 HG21 VAL A 38 12.031 -8.131 10.957 1.00 10.00 H new ATOM 0 HG22 VAL A 38 12.052 -6.750 9.835 1.00 10.00 H new ATOM 0 HG23 VAL A 38 10.791 -7.996 9.687 1.00 10.00 H new ATOM 515 N PRO A 39 14.071 -8.073 5.601 1.00 10.00 N ATOM 516 CA PRO A 39 15.207 -8.500 4.796 1.00 10.00 C ATOM 517 C PRO A 39 16.378 -8.872 5.712 1.00 10.00 C ATOM 518 O PRO A 39 16.395 -8.461 6.872 1.00 10.00 O ATOM 519 CB PRO A 39 15.557 -7.294 3.911 1.00 10.00 C ATOM 520 CG PRO A 39 14.256 -6.496 3.855 1.00 10.00 C ATOM 521 CD PRO A 39 13.683 -6.720 5.250 1.00 10.00 C ATOM 0 HA PRO A 39 14.984 -9.379 4.192 1.00 10.00 H new ATOM 0 HB2 PRO A 39 16.369 -6.706 4.338 1.00 10.00 H new ATOM 0 HB3 PRO A 39 15.878 -7.606 2.917 1.00 10.00 H new ATOM 0 HG2 PRO A 39 14.434 -5.440 3.652 1.00 10.00 H new ATOM 0 HG3 PRO A 39 13.587 -6.862 3.076 1.00 10.00 H new ATOM 0 HD2 PRO A 39 14.082 -5.997 5.962 1.00 10.00 H new ATOM 0 HD3 PRO A 39 12.599 -6.606 5.255 1.00 10.00 H new ATOM 529 N PRO A 40 17.392 -9.604 5.231 1.00 10.00 N ATOM 530 CA PRO A 40 18.575 -9.909 6.025 1.00 10.00 C ATOM 531 C PRO A 40 19.490 -8.676 6.108 1.00 10.00 C ATOM 532 O PRO A 40 20.677 -8.754 5.798 1.00 10.00 O ATOM 533 CB PRO A 40 19.229 -11.083 5.290 1.00 10.00 C ATOM 534 CG PRO A 40 18.922 -10.750 3.831 1.00 10.00 C ATOM 535 CD PRO A 40 17.502 -10.185 3.902 1.00 10.00 C ATOM 0 HA PRO A 40 18.351 -10.170 7.059 1.00 10.00 H new ATOM 0 HB2 PRO A 40 20.301 -11.138 5.480 1.00 10.00 H new ATOM 0 HB3 PRO A 40 18.803 -12.041 5.589 1.00 10.00 H new ATOM 0 HG2 PRO A 40 19.626 -10.024 3.425 1.00 10.00 H new ATOM 0 HG3 PRO A 40 18.974 -11.634 3.195 1.00 10.00 H new ATOM 0 HD2 PRO A 40 17.337 -9.435 3.129 1.00 10.00 H new ATOM 0 HD3 PRO A 40 16.758 -10.967 3.751 1.00 10.00 H new ATOM 543 N SER A 41 18.947 -7.524 6.515 1.00 10.00 N ATOM 544 CA SER A 41 19.690 -6.283 6.630 1.00 10.00 C ATOM 545 C SER A 41 18.949 -5.372 7.611 1.00 10.00 C ATOM 546 O SER A 41 18.608 -4.238 7.287 1.00 10.00 O ATOM 547 CB SER A 41 19.885 -5.657 5.238 1.00 10.00 C ATOM 548 OG SER A 41 21.015 -4.806 5.226 1.00 10.00 O ATOM 0 H SER A 41 17.965 -7.435 6.775 1.00 10.00 H new ATOM 0 HA SER A 41 20.692 -6.452 7.025 1.00 10.00 H new ATOM 0 HB2 SER A 41 20.008 -6.444 4.494 1.00 10.00 H new ATOM 0 HB3 SER A 41 18.995 -5.092 4.960 1.00 10.00 H new ATOM 0 HG SER A 41 21.123 -4.419 4.332 1.00 10.00 H new ATOM 554 N ILE A 42 18.721 -5.883 8.830 1.00 10.00 N ATOM 555 CA ILE A 42 18.036 -5.173 9.905 1.00 10.00 C ATOM 556 C ILE A 42 16.547 -5.035 9.545 1.00 10.00 C ATOM 557 O ILE A 42 16.129 -5.368 8.438 1.00 10.00 O ATOM 558 CB ILE A 42 18.755 -3.843 10.255 1.00 10.00 C ATOM 559 CG1 ILE A 42 20.292 -3.996 10.143 1.00 10.00 C ATOM 560 CG2 ILE A 42 18.433 -3.388 11.689 1.00 10.00 C ATOM 561 CD1 ILE A 42 21.091 -2.805 10.674 1.00 10.00 C ATOM 0 H ILE A 42 19.017 -6.822 9.095 1.00 10.00 H new ATOM 0 HA ILE A 42 18.080 -5.745 10.832 1.00 10.00 H new ATOM 0 HB ILE A 42 18.395 -3.101 9.542 1.00 10.00 H new ATOM 0 HG12 ILE A 42 20.595 -4.891 10.686 1.00 10.00 H new ATOM 0 HG13 ILE A 42 20.553 -4.154 9.097 1.00 10.00 H new ATOM 0 HG21 ILE A 42 18.953 -2.454 11.900 1.00 10.00 H new ATOM 0 HG22 ILE A 42 17.358 -3.236 11.790 1.00 10.00 H new ATOM 0 HG23 ILE A 42 18.759 -4.152 12.395 1.00 10.00 H new ATOM 0 HD11 ILE A 42 22.157 -3.000 10.555 1.00 10.00 H new ATOM 0 HD12 ILE A 42 20.822 -1.908 10.116 1.00 10.00 H new ATOM 0 HD13 ILE A 42 20.865 -2.657 11.730 1.00 10.00 H new ATOM 573 N ARG A 43 15.718 -4.616 10.505 1.00 10.00 N ATOM 574 CA ARG A 43 14.287 -4.457 10.294 1.00 10.00 C ATOM 575 C ARG A 43 13.951 -3.638 9.059 1.00 10.00 C ATOM 576 O ARG A 43 12.970 -3.931 8.376 1.00 10.00 O ATOM 577 CB ARG A 43 13.559 -3.839 11.495 1.00 10.00 C ATOM 578 CG ARG A 43 14.330 -3.061 12.564 1.00 10.00 C ATOM 579 CD ARG A 43 14.867 -1.676 12.183 1.00 10.00 C ATOM 580 NE ARG A 43 15.324 -0.971 13.395 1.00 10.00 N ATOM 581 CZ ARG A 43 15.680 0.323 13.487 1.00 10.00 C ATOM 582 NH1 ARG A 43 15.796 1.087 12.403 1.00 10.00 N ATOM 583 NH2 ARG A 43 15.917 0.856 14.691 1.00 10.00 N ATOM 0 H ARG A 43 16.025 -4.379 11.448 1.00 10.00 H new ATOM 0 HA ARG A 43 13.934 -5.479 10.153 1.00 10.00 H new ATOM 0 HB2 ARG A 43 12.798 -3.168 11.097 1.00 10.00 H new ATOM 0 HB3 ARG A 43 13.036 -4.649 12.003 1.00 10.00 H new ATOM 0 HG2 ARG A 43 13.678 -2.942 13.429 1.00 10.00 H new ATOM 0 HG3 ARG A 43 15.174 -3.673 12.882 1.00 10.00 H new ATOM 0 HD2 ARG A 43 15.691 -1.776 11.476 1.00 10.00 H new ATOM 0 HD3 ARG A 43 14.089 -1.097 11.685 1.00 10.00 H new ATOM 0 HE ARG A 43 15.375 -1.521 14.252 1.00 10.00 H new ATOM 0 HH11 ARG A 43 15.614 0.693 11.480 1.00 10.00 H new ATOM 0 HH12 ARG A 43 16.067 2.066 12.496 1.00 10.00 H new ATOM 0 HH21 ARG A 43 15.827 0.282 15.529 1.00 10.00 H new ATOM 0 HH22 ARG A 43 16.187 1.836 14.770 1.00 10.00 H new ATOM 597 N ASP A 44 14.690 -2.548 8.866 1.00 10.00 N ATOM 598 CA ASP A 44 14.292 -1.495 7.963 1.00 10.00 C ATOM 599 C ASP A 44 14.129 -2.050 6.562 1.00 10.00 C ATOM 600 O ASP A 44 14.997 -2.743 6.037 1.00 10.00 O ATOM 601 CB ASP A 44 15.289 -0.350 8.007 1.00 10.00 C ATOM 602 CG ASP A 44 15.371 0.212 9.410 1.00 10.00 C ATOM 603 OD1 ASP A 44 14.322 0.594 9.967 1.00 10.00 O ATOM 604 OD2 ASP A 44 16.460 0.163 10.014 1.00 10.00 O ATOM 0 H ASP A 44 15.580 -2.379 9.336 1.00 10.00 H new ATOM 0 HA ASP A 44 13.328 -1.095 8.278 1.00 10.00 H new ATOM 0 HB2 ASP A 44 16.271 -0.700 7.689 1.00 10.00 H new ATOM 0 HB3 ASP A 44 14.988 0.432 7.310 1.00 10.00 H new ATOM 609 N THR A 45 12.961 -1.776 5.999 1.00 10.00 N ATOM 610 CA THR A 45 12.474 -2.479 4.829 1.00 10.00 C ATOM 611 C THR A 45 11.665 -1.550 3.922 1.00 10.00 C ATOM 612 O THR A 45 11.742 -0.331 4.067 1.00 10.00 O ATOM 613 CB THR A 45 11.713 -3.731 5.283 1.00 10.00 C ATOM 614 OG1 THR A 45 11.415 -4.502 4.146 1.00 10.00 O ATOM 615 CG2 THR A 45 10.431 -3.427 6.066 1.00 10.00 C ATOM 0 H THR A 45 12.325 -1.057 6.345 1.00 10.00 H new ATOM 0 HA THR A 45 13.308 -2.813 4.211 1.00 10.00 H new ATOM 0 HB THR A 45 12.357 -4.274 5.975 1.00 10.00 H new ATOM 0 HG1 THR A 45 10.741 -5.176 4.375 1.00 10.00 H new ATOM 0 HG21 THR A 45 9.949 -4.362 6.352 1.00 10.00 H new ATOM 0 HG22 THR A 45 10.678 -2.857 6.962 1.00 10.00 H new ATOM 0 HG23 THR A 45 9.753 -2.846 5.442 1.00 10.00 H new ATOM 623 N ALA A 46 10.918 -2.118 2.968 1.00 10.00 N ATOM 624 CA ALA A 46 10.262 -1.395 1.896 1.00 10.00 C ATOM 625 C ALA A 46 9.017 -2.120 1.392 1.00 10.00 C ATOM 626 O ALA A 46 8.886 -3.338 1.555 1.00 10.00 O ATOM 627 CB ALA A 46 11.251 -1.151 0.751 1.00 10.00 C ATOM 0 H ALA A 46 10.755 -3.124 2.928 1.00 10.00 H new ATOM 0 HA ALA A 46 9.930 -0.436 2.294 1.00 10.00 H new ATOM 0 HB1 ALA A 46 10.752 -0.607 -0.051 1.00 10.00 H new ATOM 0 HB2 ALA A 46 12.094 -0.565 1.117 1.00 10.00 H new ATOM 0 HB3 ALA A 46 11.612 -2.107 0.372 1.00 10.00 H new ATOM 633 N ALA A 47 8.119 -1.353 0.763 1.00 10.00 N ATOM 634 CA ALA A 47 7.040 -1.907 -0.040 1.00 10.00 C ATOM 635 C ALA A 47 7.537 -2.198 -1.454 1.00 10.00 C ATOM 636 O ALA A 47 8.512 -1.590 -1.896 1.00 10.00 O ATOM 637 CB ALA A 47 5.836 -0.964 -0.080 1.00 10.00 C ATOM 0 H ALA A 47 8.126 -0.334 0.801 1.00 10.00 H new ATOM 0 HA ALA A 47 6.716 -2.839 0.423 1.00 10.00 H new ATOM 0 HB1 ALA A 47 5.047 -1.407 -0.688 1.00 10.00 H new ATOM 0 HB2 ALA A 47 5.466 -0.803 0.933 1.00 10.00 H new ATOM 0 HB3 ALA A 47 6.135 -0.010 -0.513 1.00 10.00 H new ATOM 643 N TYR A 48 6.836 -3.082 -2.171 1.00 10.00 N ATOM 644 CA TYR A 48 6.944 -3.212 -3.612 1.00 10.00 C ATOM 645 C TYR A 48 5.515 -3.036 -4.120 1.00 10.00 C ATOM 646 O TYR A 48 4.606 -3.686 -3.589 1.00 10.00 O ATOM 647 CB TYR A 48 7.521 -4.569 -4.059 1.00 10.00 C ATOM 648 CG TYR A 48 8.534 -5.259 -3.157 1.00 10.00 C ATOM 649 CD1 TYR A 48 9.711 -4.597 -2.759 1.00 10.00 C ATOM 650 CD2 TYR A 48 8.383 -6.631 -2.870 1.00 10.00 C ATOM 651 CE1 TYR A 48 10.727 -5.307 -2.092 1.00 10.00 C ATOM 652 CE2 TYR A 48 9.424 -7.349 -2.257 1.00 10.00 C ATOM 653 CZ TYR A 48 10.613 -6.694 -1.900 1.00 10.00 C ATOM 654 OH TYR A 48 11.657 -7.388 -1.363 1.00 10.00 O ATOM 0 H TYR A 48 6.171 -3.732 -1.753 1.00 10.00 H new ATOM 0 HA TYR A 48 7.638 -2.475 -4.016 1.00 10.00 H new ATOM 0 HB2 TYR A 48 6.685 -5.253 -4.203 1.00 10.00 H new ATOM 0 HB3 TYR A 48 7.988 -4.426 -5.034 1.00 10.00 H new ATOM 0 HD1 TYR A 48 9.834 -3.544 -2.966 1.00 10.00 H new ATOM 0 HD2 TYR A 48 7.461 -7.134 -3.123 1.00 10.00 H new ATOM 0 HE1 TYR A 48 11.598 -4.783 -1.726 1.00 10.00 H new ATOM 0 HE2 TYR A 48 9.309 -8.405 -2.061 1.00 10.00 H new ATOM 0 HH TYR A 48 11.315 -8.161 -0.867 1.00 10.00 H new ATOM 664 N MET A 49 5.297 -2.140 -5.084 1.00 10.00 N ATOM 665 CA MET A 49 3.992 -1.944 -5.696 1.00 10.00 C ATOM 666 C MET A 49 4.158 -1.305 -7.073 1.00 10.00 C ATOM 667 O MET A 49 5.267 -0.967 -7.473 1.00 10.00 O ATOM 668 CB MET A 49 3.059 -1.142 -4.769 1.00 10.00 C ATOM 669 CG MET A 49 3.465 0.313 -4.520 1.00 10.00 C ATOM 670 SD MET A 49 2.263 1.291 -3.578 1.00 10.00 S ATOM 671 CE MET A 49 2.597 0.682 -1.912 1.00 10.00 C ATOM 0 H MET A 49 6.025 -1.532 -5.459 1.00 10.00 H new ATOM 0 HA MET A 49 3.511 -2.911 -5.841 1.00 10.00 H new ATOM 0 HB2 MET A 49 2.056 -1.153 -5.195 1.00 10.00 H new ATOM 0 HB3 MET A 49 3.003 -1.654 -3.808 1.00 10.00 H new ATOM 0 HG2 MET A 49 4.416 0.323 -3.988 1.00 10.00 H new ATOM 0 HG3 MET A 49 3.632 0.798 -5.482 1.00 10.00 H new ATOM 0 HE1 MET A 49 1.656 0.445 -1.416 1.00 10.00 H new ATOM 0 HE2 MET A 49 3.213 -0.215 -1.969 1.00 10.00 H new ATOM 0 HE3 MET A 49 3.124 1.448 -1.343 1.00 10.00 H new ATOM 681 N THR A 50 3.050 -1.105 -7.776 1.00 10.00 N ATOM 682 CA THR A 50 2.954 -0.241 -8.940 1.00 10.00 C ATOM 683 C THR A 50 2.381 1.100 -8.476 1.00 10.00 C ATOM 684 O THR A 50 1.900 1.202 -7.352 1.00 10.00 O ATOM 685 CB THR A 50 2.060 -0.913 -9.992 1.00 10.00 C ATOM 686 OG1 THR A 50 0.924 -1.488 -9.375 1.00 10.00 O ATOM 687 CG2 THR A 50 2.832 -2.023 -10.711 1.00 10.00 C ATOM 0 H THR A 50 2.166 -1.556 -7.541 1.00 10.00 H new ATOM 0 HA THR A 50 3.928 -0.070 -9.399 1.00 10.00 H new ATOM 0 HB THR A 50 1.749 -0.152 -10.707 1.00 10.00 H new ATOM 0 HG1 THR A 50 0.361 -1.912 -10.056 1.00 10.00 H new ATOM 0 HG21 THR A 50 2.187 -2.492 -11.454 1.00 10.00 H new ATOM 0 HG22 THR A 50 3.706 -1.597 -11.205 1.00 10.00 H new ATOM 0 HG23 THR A 50 3.153 -2.771 -9.986 1.00 10.00 H new ATOM 695 N LEU A 51 2.417 2.121 -9.330 1.00 10.00 N ATOM 696 CA LEU A 51 1.628 3.333 -9.203 1.00 10.00 C ATOM 697 C LEU A 51 1.089 3.642 -10.594 1.00 10.00 C ATOM 698 O LEU A 51 1.794 3.358 -11.563 1.00 10.00 O ATOM 699 CB LEU A 51 2.511 4.488 -8.709 1.00 10.00 C ATOM 700 CG LEU A 51 1.922 5.126 -7.449 1.00 10.00 C ATOM 701 CD1 LEU A 51 2.036 4.256 -6.193 1.00 10.00 C ATOM 702 CD2 LEU A 51 2.636 6.449 -7.179 1.00 10.00 C ATOM 0 H LEU A 51 3.018 2.122 -10.154 1.00 10.00 H new ATOM 0 HA LEU A 51 0.818 3.206 -8.484 1.00 10.00 H new ATOM 0 HB2 LEU A 51 3.515 4.119 -8.499 1.00 10.00 H new ATOM 0 HB3 LEU A 51 2.605 5.240 -9.492 1.00 10.00 H new ATOM 0 HG LEU A 51 0.859 5.262 -7.648 1.00 10.00 H new ATOM 0 HD11 LEU A 51 1.595 4.781 -5.346 1.00 10.00 H new ATOM 0 HD12 LEU A 51 1.508 3.316 -6.352 1.00 10.00 H new ATOM 0 HD13 LEU A 51 3.086 4.051 -5.986 1.00 10.00 H new ATOM 0 HD21 LEU A 51 2.222 6.910 -6.282 1.00 10.00 H new ATOM 0 HD22 LEU A 51 3.700 6.265 -7.034 1.00 10.00 H new ATOM 0 HD23 LEU A 51 2.496 7.118 -8.028 1.00 10.00 H new ATOM 714 N THR A 52 -0.120 4.208 -10.689 1.00 10.00 N ATOM 715 CA THR A 52 -0.857 4.296 -11.946 1.00 10.00 C ATOM 716 C THR A 52 -1.589 5.632 -12.098 1.00 10.00 C ATOM 717 O THR A 52 -2.585 5.859 -11.413 1.00 10.00 O ATOM 718 CB THR A 52 -1.830 3.108 -12.024 1.00 10.00 C ATOM 719 OG1 THR A 52 -1.182 1.902 -11.662 1.00 10.00 O ATOM 720 CG2 THR A 52 -2.395 2.958 -13.441 1.00 10.00 C ATOM 0 H THR A 52 -0.611 4.617 -9.894 1.00 10.00 H new ATOM 0 HA THR A 52 -0.151 4.250 -12.775 1.00 10.00 H new ATOM 0 HB THR A 52 -2.644 3.307 -11.327 1.00 10.00 H new ATOM 0 HG1 THR A 52 -1.778 1.367 -11.098 1.00 10.00 H new ATOM 0 HG21 THR A 52 -3.081 2.111 -13.472 1.00 10.00 H new ATOM 0 HG22 THR A 52 -2.929 3.867 -13.718 1.00 10.00 H new ATOM 0 HG23 THR A 52 -1.578 2.789 -14.142 1.00 10.00 H new ATOM 728 N ASN A 53 -1.161 6.489 -13.038 1.00 10.00 N ATOM 729 CA ASN A 53 -1.947 7.655 -13.430 1.00 10.00 C ATOM 730 C ASN A 53 -3.001 7.243 -14.451 1.00 10.00 C ATOM 731 O ASN A 53 -2.663 6.837 -15.561 1.00 10.00 O ATOM 732 CB ASN A 53 -1.077 8.746 -14.073 1.00 10.00 C ATOM 733 CG ASN A 53 -1.030 10.029 -13.258 1.00 10.00 C ATOM 734 OD1 ASN A 53 -1.709 11.000 -13.582 1.00 10.00 O ATOM 735 ND2 ASN A 53 -0.203 10.064 -12.224 1.00 10.00 N ATOM 0 H ASN A 53 -0.276 6.391 -13.536 1.00 10.00 H new ATOM 0 HA ASN A 53 -2.404 8.052 -12.523 1.00 10.00 H new ATOM 0 HB2 ASN A 53 -0.063 8.366 -14.200 1.00 10.00 H new ATOM 0 HB3 ASN A 53 -1.461 8.969 -15.068 1.00 10.00 H new ATOM 0 HD21 ASN A 53 -0.116 10.916 -11.669 1.00 10.00 H new ATOM 0 HD22 ASN A 53 0.346 9.239 -11.982 1.00 10.00 H new ATOM 742 N LYS A 54 -4.277 7.443 -14.120 1.00 10.00 N ATOM 743 CA LYS A 54 -5.316 7.545 -15.127 1.00 10.00 C ATOM 744 C LYS A 54 -6.347 8.560 -14.639 1.00 10.00 C ATOM 745 O LYS A 54 -7.386 8.203 -14.095 1.00 10.00 O ATOM 746 CB LYS A 54 -5.876 6.163 -15.456 1.00 10.00 C ATOM 747 CG LYS A 54 -6.878 6.157 -16.613 1.00 10.00 C ATOM 748 CD LYS A 54 -6.242 6.585 -17.951 1.00 10.00 C ATOM 749 CE LYS A 54 -6.365 8.094 -18.252 1.00 10.00 C ATOM 750 NZ LYS A 54 -5.077 8.720 -18.632 1.00 10.00 N ATOM 0 H LYS A 54 -4.609 7.537 -13.160 1.00 10.00 H new ATOM 0 HA LYS A 54 -4.929 7.914 -16.077 1.00 10.00 H new ATOM 0 HB2 LYS A 54 -5.049 5.496 -15.701 1.00 10.00 H new ATOM 0 HB3 LYS A 54 -6.360 5.757 -14.568 1.00 10.00 H new ATOM 0 HG2 LYS A 54 -7.299 5.157 -16.719 1.00 10.00 H new ATOM 0 HG3 LYS A 54 -7.704 6.828 -16.377 1.00 10.00 H new ATOM 0 HD2 LYS A 54 -5.187 6.312 -17.944 1.00 10.00 H new ATOM 0 HD3 LYS A 54 -6.711 6.025 -18.760 1.00 10.00 H new ATOM 0 HE2 LYS A 54 -7.084 8.240 -19.058 1.00 10.00 H new ATOM 0 HE3 LYS A 54 -6.763 8.602 -17.374 1.00 10.00 H new ATOM 0 HZ1 LYS A 54 -5.260 9.610 -19.138 1.00 10.00 H new ATOM 0 HZ2 LYS A 54 -4.520 8.916 -17.776 1.00 10.00 H new ATOM 0 HZ3 LYS A 54 -4.546 8.074 -19.250 1.00 10.00 H new ATOM 764 N SER A 55 -5.999 9.830 -14.843 1.00 10.00 N ATOM 765 CA SER A 55 -6.669 11.052 -14.406 1.00 10.00 C ATOM 766 C SER A 55 -5.710 12.239 -14.541 1.00 10.00 C ATOM 767 O SER A 55 -6.173 13.369 -14.672 1.00 10.00 O ATOM 768 CB SER A 55 -7.259 10.968 -12.993 1.00 10.00 C ATOM 769 OG SER A 55 -8.540 10.377 -13.046 1.00 10.00 O ATOM 0 H SER A 55 -5.155 10.049 -15.372 1.00 10.00 H new ATOM 0 HA SER A 55 -7.528 11.195 -15.061 1.00 10.00 H new ATOM 0 HB2 SER A 55 -6.604 10.381 -12.349 1.00 10.00 H new ATOM 0 HB3 SER A 55 -7.326 11.965 -12.557 1.00 10.00 H new ATOM 0 HG SER A 55 -8.469 9.475 -13.424 1.00 10.00 H new ATOM 775 N ASP A 56 -4.395 11.993 -14.617 1.00 10.00 N ATOM 776 CA ASP A 56 -3.546 12.759 -15.512 1.00 10.00 C ATOM 777 C ASP A 56 -3.316 14.164 -14.956 1.00 10.00 C ATOM 778 O ASP A 56 -3.535 15.157 -15.646 1.00 10.00 O ATOM 779 CB ASP A 56 -4.143 12.744 -16.936 1.00 10.00 C ATOM 780 CG ASP A 56 -4.277 11.352 -17.549 1.00 10.00 C ATOM 781 OD1 ASP A 56 -4.216 10.331 -16.825 1.00 10.00 O ATOM 782 OD2 ASP A 56 -4.406 11.262 -18.796 1.00 10.00 O ATOM 0 H ASP A 56 -3.910 11.278 -14.074 1.00 10.00 H new ATOM 0 HA ASP A 56 -2.560 12.300 -15.582 1.00 10.00 H new ATOM 0 HB2 ASP A 56 -5.127 13.212 -16.909 1.00 10.00 H new ATOM 0 HB3 ASP A 56 -3.517 13.355 -17.586 1.00 10.00 H new ATOM 787 N GLN A 57 -2.857 14.235 -13.702 1.00 10.00 N ATOM 788 CA GLN A 57 -2.757 15.456 -12.918 1.00 10.00 C ATOM 789 C GLN A 57 -1.526 15.369 -12.007 1.00 10.00 C ATOM 790 O GLN A 57 -1.053 14.265 -11.728 1.00 10.00 O ATOM 791 CB GLN A 57 -4.051 15.598 -12.102 1.00 10.00 C ATOM 792 CG GLN A 57 -5.129 16.334 -12.907 1.00 10.00 C ATOM 793 CD GLN A 57 -6.515 16.119 -12.316 1.00 10.00 C ATOM 794 OE1 GLN A 57 -6.911 16.797 -11.375 1.00 10.00 O ATOM 795 NE2 GLN A 57 -7.261 15.170 -12.870 1.00 10.00 N ATOM 0 H GLN A 57 -2.535 13.411 -13.193 1.00 10.00 H new ATOM 0 HA GLN A 57 -2.639 16.332 -13.556 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -4.415 14.611 -11.816 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -3.846 16.141 -11.180 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -4.903 17.400 -12.928 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -5.115 15.985 -13.939 1.00 10.00 H new ATOM 0 HE21 GLN A 57 -6.896 14.626 -13.652 1.00 10.00 H new ATOM 0 HE22 GLN A 57 -8.198 14.985 -12.513 1.00 10.00 H new ATOM 804 N PRO A 58 -0.985 16.511 -11.549 1.00 10.00 N ATOM 805 CA PRO A 58 0.228 16.561 -10.747 1.00 10.00 C ATOM 806 C PRO A 58 -0.054 16.187 -9.286 1.00 10.00 C ATOM 807 O PRO A 58 -0.017 17.032 -8.383 1.00 10.00 O ATOM 808 CB PRO A 58 0.748 17.989 -10.918 1.00 10.00 C ATOM 809 CG PRO A 58 -0.536 18.801 -11.082 1.00 10.00 C ATOM 810 CD PRO A 58 -1.416 17.856 -11.901 1.00 10.00 C ATOM 0 HA PRO A 58 0.977 15.836 -11.067 1.00 10.00 H new ATOM 0 HB2 PRO A 58 1.325 18.315 -10.053 1.00 10.00 H new ATOM 0 HB3 PRO A 58 1.398 18.081 -11.788 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -0.988 19.047 -10.121 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -0.358 19.743 -11.601 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -2.471 18.003 -11.668 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -1.297 18.038 -12.969 1.00 10.00 H new ATOM 818 N ILE A 59 -0.344 14.906 -9.054 1.00 10.00 N ATOM 819 CA ILE A 59 -0.704 14.411 -7.732 1.00 10.00 C ATOM 820 C ILE A 59 0.569 14.067 -6.945 1.00 10.00 C ATOM 821 O ILE A 59 1.621 13.796 -7.516 1.00 10.00 O ATOM 822 CB ILE A 59 -1.708 13.248 -7.836 1.00 10.00 C ATOM 823 CG1 ILE A 59 -2.872 13.512 -8.804 1.00 10.00 C ATOM 824 CG2 ILE A 59 -2.249 12.837 -6.459 1.00 10.00 C ATOM 825 CD1 ILE A 59 -3.560 14.841 -8.545 1.00 10.00 C ATOM 0 H ILE A 59 -0.335 14.187 -9.778 1.00 10.00 H new ATOM 0 HA ILE A 59 -1.220 15.189 -7.169 1.00 10.00 H new ATOM 0 HB ILE A 59 -1.134 12.422 -8.255 1.00 10.00 H new ATOM 0 HG12 ILE A 59 -2.499 13.494 -9.828 1.00 10.00 H new ATOM 0 HG13 ILE A 59 -3.601 12.707 -8.717 1.00 10.00 H new ATOM 0 HG21 ILE A 59 -2.954 12.014 -6.576 1.00 10.00 H new ATOM 0 HG22 ILE A 59 -1.422 12.519 -5.823 1.00 10.00 H new ATOM 0 HG23 ILE A 59 -2.755 13.686 -5.999 1.00 10.00 H new ATOM 0 HD11 ILE A 59 -4.374 14.974 -9.258 1.00 10.00 H new ATOM 0 HD12 ILE A 59 -3.960 14.852 -7.531 1.00 10.00 H new ATOM 0 HD13 ILE A 59 -2.840 15.652 -8.660 1.00 10.00 H new ATOM 837 N LYS A 60 0.479 14.164 -5.619 1.00 10.00 N ATOM 838 CA LYS A 60 1.563 14.238 -4.664 1.00 10.00 C ATOM 839 C LYS A 60 1.209 13.378 -3.449 1.00 10.00 C ATOM 840 O LYS A 60 0.710 13.864 -2.433 1.00 10.00 O ATOM 841 CB LYS A 60 1.805 15.720 -4.345 1.00 10.00 C ATOM 842 CG LYS A 60 0.566 16.631 -4.436 1.00 10.00 C ATOM 843 CD LYS A 60 0.969 18.107 -4.352 1.00 10.00 C ATOM 844 CE LYS A 60 -0.071 18.999 -5.054 1.00 10.00 C ATOM 845 NZ LYS A 60 0.018 18.945 -6.536 1.00 10.00 N ATOM 0 H LYS A 60 -0.430 14.195 -5.157 1.00 10.00 H new ATOM 0 HA LYS A 60 2.499 13.837 -5.053 1.00 10.00 H new ATOM 0 HB2 LYS A 60 2.215 15.794 -3.338 1.00 10.00 H new ATOM 0 HB3 LYS A 60 2.565 16.101 -5.027 1.00 10.00 H new ATOM 0 HG2 LYS A 60 0.041 16.446 -5.373 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -0.127 16.392 -3.629 1.00 10.00 H new ATOM 0 HD2 LYS A 60 1.063 18.404 -3.307 1.00 10.00 H new ATOM 0 HD3 LYS A 60 1.946 18.248 -4.813 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -1.071 18.693 -4.745 1.00 10.00 H new ATOM 0 HE3 LYS A 60 0.063 20.030 -4.726 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -0.718 19.552 -6.950 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 0.955 19.279 -6.840 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -0.121 17.965 -6.857 1.00 10.00 H new ATOM 859 N LEU A 61 1.446 12.073 -3.583 1.00 10.00 N ATOM 860 CA LEU A 61 0.937 11.052 -2.677 1.00 10.00 C ATOM 861 C LEU A 61 1.813 10.902 -1.436 1.00 10.00 C ATOM 862 O LEU A 61 2.368 9.841 -1.157 1.00 10.00 O ATOM 863 CB LEU A 61 0.789 9.732 -3.441 1.00 10.00 C ATOM 864 CG LEU A 61 -0.375 9.779 -4.441 1.00 10.00 C ATOM 865 CD1 LEU A 61 -0.340 8.513 -5.297 1.00 10.00 C ATOM 866 CD2 LEU A 61 -1.725 9.910 -3.716 1.00 10.00 C ATOM 0 H LEU A 61 2.010 11.691 -4.342 1.00 10.00 H new ATOM 0 HA LEU A 61 -0.043 11.359 -2.312 1.00 10.00 H new ATOM 0 HB2 LEU A 61 1.716 9.514 -3.972 1.00 10.00 H new ATOM 0 HB3 LEU A 61 0.628 8.919 -2.733 1.00 10.00 H new ATOM 0 HG LEU A 61 -0.265 10.656 -5.079 1.00 10.00 H new ATOM 0 HD11 LEU A 61 -1.163 8.534 -6.012 1.00 10.00 H new ATOM 0 HD12 LEU A 61 0.607 8.463 -5.835 1.00 10.00 H new ATOM 0 HD13 LEU A 61 -0.439 7.637 -4.656 1.00 10.00 H new ATOM 0 HD21 LEU A 61 -2.531 9.941 -4.450 1.00 10.00 H new ATOM 0 HD22 LEU A 61 -1.868 9.055 -3.056 1.00 10.00 H new ATOM 0 HD23 LEU A 61 -1.735 10.828 -3.128 1.00 10.00 H new ATOM 878 N VAL A 62 1.884 11.969 -0.645 1.00 10.00 N ATOM 879 CA VAL A 62 2.731 12.013 0.537 1.00 10.00 C ATOM 880 C VAL A 62 2.052 11.345 1.740 1.00 10.00 C ATOM 881 O VAL A 62 1.845 11.971 2.774 1.00 10.00 O ATOM 882 CB VAL A 62 3.213 13.455 0.788 1.00 10.00 C ATOM 883 CG1 VAL A 62 2.099 14.481 1.017 1.00 10.00 C ATOM 884 CG2 VAL A 62 4.263 13.513 1.907 1.00 10.00 C ATOM 0 H VAL A 62 1.355 12.826 -0.808 1.00 10.00 H new ATOM 0 HA VAL A 62 3.629 11.420 0.367 1.00 10.00 H new ATOM 0 HB VAL A 62 3.680 13.754 -0.150 1.00 10.00 H new ATOM 0 HG11 VAL A 62 2.539 15.464 1.184 1.00 10.00 H new ATOM 0 HG12 VAL A 62 1.452 14.517 0.141 1.00 10.00 H new ATOM 0 HG13 VAL A 62 1.512 14.193 1.889 1.00 10.00 H new ATOM 0 HG21 VAL A 62 4.579 14.545 2.056 1.00 10.00 H new ATOM 0 HG22 VAL A 62 3.831 13.129 2.831 1.00 10.00 H new ATOM 0 HG23 VAL A 62 5.125 12.906 1.629 1.00 10.00 H new ATOM 894 N GLY A 63 1.719 10.054 1.639 1.00 10.00 N ATOM 895 CA GLY A 63 1.419 9.297 2.847 1.00 10.00 C ATOM 896 C GLY A 63 1.535 7.789 2.658 1.00 10.00 C ATOM 897 O GLY A 63 1.276 7.273 1.574 1.00 10.00 O ATOM 0 H GLY A 63 1.653 9.531 0.766 1.00 10.00 H new ATOM 0 HA2 GLY A 63 2.097 9.610 3.641 1.00 10.00 H new ATOM 0 HA3 GLY A 63 0.409 9.538 3.177 1.00 10.00 H new ATOM 901 N ALA A 64 1.907 7.093 3.736 1.00 10.00 N ATOM 902 CA ALA A 64 2.007 5.642 3.813 1.00 10.00 C ATOM 903 C ALA A 64 1.899 5.214 5.282 1.00 10.00 C ATOM 904 O ALA A 64 2.833 4.636 5.835 1.00 10.00 O ATOM 905 CB ALA A 64 3.339 5.208 3.189 1.00 10.00 C ATOM 0 H ALA A 64 2.156 7.549 4.613 1.00 10.00 H new ATOM 0 HA ALA A 64 1.199 5.161 3.262 1.00 10.00 H new ATOM 0 HB1 ALA A 64 3.428 4.123 3.240 1.00 10.00 H new ATOM 0 HB2 ALA A 64 3.374 5.527 2.147 1.00 10.00 H new ATOM 0 HB3 ALA A 64 4.163 5.666 3.736 1.00 10.00 H new ATOM 911 N ALA A 65 0.782 5.534 5.941 1.00 10.00 N ATOM 912 CA ALA A 65 0.656 5.354 7.388 1.00 10.00 C ATOM 913 C ALA A 65 0.100 3.962 7.685 1.00 10.00 C ATOM 914 O ALA A 65 -0.858 3.540 7.041 1.00 10.00 O ATOM 915 CB ALA A 65 -0.228 6.458 7.973 1.00 10.00 C ATOM 0 H ALA A 65 -0.049 5.920 5.493 1.00 10.00 H new ATOM 0 HA ALA A 65 1.636 5.430 7.860 1.00 10.00 H new ATOM 0 HB1 ALA A 65 -0.318 6.319 9.050 1.00 10.00 H new ATOM 0 HB2 ALA A 65 0.221 