USER MOD reduce.3.24.130724 H: found=0, std=0, add=472, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 475 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 Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 81:sc= 0.826 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.473 K(o=-0.47,f=-3!) USER MOD Single : A 97 MET CE :methyl -143:sc= -1.27 (180deg=-4.6!) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot -12:sc= 0.392 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 30:sc= -0.71 USER MOD Single : A 142 ASN : amide:sc= -0.477 X(o=-0.48,f=-0.82) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot -138:sc= -0.598 USER MOD Single : A 164 GLN : amide:sc= 0 X(o=0,f=-0.065) USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.512 -6.740 4.863 1.00 0.00 N ATOM 32 CA ARG A 59 -0.401 -7.329 3.884 1.00 0.00 C ATOM 33 C ARG A 59 -0.945 -8.662 4.382 1.00 0.00 C ATOM 34 O ARG A 59 -0.203 -9.630 4.541 1.00 0.00 O ATOM 35 CB ARG A 59 0.307 -7.512 2.543 1.00 0.00 C ATOM 36 CG ARG A 59 -0.661 -7.281 1.393 1.00 0.00 C ATOM 37 CD ARG A 59 -1.345 -8.602 1.065 1.00 0.00 C ATOM 38 NE ARG A 59 -0.656 -9.257 -0.038 1.00 0.00 N ATOM 39 CZ ARG A 59 -0.812 -8.842 -1.297 1.00 0.00 C ATOM 40 NH1 ARG A 59 -1.586 -7.822 -1.575 1.00 0.00 N ATOM 41 NH2 ARG A 59 -0.187 -9.456 -2.265 1.00 0.00 N ATOM 0 HA ARG A 59 -1.241 -6.648 3.748 1.00 0.00 H new ATOM 0 HB2 ARG A 59 1.142 -6.816 2.468 1.00 0.00 H new ATOM 0 HB3 ARG A 59 0.723 -8.517 2.479 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -1.401 -6.529 1.666 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -0.129 -6.903 0.520 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.344 -9.250 1.942 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.388 -8.426 0.800 1.00 0.00 H new ATOM 0 HE ARG A 59 -0.042 -10.048 0.155 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.078 -7.336 -0.825 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -1.697 -7.514 -2.541 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.418 -10.250 -2.058 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -0.304 -9.141 -3.228 1.00 0.00 H new ATOM 55 N VAL A 60 -2.251 -8.697 4.628 1.00 0.00 N ATOM 56 CA VAL A 60 -2.903 -9.900 5.108 1.00 0.00 C ATOM 57 C VAL A 60 -4.104 -10.229 4.230 1.00 0.00 C ATOM 58 O VAL A 60 -4.826 -9.342 3.795 1.00 0.00 O ATOM 59 CB VAL A 60 -3.355 -9.725 6.553 1.00 0.00 C ATOM 60 CG1 VAL A 60 -4.046 -11.006 7.021 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.136 -9.449 7.435 1.00 0.00 C ATOM 0 H VAL A 60 -2.876 -7.901 4.501 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.187 -10.721 5.062 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.050 -8.888 6.624 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.372 -10.887 8.054 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -4.911 -11.205 6.388 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.348 -11.841 6.954 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.456 -9.323 8.469 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.442 -10.287 7.369 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.640 -8.540 7.096 1.00 0.00 H new ATOM 71 N VAL A 61 -4.303 -11.503 3.963 1.00 0.00 N ATOM 72 CA VAL A 61 -5.417 -11.943 3.128 1.00 0.00 C ATOM 73 C VAL A 61 -6.336 -12.885 3.899 1.00 0.00 C ATOM 74 O VAL A 61 -5.888 -13.888 4.451 1.00 0.00 O ATOM 75 CB VAL A 61 -4.886 -12.663 1.888 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.061 -13.218 1.078 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.104 -11.673 1.023 1.00 0.00 C ATOM 0 H VAL A 61 -3.711 -12.258 4.309 1.00 0.00 H new ATOM 0 HA VAL A 61 -5.985 -11.062 2.830 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.233 -13.480 2.195 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.683 -13.731 0.194 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.626 -13.920 1.691 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.711 -12.398 0.772 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.724 -12.184 0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.761 -10.859 0.718 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.269 -11.270 1.596 1.00 0.00 H new ATOM 87 N VAL A 62 -7.625 -12.566 3.925 1.00 0.00 N ATOM 88 CA VAL A 62 -8.595 -13.410 4.623 1.00 0.00 C ATOM 89 C VAL A 62 -9.566 -14.026 3.617 1.00 0.00 C ATOM 90 O VAL A 62 -10.385 -13.328 3.033 1.00 0.00 O ATOM 91 CB VAL A 62 -9.373 -12.572 5.652 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.387 -13.456 6.373 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.393 -11.978 6.671 1.00 0.00 C ATOM 0 H VAL A 62 -8.022 -11.740 3.477 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.064 -14.208 5.141 1.00 0.00 H new ATOM 0 HB VAL A 62 -9.899 -11.766 5.140 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.937 -12.860 7.101 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.084 -13.876 5.648 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -9.866 -14.264 6.885 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.943 -11.384 7.401 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.866 -12.784 7.182 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.672 -11.343 6.155 1.00 0.00 H new ATOM 103 N TYR A 63 -9.488 -15.347 3.443 1.00 0.00 N ATOM 104 CA TYR A 63 -10.365 -16.045 2.529 1.00 0.00 C ATOM 105 C TYR A 63 -11.714 -16.262 3.169 1.00 0.00 C ATOM 106 O TYR A 63 -11.814 -16.574 4.352 1.00 0.00 O ATOM 107 CB TYR A 63 -9.744 -17.389 2.152 1.00 0.00 C ATOM 108 CG TYR A 63 -8.561 -17.165 1.238 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.321 -16.787 1.772 1.00 0.00 C ATOM 110 CD2 TYR A 63 -8.702 -17.348 -0.144 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.225 -16.594 0.922 1.00 0.00 C ATOM 112 CE2 TYR A 63 -7.606 -17.152 -0.991 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.367 -16.774 -0.458 1.00 0.00 C ATOM 114 OH TYR A 63 -5.287 -16.583 -1.295 1.00 0.00 O ATOM 0 H TYR A 63 -8.822 -15.947 3.929 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.497 -15.444 1.629 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.427 -17.919 3.050 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -10.485 -18.017 1.657 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.211 -16.645 2.837 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.657 -17.640 -0.555 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.269 -16.306 1.333 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.715 -17.292 -2.056 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.558 -16.750 -2.222 1.00 0.00 H new ATOM 124 N ILE A 64 -12.742 -16.075 2.370 1.00 0.00 N ATOM 125 CA ILE A 64 -14.123 -16.225 2.823 1.00 0.00 C ATOM 126 C ILE A 64 -14.643 -17.617 2.466 1.00 0.00 C ATOM 127 O ILE A 64 -14.140 -18.257 1.546 1.00 0.00 O ATOM 128 CB ILE A 64 -15.033 -15.159 2.173 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.290 -13.821 2.007 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.251 -14.939 3.068 1.00 0.00 C ATOM 131 CD1 ILE A 64 -14.059 -13.173 3.363 1.00 0.00 C ATOM 0 H ILE A 64 -12.653 -15.815 1.388 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.141 -16.092 3.905 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.334 -15.514 1.187 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.335 -13.987 1.508 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -14.870 -13.152 1.371 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -16.901 -14.188 2.619 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -16.798 -15.876 3.175 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -15.924 -14.596 4.050 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -13.533 -12.228 3.230 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.018 -12.989 3.847 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -13.460 -13.837 3.986 1.00 0.00 H new ATOM 143 N ARG A 65 -15.657 -18.068 3.200 1.00 0.00 N ATOM 144 CA ARG A 65 -16.263 -19.377 2.955 1.00 0.00 C ATOM 145 C ARG A 65 -16.614 -19.533 1.481 1.00 0.00 C ATOM 146 O ARG A 65 -16.443 -18.606 0.689 1.00 0.00 O ATOM 147 CB ARG A 65 -17.519 -19.534 3.807 1.00 0.00 C ATOM 148 CG ARG A 65 -17.158 -20.196 5.137 1.00 0.00 C ATOM 149 CD ARG A 65 -17.110 -21.708 4.937 1.00 0.00 C ATOM 150 NE ARG A 65 -16.700 -22.377 6.167 1.00 0.00 N ATOM 151 CZ ARG A 65 -16.740 -23.705 6.288 1.00 0.00 C ATOM 152 NH1 ARG A 65 -17.155 -24.460 5.300 1.00 0.00 N ATOM 153 NH2 ARG A 65 -16.359 -24.264 7.406 1.00 0.00 N ATOM 0 H ARG A 65 -16.077 -17.547 3.970 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.545 -20.151 3.227 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.973 -18.559 3.986 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -18.257 -20.137 3.278 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -16.194 -19.831 5.490 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -17.894 -19.939 5.898 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -18.091 -22.071 4.629 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -16.414 -21.952 4.135 1.00 0.00 H new ATOM 0 HE ARG A 65 -16.375 -21.815 6.954 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -17.453 -24.034 4.423 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -17.180 -25.474 5.408 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -16.033 -23.685 8.180 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -16.387 -25.279 7.504 1.00 0.00 H new ATOM 517 N LYS A 89 -20.870 -7.248 6.096 1.00 0.00 N ATOM 518 CA LYS A 89 -20.743 -7.589 7.501 1.00 0.00 C ATOM 519 C LYS A 89 -19.292 -7.871 7.860 1.00 0.00 C ATOM 520 O LYS A 89 -18.793 -7.421 8.890 1.00 0.00 O ATOM 521 CB LYS A 89 -21.606 -8.822 7.804 1.00 0.00 C ATOM 522 CG LYS A 89 -21.735 -9.006 9.315 1.00 0.00 C ATOM 523 CD LYS A 89 -22.764 -8.011 9.856 1.00 0.00 C ATOM 524 CE LYS A 89 -22.089 -7.085 10.866 1.00 0.00 C ATOM 525 NZ LYS A 89 -23.126 -6.307 11.603 1.00 0.00 N ATOM 0 HA LYS A 89 -21.084 -6.745 8.100 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -22.593 -8.705 7.357 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.158 -9.710 7.358 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -22.042 -10.026 9.544 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -20.770 -8.848 9.797 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -23.188 -7.428 9.038 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -23.589 -8.544 10.329 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -21.491 -7.668 11.567 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.407 -6.407 10.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -22.664 -5.677 12.