7.430 7.769 1.00 10.00 H new ATOM 0 HB3 ALA A 65 -1.217 6.412 7.517 1.00 10.00 H new ATOM 921 N THR A 66 0.694 3.216 8.622 1.00 10.00 N ATOM 922 CA THR A 66 0.374 1.802 8.775 1.00 10.00 C ATOM 923 C THR A 66 0.812 1.279 10.152 1.00 10.00 C ATOM 924 O THR A 66 1.817 1.747 10.707 1.00 10.00 O ATOM 925 CB THR A 66 1.042 1.029 7.620 1.00 10.00 C ATOM 926 OG1 THR A 66 0.817 -0.358 7.732 1.00 10.00 O ATOM 927 CG2 THR A 66 2.549 1.278 7.521 1.00 10.00 C ATOM 0 H THR A 66 1.392 3.568 9.278 1.00 10.00 H new ATOM 0 HA THR A 66 -0.705 1.654 8.727 1.00 10.00 H new ATOM 0 HB THR A 66 0.576 1.410 6.711 1.00 10.00 H new ATOM 0 HG1 THR A 66 -0.053 -0.581 7.340 1.00 10.00 H new ATOM 0 HG21 THR A 66 2.958 0.705 6.689 1.00 10.00 H new ATOM 0 HG22 THR A 66 2.732 2.340 7.356 1.00 10.00 H new ATOM 0 HG23 THR A 66 3.031 0.966 8.448 1.00 10.00 H new ATOM 935 N PRO A 67 0.123 0.274 10.720 1.00 10.00 N ATOM 936 CA PRO A 67 0.574 -0.414 11.921 1.00 10.00 C ATOM 937 C PRO A 67 1.695 -1.422 11.596 1.00 10.00 C ATOM 938 O PRO A 67 1.712 -2.521 12.144 1.00 10.00 O ATOM 939 CB PRO A 67 -0.689 -1.079 12.480 1.00 10.00 C ATOM 940 CG PRO A 67 -1.468 -1.428 11.214 1.00 10.00 C ATOM 941 CD PRO A 67 -1.170 -0.244 10.293 1.00 10.00 C ATOM 0 HA PRO A 67 1.019 0.258 12.655 1.00 10.00 H new ATOM 0 HB2 PRO A 67 -0.454 -1.966 13.069 1.00 10.00 H new ATOM 0 HB3 PRO A 67 -1.249 -0.405 13.128 1.00 10.00 H new ATOM 0 HG2 PRO A 67 -1.134 -2.371 10.781 1.00 10.00 H new ATOM 0 HG3 PRO A 67 -2.535 -1.528 11.411 1.00 10.00 H new ATOM 0 HD2 PRO A 67 -1.141 -0.558 9.250 1.00 10.00 H new ATOM 0 HD3 PRO A 67 -1.944 0.520 10.375 1.00 10.00 H new ATOM 949 N LEU A 68 2.657 -1.034 10.746 1.00 10.00 N ATOM 950 CA LEU A 68 3.772 -1.868 10.303 1.00 10.00 C ATOM 951 C LEU A 68 5.091 -1.131 10.573 1.00 10.00 C ATOM 952 O LEU A 68 5.857 -1.518 11.454 1.00 10.00 O ATOM 953 CB LEU A 68 3.554 -2.210 8.818 1.00 10.00 C ATOM 954 CG LEU A 68 4.318 -3.451 8.339 1.00 10.00 C ATOM 955 CD1 LEU A 68 3.842 -3.807 6.929 1.00 10.00 C ATOM 956 CD2 LEU A 68 5.838 -3.248 8.322 1.00 10.00 C ATOM 0 H LEU A 68 2.676 -0.100 10.338 1.00 10.00 H new ATOM 0 HA LEU A 68 3.823 -2.807 10.853 1.00 10.00 H new ATOM 0 HB2 LEU A 68 2.489 -2.364 8.645 1.00 10.00 H new ATOM 0 HB3 LEU A 68 3.855 -1.356 8.212 1.00 10.00 H new ATOM 0 HG LEU A 68 4.111 -4.256 9.044 1.00 10.00 H new ATOM 0 HD11 LEU A 68 4.377 -4.688 6.576 1.00 10.00 H new ATOM 0 HD12 LEU A 68 2.772 -4.016 6.948 1.00 10.00 H new ATOM 0 HD13 LEU A 68 4.037 -2.971 6.257 1.00 10.00 H new ATOM 0 HD21 LEU A 68 6.323 -4.160 7.974 1.00 10.00 H new ATOM 0 HD22 LEU A 68 6.088 -2.426 7.651 1.00 10.00 H new ATOM 0 HD23 LEU A 68 6.185 -3.013 9.328 1.00 10.00 H new ATOM 968 N ALA A 69 5.332 -0.039 9.842 1.00 10.00 N ATOM 969 CA ALA A 69 6.513 0.804 9.972 1.00 10.00 C ATOM 970 C ALA A 69 6.285 1.883 11.019 1.00 10.00 C ATOM 971 O ALA A 69 5.211 2.484 11.061 1.00 10.00 O ATOM 972 CB ALA A 69 6.772 1.487 8.632 1.00 10.00 C ATOM 0 H ALA A 69 4.688 0.289 9.122 1.00 10.00 H new ATOM 0 HA ALA A 69 7.359 0.185 10.270 1.00 10.00 H new ATOM 0 HB1 ALA A 69 7.654 2.123 8.712 1.00 10.00 H new ATOM 0 HB2 ALA A 69 6.938 0.731 7.864 1.00 10.00 H new ATOM 0 HB3 ALA A 69 5.909 2.096 8.361 1.00 10.00 H new ATOM 978 N THR A 70 7.283 2.163 11.852 1.00 10.00 N ATOM 979 CA THR A 70 7.309 3.361 12.682 1.00 10.00 C ATOM 980 C THR A 70 7.737 4.551 11.821 1.00 10.00 C ATOM 981 O THR A 70 7.260 5.663 12.024 1.00 10.00 O ATOM 982 CB THR A 70 8.251 3.159 13.878 1.00 10.00 C ATOM 983 OG1 THR A 70 7.914 1.959 14.538 1.00 10.00 O ATOM 984 CG2 THR A 70 8.140 4.299 14.893 1.00 10.00 C ATOM 0 H THR A 70 8.099 1.563 11.970 1.00 10.00 H new ATOM 0 HA THR A 70 6.315 3.560 13.083 1.00 10.00 H new ATOM 0 HB THR A 70 9.269 3.131 13.490 1.00 10.00 H new ATOM 0 HG1 THR A 70 8.273 1.198 14.036 1.00 10.00 H new ATOM 0 HG21 THR A 70 8.823 4.116 15.722 1.00 10.00 H new ATOM 0 HG22 THR A 70 8.399 5.242 14.411 1.00 10.00 H new ATOM 0 HG23 THR A 70 7.119 4.353 15.270 1.00 10.00 H new ATOM 992 N SER A 71 8.631 4.307 10.858 1.00 10.00 N ATOM 993 CA SER A 71 9.241 5.320 10.012 1.00 10.00 C ATOM 994 C SER A 71 8.946 5.019 8.534 1.00 10.00 C ATOM 995 O SER A 71 9.845 4.594 7.810 1.00 10.00 O ATOM 996 CB SER A 71 10.745 5.335 10.329 1.00 10.00 C ATOM 997 OG SER A 71 11.456 6.151 9.424 1.00 10.00 O ATOM 0 H SER A 71 8.957 3.364 10.644 1.00 10.00 H new ATOM 0 HA SER A 71 8.829 6.310 10.207 1.00 10.00 H new ATOM 0 HB2 SER A 71 10.900 5.696 11.346 1.00 10.00 H new ATOM 0 HB3 SER A 71 11.137 4.319 10.289 1.00 10.00 H new ATOM 0 HG SER A 71 12.409 6.141 9.653 1.00 10.00 H new ATOM 1003 N PRO A 72 7.711 5.240 8.057 1.00 10.00 N ATOM 1004 CA PRO A 72 7.398 5.168 6.640 1.00 10.00 C ATOM 1005 C PRO A 72 7.941 6.407 5.928 1.00 10.00 C ATOM 1006 O PRO A 72 7.489 7.519 6.189 1.00 10.00 O ATOM 1007 CB PRO A 72 5.870 5.094 6.582 1.00 10.00 C ATOM 1008 CG PRO A 72 5.427 5.882 7.815 1.00 10.00 C ATOM 1009 CD PRO A 72 6.531 5.590 8.833 1.00 10.00 C ATOM 0 HA PRO A 72 7.850 4.310 6.142 1.00 10.00 H new ATOM 0 HB2 PRO A 72 5.482 5.534 5.664 1.00 10.00 H new ATOM 0 HB3 PRO A 72 5.517 4.063 6.616 1.00 10.00 H new ATOM 0 HG2 PRO A 72 5.346 6.948 7.604 1.00 10.00 H new ATOM 0 HG3 PRO A 72 4.452 5.553 8.174 1.00 10.00 H new ATOM 0 HD2 PRO A 72 6.722 6.460 9.462 1.00 10.00 H new ATOM 0 HD3 PRO A 72 6.244 4.774 9.496 1.00 10.00 H new ATOM 1017 N MET A 73 8.920 6.218 5.039 1.00 10.00 N ATOM 1018 CA MET A 73 9.612 7.297 4.352 1.00 10.00 C ATOM 1019 C MET A 73 9.624 7.039 2.845 1.00 10.00 C ATOM 1020 O MET A 73 9.897 5.927 2.404 1.00 10.00 O ATOM 1021 CB MET A 73 11.029 7.390 4.918 1.00 10.00 C ATOM 1022 CG MET A 73 10.999 7.894 6.368 1.00 10.00 C ATOM 1023 SD MET A 73 12.585 8.437 7.052 1.00 10.00 S ATOM 1024 CE MET A 73 12.789 10.006 6.177 1.00 10.00 C ATOM 0 H MET A 73 9.255 5.291 4.776 1.00 10.00 H new ATOM 0 HA MET A 73 9.100 8.246 4.512 1.00 10.00 H new ATOM 0 HB2 MET A 73 11.508 6.412 4.877 1.00 10.00 H new ATOM 0 HB3 MET A 73 11.628 8.064 4.305 1.00 10.00 H new ATOM 0 HG2 MET A 73 10.296 8.725 6.429 1.00 10.00 H new ATOM 0 HG3 MET A 73 10.607 7.098 7.001 1.00 10.00 H new ATOM 0 HE1 MET A 73 13.657 10.533 6.573 1.00 10.00 H new ATOM 0 HE2 MET A 73 12.935 9.814 5.114 1.00 10.00 H new ATOM 0 HE3 MET A 73 11.898 10.618 6.316 1.00 10.00 H new ATOM 1034 N LEU A 74 9.299 8.062 2.055 1.00 10.00 N ATOM 1035 CA LEU A 74 9.125 7.971 0.612 1.00 10.00 C ATOM 1036 C LEU A 74 10.468 8.095 -0.116 1.00 10.00 C ATOM 1037 O LEU A 74 11.380 8.762 0.373 1.00 10.00 O ATOM 1038 CB LEU A 74 8.164 9.101 0.199 1.00 10.00 C ATOM 1039 CG LEU A 74 6.719 8.697 0.548 1.00 10.00 C ATOM 1040 CD1 LEU A 74 5.885 9.905 0.973 1.00 10.00 C ATOM 1041 CD2 LEU A 74 6.057 8.015 -0.651 1.00 10.00 C ATOM 0 H LEU A 74 9.146 9.004 2.416 1.00 10.00 H new ATOM 0 HA LEU A 74 8.713 7.000 0.338 1.00 10.00 H new ATOM 0 HB2 LEU A 74 8.429 10.025 0.713 1.00 10.00 H new ATOM 0 HB3 LEU A 74 8.251 9.295 -0.870 1.00 10.00 H new ATOM 0 HG LEU A 74 6.765 8.002 1.386 1.00 10.00 H new ATOM 0 HD11 LEU A 74 4.872 9.582 1.212 1.00 10.00 H new ATOM 0 HD12 LEU A 74 6.335 10.367 1.852 1.00 10.00 H new ATOM 0 HD13 LEU A 74 5.853 10.629 0.159 1.00 10.00 H new ATOM 0 HD21 LEU A 74 5.036 7.734 -0.392 1.00 10.00 H new ATOM 0 HD22 LEU A 74 6.041 8.702 -1.497 1.00 10.00 H new ATOM 0 HD23 LEU A 74 6.622 7.122 -0.919 1.00 10.00 H new ATOM 1053 N MET A 75 10.580 7.443 -1.280 1.00 10.00 N ATOM 1054 CA MET A 75 11.789 7.388 -2.095 1.00 10.00 C ATOM 1055 C MET A 75 11.546 7.771 -3.559 1.00 10.00 C ATOM 1056 O MET A 75 10.489 8.291 -3.912 1.00 10.00 O ATOM 1057 CB MET A 75 12.457 6.011 -1.975 1.00 10.00 C ATOM 1058 CG MET A 75 13.918 6.162 -1.529 1.00 10.00 C ATOM 1059 SD MET A 75 14.139 5.833 0.228 1.00 10.00 S ATOM 1060 CE MET A 75 15.614 6.781 0.628 1.00 10.00 C ATOM 0 H MET A 75 9.803 6.924 -1.689 1.00 10.00 H new ATOM 0 HA MET A 75 12.471 8.141 -1.701 1.00 10.00 H new ATOM 0 HB2 MET A 75 11.913 5.397 -1.257 1.00 10.00 H new ATOM 0 HB3 MET A 75 12.414 5.494 -2.934 1.00 10.00 H new ATOM 0 HG2 MET A 75 14.543 5.479 -2.105 1.00 10.00 H new ATOM 0 HG3 MET A 75 14.260 7.173 -1.752 1.00 10.00 H new ATOM 0 HE1 MET A 75 16.054 6.398 1.549 1.00 10.00 H new ATOM 0 HE2 MET A 75 16.336 6.691 -0.184 1.00 10.00 H new ATOM 0 HE3 MET A 75 15.347 7.829 0.762 1.00 10.00 H new ATOM 1070 N THR A 76 12.583 7.634 -4.392 1.00 10.00 N ATOM 1071 CA THR A 76 12.608 8.088 -5.766 1.00 10.00 C ATOM 1072 C THR A 76 13.708 7.326 -6.511 1.00 10.00 C ATOM 1073 O THR A 76 14.815 7.220 -5.990 1.00 10.00 O ATOM 1074 CB THR A 76 12.903 9.580 -5.678 1.00 10.00 C ATOM 1075 OG1 THR A 76 11.692 10.294 -5.537 1.00 10.00 O ATOM 1076 CG2 THR A 76 13.672 10.098 -6.875 1.00 10.00 C ATOM 0 H THR A 76 13.454 7.186 -4.107 1.00 10.00 H new ATOM 0 HA THR A 76 11.678 7.913 -6.307 1.00 10.00 H new ATOM 0 HB THR A 76 13.537 9.734 -4.804 1.00 10.00 H new ATOM 0 HG1 THR A 76 11.027 9.726 -5.094 1.00 10.00 H new ATOM 0 HG21 THR A 76 13.853 11.166 -6.757 1.00 10.00 H new ATOM 0 HG22 THR A 76 14.625 9.574 -6.949 1.00 10.00 H new ATOM 0 HG23 THR A 76 13.092 9.927 -7.782 1.00 10.00 H new ATOM 1084 N THR A 77 13.439 6.818 -7.714 1.00 10.00 N ATOM 1085 CA THR A 77 14.440 6.195 -8.576 1.00 10.00 C ATOM 1086 C THR A 77 15.068 7.185 -9.533 1.00 10.00 C ATOM 1087 O THR A 77 14.916 8.404 -9.419 1.00 10.00 O ATOM 1088 CB THR A 77 13.979 4.888 -9.266 1.00 10.00 C ATOM 1089 OG1 THR A 77 15.098 4.143 -9.713 1.00 10.00 O ATOM 1090 CG2 THR A 77 13.034 5.109 -10.437 1.00 10.00 C ATOM 0 H THR A 77 12.504 6.829 -8.122 1.00 10.00 H new ATOM 0 HA THR A 77 15.229 5.867 -7.899 1.00 10.00 H new ATOM 0 HB THR A 77 13.425 4.337 -8.506 1.00 10.00 H new ATOM 0 HG1 THR A 77 14.898 3.185 -9.655 1.00 10.00 H new ATOM 0 HG21 THR A 77 12.756 4.147 -10.867 1.00 10.00 H new ATOM 0 HG22 THR A 77 12.138 5.623 -10.089 1.00 10.00 H new ATOM 0 HG23 THR A 77 13.529 5.716 -11.195 1.00 10.00 H new ATOM 1098 N THR A 78 15.890 6.630 -10.414 1.00 10.00 N ATOM 1099 CA THR A 78 16.838 7.358 -11.208 1.00 10.00 C ATOM 1100 C THR A 78 16.077 7.976 -12.387 1.00 10.00 C ATOM 1101 O THR A 78 16.182 7.503 -13.517 1.00 10.00 O ATOM 1102 CB THR A 78 17.959 6.401 -11.642 1.00 10.00 C ATOM 1103 OG1 THR A 78 18.464 5.726 -10.504 1.00 10.00 O ATOM 1104 CG2 THR A 78 19.121 7.164 -12.287 1.00 10.00 C ATOM 0 H THR A 78 15.906 5.626 -10.592 1.00 10.00 H new ATOM 0 HA THR A 78 17.314 8.167 -10.654 1.00 10.00 H new ATOM 0 HB THR A 78 17.540 5.701 -12.365 1.00 10.00 H new ATOM 0 HG1 THR A 78 19.178 5.113 -10.777 1.00 10.00 H new ATOM 0 HG21 THR A 78 19.899 6.460 -12.584 1.00 10.00 H new ATOM 0 HG22 THR A 78 18.762 7.699 -13.166 1.00 10.00 H new ATOM 0 HG23 THR A 78 19.531 7.876 -11.571 1.00 10.00 H new ATOM 1112 N HIS A 79 15.277 9.004 -12.082 1.00 10.00 N ATOM 1113 CA HIS A 79 14.371 9.699 -12.988 1.00 10.00 C ATOM 1114 C HIS A 79 13.122 8.863 -13.279 1.00 10.00 C ATOM 1115 O HIS A 79 13.067 7.670 -12.976 1.00 10.00 O ATOM 1116 CB HIS A 79 15.077 10.184 -14.265 1.00 10.00 C ATOM 1117 CG HIS A 79 16.331 10.976 -13.992 1.00 10.00 C ATOM 1118 ND1 HIS A 79 17.626 10.453 -13.956 1.00 10.00 N ATOM 1119 CD2 HIS A 79 16.377 12.310 -13.706 1.00 10.00 C ATOM 1120 CE1 HIS A 79 18.422 11.486 -13.650 1.00 10.00 C ATOM 1121 NE2 HIS A 79 17.702 12.612 -13.493 1.00 10.00 N ATOM 0 H HIS A 79 15.247 9.392 -11.139 1.00 10.00 H new ATOM 0 HA HIS A 79 14.033 10.602 -12.479 1.00 10.00 H new ATOM 0 HB2 HIS A 79 15.328 9.321 -14.882 1.00 10.00 H new ATOM 0 HB3 HIS A 79 14.386 10.799 -14.842 1.00 10.00 H new ATOM 0 HD2 HIS A 79 15.541 12.992 -13.657 1.00 10.00 H new