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -23.678 -5.739 10.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -23.760 -6.961 12.105 1.00 0.00 H new ATOM 539 N VAL A 90 -18.623 -8.610 6.990 1.00 0.00 N ATOM 540 CA VAL A 90 -17.226 -8.948 7.213 1.00 0.00 C ATOM 541 C VAL A 90 -16.357 -7.708 7.049 1.00 0.00 C ATOM 542 O VAL A 90 -15.412 -7.487 7.806 1.00 0.00 O ATOM 543 CB VAL A 90 -16.776 -10.044 6.242 1.00 0.00 C ATOM 544 CG1 VAL A 90 -15.274 -10.288 6.414 1.00 0.00 C ATOM 545 CG2 VAL A 90 -17.538 -11.336 6.551 1.00 0.00 C ATOM 0 H VAL A 90 -19.021 -8.985 6.129 1.00 0.00 H new ATOM 0 HA VAL A 90 -17.117 -9.324 8.230 1.00 0.00 H new ATOM 0 HB VAL A 90 -16.981 -9.733 5.217 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.951 -11.068 5.724 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.729 -9.368 6.203 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -15.071 -10.603 7.438 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -17.221 -12.119 5.862 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -17.328 -11.646 7.575 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -18.608 -11.164 6.436 1.00 0.00 H new ATOM 555 N TYR A 91 -16.702 -6.901 6.057 1.00 0.00 N ATOM 556 CA TYR A 91 -15.971 -5.677 5.787 1.00 0.00 C ATOM 557 C TYR A 91 -16.079 -4.725 6.959 1.00 0.00 C ATOM 558 O TYR A 91 -15.094 -4.118 7.371 1.00 0.00 O ATOM 559 CB TYR A 91 -16.496 -5.001 4.515 1.00 0.00 C ATOM 560 CG TYR A 91 -15.789 -3.677 4.313 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.446 -3.648 3.912 1.00 0.00 C ATOM 562 CD2 TYR A 91 -16.485 -2.481 4.509 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.803 -2.421 3.709 1.00 0.00 C ATOM 564 CE2 TYR A 91 -15.843 -1.254 4.310 1.00 0.00 C ATOM 565 CZ TYR A 91 -14.500 -1.224 3.911 1.00 0.00 C ATOM 566 OH TYR A 91 -13.862 -0.013 3.723 1.00 0.00 O ATOM 0 H TYR A 91 -17.485 -7.074 5.426 1.00 0.00 H new ATOM 0 HA TYR A 91 -14.923 -5.936 5.638 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.331 -5.648 3.653 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.571 -4.842 4.593 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -13.908 -4.572 3.760 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -17.521 -2.504 4.815 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.769 -2.398 3.397 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -16.382 -0.331 4.464 1.00 0.00 H new ATOM 0 HH TYR A 91 -14.489 0.718 3.904 1.00 0.00 H new ATOM 576 N ASP A 92 -17.291 -4.594 7.479 1.00 0.00 N ATOM 577 CA ASP A 92 -17.532 -3.692 8.597 1.00 0.00 C ATOM 578 C ASP A 92 -16.776 -4.149 9.831 1.00 0.00 C ATOM 579 O ASP A 92 -16.228 -3.337 10.576 1.00 0.00 O ATOM 580 CB ASP A 92 -19.031 -3.617 8.907 1.00 0.00 C ATOM 581 CG ASP A 92 -19.752 -2.827 7.818 1.00 0.00 C ATOM 582 OD1 ASP A 92 -19.076 -2.181 7.034 1.00 0.00 O ATOM 583 OD2 ASP A 92 -20.971 -2.872 7.788 1.00 0.00 O ATOM 0 H ASP A 92 -18.116 -5.095 7.149 1.00 0.00 H new ATOM 0 HA ASP A 92 -17.175 -2.702 8.315 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.447 -4.622 8.974 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -19.187 -3.142 9.876 1.00 0.00 H new ATOM 588 N SER A 93 -16.756 -5.451 10.041 1.00 0.00 N ATOM 589 CA SER A 93 -16.069 -6.008 11.196 1.00 0.00 C ATOM 590 C SER A 93 -14.563 -5.836 11.050 1.00 0.00 C ATOM 591 O SER A 93 -13.862 -5.526 12.012 1.00 0.00 O ATOM 592 CB SER A 93 -16.416 -7.484 11.348 1.00 0.00 C ATOM 593 OG SER A 93 -17.813 -7.615 11.568 1.00 0.00 O ATOM 0 H SER A 93 -17.202 -6.139 9.435 1.00 0.00 H new ATOM 0 HA SER A 93 -16.395 -5.474 12.088 1.00 0.00 H new ATOM 0 HB2 SER A 93 -16.124 -8.033 10.453 1.00 0.00 H new ATOM 0 HB3 SER A 93 -15.862 -7.916 12.182 1.00 0.00 H new ATOM 0 HG SER A 93 -18.285 -7.564 10.711 1.00 0.00 H new ATOM 599 N LEU A 94 -14.079 -6.043 9.833 1.00 0.00 N ATOM 600 CA LEU A 94 -12.653 -5.909 9.550 1.00 0.00 C ATOM 601 C LEU A 94 -12.229 -4.447 9.607 1.00 0.00 C ATOM 602 O LEU A 94 -11.085 -4.142 9.936 1.00 0.00 O ATOM 603 CB LEU A 94 -12.312 -6.499 8.179 1.00 0.00 C ATOM 604 CG LEU A 94 -12.416 -8.032 8.225 1.00 0.00 C ATOM 605 CD1 LEU A 94 -12.333 -8.587 6.805 1.00 0.00 C ATOM 606 CD2 LEU A 94 -11.271 -8.603 9.075 1.00 0.00 C ATOM 0 H LEU A 94 -14.648 -6.303 9.028 1.00 0.00 H new ATOM 0 HA LEU A 94 -12.107 -6.463 10.313 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -12.991 -6.103 7.424 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -11.304 -6.203 7.887 1.00 0.00 H new ATOM 0 HG LEU A 94 -13.368 -8.320 8.671 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.406 -9.674 6.834 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -13.151 -8.184 6.208 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -11.382 -8.300 6.357 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.348 -9.690 9.106 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.315 -8.319 8.635 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -11.337 -8.206 10.088 1.00 0.00 H new ATOM 618 N LYS A 95 -13.156 -3.554 9.269 1.00 0.00 N ATOM 619 CA LYS A 95 -12.874 -2.121 9.276 1.00 0.00 C ATOM 620 C LYS A 95 -12.782 -1.580 10.697 1.00 0.00 C ATOM 621 O LYS A 95 -11.991 -0.678 10.982 1.00 0.00 O ATOM 622 CB LYS A 95 -13.970 -1.364 8.537 1.00 0.00 C ATOM 623 CG LYS A 95 -13.390 -0.762 7.263 1.00 0.00 C ATOM 624 CD LYS A 95 -12.638 0.526 7.602 1.00 0.00 C ATOM 625 CE LYS A 95 -11.134 0.337 7.354 1.00 0.00 C ATOM 626 NZ LYS A 95 -10.366 1.134 8.353 1.00 0.00 N ATOM 0 H LYS A 95 -14.106 -3.796 8.988 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.915 -1.976 8.778 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -14.793 -2.036 8.294 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.378 -0.578 9.172 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -12.716 -1.474 6.786 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -14.188 -0.553 6.551 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -13.015 1.348 6.993 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -12.812 0.795 8.644 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.870 -0.718 7.433 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -10.878 0.655 6.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.347 1.008 8.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -10.611 2.140 8.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -10.604 0.810 9.312 1.00 0.00 H new ATOM 640 N ASN A 96 -13.590 -2.138 11.588 1.00 0.00 N ATOM 641 CA ASN A 96 -13.598 -1.710 12.984 1.00 0.00 C ATOM 642 C ASN A 96 -12.507 -2.423 13.780 1.00 0.00 C ATOM 643 O ASN A 96 -12.437 -2.290 15.002 1.00 0.00 O ATOM 644 CB ASN A 96 -14.964 -1.995 13.612 1.00 0.00 C ATOM 645 CG ASN A 96 -15.101 -1.242 14.932 1.00 0.00 C ATOM 646 OD1 ASN A 96 -14.269 -0.390 15.250 1.00 0.00 O ATOM 647 ND2 ASN A 96 -16.108 -1.501 15.718 1.00 0.00 N ATOM 0 H ASN A 96 -14.248 -2.887 11.372 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.402 -0.638 13.012 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.757 -1.693 12.928 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -15.079 -3.066 13.781 