ATOM 0 HE1 HIS A 79 19.495 11.424 -13.544 1.00 10.00 H new ATOM 0 HE2 HIS A 79 18.075 13.532 -13.257 1.00 10.00 H new ATOM 1129 N SER A 80 12.096 9.515 -13.837 1.00 10.00 N ATOM 1130 CA SER A 80 10.795 8.943 -14.169 1.00 10.00 C ATOM 1131 C SER A 80 10.005 8.569 -12.910 1.00 10.00 C ATOM 1132 O SER A 80 8.989 9.193 -12.608 1.00 10.00 O ATOM 1133 CB SER A 80 10.932 7.779 -15.159 1.00 10.00 C ATOM 1134 OG SER A 80 11.650 8.215 -16.299 1.00 10.00 O ATOM 0 H SER A 80 12.158 10.504 -14.079 1.00 10.00 H new ATOM 0 HA SER A 80 10.210 9.710 -14.676 1.00 10.00 H new ATOM 0 HB2 SER A 80 11.450 6.944 -14.687 1.00 10.00 H new ATOM 0 HB3 SER A 80 9.946 7.418 -15.452 1.00 10.00 H new ATOM 0 HG SER A 80 11.740 7.473 -16.932 1.00 10.00 H new ATOM 1140 N GLY A 81 10.466 7.562 -12.167 1.00 10.00 N ATOM 1141 CA GLY A 81 9.928 7.271 -10.852 1.00 10.00 C ATOM 1142 C GLY A 81 10.511 8.297 -9.886 1.00 10.00 C ATOM 1143 O GLY A 81 11.584 8.096 -9.317 1.00 10.00 O ATOM 0 H GLY A 81 11.215 6.935 -12.462 1.00 10.00 H new ATOM 0 HA2 GLY A 81 8.839 7.327 -10.861 1.00 10.00 H new ATOM 0 HA3 GLY A 81 10.192 6.259 -10.544 1.00 10.00 H new ATOM 1147 N GLY A 82 9.834 9.439 -9.782 1.00 10.00 N ATOM 1148 CA GLY A 82 10.305 10.553 -8.978 1.00 10.00 C ATOM 1149 C GLY A 82 11.503 11.264 -9.620 1.00 10.00 C ATOM 1150 O GLY A 82 11.721 11.178 -10.828 1.00 10.00 O ATOM 0 H GLY A 82 8.946 9.613 -10.253 1.00 10.00 H new ATOM 0 HA2 GLY A 82 9.493 11.267 -8.838 1.00 10.00 H new ATOM 0 HA3 GLY A 82 10.586 10.192 -7.989 1.00 10.00 H new ATOM 1154 N MET A 83 12.246 12.018 -8.802 1.00 10.00 N ATOM 1155 CA MET A 83 13.234 12.993 -9.252 1.00 10.00 C ATOM 1156 C MET A 83 14.487 12.379 -9.894 1.00 10.00 C ATOM 1157 O MET A 83 14.690 12.546 -11.093 1.00 10.00 O ATOM 1158 CB MET A 83 13.623 13.935 -8.101 1.00 10.00 C ATOM 1159 CG MET A 83 12.444 14.776 -7.599 1.00 10.00 C ATOM 1160 SD MET A 83 12.894 15.961 -6.305 1.00 10.00 S ATOM 1161 CE MET A 83 11.296 16.758 -6.039 1.00 10.00 C ATOM 0 H MET A 83 12.172 11.963 -7.786 1.00 10.00 H new ATOM 0 HA MET A 83 12.747 13.559 -10.046 1.00 10.00 H new ATOM 0 HB2 MET A 83 14.022 13.347 -7.275 1.00 10.00 H new ATOM 0 HB3 MET A 83 14.421 14.598 -8.434 1.00 10.00 H new ATOM 0 HG2 MET A 83 12.011 15.317 -8.440 1.00 10.00 H new ATOM 0 HG3 MET A 83 11.671 14.110 -7.216 1.00 10.00 H new ATOM 0 HE1 MET A 83 11.394 17.521 -5.267 1.00 10.00 H new ATOM 0 HE2 MET A 83 10.962 17.222 -6.967 1.00 10.00 H new ATOM 0 HE3 MET A 83 10.566 16.013 -5.722 1.00 10.00 H new ATOM 1171 N ALA A 84 15.386 11.783 -9.099 1.00 10.00 N ATOM 1172 CA ALA A 84 16.771 11.547 -9.487 1.00 10.00 C ATOM 1173 C ALA A 84 17.501 10.828 -8.349 1.00 10.00 C ATOM 1174 O ALA A 84 18.420 11.369 -7.738 1.00 10.00 O ATOM 1175 CB ALA A 84 17.475 12.870 -9.830 1.00 10.00 C ATOM 0 H ALA A 84 15.164 11.450 -8.161 1.00 10.00 H new ATOM 0 HA ALA A 84 16.789 10.920 -10.378 1.00 10.00 H new ATOM 0 HB1 ALA A 84 18.507 12.669 -10.117 1.00 10.00 H new ATOM 0 HB2 ALA A 84 16.956 13.354 -10.657 1.00 10.00 H new ATOM 0 HB3 ALA A 84 17.461 13.526 -8.959 1.00 10.00 H new ATOM 1181 N GLY A 85 17.089 9.594 -8.079 1.00 10.00 N ATOM 1182 CA GLY A 85 17.842 8.645 -7.277 1.00 10.00 C ATOM 1183 C GLY A 85 17.403 8.569 -5.815 1.00 10.00 C ATOM 1184 O GLY A 85 16.599 9.382 -5.360 1.00 10.00 O ATOM 0 H GLY A 85 16.203 9.221 -8.420 1.00 10.00 H new ATOM 0 HA2 GLY A 85 17.749 7.655 -7.724 1.00 10.00 H new ATOM 0 HA3 GLY A 85 18.898 8.913 -7.314 1.00 10.00 H new ATOM 1188 N MET A 86 17.935 7.561 -5.104 1.00 10.00 N ATOM 1189 CA MET A 86 17.404 6.952 -3.878 1.00 10.00 C ATOM 1190 C MET A 86 17.575 7.836 -2.636 1.00 10.00 C ATOM 1191 O MET A 86 18.146 7.431 -1.627 1.00 10.00 O ATOM 1192 CB MET A 86 18.077 5.576 -3.713 1.00 10.00 C ATOM 1193 CG MET A 86 17.254 4.504 -2.980 1.00 10.00 C ATOM 1194 SD MET A 86 17.456 4.266 -1.188 1.00 10.00 S ATOM 1195 CE MET A 86 17.893 2.512 -1.155 1.00 10.00 C ATOM 0 H MET A 86 18.809 7.121 -5.393 1.00 10.00 H new ATOM 0 HA MET A 86 16.325 6.836 -3.975 1.00 10.00 H new ATOM 0 HB2 MET A 86 18.330 5.197 -4.703 1.00 10.00 H new ATOM 0 HB3 MET A 86 19.015 5.715 -3.176 1.00 10.00 H new ATOM 0 HG2 MET A 86 16.202 4.724 -3.161 1.00 10.00 H new ATOM 0 HG3 MET A 86 17.467 3.549 -3.459 1.00 10.00 H new ATOM 0 HE1 MET A 86 18.053 2.196 -0.124 1.00 10.00 H new ATOM 0 HE2 MET A 86 17.084 1.927 -1.592 1.00 10.00 H new ATOM 0 HE3 MET A 86 18.806 2.354 -1.729 1.00 10.00 H new ATOM 1205 N LYS A 87 17.045 9.049 -2.713 1.00 10.00 N ATOM 1206 CA LYS A 87 17.069 10.066 -1.678 1.00 10.00 C ATOM 1207 C LYS A 87 15.757 10.034 -0.896 1.00 10.00 C ATOM 1208 O LYS A 87 14.720 9.645 -1.435 1.00 10.00 O ATOM 1209 CB LYS A 87 17.307 11.435 -2.338 1.00 10.00 C ATOM 1210 CG LYS A 87 16.118 11.910 -3.196 1.00 10.00 C ATOM 1211 CD LYS A 87 16.555 12.858 -4.324 1.00 10.00 C ATOM 1212 CE LYS A 87 17.339 14.089 -3.847 1.00 10.00 C ATOM 1213 NZ LYS A 87 16.574 14.908 -2.884 1.00 10.00 N ATOM 0 H LYS A 87 16.558 9.365 -3.552 1.00 10.00 H new ATOM 0 HA LYS A 87 17.877 9.877 -0.971 1.00 10.00 H new ATOM 0 HB2 LYS A 87 17.506 12.175 -1.563 1.00 10.00 H new ATOM 0 HB3 LYS A 87 18.199 11.380 -2.963 1.00 10.00 H new ATOM 0 HG2 LYS A 87 15.615 11.044 -3.626 1.00 10.00 H new ATOM 0 HG3 LYS A 87 15.393 12.416 -2.559 1.00 10.00 H new ATOM 0 HD2 LYS A 87 17.170 12.302 -5.032 1.00 10.00 H new ATOM 0 HD3 LYS A 87 15.670 13.193 -4.865 1.00 10.00 H new ATOM 0 HE2 LYS A 87 18.271 13.765 -3.384 1.00 10.00 H new ATOM 0 HE3 LYS A 87 17.607 14.701 -4.708 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 17.146 15.726 -2.593 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 15.696 15.241 -3.332 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 16.340 14.334 -2.049 1.00 10.00 H new ATOM 1227 N MET A 88 15.779 10.510 0.351 1.00 10.00 N ATOM 1228 CA MET A 88 14.576 10.648 1.162 1.00 10.00 C ATOM 1229 C MET A 88 13.884 11.922 0.690 1.00 10.00 C ATOM 1230 O MET A 88 14.001 12.994 1.281 1.00 10.00 O ATOM 1231 CB MET A 88 14.940 10.690 2.652 1.00 10.00 C ATOM 1232 CG MET A 88 15.333 9.287 3.129 1.00 10.00 C ATOM 1233 SD MET A 88 15.852 9.115 4.857 1.00 10.00 S ATOM 1234 CE MET A 88 17.346 10.130 4.880 1.00 10.00 C ATOM 0 H MET A 88 16.632 10.809 0.823 1.00 10.00 H new ATOM 0 HA MET A 88 13.903 9.799 1.046 1.00 10.00 H new ATOM 0 HB2 MET A 88 15.765 11.384 2.815 1.00 10.00 H new ATOM 0 HB3 MET A 88 14.094 11.058 3.232 1.00 10.00 H new ATOM 0 HG2 MET A 88 14.484 8.624 2.964 1.00 10.00 H new ATOM 0 HG3 MET A 88 16.145 8.930 2.495 1.00 10.00 H new ATOM 0 HE1 MET A 88 17.854 10.007 5.836 1.00 10.00 H new ATOM 0 HE2 MET A 88 18.010 9.819 4.073 1.00 10.00 H new ATOM 0 HE3 MET A 88 17.076 11.177 4.744 1.00 10.00 H new ATOM 1244 N VAL A 89 13.238 11.793 -0.466 1.00 10.00 N ATOM 1245 CA VAL A 89 12.534 12.863 -1.140 1.00 10.00 C ATOM 1246 C VAL A 89 11.378 13.363 -0.251 1.00 10.00 C ATOM 1247 O VAL A 89 10.854 12.571 0.531 1.00 10.00 O ATOM 1248 CB VAL A 89 12.065 12.313 -2.507 1.00 10.00 C ATOM 1249 CG1 VAL A 89 10.973 11.244 -2.349 1.00 10.00 C ATOM 1250 CG2 VAL A 89 11.609 13.401 -3.484 1.00 10.00 C ATOM 0 H VAL A 89 13.193 10.908 -0.971 1.00 10.00 H new ATOM 0 HA VAL A 89 13.171 13.729 -1.318 1.00 10.00 H new ATOM 0 HB VAL A 89 12.949 11.849 -2.945 1.00 10.00 H new ATOM 0 HG11 VAL A 89 10.671 10.884 -3.333 1.00 10.00 H new ATOM 0 HG12 VAL A 89 11.361 10.412 -1.761 1.00 10.00 H new ATOM 0 HG13 VAL A 89 10.111 11.677 -1.841 1.00 10.00 H new ATOM 0 HG21 VAL A 89 11.295 12.940 -4.421 1.00 10.00 H new ATOM 0 HG22 VAL A 89 10.773 13.951 -3.052 1.00 10.00 H new ATOM 0 HG23 VAL A 89 12.434 14.087 -3.676 1.00 10.00 H new ATOM 1260 N PRO A 90 10.942 14.634 -0.374 1.00 10.00 N ATOM 1261 CA PRO A 90 9.671 15.112 0.166 1.00 10.00 C ATOM 1262 C PRO A 90 8.552 14.069 0.060 1.00 10.00 C ATOM 1263 O PRO A 90 7.894 13.750 1.047 1.00 10.00 O ATOM 1264 CB PRO A 90 9.348 16.411 -0.591 1.00 10.00 C ATOM 1265 CG PRO A 90 10.497 16.627 -1.577 1.00 10.00 C ATOM 1266 CD PRO A 90 11.613 15.728 -1.057 1.00 10.00 C ATOM 0 HA PRO A 90 9.752 15.299 1.237 1.00 10.00 H new ATOM 0 HB2 PRO A 90 8.396 16.330 -1.115 1.00 10.00 H new ATOM 0 HB3 PRO A 90 9.262 17.252 0.097 1.00 10.00 H new ATOM 0 HG2 PRO A 90 10.207 16.355 -2.592 1.00 10.00 H new ATOM 0 HG3 PRO A 90 10.807 17.672 -1.604 1.00 10.00 H new ATOM 0 HD2 PRO A 90 12.233 15.359 -1.874 1.00 10.00 H new ATOM 0 HD3 PRO A 90 12.270 16.271 -0.378 1.00 10.00 H new ATOM 1274 N TRP A 91 8.359 13.544 -1.149 1.00 10.00 N ATOM 1275 CA TRP A 91 7.413 12.523 -1.542 1.00 10.00 C ATOM 1276 C TRP A 91 7.658 12.319 -3.033 1.00 10.00 C ATOM 1277 O TRP A 91 8.440 13.058 -3.634 1.00 10.00 O ATOM 1278 CB TRP A 91 5.968 12.961 -1.281 1.00 10.00 C ATOM 1279 CG TRP A 91 5.557 14.211 -1.973 1.00 10.00 C ATOM 1280 CD1 TRP A 91 5.103 14.274 -3.240 1.00 10.00 C ATOM 1281 CD2 TRP A 91 5.630 15.583 -1.500 1.00 10.00 C ATOM 1282 NE1 TRP A 91 5.028 15.587 -3.627 1.00 10.00 N ATOM 1283 CE2 TRP A 91 5.347 16.442 -2.594 1.00 10.00 C ATOM 1284 CE3 TRP A 91 5.961 16.194 -0.274 1.00 10.00 C ATOM 1285 CZ2 TRP A 91 5.456 17.831 -2.491 1.00 10.00 C ATOM 1286 CZ3 TRP A 91 6.009 17.593 -0.141 1.00 10.00 C ATOM 1287 CH2 TRP A 91 5.777 18.415 -1.255 1.00 10.00 C ATOM 0 H TRP A 91 8.916 13.857 -1.944 1.00 10.00 H new ATOM 0 HA TRP A 91 7.550 11.606 -0.969 1.00 10.00 H new ATOM 0 HB2 TRP A 91 5.299 12.157 -1.588 1.00 10.00 H new ATOM 0 HB3 TRP A 91 5.833 13.096 -0.208 1.00 10.00 H new ATOM 0 HD1 TRP A 91 4.840 13.425 -3.853 1.00 10.00 H new ATOM 0 HE1 TRP A 91 4.768 15.894 -4.564 1.00 10.00 H new ATOM 0 HE3 TRP A 91 6.183 15.574 0.582 1.00 10.00 H new ATOM 0 HZ2 TRP A 91 5.294 18.453 -3.359 1.00 10.00 H new ATOM 0 HZ3 TRP A 91 6.225 18.036 0.820 1.00 10.00 H new ATOM 0 HH2 TRP A 91 5.845 19.489 -1.162 1.00 10.00 H new ATOM 1298 N LEU A 92 6.968 11.357 -3.631 1.00 10.00 N ATOM 1299 CA LEU A 92 7.039 11.138 -5.069 1.00 10.00 C ATOM 1300 C LEU A 92 5.831 11.786 -5.741 1.00 10.00 C ATOM 1301 O LEU A 92 4.732 11.234 -5.723 1.00 10.00 O ATOM 1302 CB LEU A 92 7.229 9.652 -5.411 1.00 10.00 C ATOM 1303 CG LEU A 92 6.270 8.675 -4.706 1.00 10.00 C ATOM 1304 CD1 LEU A 92 5.404 7.936 -5.727 1.00 10.00 C ATOM 1305 CD2 LEU A 92 7.078 7.646 -3.906 1.00 10.00 C ATOM 0 H LEU A 92 6.349 10.713 -3.139 1.00 10.00 H new ATOM 0 HA LEU A 92 7.927 11.624 -5.472 1.00 10.00 H new ATOM 0 HB2 LEU A 92 7.116 9.529 -6.488 1.00 10.00 H new ATOM 0 HB3 LEU A 92 8.252 9.369 -5.164 1.00 10.00 H new ATOM 0 HG LEU A 92 5.626 9.249 -4.039 1.00 10.00 H new ATOM 0 HD11 LEU A 92 4.734 7.251 -5.208 1.00 10.00 H new ATOM 0 HD12 LEU A 92 4.817 8.657 -6.296 1.00 10.00 H new ATOM 0 HD13 LEU A 92 6.043 7.373 -6.407 1.00 10.00 H new ATOM 0 HD21 LEU A 92 6.397 6.956 -3.408 1.00 10.00 H new ATOM 0 HD22 LEU A 92 7.729 7.090 -4.581 1.00 10.00 H new ATOM 0 HD23 LEU A 92 7.684 8.160 -3.159 1.00 10.00 H new ATOM 1317 N THR A 93 6.024 12.971 -6.331 1.00 10.00 N ATOM 1318 CA THR A 93 4.976 13.598 -7.123 1.00 10.00 C ATOM 1319 C THR A 93 4.927 12.875 -8.464 1.00 10.00 C ATOM 1320 O THR A 93 5.962 12.594 -9.064 1.00 10.00 O ATOM 1321 CB THR A 93 5.275 15.083 -7.382 1.00 10.00 C ATOM 1322 OG1 THR A 93 5.716 15.734 -6.213 1.00 10.00 O ATOM 1323 CG2 THR A 93 4.071 15.842 -7.949 1.00 10.00 C ATOM 0 H THR A 93 6.890 13.506 -6.272 1.00 10.00 H new ATOM 0 HA THR A 93 4.031 13.532 -6.583 1.00 10.00 H new ATOM 0 HB THR A 93 6.069 15.093 -8.129 1.00 10.00 H new ATOM 0 HG1 THR A 93 5.898 16.676 -6.412 1.00 10.00 H new ATOM 0 HG21 THR A 93 4.342 16.885 -8.111 1.00 10.00 H new ATOM 0 HG22 THR A 93 3.771 15.393 -8.896 1.00 10.00 H new ATOM 0 HG23 THR A 93 3.242 15.788 -7.243 1.00 10.00 H new ATOM 1331 N ILE A 94 3.713 12.594 -8.923 1.00 10.00 N ATOM 1332 CA ILE A 94 3.410 11.974 -10.194 1.00 10.00 C ATOM 1333 C ILE A 94 2.844 13.082 -11.093 1.00 10.00 C ATOM 1334 O ILE A 94 1.684 13.460 -10.933 1.00 10.00 O ATOM 1335 CB ILE A 94 2.475 10.769 -9.954 1.00 10.00 C ATOM 1336 CG1 ILE A 94 1.383 11.012 -8.894 1.00 10.00 C ATOM 1337 CG2 ILE A 94 3.349 9.585 -9.523 1.00 10.00 C ATOM 1338 CD1 ILE A 94 0.429 9.830 -8.705 1.00 10.00 C ATOM 0 H ILE A 94 2.873 12.807 -8.385 1.00 10.00 H new ATOM 0 HA ILE A 94 4.278 11.554 -10.703 1.00 10.00 H new ATOM 0 HB ILE A 94 1.941 10.579 -10.885 1.00 10.00 H new ATOM 0 HG12 ILE A 94 1.860 11.238 -7.940 1.00 10.00 H new ATOM 0 HG13 ILE A 94 0.805 11.891 -9.177 1.00 10.00 H new ATOM 0 HG21 ILE A 94 2.719 8.714 -9.344 1.00 10.00 H new ATOM 0 HG22 ILE A 94 4.068 9.358 -10.310 1.00 10.00 H new ATOM 0 HG23 ILE A 94 3.882 9.841 -8.607 1.00 10.00 H new ATOM 0 HD11 ILE A 94 -0.310 10.077 -7.943 1.00 10.00 H new ATOM 0 HD12 ILE A 94 -0.077 9.617 -9.647 1.00 10.00 H new ATOM 0 HD13 ILE A 94 0.994 8.953 -8.390 1.00 10.00 H new ATOM 1350 N PRO A 95 3.665 13.676 -11.980 1.00 10.00 N ATOM 1351 CA PRO A 95 3.398 14.974 -12.596 1.00 10.00 C ATOM 1352 C PRO A 95 2.421 14.859 -13.771 1.00 10.00 C ATOM 1353 O PRO A 95 2.720 15.307 -14.875 1.00 10.00 O ATOM 1354 CB PRO A 95 4.769 15.466 -13.066 1.00 10.00 C ATOM 1355 CG PRO A 95 5.491 14.171 -13.428 1.00 10.00 C ATOM 1356 CD PRO A 95 5.002 13.220 -12.339 1.00 10.00 C ATOM 0 HA PRO A 95 2.925 15.663 -11.896 1.00 10.00 H new ATOM 0 HB2 PRO A 95 4.686 16.135 -13.922 1.00 10.00 H new ATOM 0 HB3 PRO A 95 5.292 16.014 -12.282 1.00 10.00 H new ATOM 0 HG2 PRO A 95 5.225 13.821 -14.425 1.00 10.00 H new ATOM 0 HG3 PRO A 95 6.574 14.289 -13.410 1.00 10.00 H new ATOM 0 HD2 PRO A 95 4.980 12.192 -12.700 1.00 10.00 H new ATOM 0 HD3 PRO A 95 5.667 13.241 -11.475 1.00 10.00 H new ATOM 1364 N ALA A 96 1.261 14.238 -13.550 1.00 10.00 N ATOM 1365 CA ALA A 96 0.462 13.649 -14.606 1.00 10.00 C ATOM 1366 C ALA A 96 1.232 12.517 -15.297 1.00 10.00 C ATOM 1367 O ALA A 96 2.454 12.522 -15.411 1.00 10.00 O ATOM 1368 CB ALA A 96 -0.063 14.707 -15.578 1.00 10.00 C ATOM 0 H ALA A 96 0.853 14.133 -12.621 1.00 10.00 H new ATOM 0 HA ALA A 96 -0.425 13.199 -14.160 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -0.657 14.225 -16.355 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -0.684 15.422 -15.037 1.00 10.00 H new ATOM 0 HB3 ALA A 96 0.777 15.229 -16.036 1.00 10.00 H new ATOM 1374 N ARG A 97 0.497 11.480 -15.691 1.00 10.00 N ATOM 1375 CA ARG A 97 0.982 10.275 -16.362 1.00 10.00 C ATOM 1376 C ARG A 97 1.992 9.475 -15.536 1.00 10.00 C ATOM 1377 O ARG A 97 2.439 8.417 -15.973 1.00 10.00 O ATOM 1378 CB ARG A 97 1.476 10.609 -17.774 1.00 10.00 C ATOM 1379 CG ARG A 97 0.290 10.768 -18.733 1.00 10.00 C ATOM 1380 CD ARG A 97 -0.785 11.736 -18.251 1.00 10.00 C ATOM 1381 NE ARG A 97 -1.858 11.890 -19.239 1.00 10.00 N ATOM 1382 CZ ARG A 97 -2.131 12.969 -19.979 1.00 10.00 C ATOM 1383 NH1 ARG A 97 -1.175 13.855 -20.275 1.00 10.00 N ATOM 1384 NH2 ARG A 97 -3.392 13.130 -20.386 1.00 10.00 N ATOM 0 H ARG A 97 -0.512 11.456 -15.542 1.00 10.00 H new ATOM 0 HA ARG A 97 0.134 9.598 -16.463 1.00 10.00 H new ATOM 0 HB2 ARG A 97 2.061 11.529 -17.753 1.00 10.00 H new ATOM 0 HB3 ARG A 97 2.137 9.819 -18.131 1.00 10.00 H new ATOM 0 HG2 ARG A 97 0.663 11.110 -19.699 1.00 10.00 H new ATOM 0 HG3 ARG A 97 -0.165 9.791 -18.894 1.00 10.00 H new ATOM 0 HD2 ARG A 97 -1.204 11.376 -17.311 1.00 10.00 H new ATOM 0 HD3 ARG A 97 -0.335 12.708 -18.048 1.00 10.00 H new ATOM 0 HE ARG A 97 -2.465 11.082 -19.377 1.00 10.00 H new ATOM 0 HH11 ARG A 97 -0.224 13.712 -19.935 1.00 10.00 H new ATOM 0 HH12 ARG A 97 -1.396 14.674 -20.841 1.00 10.00 H new ATOM 0 HH21 ARG A 97 -4.102 12.444 -20.130 1.00 10.00 H new ATOM 0 HH22 ARG A 97 -3.646 13.939 -20.953 1.00 10.00 H new ATOM 1398 N GLY A 98 2.265 9.906 -14.306 1.00 10.00 N ATOM 1399 CA GLY A 98 3.143 9.223 -13.390 1.00 10.00 C ATOM 1400 C GLY A 98 2.562 7.849 -13.077 1.00 10.00 C ATOM 1401 O GLY A 98 1.501 7.744 -12.458 1.00 10.00 O ATOM 0 H GLY A 98 1.866 10.762 -13.920 1.00 10.00 H new ATOM 0 HA2 GLY A 98 4.137 9.121 -13.826 1.00 10.00 H new ATOM 0 HA3 GLY A 98 3.255 9.802 -12.473 1.00 10.00 H new ATOM 1405 N THR A 99 3.241 6.823 -13.585 1.00 10.00 N ATOM 1406 CA THR A 99 2.783 5.455 -13.704 1.00 10.00 C ATOM 1407 C THR A 99 4.039 4.610 -13.597 1.00 10.00 C ATOM 1408 O THR A 99 4.622 4.209 -14.602 1.00 10.00 O ATOM 1409 CB THR A 99 2.049 5.269 -15.041 1.00 10.00 C ATOM 1410 OG1 THR A 99 0.957 6.165 -15.085 1.00 10.00 O ATOM 1411 CG2 THR A 99 1.552 3.839 -15.277 1.00 10.00 C ATOM 0 H THR A 99 4.188 6.941 -13.946 1.00 10.00 H new ATOM 0 HA THR A 99 2.067 5.168 -12.934 1.00 10.00 H new ATOM 0 HB THR A 99 2.767 5.476 -15.835 1.00 10.00 H new ATOM 0 HG1 THR A 99 1.245 7.012 -15.486 1.00 10.00 H new ATOM 0 HG21 THR A 99 1.044 3.785 -16.240 1.00 10.00 H new ATOM 0 HG22 THR A 99 2.400 3.154 -15.275 1.00 10.00 H new ATOM 0 HG23 THR A 99 0.858 3.560 -14.484 1.00 10.00 H new ATOM 1419 N LEU A 100 4.519 4.476 -12.364 1.00 10.00 N ATOM 1420 CA LEU A 100 5.841 3.966 -12.066 1.00 10.00 C ATOM 1421 C LEU A 100 5.723 2.655 -11.286 1.00 10.00 C ATOM 1422 O LEU A 100 4.704 1.960 -11.341 1.00 10.00 O ATOM 1423 CB LEU A 100 6.645 5.070 -11.355 1.00 10.00 C ATOM 1424 CG LEU A 100 6.026 5.471 -10.005 1.00 10.00 C ATOM 1425 CD1 LEU A 100 7.109 5.613 -8.939 1.00 10.00 C ATOM 1426 CD2 LEU A 100 5.254 6.792 -10.113 1.00 10.00 C ATOM 0 H LEU A 100 3.984 4.726 -11.532 1.00 10.00 H new ATOM 0 HA LEU A 100 6.394 3.715 -12.971 1.00 10.00 H new ATOM 0 HB2 LEU A 100 7.667 4.725 -11.195 1.00 10.00 H new ATOM 0 HB3 LEU A 100 6.702 5.947 -12.000 1.00 10.00 H new ATOM 0 HG LEU A 100 5.332 4.680 -9.720 1.00 10.00 H new ATOM 0 HD11 LEU A 100 6.652 5.897 -7.991 1.00 10.00 H new ATOM 0 HD12 LEU A 100 7.630 4.663 -8.820 1.00 10.00 H new ATOM 0 HD13 LEU A 100 7.820 6.381 -9.243 1.00 10.00 H new ATOM 0 HD21 LEU A 100 4.830 7.046 -9.142 1.00 10.00 H new ATOM 0 HD22 LEU A 100 5.931 7.584 -10.431 1.00 10.00 H new ATOM 0 HD23 LEU A 100 4.452 6.686 -10.843 1.00 10.00 H new ATOM 1438 N THR A 101 6.779 2.289 -10.568 1.00 10.00 N ATOM 1439 CA THR A 101 6.883 1.022 -9.880 1.00 10.00 C ATOM 1440 C THR A 101 7.795 1.242 -8.687 1.00 10.00 C ATOM 1441 O THR A 101 8.943 1.649 -8.843 1.00 10.00 O ATOM 1442 CB THR A 101 7.382 -0.071 -10.836 1.00 10.00 C ATOM 1443 OG1 THR A 101 6.549 -0.113 -11.981 1.00 10.00 O ATOM 1444 CG2 THR A 101 7.346 -1.450 -10.172 1.00 10.00 C ATOM 0 H THR A 101 7.600 2.882 -10.450 1.00 10.00 H new ATOM 0 HA THR A 101 5.914 0.671 -9.525 1.00 10.00 H new ATOM 0 HB THR A 101 8.410 0.169 -11.108 1.00 10.00 H new ATOM 0 HG1 THR A 101 6.868 -0.809 -12.592 1.00 10.00 H new ATOM 0 HG21 THR A 101 7.705 -2.202 -10.875 1.00 10.00 H new ATOM 0 HG22 THR A 101 7.984 -1.445 -9.288 1.00 10.00 H new ATOM 0 HG23 THR A 101 6.323 -1.686 -9.880 1.00 10.00 H new ATOM 1452 N LEU A 102 7.237 1.024 -7.503 1.00 10.00 N ATOM 1453 CA LEU A 102 7.909 1.127 -6.233 1.00 10.00 C ATOM 1454 C LEU A 102 8.596 -0.217 -6.024 1.00 10.00 C ATOM 1455 O LEU A 102 7.941 -1.258 -6.072 1.00 10.00 O ATOM 1456 CB LEU A 102 6.868 1.425 -5.152 1.00 10.00 C ATOM 1457 CG LEU A 102 6.507 2.922 -5.095 1.00 10.00 C ATOM 1458 CD1 LEU A 102 5.794 3.409 -6.360 1.00 10.00 C ATOM 1459 CD2 LEU A 102 5.638 3.212 -3.870 1.00 10.00 C ATOM 0 H LEU A 102 6.257 0.758 -7.408 1.00 10.00 H new ATOM 0 HA LEU A 102 8.645 1.930 -6.193 1.00 10.00 H new ATOM 0 HB2 LEU A 102 5.968 0.842 -5.345 1.00 10.00 H new ATOM 0 HB3 LEU A 102 7.251 1.107 -4.182 1.00 10.00 H new ATOM 0 HG LEU A 102 7.448 3.468 -5.022 1.00 10.00 H new ATOM 0 HD11 LEU A 102 5.565 4.470 -6.263 1.00 10.00 H new ATOM 0 HD12 LEU A 102 6.440 3.255 -7.224 1.00 10.00 H new ATOM 0 HD13 LEU A 102 4.869 2.849 -6.495 1.00 10.00 H new ATOM 0 HD21 LEU A 102 5.391 4.273 -3.842 1.00 10.00 H new ATOM 0 HD22 LEU A 102 4.720 2.627 -3.928 1.00 10.00 H new ATOM 0 HD23 LEU A 102 6.183 2.943 -2.965 1.00 10.00 H new ATOM 1471 N GLN A 103 9.918 -0.194 -5.879 1.00 10.00 N ATOM 1472 CA GLN A 103 10.799 -1.322 -6.095 1.00 10.00 C ATOM 1473 C GLN A 103 12.067 -1.103 -5.275 1.00 10.00 C ATOM 1474 O GLN A 103 12.430 0.034 -4.977 1.00 10.00 O ATOM 1475 CB GLN A 103 11.107 -1.412 -7.598 1.00 10.00 C ATOM 1476 CG GLN A 103 11.710 -0.110 -8.154 1.00 10.00 C ATOM 1477 CD GLN A 103 11.791 -0.120 -9.676 1.00 10.00 C ATOM 1478 OE1 GLN A 103 10.974 -0.736 -10.354 1.00 10.00 O ATOM 1479 NE2 GLN A 103 12.788 0.554 -10.232 1.00 10.00 N ATOM 0 H GLN A 103 10.418 0.649 -5.596 1.00 10.00 H new ATOM 0 HA GLN A 103 10.341 -2.259 -5.779 1.00 10.00 H new ATOM 0 HB2 GLN A 103 11.800 -2.234 -7.775 1.00 10.00 H new ATOM 0 HB3 GLN A 103 10.191 -1.645 -8.140 1.00 10.00 H new ATOM 0 HG2 GLN A 103 11.105 0.737 -7.829 1.00 10.00 H new ATOM 0 HG3 GLN A 103 12.708 0.033 -7.739 1.00 10.00 H new ATOM 0 HE21 GLN A 103 13.453 1.057 -9.645 1.00 10.00 H new ATOM 0 HE22 GLN A 103 12.890 0.569 -11.247 1.00 10.00 H new ATOM 1488 N ARG A 104 12.768 -2.179 -4.912 1.00 10.00 N ATOM 1489 CA ARG A 104 13.920 -2.095 -4.019 1.00 10.00 C ATOM 1490 C ARG A 104 15.182 -1.650 -4.777 1.00 10.00 C ATOM 1491 O ARG A 104 16.225 -2.295 -4.674 1.00 10.00 O ATOM 1492 CB ARG A 104 14.100 -3.435 -3.281 1.00 10.00 C ATOM 1493 CG ARG A 104 14.781 -3.249 -1.913 1.00 10.00 C ATOM 1494 CD ARG A 104 16.094 -4.024 -1.772 1.00 10.00 C ATOM 1495 NE ARG A 104 15.887 -5.482 -1.706 1.00 10.00 N ATOM 1496 CZ ARG A 104 16.810 -6.349 -1.255 1.00 10.00 C ATOM 1497 NH1 ARG A 104 17.995 -5.900 -0.836 1.00 10.00 N ATOM 1498 NH2 ARG A 104 16.566 -7.657 -1.213 1.00 10.00 N ATOM 0 H ARG A 104 12.554 -3.125 -5.227 1.00 10.00 H new ATOM 0 HA ARG A 104 13.741 -1.327 -3.266 1.00 10.00 H new ATOM 0 HB2 ARG A 104 13.127 -3.906 -3.141 1.00 10.00 H new ATOM 0 HB3 ARG A 104 14.696 -4.110 -3.895 1.00 10.00 H new ATOM 0 HG2 ARG A 104 14.976 -2.188 -1.755 1.00 10.00 H new ATOM 0 HG3 ARG A 104 14.095 -3.567 -1.128 1.00 10.00 H new ATOM 0 HD2 ARG A 104 16.742 -3.791 -2.617 1.00 10.00 H new ATOM 0 HD3 ARG A 104 16.612 -3.693 -0.872 1.00 10.00 H new ATOM 0 HE ARG A 104 14.991 -5.855 -2.021 1.00 10.00 H new ATOM 0 HH11 ARG A 104 18.199 -4.901 -0.858 1.00 10.00 H new ATOM 0 HH12 ARG A 104 18.697 -6.556 -0.493 1.00 10.00 H new ATOM 0 HH21 ARG A 104 15.665 -8.018 -1.527 1.00 10.00 H new ATOM 0 HH22 ARG A 104 17.280 -8.298 -0.867 1.00 10.00 H new ATOM 1512 N ASP A 105 15.074 -0.551 -5.529 1.00 10.00 N ATOM 1513 CA ASP A 105 16.137 0.056 -6.319 1.00 10.00 C ATOM 1514 C ASP A 105 16.257 1.514 -5.871 1.00 10.00 C ATOM 1515 O ASP A 105 17.203 1.868 -5.174 1.00 10.00 O ATOM 1516 CB ASP A 105 15.876 -0.167 -7.829 1.00 10.00 C ATOM 1517 CG ASP A 105 15.795 1.103 -8.666 1.00 10.00 C ATOM 1518 OD1 ASP A 105 14.685 1.687 -8.697 1.00 10.00 O ATOM 1519 OD2 ASP A 105 16.834 1.516 -9.208 1.00 10.00 O ATOM 0 H ASP A 105 14.196 -0.038 -5.604 1.00 10.00 H new ATOM 0 HA ASP A 105 17.109 -0.409 -6.153 1.00 10.00 H new ATOM 0 HB2 ASP A 105 16.670 -0.797 -8.230 1.00 10.00 H new ATOM 0 HB3 ASP A 105 14.943 -0.719 -7.943 1.00 10.00 H new ATOM 1524 N GLY A 106 15.269 2.341 -6.217 1.00 10.00 N ATOM 1525 CA GLY A 106 15.346 3.786 -6.133 1.00 10.00 C ATOM 1526 C GLY A 106 14.028 4.357 -5.618 1.00 10.00 C ATOM 1527 O GLY A 106 14.019 5.027 -4.588 1.00 10.00 O ATOM 0 H GLY A 106 14.373 2.007 -6.572 1.00 10.00 H new ATOM 0 HA2 GLY A 106 16.160 4.076 -5.469 1.00 10.00 H new ATOM 0 HA3 GLY A 106 15.572 4.203 -7.115 1.00 10.00 H new ATOM 1531 N ASP A 107 12.907 4.050 -6.279 1.00 10.00 N ATOM 1532 CA ASP A 107 11.581 4.588 -5.983 1.00 10.00 C ATOM 1533 C ASP A 107 10.844 3.548 -5.172 1.00 10.00 C ATOM 1534 O ASP A 107 10.916 2.381 -5.536 1.00 10.00 O ATOM 1535 CB ASP A 107 10.794 4.868 -7.266 1.00 10.00 C ATOM 1536 CG ASP A 107 9.594 5.742 -6.946 1.00 10.00 C ATOM 1537 OD1 ASP A 107 8.729 5.257 -6.190 1.00 10.00 O ATOM 1538 OD2 ASP A 107 9.579 6.885 -7.445 1.00 10.00 O ATOM 0 H ASP A 107 12.901 3.397 -7.062 1.00 10.00 H new ATOM 0 HA ASP A 107 11.683 5.528 -5.441 1.00 10.00 H new ATOM 0 HB2 ASP A 107 11.434 5.364 -7.996 1.00 10.00 H new ATOM 0 HB3 ASP A 107 10.465 3.931 -7.715 1.00 10.00 H new ATOM 1543 N HIS A 108 10.262 3.917 -4.034 1.00 10.00 N ATOM 1544 CA HIS A 108 9.638 2.997 -3.099 1.00 10.00 C ATOM 1545 C HIS A 108 9.134 3.800 -1.903 1.00 10.00 C ATOM 1546 O HIS A 108 9.338 5.014 -1.834 1.00 10.00 O ATOM 1547 CB HIS A 108 10.589 1.852 -2.684 1.00 10.00 C ATOM 1548 CG HIS A 108 12.021 2.254 -2.421 1.00 10.00 C ATOM 1549 ND1 HIS A 108 12.968 2.525 -3.376 1.00 10.00 N ATOM 1550 CD2 HIS A 108 12.665 2.214 -1.219 1.00 10.00 C ATOM 1551 CE1 HIS A 108 14.153 2.631 -2.768 1.00 10.00 C ATOM 1552 NE2 HIS A 108 14.029 2.493 -1.431 1.00 10.00 N ATOM 0 H HIS A 108 10.212 4.890 -3.733 1.00 10.00 H new ATOM 0 HA HIS A 108 8.794 2.503 -3.581 1.00 10.00 H new ATOM 0 HB2 HIS A 108 10.192 1.382 -1.784 1.00 10.00 H new ATOM 0 HB3 HIS A 108 10.581 1.095 -3.469 1.00 10.00 H new ATOM 0 HD2 HIS A 108 12.206 2.004 -0.264 1.00 10.00 H new ATOM 0 HE1 HIS A 108 15.088 2.804 -3.280 1.00 10.00 H new ATOM 0 HE2 HIS A 108 14.763 2.573 -0.728 1.00 10.00 H new ATOM 1560 N VAL A 109 8.514 3.108 -0.946 1.00 10.00 N ATOM 1561 CA VAL A 109 8.366 3.585 0.415 1.00 10.00 C ATOM 1562 C VAL A 109 9.279 2.680 1.226 1.00 10.00 C ATOM 1563 O VAL A 109 9.082 1.464 1.192 1.00 10.00 O ATOM 1564 CB VAL A 109 6.908 3.449 0.892 1.00 10.00 C ATOM 1565 CG1 VAL A 109 6.778 3.872 2.363 1.00 10.00 C ATOM 1566 CG2 VAL A 109 5.963 4.321 0.060 1.00 10.00 C ATOM 0 H VAL A 109 8.098 2.190 -1.104 1.00 10.00 H new ATOM 0 HA VAL A 109 8.620 4.640 0.515 1.00 10.00 H new ATOM 0 HB VAL A 109 6.633 2.401 0.774 1.00 10.00 H new ATOM 0 HG11 VAL A 109 5.741 3.769 2.681 1.00 10.00 H new ATOM 0 HG12 VAL A 109 7.412 3.237 2.982 1.00 10.00 H new ATOM 0 HG13 VAL A 109 7.089 4.911 2.472 1.00 10.00 H new ATOM 0 HG21 VAL A 109 4.942 4.201 0.423 1.00 10.00 H new ATOM 0 HG22 VAL A 109 6.259 5.366 0.149 1.00 10.00 H new ATOM 0 HG23 VAL A 109 6.014 4.017 -0.986 1.00 10.00 H new ATOM 1576 N MET A 110 10.250 3.250 1.947 1.00 10.00 N ATOM 1577 CA MET A 110 10.950 2.522 2.983 1.00 10.00 C ATOM 1578 C MET A 110 10.079 2.579 4.232 1.00 10.00 C ATOM 1579 O MET A 110 10.013 3.578 4.944 1.00 10.00 O ATOM 1580 CB MET A 110 12.370 3.034 3.254 1.00 10.00 C ATOM 1581 CG MET A 110 13.231 2.963 1.998 1.00 10.00 C ATOM 1582 SD MET A 110 14.984 3.364 2.203 1.00 10.00 S ATOM 1583 CE MET A 110 15.619 1.767 2.759 1.00 10.00 C ATOM 0 H MET A 110 10.561 4.214 1.824 1.00 10.00 H new ATOM 0 HA MET A 110 11.102 1.494 2.654 1.00 10.00 H new ATOM 0 HB2 MET A 110 12.326 4.063 3.610 1.00 10.00 H new ATOM 0 HB3 MET A 110 12.828 2.441 4.046 1.00 10.00 H new ATOM 0 HG2 MET A 110 13.156 1.956 1.589 1.00 10.00 H new ATOM 0 HG3 MET A 110 12.810 3.641 1.256 1.00 10.00 H new ATOM 0 HE1 MET A 110 16.693 1.842 2.932 1.00 10.00 H new ATOM 0 HE2 MET A 110 15.122 1.480 3.686 1.00 10.00 H new ATOM 0 HE3 MET A 110 15.426 1.013 1.996 1.00 10.00 H new ATOM 1593 N LEU A 111 9.407 1.465 4.472 1.00 10.00 N ATOM 1594 CA LEU A 111 8.637 1.159 5.657 1.00 10.00 C ATOM 1595 C LEU A 111 9.637 0.753 6.745 1.00 10.00 C ATOM 1596 O LEU A 111 9.831 -0.430 7.016 1.00 10.00 O ATOM 1597 CB LEU A 111 7.674 0.013 5.285 1.00 10.00 C ATOM 1598 CG LEU A 111 6.525 0.469 4.369 1.00 10.00 C ATOM 1599 CD1 LEU A 111 5.720 -0.753 3.925 1.00 10.00 C ATOM 1600 CD2 LEU A 111 5.581 1.451 5.074 1.00 10.00 C ATOM 0 H LEU A 111 9.387 0.702 3.796 1.00 10.00 H new ATOM 0 HA LEU A 111 8.047 1.997 6.026 1.00 10.00 H new ATOM 0 HB2 LEU A 111 8.235 -0.779 4.789 1.00 10.00 H new ATOM 0 HB3 LEU A 111 7.257 -0.415 6.197 1.00 10.00 H new ATOM 0 HG LEU A 111 6.967 0.979 3.513 1.00 10.00 H new ATOM 0 HD11 LEU A 111 4.904 -0.435 3.276 1.00 10.00 H new ATOM 0 HD12 LEU A 111 6.370 -1.439 3.382 1.00 10.00 H new ATOM 0 HD13 LEU A 111 5.311 -1.257 4.801 1.00 10.00 H new ATOM 0 HD21 LEU A 111 4.785 1.746 4.390 1.00 10.00 H new ATOM 0 HD22 LEU A 111 5.146 0.972 5.951 1.00 10.00 H new ATOM 0 HD23 LEU A 111 6.140 2.334 5.383 1.00 10.00 H new ATOM 1612 N MET A 112 10.303 1.748 7.344 1.00 10.00 N ATOM 1613 CA MET A 112 11.386 1.524 8.293 1.00 10.00 C ATOM 1614 C MET A 112 10.867 1.441 9.729 1.00 10.00 C ATOM 1615 O MET A 112 9.741 1.841 10.035 1.00 10.00 O ATOM 1616 CB MET A 112 12.443 2.628 8.150 1.00 10.00 C ATOM 1617 CG MET A 112 13.027 2.657 6.739 1.00 10.00 C ATOM 1618 SD MET A 112 14.250 3.953 6.399 1.00 10.00 S ATOM 1619 CE MET A 112 15.578 3.528 7.549 1.00 10.00 C ATOM 0 H MET A 112 10.100 2.734 7.179 1.00 10.00 H new ATOM 0 HA MET A 112 11.848 0.564 8.065 1.00 10.00 H new ATOM 0 HB2 MET A 112 11.996 3.595 8.381 1.00 10.00 H new ATOM 0 HB3 MET A 112 13.242 2.466 8.873 1.00 10.00 H new ATOM 0 HG2 MET A 112 13.490 1.690 6.541 1.00 10.00 H new ATOM 0 HG3 MET A 112 12.205 2.768 6.031 1.00 10.00 H new ATOM 0 HE1 MET A 112 16.415 4.212 7.407 1.00 10.00 H new ATOM 0 HE2 MET A 112 15.213 3.609 8.573 1.00 10.00 H new ATOM 0 HE3 MET A 112 15.909 2.506 7.361 1.00 10.00 H new ATOM 1629 N GLY A 113 11.717 0.950 10.630 1.00 10.00 N ATOM 1630 CA GLY A 113 11.411 0.899 12.049 1.00 10.00 C ATOM 1631 C GLY A 113 10.251 -0.055 12.330 1.00 10.00 C ATOM 1632 O GLY A 113 9.162 0.379 12.696 1.00 10.00 O ATOM 0 H GLY A 113 12.636 0.578 10.391 1.00 10.00 H new ATOM 0 HA2 GLY A 113 12.293 0.576 12.603 1.00 10.00 H new ATOM 0 HA3 GLY A 113 11.159 1.898 12.405 1.00 10.00 H new ATOM 1636 N LEU A 114 10.490 -1.356 12.168 1.00 10.00 N ATOM 1637 CA LEU A 114 9.577 -2.422 12.571 1.00 10.00 C ATOM 1638 C LEU A 114 9.058 -2.172 13.990 1.00 10.00 C ATOM 1639 O LEU A 114 9.854 -1.867 14.876 1.00 10.00 O ATOM 1640 CB LEU A 114 10.360 -3.742 12.533 1.00 10.00 C ATOM 1641 CG LEU A 114 9.589 -4.985 12.999 1.00 10.00 C ATOM 1642 CD1 LEU A 114 8.581 -5.417 11.936 1.00 10.00 C ATOM 1643 CD2 LEU A 114 10.578 -6.130 13.243 1.00 10.00 C ATOM 0 H LEU A 114 11.348 -1.706 11.741 1.00 10.00 H new ATOM 0 HA LEU A 114 8.720 -2.458 11.898 1.00 10.00 H new ATOM 0 HB2 LEU A 114 10.703 -3.911 11.512 1.00 10.00 H new ATOM 0 HB3 LEU A 114 11.249 -3.634 13.154 1.00 10.00 H new ATOM 0 HG LEU A 114 9.056 -4.744 13.918 1.00 10.00 H new ATOM 0 HD11 LEU A 114 8.043 -6.299 12.282 1.00 10.00 H new ATOM 0 HD12 LEU A 114 7.873 -4.608 11.756 1.00 10.00 H new ATOM 0 HD13 LEU A 114 9.107 -5.652 11.011 1.00 10.00 H new ATOM 0 HD21 LEU A 114 10.035 -7.015 13.574 1.00 10.00 H new ATOM 0 HD22 LEU A 114 11.109 -6.355 12.318 1.00 10.00 H new ATOM 0 HD23 LEU A 114 11.294 -5.835 14.010 1.00 10.00 H new ATOM 1655 N LYS A 115 7.747 -2.334 14.208 1.00 10.00 N ATOM 1656 CA LYS A 115 7.147 -2.301 15.539 1.00 10.00 C ATOM 1657 C LYS A 115 6.452 -3.624 15.876 1.00 10.00 C ATOM 1658 O LYS A 115 6.817 -4.287 16.842 1.00 10.00 O ATOM 1659 CB LYS A 115 6.251 -1.065 15.702 1.00 10.00 C ATOM 1660 CG LYS A 115 5.104 -0.892 14.697 1.00 10.00 C ATOM 1661 CD LYS A 115 4.906 0.588 14.330 1.00 10.00 C ATOM 1662 CE LYS A 115 3.608 0.729 13.527 1.00 10.00 C ATOM 1663 NZ LYS A 115 3.392 2.067 12.933 1.00 10.00 N ATOM 0 H LYS A 115 7.073 -2.492 13.459 1.00 10.00 H new ATOM 0 HA LYS A 115 7.940 -2.198 16.280 1.00 10.00 H new ATOM 0 HB2 LYS A 115 5.822 -1.089 16.704 1.00 10.00 H new ATOM 0 HB3 LYS A 115 6.884 -0.179 15.648 1.00 10.00 H new ATOM 0 HG2 LYS A 115 5.316 -1.468 13.796 1.00 10.00 H new ATOM 0 HG3 LYS A 115 4.182 -1.291 15.121 1.00 10.00 H new ATOM 0 HD2 LYS A 115 4.859 1.198 15.232 1.00 10.00 H new ATOM 0 HD3 LYS A 115 5.752 0.948 13.745 1.00 10.00 H new ATOM 0 HE2 LYS A 115 3.608 -0.013 12.728 1.00 10.00 H new ATOM 0 HE3 LYS A 115 2.766 0.495 14.179 1.00 10.00 H new ATOM 0 HZ1 LYS A 115 2.656 2.007 12.200 1.00 10.00 H new ATOM 0 HZ2 LYS A 115 3.089 2.731 13.674 1.00 10.00 H new ATOM 0 HZ3 LYS A 115 4.278 2.405 12.507 1.00 10.00 H new ATOM 1677 N ARG A 116 5.451 -4.012 15.084 1.00 10.00 N ATOM 1678 CA ARG A 116 4.752 -5.286 15.231 1.00 10.00 C ATOM 1679 C ARG A 116 5.404 -6.325 14.310 1.00 10.00 C ATOM 1680 O ARG A 116 5.838 -5.957 13.220 1.00 10.00 O ATOM 1681 CB ARG A 116 3.263 -5.103 14.899 1.00 10.00 C ATOM 1682 CG ARG A 116 2.530 -4.201 15.907 1.00 10.00 C ATOM 1683 CD ARG A 116 2.296 -4.900 17.257 1.00 10.00 C ATOM 1684 NE ARG A 116 1.684 -3.999 18.249 1.00 10.00 N ATOM 1685 CZ ARG A 116 0.376 -3.706 18.349 1.00 10.00 C ATOM 1686 NH1 ARG A 116 -0.486 -4.186 17.447 1.00 10.00 N ATOM 1687 NH2 ARG A 116 -0.059 -2.932 19.350 1.00 10.00 N ATOM 0 H ARG A 116 5.100 -3.442 14.314 1.00 10.00 H new ATOM 0 HA ARG A 116 4.825 -5.638 16.260 1.00 10.00 H new ATOM 0 HB2 ARG A 116 3.169 -4.675 13.901 1.00 10.00 H new ATOM 0 HB3 ARG A 116 2.779 -6.079 14.874 1.00 10.00 H new ATOM 0 HG2 ARG A 116 3.111 -3.293 16.067 1.00 10.00 H new ATOM 0 HG3 ARG A 116 1.571 -3.896 15.488 1.00 10.00 H new ATOM 0 HD2 ARG A 116 1.652 -5.767 17.109 1.00 10.00 H new ATOM 0 HD3 ARG A 116 3.246 -5.271 17.642 1.00 10.00 H new ATOM 0 HE ARG A 116 2.310 -3.557 18.922 1.00 10.00 H new ATOM 0 HH11 ARG A 116 -0.151 -4.774 16.684 1.00 10.00 H new ATOM 0 HH12 ARG A 116 -1.479 -3.964 17.522 1.00 10.00 H new ATOM 0 HH21 ARG A 116 0.602 -2.565 20.035 1.00 10.00 H new ATOM 0 HH22 ARG A 116 -1.051 -2.708 19.428 1.00 10.00 H new ATOM 1701 N PRO A 117 5.502 -7.599 14.730 1.00 10.00 N ATOM 1702 CA PRO A 117 6.167 -8.643 13.963 1.00 10.00 C ATOM 1703 C PRO A 117 5.387 -8.982 12.690 1.00 10.00 C ATOM 1704 O PRO A 117 4.199 -8.686 12.585 1.00 10.00 O ATOM 1705 CB PRO A 117 6.266 -9.845 14.908 1.00 10.00 C ATOM 1706 CG PRO A 117 5.059 -9.658 15.827 1.00 10.00 C ATOM 1707 CD PRO A 117 4.983 -8.139 15.977 1.00 10.00 C ATOM 0 HA PRO A 117 7.153 -8.327 13.622 1.00 10.00 H new ATOM 0 HB2 PRO A 117 6.219 -10.790 14.366 1.00 10.00 H new ATOM 0 HB3 PRO A 117 7.202 -9.844 15.466 1.00 10.00 H new ATOM 0 HG2 PRO A 117 4.149 -10.068 15.389 1.00 10.00 H new ATOM 0 HG3 PRO A 117 5.201 -10.153 16.788 1.00 10.00 H new ATOM 0 HD2 PRO A 117 3.957 -7.812 16.149 1.00 10.00 H new ATOM 0 HD3 PRO A 117 5.573 -7.799 16.828 1.00 10.00 H new ATOM 1715 N LEU A 118 6.080 -9.597 11.726 1.00 10.00 N ATOM 1716 CA LEU A 118 5.602 -9.846 10.369 1.00 10.00 C ATOM 1717 C LEU A 118 5.694 -11.337 10.030 1.00 10.00 C ATOM 1718 O LEU A 118 6.501 -12.053 10.621 1.00 10.00 O ATOM 1719 CB LEU A 118 6.481 -9.045 9.394 1.00 10.00 C ATOM 1720 CG LEU A 118 6.555 -7.543 9.711 1.00 10.00 C ATOM 1721 CD1 LEU A 118 7.493 -6.846 8.721 1.00 10.00 C ATOM 1722 CD2 LEU A 118 5.190 -6.851 9.672 1.00 10.00 C ATOM 0 H LEU A 118 7.026 -9.947 11.879 1.00 10.00 H new ATOM 0 HA LEU A 118 4.559 -9.539 10.288 1.00 10.00 H new ATOM 0 HB2 LEU A 118 7.489 -9.459 9.406 1.00 10.00 H new ATOM 0 HB3 LEU A 118 6.095 -9.174 8.383 1.00 10.00 H new ATOM 0 HG LEU A 118 6.935 -7.462 10.729 1.00 10.00 H new ATOM 0 HD11 LEU A 118 7.540 -5.782 8.952 1.00 10.00 H new ATOM 0 HD12 LEU A 118 8.490 -7.279 8.798 1.00 10.00 H new ATOM 0 HD13 LEU A 118 7.117 -6.981 7.707 1.00 10.00 H new ATOM 0 HD21 LEU A 118 5.312 -5.793 9.905 1.00 10.00 H new ATOM 0 HD22 LEU A 118 4.757 -6.956 8.677 1.00 10.00 H new ATOM 0 HD23 LEU A 118 4.528 -7.310 10.406 1.00 10.00 H new ATOM 1734 N LYS A 119 4.892 -11.799 9.062 1.00 10.00 N ATOM 1735 CA LYS A 119 4.978 -13.132 8.476 1.00 10.00 C ATOM 1736 C LYS A 119 4.886 -13.010 6.952 1.00 10.00 C ATOM 1737 O LYS A 119 4.157 -12.158 6.443 1.00 10.00 O ATOM 1738 CB LYS A 119 3.851 -14.046 8.997 1.00 10.00 C ATOM 1739 CG LYS A 119 4.195 -14.797 10.293 1.00 10.00 C ATOM 1740 CD LYS A 119 3.988 -13.993 11.588 1.00 10.00 C ATOM 1741 CE LYS A 119 2.713 -14.388 12.352 1.00 10.00 C ATOM 1742 NZ LYS A 119 1.497 -13.758 11.801 1.00 10.00 N ATOM 0 H LYS A 119 4.145 -11.235 8.657 1.00 10.00 H new ATOM 0 HA LYS A 119 5.929 -13.580 8.762 1.00 10.00 H new ATOM 0 HB2 LYS A 119 2.959 -13.443 9.166 1.00 10.00 H new ATOM 0 HB3 LYS A 119 3.602 -14.773 8.224 1.00 10.00 H new ATOM 0 HG2 LYS A 119 3.587 -15.700 10.343 1.00 10.00 H new ATOM 0 HG3 LYS A 119 5.236 -15.116 10.244 1.00 10.00 H new ATOM 0 HD2 LYS A 119 4.851 -14.135 12.238 1.00 10.00 H new ATOM 0 HD3 LYS A 119 3.944 -12.931 11.345 1.00 10.00 H new ATOM 0 HE2 LYS A 119 2.599 -15.472 12.324 1.00 10.00 H new ATOM 0 HE3 LYS A 119 2.820 -14.105 13.399 1.00 10.00 H new ATOM 0 HZ1 LYS A 119 0.667 -14.072 12.343 1.00 10.00 H new ATOM 0 HZ2 LYS A 119 1.582 -12.724 11.866 1.00 10.00 H new ATOM 0 HZ3 LYS A 119 1.384 -14.034 10.805 1.00 10.00 H new ATOM 1756 N VAL A 120 5.614 -13.875 6.236 1.00 10.00 N ATOM 1757 CA VAL A 120 5.689 -13.924 4.778 1.00 10.00 C ATOM 1758 C VAL A 120 4.372 -14.499 4.235 1.00 10.00 C ATOM 1759 O VAL A 120 4.317 -15.612 3.708 1.00 10.00 O ATOM 1760 CB VAL A 120 6.924 -14.760 4.368 1.00 10.00 C ATOM 1761 CG1 VAL A 120 7.182 -14.730 2.854 1.00 10.00 C ATOM 1762 CG2 VAL A 120 8.193 -14.247 5.064 1.00 10.00 C ATOM 0 H VAL A 120 6.191 -14.590 6.680 1.00 10.00 H new ATOM 0 HA VAL A 120 5.813 -12.929 4.350 1.00 10.00 H new ATOM 0 HB VAL A 120 6.700 -15.782 4.674 1.00 10.00 H new ATOM 0 HG11 VAL A 120 8.060 -15.333 2.623 1.00 10.00 H new ATOM 0 HG12 VAL A 120 6.316 -15.134 2.329 1.00 10.00 H new ATOM 0 HG13 VAL A 120 7.353 -13.702 2.534 1.00 10.00 H new ATOM 0 HG21 VAL A 120 9.046 -14.853 4.758 1.00 10.00 H new ATOM 0 HG22 VAL A 120 8.367 -13.208 4.784 1.00 10.00 H new ATOM 0 HG23 VAL A 120 8.068 -14.316 6.145 1.00 10.00 H new ATOM 1772 N GLY A 121 3.280 -13.751 4.348 1.00 10.00 N ATOM 1773 CA GLY A 121 1.940 -14.307 4.292 1.00 10.00 C ATOM 1774 C GLY A 121 0.919 -13.454 5.036 1.00 10.00 C ATOM 1775 O GLY A 121 -0.275 -13.636 4.809 1.00 10.00 O ATOM 0 H GLY A 121 3.303 -12.740 4.481 1.00 10.00 H new ATOM 0 HA2 GLY A 121 1.635 -14.406 3.250 1.00 10.00 H new ATOM 0 HA3 GLY A 121 1.949 -15.310 4.718 1.00 10.00 H new ATOM 1779 N GLU A 122 1.349 -12.523 5.900 1.00 10.00 N ATOM 1780 CA GLU A 122 0.426 -11.580 6.482 1.00 10.00 C ATOM 1781 C GLU A 122 -0.104 -10.667 5.385 1.00 10.00 C ATOM 1782 O GLU A 122 0.239 -10.740 4.202 1.00 10.00 O ATOM 1783 CB GLU A 122 1.110 -10.732 7.571 1.00 10.00 C ATOM 1784 CG GLU A 122 0.303 -10.651 8.872 1.00 10.00 C ATOM 1785 CD GLU A 122 0.741 -11.725 9.851 1.00 10.00 C ATOM 1786 OE1 GLU A 122 0.512 -12.926 9.589 1.00 10.00 O ATOM 1787 OE2 GLU A 122 1.357 -11.372 10.881 1.00 10.00 O ATOM 0 H GLU A 122 2.318 -12.415 6.198 1.00 10.00 H new ATOM 0 HA GLU A 122 -0.392 -12.132 6.946 1.00 10.00 H new ATOM 0 HB2 GLU A 122 2.092 -11.153 7.786 1.00 10.00 H new ATOM 0 HB3 GLU A 122 1.272 -9.724 7.189 1.00 10.00 H new ATOM 0 HG2 GLU A 122 0.432 -9.667 9.324 1.00 10.00 H new ATOM 0 HG3 GLU A 122 -0.759 -10.764 8.653 1.00 10.00 H new ATOM 1794 N THR A 123 -0.916 -9.736 5.837 1.00 10.00 N ATOM 1795 CA THR A 123 -1.469 -8.654 5.047 1.00 10.00 C ATOM 1796 C THR A 123 -1.791 -7.536 6.026 1.00 10.00 C ATOM 1797 O THR A 123 -2.414 -7.794 7.055 1.00 10.00 O ATOM 1798 CB THR A 123 -2.698 -9.135 4.259 1.00 10.00 C ATOM 1799 OG1 THR A 123 -2.309 -10.075 3.275 1.00 10.00 O ATOM 1800 CG2 THR A 123 -3.401 -7.987 3.528 1.00 10.00 C ATOM 0 H THR A 123 -1.223 -9.710 6.809 1.00 10.00 H new ATOM 0 HA THR A 123 -0.768 -8.293 4.294 1.00 10.00 H new ATOM 0 HB THR A 123 -3.378 -9.575 4.988 1.00 10.00 H new ATOM 0 HG1 THR A 123 -1.361 -10.296 3.390 1.00 10.00 H new ATOM 0 HG21 THR A 123 -4.263 -8.375 2.985 1.00 10.00 H new ATOM 0 HG22 THR A 123 -3.733 -7.243 4.253 1.00 10.00 H new ATOM 0 HG23 THR A 123 -2.708 -7.525 2.825 1.00 10.00 H new ATOM 1808 N VAL A 124 -1.321 -6.321 5.742 1.00 10.00 N ATOM 1809 CA VAL A 124 -1.505 -5.169 6.615 1.00 10.00 C ATOM 1810 C VAL A 124 -2.013 -4.002 5.773 1.00 10.00 C ATOM 1811 O VAL A 124 -1.667 -3.880 4.600 1.00 10.00 O ATOM 1812 CB VAL A 124 -0.190 -4.835 7.342 1.00 10.00 C ATOM 1813 CG1 VAL A 124 -0.400 -3.697 8.349 1.00 10.00 C ATOM 1814 CG2 VAL A 124 0.353 -6.050 8.108 1.00 10.00 C ATOM 0 H VAL A 124 -0.798 -6.111 4.892 1.00 10.00 H new ATOM 0 HA VAL A 124 -2.242 -5.387 7.388 1.00 10.00 H new ATOM 0 HB VAL A 124 0.525 -4.536 6.576 1.00 10.00 H new ATOM 0 HG11 VAL A 124 0.542 -3.477 8.851 1.00 10.00 H new ATOM 0 HG12 VAL A 124 -0.748 -2.807 7.825 1.00 10.00 H new ATOM 0 HG13 VAL A 124 -1.144 -3.997 9.087 1.00 10.00 H new ATOM 0 HG21 VAL A 124 1.282 -5.779 8.609 1.00 10.00 H new ATOM 0 HG22 VAL A 124 -0.379 -6.370 8.849 1.00 10.00 H new ATOM 0 HG23 VAL A 124 0.542 -6.865 7.410 1.00 10.00 H new ATOM 1824 N ASN A 125 -2.859 -3.153 6.359 1.00 10.00 N ATOM 1825 CA ASN A 125 -3.402 -1.997 5.663 1.00 10.00 C ATOM 1826 C ASN A 125 -2.336 -0.907 5.570 1.00 10.00 C ATOM 1827 O ASN A 125 -1.704 -0.581 6.578 1.00 10.00 O ATOM 1828 CB ASN A 125 -4.639 -1.462 6.392 1.00 10.00 C ATOM 1829 CG ASN A 125 -5.785 -2.469 6.390 1.00 10.00 C ATOM 1830 OD1 ASN A 125 -6.337 -2.793 5.343 1.00 10.00 O ATOM 1831 ND2 ASN A 125 -6.155 -2.990 7.557 1.00 10.00 N ATOM 0 H ASN A 125 -3.182 -3.250 7.322 1.00 10.00 H new ATOM 0 HA ASN A 125 -3.699 -2.298 4.658 1.00 10.00 H new ATOM 0 HB2 ASN A 125 -4.375 -1.215 7.420 1.00 10.00 H new ATOM 0 HB3 ASN A 125 -4.968 -0.538 5.917 1.00 10.00 H new ATOM 0 HD21 ASN A 125 -6.911 -3.673 7.594 1.00 10.00 H new ATOM 0 HD22 ASN A 125 -5.682 -2.706 8.415 1.00 10.00 H new ATOM 1838 N ILE A 126 -2.158 -0.322 4.383 1.00 10.00 N ATOM 1839 CA ILE A 126 -1.444 0.932 4.202 1.00 10.00 C ATOM 1840 C ILE A 126 -2.484 2.031 4.005 1.00 10.00 C ATOM 1841 O ILE A 126 -3.377 1.913 3.163 1.00 10.00 O ATOM 1842 CB ILE A 126 -0.420 0.843 3.057 1.00 10.00 C ATOM 1843 CG1 ILE A 126 0.616 1.974 3.148 1.00 10.00 C ATOM 1844 CG2 ILE A 126 -1.079 0.838 1.679 1.00 10.00 C ATOM 1845 CD1 ILE A 126 1.631 1.894 2.003 1.00 10.00 C ATOM 0 H ILE A 126 -2.513 -0.716 3.512 1.00 10.00 H new ATOM 0 HA ILE A 126 -0.847 1.167 5.083 1.00 10.00 H new ATOM 0 HB ILE A 126 0.091 -0.112 3.176 1.00 10.00 H new ATOM 0 HG12 ILE A 126 0.108 2.938 3.120 1.00 10.00 H new ATOM 0 HG13 ILE A 126 1.137 1.916 4.103 1.00 10.00 H new ATOM 0 HG21 ILE A 126 -0.311 0.774 0.908 1.00 10.00 H new ATOM 0 HG22 ILE A 126 -1.747 -0.020 1.598 1.00 10.00 H new ATOM 0 HG23 ILE A 126 -1.651 1.756 1.546 1.00 10.00 H new ATOM 0 HD11 ILE A 126 2.350 2.708 2.096 1.00 10.00 H new ATOM 0 HD12 ILE A 126 2.156 0.940 2.048 1.00 10.00 H new ATOM 0 HD13 ILE A 126 1.111 1.977 1.049 1.00 10.00 H new ATOM 1857 N THR A 127 -2.379 3.081 4.813 1.00 10.00 N ATOM 1858 CA THR A 127 -3.301 4.196 4.832 1.00 10.00 C ATOM 1859 C THR A 127 -2.636 5.344 4.081 1.00 10.00 C ATOM 1860 O THR A 127 -1.731 5.997 4.607 1.00 10.00 O ATOM 1861 CB THR A 127 -3.665 4.575 6.279 1.00 10.00 C ATOM 1862 OG1 THR A 127 -3.610 3.448 7.130 1.00 10.00 O ATOM 1863 CG2 THR A 127 -5.072 5.172 6.342 1.00 10.00 C ATOM 0 H THR A 127 -1.624 3.176 5.492 1.00 10.00 H new ATOM 0 HA THR A 127 -4.241 3.939 4.344 1.00 10.00 H new ATOM 0 HB THR A 127 -2.937 5.313 6.614 1.00 10.00 H new ATOM 0 HG1 THR A 127 -2.674 3.221 7.313 1.00 10.00 H new ATOM 0 HG21 THR A 127 -5.311 5.433 7.373 1.00 10.00 H new ATOM 0 HG22 THR A 127 -5.116 6.067 5.721 1.00 10.00 H new ATOM 0 HG23 THR A 127 -5.794 4.442 5.977 1.00 10.00 H new ATOM 1871 N LEU A 128 -3.062 5.576 2.839 1.00 10.00 N ATOM 1872 CA LEU A 128 -2.545 6.670 2.038 1.00 10.00 C ATOM 1873 C LEU A 128 -3.301 7.930 2.453 1.00 10.00 C ATOM 1874 O LEU A 128 -4.524 7.976 2.334 1.00 10.00 O ATOM 1875 CB LEU A 128 -2.754 6.382 0.545 1.00 10.00 C ATOM 1876 CG LEU A 128 -1.606 6.900 -0.326 1.00 10.00 C ATOM 1877 CD1 LEU A 128 -1.993 6.698 -1.791 1.00 10.00 C ATOM 1878 CD2 LEU A 128 -1.326 8.388 -0.085 1.00 10.00 C ATOM 0 H LEU A 128 -3.770 5.012 2.369 1.00 10.00 H new ATOM 0 HA LEU A 128 -1.474 6.796 2.199 1.00 10.00 H new ATOM 0 HB2 LEU A 128 -2.859 5.307 0.398 1.00 10.00 H new ATOM 0 HB3 LEU A 128 -3.687 6.841 0.218 1.00 10.00 H new ATOM 0 HG LEU A 128 -0.701 6.348 -0.070 1.00 10.00 H new ATOM 0 HD11 LEU A 128 -1.190 7.060 -2.433 1.00 10.00 H new ATOM 0 HD12 LEU A 128 -2.159 5.638 -1.981 1.00 10.00 H new ATOM 0 HD13 LEU A 128 -2.907 7.252 -2.006 1.00 10.00 H new ATOM 0 HD21 LEU A 128 -0.504 8.712 -0.724 1.00 10.00 H new ATOM 0 HD22 LEU A 128 -2.218 8.969 -0.319 1.00 10.00 H new ATOM 0 HD23 LEU A 128 -1.056 8.543 0.960 1.00 10.00 H new ATOM 1890 N LYS A 129 -2.581 8.935 2.951 1.00 10.00 N ATOM 1891 CA LYS A 129 -3.114 10.215 3.388 1.00 10.00 C ATOM 1892 C LYS A 129 -2.275 11.302 2.730 1.00 10.00 C ATOM 1893 O LYS A 129 -1.334 11.819 3.322 1.00 10.00 O ATOM 1894 CB LYS A 129 -3.081 10.319 4.919 1.00 10.00 C ATOM 1895 CG LYS A 129 -4.237 9.540 5.556 1.00 10.00 C ATOM 1896 CD LYS A 129 -4.189 9.709 7.082 1.00 10.00 C ATOM 1897 CE LYS A 129 -5.435 9.150 7.786 1.00 10.00 C ATOM 1898 NZ LYS A 129 -6.648 9.955 7.524 1.00 10.00 N ATOM 0 H LYS A 129 -1.569 8.872 3.064 1.00 10.00 H new ATOM 0 HA LYS A 129 -4.158 10.325 3.094 1.00 10.00 H new ATOM 0 HB2 LYS A 129 -2.132 9.934 5.291 1.00 10.00 H new ATOM 0 HB3 LYS A 129 -3.138 11.366 5.216 1.00 10.00 H new ATOM 0 HG2 LYS A 129 -5.190 9.901 5.169 1.00 10.00 H new ATOM 0 HG3 LYS A 129 -4.166 8.484 5.294 1.00 10.00 H new ATOM 0 HD2 LYS A 129 -3.303 9.207 7.470 1.00 10.00 H new ATOM 0 HD3 LYS A 129 -4.087 10.767 7.322 1.00 10.00 H new ATOM 0 HE2 LYS A 129 -5.605 8.126 7.455 1.00 10.00 H new ATOM 0 HE3 LYS A 129 -5.254 9.112 8.860 1.00 10.00 H new ATOM 0 HZ1 LYS A 129 -7.439 9.585 8.089 1.00 10.00 H new ATOM 0 HZ2 LYS A 129 -6.470 10.946 7.785 1.00 10.00 H new ATOM 0 HZ3 LYS A 129 -6.889 9.901 6.514 1.00 10.00 H new ATOM 1912 N ALA A 130 -2.606 11.616 1.481 1.00 10.00 N ATOM 1913 CA ALA A 130 -1.863 12.578 0.691 1.00 10.00 C ATOM 1914 C ALA A 130 -2.319 13.994 1.028 1.00 10.00 C ATOM 1915 O ALA A 130 -3.483 14.206 1.371 1.00 10.00 O ATOM 1916 CB ALA A 130 -2.136 12.289 -0.785 1.00 10.00 C ATOM 0 H ALA A 130 -3.401 11.206 0.991 1.00 10.00 H new ATOM 0 HA ALA A 130 -0.798 12.497 0.906 1.00 10.00 H new ATOM 0 HB1 ALA A 130 -1.588 13.000 -1.403 1.00 10.00 H new ATOM 0 HB2 ALA A 130 -1.812 11.276 -1.023 1.00 10.00 H new ATOM 0 HB3 ALA A 130 -3.204 12.384 -0.983 1.00 10.00 H new ATOM 1922 N THR A 131 -1.438 14.978 0.821 1.00 10.00 N ATOM 1923 CA THR A 131 -1.813 16.390 0.854 1.00 10.00 C ATOM 1924 C THR A 131 -2.859 16.719 -0.216 1.00 10.00 C ATOM 1925 O THR A 131 -3.477 17.778 -0.155 1.00 10.00 O ATOM 1926 CB THR A 131 -0.577 17.295 0.722 1.00 10.00 C ATOM 1927 OG1 THR A 131 -0.944 18.633 0.986 1.00 10.00 O ATOM 1928 CG2 THR A 131 0.067 17.231 -0.668 1.00 10.00 C ATOM 0 H THR A 131 -0.450 14.816 0.627 1.00 10.00 H new ATOM 0 HA THR A 131 -2.268 16.586 1.825 1.00 10.00 H new ATOM 0 HB THR A 131 0.156 16.934 1.444 1.00 10.00 H new ATOM 0 HG1 THR A 131 -1.889 18.763 0.762 1.00 10.00 H new ATOM 0 HG21 THR A 131 0.934 17.891 -0.698 1.00 10.00 H new ATOM 0 HG22 THR A 131 0.382 16.209 -0.876 1.00 10.00 H new ATOM 0 HG23 THR A 131 -0.657 17.548 -1.419 1.00 10.00 H new ATOM 1936 N ASP A 132 -3.051 15.813 -1.182 1.00 10.00 N ATOM 1937 CA ASP A 132 -4.134 15.853 -2.150 1.00 10.00 C ATOM 1938 C ASP A 132 -5.512 15.692 -1.477 1.00 10.00 C ATOM 1939 O ASP A 132 -6.542 15.888 -2.118 1.00 10.00 O ATOM 1940 CB ASP A 132 -3.863 14.764 -3.197 1.00 10.00 C ATOM 1941 CG ASP A 132 -4.597 15.035 -4.498 1.00 10.00 C ATOM 1942 OD1 ASP A 132 -4.279 16.064 -5.126 1.00 10.00 O ATOM 1943 OD2 ASP A 132 -5.432 14.181 -4.873 1.00 10.00 O ATOM 0 H ASP A 132 -2.434 15.011 -1.309 1.00 10.00 H new ATOM 0 HA ASP A 132 -4.167 16.828 -2.637 1.00 10.00 H new ATOM 0 HB2 ASP A 132 -2.792 14.704 -3.390 1.00 10.00 H new ATOM 0 HB3 ASP A 132 -4.170 13.796 -2.802 1.00 10.00 H new ATOM 1948 N GLY A 133 -5.536 15.347 -0.182 1.00 10.00 N ATOM 1949 CA GLY A 133 -6.703 15.461 0.680 1.00 10.00 C ATOM 1950 C GLY A 133 -7.552 14.199 0.631 1.00 10.00 C ATOM 1951 O GLY A 133 -8.733 14.263 0.298 1.00 10.00 O ATOM 0 H GLY A 133 -4.719 14.972 0.300 1.00 10.00 H new ATOM 0 HA2 GLY A 133 -6.384 15.647 1.705 1.00 10.00 H new ATOM 0 HA3 GLY A 133 -7.303 16.318 0.372 1.00 10.00 H new ATOM 1955 N ARG A 134 -6.951 13.043 0.943 1.00 10.00 N ATOM 1956 CA ARG A 134 -7.618 11.749 0.851 1.00 10.00 C ATOM 1957 C ARG A 134 -7.258 10.883 2.061 1.00 10.00 C ATOM 1958 O ARG A 134 -6.493 11.298 2.931 1.00 10.00 O ATOM 1959 CB ARG A 134 -7.265 11.077 -0.489 1.00 10.00 C ATOM 1960 CG ARG A 134 -7.503 12.052 -1.650 1.00 10.00 C ATOM 1961 CD ARG A 134 -7.334 11.433 -3.038 1.00 10.00 C ATOM 1962 NE ARG A 134 -7.276 12.504 -4.046 1.00 10.00 N ATOM 1963 CZ ARG A 134 -8.287 13.287 -4.450 1.00 10.00 C ATOM 1964 NH1 ARG A 134 -9.548 12.998 -4.111 1.00 10.00 N ATOM 1965 NH2 ARG A 134 -8.007 14.363 -5.186 1.00 10.00 N ATOM 0 H ARG A 134 -5.985 12.985 1.267 1.00 10.00 H new ATOM 0 HA ARG A 134 -8.699 11.884 0.871 1.00 10.00 H new ATOM 0 HB2 ARG A 134 -6.223 10.758 -0.481 1.00 10.00 H new ATOM 0 HB3 ARG A 134 -7.872 10.182 -0.626 1.00 10.00 H new ATOM 0 HG2 ARG A 134 -8.511 12.458 -1.567 1.00 10.00 H new ATOM 0 HG3 ARG A 134 -6.813 12.890 -1.552 1.00 10.00 H new ATOM 0 HD2 ARG A 134 -6.423 10.835 -3.073 1.00 10.00 H new ATOM 0 HD3 ARG A 134 -8.165 10.761 -3.252 1.00 10.00 H new ATOM 0 HE ARG A 134 -6.370 12.668 -4.484 1.00 10.00 H new ATOM 0 HH11 ARG A 134 -9.747 12.176 -3.541 1.00 10.00 H new ATOM 0 HH12 ARG A 134 -10.311 13.599 -4.423 1.00 10.00 H new ATOM 0 HH21 ARG A 134 -7.040 14.576 -5.431 1.00 10.00 H new ATOM 0 HH22 ARG A 134 -8.760 14.973 -5.505 1.00 10.00 H new ATOM 1979 N THR A 135 -7.846 9.690 2.148 1.00 10.00 N ATOM 1980 CA THR A 135 -7.589 8.689 3.172 1.00 10.00 C ATOM 1981 C THR A 135 -7.973 7.350 2.547 1.00 10.00 C ATOM 1982 O THR A 135 -9.128 6.939 2.619 1.00 10.00 O ATOM 1983 CB THR A 135 -8.357 9.016 4.465 1.00 10.00 C ATOM 1984 OG1 THR A 135 -7.754 10.137 5.091 1.00 10.00 O ATOM 1985 CG2 THR A 135 -8.310 7.866 5.477 1.00 10.00 C ATOM 0 H THR A 135 -8.547 9.385 1.472 1.00 10.00 H new ATOM 0 HA THR A 135 -6.544 8.663 3.480 1.00 10.00 H new ATOM 0 HB THR A 135 -9.393 9.203 4.181 1.00 10.00 H new ATOM 0 HG1 THR A 135 -7.230 10.638 4.431 1.00 10.00 H new ATOM 0 HG21 THR A 135 -8.866 8.146 6.372 1.00 10.00 H new ATOM 0 HG22 THR A 135 -8.757 6.975 5.036 1.00 10.00 H new ATOM 0 HG23 THR A 135 -7.274 7.658 5.744 1.00 10.00 H new ATOM 1993 N LEU A 136 -7.018 6.710 1.874 1.00 10.00 N ATOM 1994 CA LEU A 136 -7.206 5.383 1.305 1.00 10.00 C ATOM 1995 C LEU A 136 -6.867 4.353 2.383 1.00 10.00 C ATOM 1996 O LEU A 136 -6.342 4.702 3.438 1.00 10.00 O ATOM 1997 CB LEU A 136 -6.299 5.185 0.080 1.00 10.00 C ATOM 1998 CG LEU A 136 -6.636 6.003 -1.182 1.00 10.00 C ATOM 1999 CD1 LEU A 136 -7.968 5.563 -1.801 1.00 10.00 C ATOM 2000 CD2 LEU A 136 -6.643 7.521 -0.969 1.00 10.00 C ATOM 0 H LEU A 136 -6.091 7.101 1.709 1.00 10.00 H new ATOM 0 HA LEU A 136 -8.239 5.263 0.977 1.00 10.00 H new ATOM 0 HB2 LEU A 136 -5.277 5.422 0.374 1.00 10.00 H new ATOM 0 HB3 LEU A 136 -6.317 4.128 -0.187 1.00 10.00 H new ATOM 0 HG LEU A 136 -5.820 5.788 -1.872 1.00 10.00 H new ATOM 0 HD11 LEU A 136 -8.172 6.162 -2.689 1.00 10.00 H new ATOM 0 HD12 LEU A 136 -7.910 4.511 -2.079 1.00 10.00 H new ATOM 0 HD13 LEU A 136 -8.770 5.703 -1.076 1.00 10.00 H new ATOM 0 HD21 LEU A 136 -6.889 8.019 -1.907 1.00 10.00 H new ATOM 0 HD22 LEU A 136 -7.387 7.779 -0.215 1.00 10.00 H new ATOM 0 HD23 LEU A 136 -5.658 7.846 -0.633 1.00 10.00 H new ATOM 2012 N ASN A 137 -7.137 3.080 2.093 1.00 10.00 N ATOM 2013 CA ASN A 137 -6.798 1.942 2.931 1.00 10.00 C ATOM 2014 C ASN A 137 -6.567 0.784 1.974 1.00 10.00 C ATOM 2015 O ASN A 137 -7.532 0.132 1.574 1.00 10.00 O ATOM 2016 CB ASN A 137 -7.945 1.641 3.905 1.00 10.00 C ATOM 2017 CG ASN A 137 -7.675 0.383 4.729 1.00 10.00 C ATOM 2018 OD1 ASN A 137 -7.327 0.463 5.902 1.00 10.00 O ATOM 2019 ND2 ASN A 137 -7.820 -0.789 4.120 1.00 10.00 N ATOM 0 H ASN A 137 -7.616 2.809 1.234 1.00 10.00 H new ATOM 0 HA ASN A 137 -5.914 2.129 3.541 1.00 10.00 H new ATOM 0 HB2 ASN A 137 -8.086 2.490 4.574 1.00 10.00 H new ATOM 0 HB3 ASN A 137 -8.873 1.517 3.347 1.00 10.00 H new ATOM 0 HD21 ASN A 137 -7.640 -1.654 4.630 1.00 10.00 H new ATOM 0 HD22 ASN A 137 -8.111 -0.824 3.143 1.00 10.00 H new ATOM 2026 N VAL A 138 -5.320 0.559 1.562 1.00 10.00 N ATOM 2027 CA VAL A 138 -5.007 -0.481 0.594 1.00 10.00 C ATOM 2028 C VAL A 138 -4.431 -1.670 1.368 1.00 10.00 C ATOM 2029 O VAL A 138 -3.646 -1.476 2.293 1.00 10.00 O ATOM 2030 CB VAL A 138 -4.053 0.062 -0.489 1.00 10.00 C ATOM 2031 CG1 VAL A 138 -3.928 -0.930 -1.654 1.00 10.00 C ATOM 2032 CG2 VAL A 138 -4.490 1.434 -1.024 1.00 10.00 C ATOM 0 H VAL A 138 -4.510 1.087 1.887 1.00 10.00 H new ATOM 0 HA VAL A 138 -5.897 -0.813 0.059 1.00 10.00 H new ATOM 0 HB VAL A 138 -3.082 0.186 -0.010 1.00 10.00 H new ATOM 0 HG11 VAL A 138 -3.250 -0.525 -2.405 1.00 10.00 H new ATOM 0 HG12 VAL A 138 -3.536 -1.878 -1.285 1.00 10.00 H new ATOM 0 HG13 VAL A 138 -4.909 -1.092 -2.100 1.00 10.00 H new ATOM 0 HG21 VAL A 138 -3.784 1.770 -1.784 1.00 10.00 H new ATOM 0 HG22 VAL A 138 -5.484 1.353 -1.463 1.00 10.00 H new ATOM 0 HG23 VAL A 138 -4.512 2.153 -0.206 1.00 10.00 H new ATOM 2042 N ALA A 139 -4.829 -2.896 1.025 1.00 10.00 N ATOM 2043 CA ALA A 139 -4.340 -4.090 1.699 1.00 10.00 C ATOM 2044 C ALA A 139 -3.001 -4.486 1.080 1.00 10.00 C ATOM 2045 O ALA A 139 -2.950 -4.809 -0.105 1.00 10.00 O ATOM 2046 CB ALA A 139 -5.374 -5.211 1.561 1.00 10.00 C ATOM 0 H ALA A 139 -5.496 -3.084 0.276 1.00 10.00 H new ATOM 0 HA ALA A 139 -4.191 -3.900 2.762 1.00 10.00 H new ATOM 0 HB1 ALA A 139 -5.010 -6.106 2.065 1.00 10.00 H new ATOM 0 HB2 ALA A 139 -6.314 -4.897 2.014 1.00 10.00 H new ATOM 0 HB3 ALA A 139 -5.535 -5.429 0.505 1.00 10.00 H new ATOM 2052 N ALA A 140 -1.922 -4.429 1.865 1.00 10.00 N ATOM 2053 CA ALA A 140 -0.574 -4.725 1.411 1.00 10.00 C ATOM 2054 C ALA A 140 -0.149 -6.107 1.897 1.00 10.00 C ATOM 2055 O ALA A 140 -0.154 -6.357 3.103 1.00 10.00 O ATOM 2056 CB ALA A 140 0.385 -3.660 1.937 1.00 10.00 C ATOM 0 H ALA A 140 -1.969 -4.170 2.851 1.00 10.00 H new ATOM 0 HA ALA A 140 -0.551 -4.720 0.321 1.00 10.00 H new ATOM 0 HB1 ALA A 140 1.397 -3.881 1.597 1.00 10.00 H new ATOM 0 HB2 ALA A 140 0.083 -2.682 1.564 1.00 10.00 H new ATOM 0 HB3 ALA A 140 0.362 -3.656 3.027 1.00 10.00 H new ATOM 2062 N THR A 141 0.231 -6.996 0.976 1.00 10.00 N ATOM 2063 CA THR A 141 0.548 -8.382 1.296 1.00 10.00 C ATOM 2064 C THR A 141 1.992 -8.482 1.798 1.00 10.00 C ATOM 2065 O THR A 141 2.926 -8.033 1.132 1.00 10.00 O ATOM 2066 CB THR A 141 0.331 -9.250 0.049 1.00 10.00 C ATOM 2067 OG1 THR A 141 -0.822 -8.806 -0.639 1.00 10.00 O ATOM 2068 CG2 THR A 141 0.145 -10.721 0.432 1.00 10.00 C ATOM 0 H THR A 141 0.326 -6.770 -0.014 1.00 10.00 H new ATOM 0 HA THR A 141 -0.108 -8.742 2.088 1.00 10.00 H new ATOM 0 HB THR A 141 1.211 -9.160 -0.588 1.00 10.00 H new ATOM 0 HG1 THR A 141 -0.960 -9.359 -1.436 1.00 10.00 H new ATOM 0 HG21 THR A 141 -0.007 -11.315 -0.469 1.00 10.00 H new ATOM 0 HG22 THR A 141 1.033 -11.076 0.955 1.00 10.00 H new ATOM 0 HG23 THR A 141 -0.724 -10.820 1.083 1.00 10.00 H new ATOM 2076 N VAL A 142 2.215 -9.069 2.971 1.00 10.00 N ATOM 2077 CA VAL A 142 3.542 -9.089 3.556 1.00 10.00 C ATOM 2078 C VAL A 142 4.305 -10.271 2.953 1.00 10.00 C ATOM 2079 O VAL A 142 4.025 -11.418 3.290 1.00 10.00 O ATOM 2080 CB VAL A 142 3.415 -9.145 5.082 1.00 10.00 C ATOM 2081 CG1 VAL A 142 4.794 -9.184 5.736 1.00 10.00 C ATOM 2082 CG2 VAL A 142 2.669 -7.907 5.602 1.00 10.00 C ATOM 0 H VAL A 142 1.497 -9.532 3.527 1.00 10.00 H new ATOM 0 HA VAL A 142 4.109 -8.186 3.330 1.00 10.00 H new ATOM 0 HB VAL A 142 2.861 -10.049 5.335 1.00 10.00 H new ATOM 0 HG11 VAL A 142 4.682 -9.224 6.819 1.00 10.00 H new ATOM 0 HG12 VAL A 142 5.334 -10.067 5.395 1.00 10.00 H new ATOM 0 HG13 VAL A 142 5.352 -8.289 5.461 1.00 10.00 H new ATOM 0 HG21 VAL A 142 2.587 -7.961 6.688 1.00 10.00 H new ATOM 0 HG22 VAL A 142 3.219 -7.008 5.324 1.00 10.00 H new ATOM 0 HG23 VAL A 142 1.672 -7.872 5.164 1.00 10.00 H new ATOM 2092 N LYS A 143 5.236 -10.002 2.035 1.00 10.00 N ATOM 2093 CA LYS A 143 6.038 -10.985 1.326 1.00 10.00 C ATOM 2094 C LYS A 143 7.465 -10.456 1.158 1.00 10.00 C ATOM 2095 O LYS A 143 7.693 -9.562 0.351 1.00 10.00 O ATOM 2096 CB LYS A 143 5.409 -11.295 -0.042 1.00 10.00 C ATOM 2097 CG LYS A 143 4.095 -12.088 0.031 1.00 10.00 C ATOM 2098 CD LYS A 143 4.325 -13.496 0.607 1.00 10.00 C ATOM 2099 CE LYS A 143 3.065 -14.369 0.551 1.00 10.00 C ATOM 2100 NZ LYS A 143 3.284 -15.694 1.179 1.00 10.00 N ATOM 0 H LYS A 143 5.457 -9.046 1.757 1.00 10.00 H new ATOM 0 HA LYS A 143 6.071 -11.909 1.903 1.00 10.00 H new ATOM 0 HB2 LYS A 143 5.225 -10.357 -0.565 1.00 10.00 H new ATOM 0 HB3 LYS A 143 6.126 -11.857 -0.640 1.00 10.00 H new ATOM 0 HG2 LYS A 143 3.377 -11.551 0.652 1.00 10.00 H new ATOM 0 HG3 LYS A 143 3.659 -12.167 -0.965 1.00 10.00 H new ATOM 0 HD2 LYS A 143 5.126 -13.985 0.053 1.00 10.00 H new ATOM 0 HD3 LYS A 143 4.658 -13.411 1.641 1.00 10.00 H new ATOM 0 HE2 LYS A 143 2.246 -13.858 1.057 1.00 10.00 H new ATOM 0 HE3 LYS A 143 2.763 -14.505 -0.487 1.00 10.00 H new ATOM 0 HZ1 LYS A 143 2.369 -16.101 1.460 1.00 10.00 H new ATOM 0 HZ2 LYS A 143 3.750 -16.328 0.499 1.00 10.00 H new ATOM 0 HZ3 LYS A 143 3.887 -15.584 2.020 1.00 10.00 H new ATOM 2114 N LYS A 144 8.400 -11.028 1.930 1.00 10.00 N ATOM 2115 CA LYS A 144 9.845 -10.800 1.918 1.00 10.00 C ATOM 2116 C LYS A 144 10.389 -10.662 0.483 1.00 10.00 C ATOM 2117 O LYS A 144 10.556 -9.542 0.006 1.00 10.00 O ATOM 2118 CB LYS A 144 10.465 -11.920 2.770 1.00 10.00 C ATOM 2119 CG LYS A 144 11.950 -11.744 3.090 1.00 10.00 C ATOM 2120 CD LYS A 144 12.278 -12.348 4.463 1.00 10.00 C ATOM 2121 CE LYS A 144 13.797 -12.455 4.659 1.00 10.00 C ATOM 2122 NZ LYS A 144 14.169 -12.581 6.082 1.00 10.00 N ATOM 0 H LYS A 144 8.140 -11.718 2.635 1.00 10.00 H new ATOM 0 HA LYS A 144 10.123 -9.844 2.362 1.00 10.00 H new ATOM 0 HB2 LYS A 144 9.913 -11.990 3.707 1.00 10.00 H new ATOM 0 HB3 LYS A 144 10.331 -12.868 2.249 1.00 10.00 H new ATOM 0 HG2 LYS A 144 12.554 -12.225 2.321 1.00 10.00 H new ATOM 0 HG3 LYS A 144 12.207 -10.685 3.081 1.00 10.00 H new ATOM 0 HD2 LYS A 144 11.847 -11.729 5.250 1.00 10.00 H new ATOM 0 HD3 LYS A 144 11.825 -13.335 4.549 1.00 10.00 H new ATOM 0 HE2 LYS A 144 14.172 -13.318 4.109 1.00 10.00 H new ATOM 0 HE3 LYS A 144 14.279 -11.574 4.236 1.00 10.00 H new ATOM 0 HZ1 LYS A 144 15.081 -13.074 6.160 1.00 10.00 H new ATOM 0 HZ2 LYS A 144 14.250 -11.634 6.505 1.00 10.00 H new ATOM 0 HZ3 LYS A 144 13.438 -13.124 6.585 1.00 10.00 H new