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -16.209 -0.998 16.599 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -16.795 -2.207 15.452 1.00 0.00 H new ATOM 654 N MET A 97 -11.664 -3.188 13.091 1.00 0.00 N ATOM 655 CA MET A 97 -10.597 -3.918 13.753 1.00 0.00 C ATOM 656 C MET A 97 -9.692 -2.972 14.527 1.00 0.00 C ATOM 657 O MET A 97 -8.959 -3.417 15.409 1.00 0.00 O ATOM 658 CB MET A 97 -9.776 -4.683 12.721 1.00 0.00 C ATOM 659 CG MET A 97 -10.513 -5.964 12.330 1.00 0.00 C ATOM 660 SD MET A 97 -10.302 -7.211 13.621 1.00 0.00 S ATOM 661 CE MET A 97 -9.312 -8.371 12.646 1.00 0.00 C ATOM 0 H MET A 97 -11.702 -3.315 12.080 1.00 0.00 H new ATOM 0 HA MET A 97 -11.046 -4.620 14.456 1.00 0.00 H new ATOM 0 HB2 MET A 97 -9.611 -4.063 11.840 1.00 0.00 H new ATOM 0 HB3 MET A 97 -8.795 -4.926 13.129 1.00 0.00 H new ATOM 0 HG2 MET A 97 -11.573 -5.754 12.184 1.00 0.00 H new ATOM 0 HG3 MET A 97 -10.129 -6.340 11.382 1.00 0.00 H new ATOM 0 HE1 MET A 97 -9.588 -9.393 12.906 1.00 0.00 H new ATOM 0 HE2 MET A 97 -9.496 -8.204 11.585 1.00 0.00 H new ATOM 0 HE3 MET A 97 -8.254 -8.215 12.859 1.00 0.00 H new ATOM 671 N SER A 98 -9.735 -1.671 14.186 1.00 0.00 N ATOM 672 CA SER A 98 -8.906 -0.667 14.856 1.00 0.00 C ATOM 673 C SER A 98 -7.460 -0.764 14.388 1.00 0.00 C ATOM 674 O SER A 98 -6.956 0.123 13.696 1.00 0.00 O ATOM 675 CB SER A 98 -8.991 -0.839 16.376 1.00 0.00 C ATOM 676 OG SER A 98 -8.902 0.432 17.002 1.00 0.00 O ATOM 0 H SER A 98 -10.335 -1.297 13.451 1.00 0.00 H new ATOM 0 HA SER A 98 -9.282 0.322 14.595 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.929 -1.324 16.646 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.186 -1.485 16.725 1.00 0.00 H new ATOM 0 HG SER A 98 -8.958 0.322 17.974 1.00 0.00 H new ATOM 682 N THR A 99 -6.804 -1.855 14.755 1.00 0.00 N ATOM 683 CA THR A 99 -5.420 -2.079 14.361 1.00 0.00 C ATOM 684 C THR A 99 -5.291 -2.137 12.835 1.00 0.00 C ATOM 685 O THR A 99 -4.180 -2.066 12.292 1.00 0.00 O ATOM 686 CB THR A 99 -4.897 -3.374 14.980 1.00 0.00 C ATOM 687 OG1 THR A 99 -4.997 -3.290 16.394 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.433 -3.582 14.577 1.00 0.00 C ATOM 0 H THR A 99 -7.207 -2.599 15.325 1.00 0.00 H new ATOM 0 HA THR A 99 -4.822 -1.244 14.726 1.00 0.00 H new ATOM 0 HB THR A 99 -5.489 -4.216 14.622 1.00 0.00 H new ATOM 0 HG1 THR A 99 -4.664 -4.120 16.795 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.062 -4.506 15.020 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.360 -3.645 13.491 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.835 -2.743 14.933 1.00 0.00 H new ATOM 696 N VAL A 100 -6.425 -2.287 12.155 1.00 0.00 N ATOM 697 CA VAL A 100 -6.439 -2.361 10.702 1.00 0.00 C ATOM 698 C VAL A 100 -6.175 -0.998 10.076 1.00 0.00 C ATOM 699 O VAL A 100 -6.595 0.035 10.599 1.00 0.00 O ATOM 700 CB VAL A 100 -7.799 -2.860 10.214 1.00 0.00 C ATOM 701 CG1 VAL A 100 -8.894 -1.873 10.653 1.00 0.00 C ATOM 702 CG2 VAL A 100 -7.790 -2.973 8.678 1.00 0.00 C ATOM 0 H VAL A 100 -7.345 -2.359 12.590 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.651 -3.052 10.403 1.00 0.00 H new ATOM 0 HB VAL A 100 -8.000 -3.841 10.644 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -9.864 -2.228 10.305 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.903 -1.799 11.740 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.692 -0.891 10.225 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.761 -3.329 8.334 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.587 -1.995 8.242 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.016 -3.675 8.369 1.00 0.00 H new ATOM 712 N LYS A 101 -5.490 -1.009 8.941 1.00 0.00 N ATOM 713 CA LYS A 101 -5.188 0.222 8.228 1.00 0.00 C ATOM 714 C LYS A 101 -6.089 0.368 7.003 1.00 0.00 C ATOM 715 O LYS A 101 -6.614 1.447 6.732 1.00 0.00 O ATOM 716 CB LYS A 101 -3.718 0.238 7.796 1.00 0.00 C ATOM 717 CG LYS A 101 -3.372 1.616 7.232 1.00 0.00 C ATOM 718 CD LYS A 101 -3.134 2.601 8.382 1.00 0.00 C ATOM 719 CE LYS A 101 -4.354 3.510 8.540 1.00 0.00 C ATOM 720 NZ LYS A 101 -4.124 4.788 7.809 1.00 0.00 N ATOM 0 H LYS A 101 -5.134 -1.855 8.496 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.371 1.060 8.900 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.075 0.008 8.646 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.540 -0.531 7.044 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.482 1.550 6.607 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.182 1.973 6.596 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -2.951 2.057 9.308 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -2.245 3.200 8.183 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -5.243 3.013 8.152 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -4.536 3.711 9.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -4.955 5.404 7.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -3.286 5.265 8.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -3.971 4.588 6.800 1.00 0.00 H new ATOM 734 N SER A 102 -6.265 -0.726 6.271 1.00 0.00 N ATOM 735 CA SER A 102 -7.102 -0.714 5.078 1.00 0.00 C ATOM 736 C SER A 102 -7.547 -2.127 4.732 1.00 0.00 C ATOM 737 O SER A 102 -6.834 -3.088 4.987 1.00 0.00 O ATOM 738 CB SER A 102 -6.335 -0.104 3.902 1.00 0.00 C ATOM 739 OG SER A 102 -7.187 -0.042 2.768 1.00 0.00 O ATOM 0 H SER A 102 -5.841 -1.629 6.482 1.00 0.00 H new ATOM 0 HA SER A 102 -7.985 -0.107 5.278 1.00 0.00 H new ATOM 0 HB2 SER A 102 -5.982 0.894 4.161 1.00 0.00 H new ATOM 0 HB3 SER A 102 -5.454 -0.705 3.677 1.00 0.00 H new ATOM 0 HG SER A 102 -6.699 0.350 2.014 1.00 0.00 H new ATOM 745 N VAL A 103 -8.730 -2.244 4.144 1.00 0.00 N ATOM 746 CA VAL A 103 -9.255 -3.554 3.763 1.00 0.00 C ATOM 747 C VAL A 103 -9.867 -3.519 2.365 1.00 0.00 C ATOM 748 O VAL A 103 -10.682 -2.652 2.057 1.00 0.00 O ATOM 749 CB VAL A 103 -10.313 -4.003 4.768 1.00 0.00 C ATOM 750 CG1 VAL A 103 -11.062 -2.775 5.291 1.00 0.00 C ATOM 751 CG2 VAL A 103 -11.295 -4.970 4.086 1.00 0.00 C ATOM 0 H VAL A 103 -9.341 -1.458 3.921 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.425 -4.260 3.760 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.835 -4.516 5.603 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -11.819 -3.089 6.009 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -10.358 -2.100 5.778 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -11.543 -2.260 4.459 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -12.049 -5.289 4.805 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -11.780 -4.466 3.250 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.752 -5.841 3.719 1.00 0.00 H new ATOM 761 N THR A 104 -9.476 -4.474 1.528 1.00 0.00 N ATOM 762 CA THR A 104 -9.997 -4.552 0.172 1.00 0.00 C ATOM 763 C THR A 104 -10.593 -5.933 -0.088 1.00 0.00 C ATOM 764 O THR A 104 -9.967 -6.951 0.194 1.00 0.00 O ATOM 765 CB THR A 104 -8.881 -4.276 -0.835 1.00 0.00 C ATOM 766 OG1 THR A 104 -8.363 -2.971 -0.620 1.00 0.00 O ATOM 767 CG2 THR A 104 -9.450 -4.380 -2.246 1.00 0.00 C ATOM 0 H THR A 104 -8.802 -5.202 1.766 1.00 0.00 H new ATOM 0 HA THR A 104 -10.779 -3.801 0.057 1.00 0.00 H new ATOM 0 HB THR A 104 -8.079 -5.003 -0.710 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.646 -2.793 -1.264 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.661 -4.185 -2.972 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.849 -5.382 -2.405 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.248 -3.648 -2.371 1.00 0.00 H new ATOM 775 N PHE A 105 -11.801 -5.965 -0.623 1.00 0.00 N ATOM 776 CA PHE A 105 -12.457 -7.231 -0.905 1.00 0.00 C ATOM 777 C PHE A 105 -12.075 -7.734 -2.292 1.00 0.00 C ATOM 778 O PHE A 105 -12.443 -7.138 -3.305 1.00 0.00 O ATOM 779 CB PHE A 105 -13.972 -7.054 -0.845 1.00 0.00 C ATOM 780 CG PHE A 105 -14.654 -8.364 -1.140 1.00 0.00 C ATOM 781 CD1 PHE A 105 -14.653 -9.379 -0.180 1.00 0.00 C ATOM 782 CD2 PHE A 105 -15.317 -8.561 -2.362 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.304 -10.580 -0.432 1.00 0.00 C ATOM 784 CE2 PHE A 105 -15.966 -9.775 -2.615 1.00 0.00 C ATOM 785 CZ PHE A 105 -15.959 -10.779 -1.644 1.00 0.00 C ATOM 0 H PHE A 105 -12.344 -5.137 -0.869 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.136 -7.957 -0.158 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.266 -6.695 0.141 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.287 -6.300 -1.566 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -14.145 -9.229 0.761 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.326 -7.777 -3.105 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -15.302 -11.361 0.314 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -16.470 -9.935 -3.557 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.464 -11.714 -1.835 1.00 0.00 H new ATOM 795 N SER A 106 -11.359 -8.845 -2.327 1.00 0.00 N ATOM 796 CA SER A 106 -10.946 -9.446 -3.585 1.00 0.00 C ATOM 797 C SER A 106 -11.916 -10.562 -3.966 1.00 0.00 C ATOM 798 O SER A 106 -11.905 -11.637 -3.365 1.00 0.00 O ATOM 799 CB SER A 106 -9.533 -10.023 -3.451 1.00 0.00 C ATOM 800 OG SER A 106 -9.186 -10.698 -4.653 1.00 0.00 O ATOM 0 H SER A 106 -11.051 -9.351 -1.497 1.00 0.00 H new ATOM 0 HA SER A 106 -10.949 -8.680 -4.361 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.819 -9.224 -3.250 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.487 -10.712 -2.607 1.00 0.00 H new ATOM 0 HG SER A 106 -8.282 -11.067 -4.572 1.00 0.00 H new ATOM 806 N SER A 107 -12.749 -10.298 -4.962 1.00 0.00 N ATOM 807 CA SER A 107 -13.721 -11.285 -5.416 1.00 0.00 C ATOM 808 C SER A 107 -13.008 -12.508 -5.991 1.00 0.00 C ATOM 809 O SER A 107 -11.862 -12.429 -6.427 1.00 0.00 O ATOM 810 CB SER A 107 -14.637 -10.664 -6.473 1.00 0.00 C ATOM 811 OG SER A 107 -15.354 -9.580 -5.896 1.00 0.00 O ATOM 0 H SER A 107 -12.773 -9.414 -5.470 1.00 0.00 H new ATOM 0 HA SER A 107 -14.323 -11.603 -4.565 1.00 0.00 H new ATOM 0 HB2 SER A 107 -14.048 -10.315 -7.321 1.00 0.00 H new ATOM 0 HB3 SER A 107 -15.332 -11.413 -6.854 1.00 0.00 H new ATOM 0 HG SER A 107 -15.252 -9.602 -4.922 1.00 0.00 H new ATOM 817 N LYS A 108 -13.698 -13.641 -5.980 1.00 0.00 N ATOM 818 CA LYS A 108 -13.136 -14.884 -6.492 1.00 0.00 C ATOM 819 C LYS A 108 -12.846 -14.762 -7.974 1.00 0.00 C ATOM 820 O LYS A 108 -11.924 -15.387 -8.491 1.00 0.00 O ATOM 821 CB LYS A 108 -14.119 -16.034 -6.249 1.00 0.00 C ATOM 822 CG LYS A 108 -15.446 -15.743 -6.959 1.00 0.00 C ATOM 823 CD LYS A 108 -16.505 -16.746 -6.487 1.00 0.00 C ATOM 824 CE LYS A 108 -17.041 -16.316 -5.118 1.00 0.00 C ATOM 825 NZ LYS A 108 -17.876 -17.408 -4.546 1.00 0.00 N ATOM 0 H LYS A 108 -14.649 -13.725 -5.622 1.00 0.00 H new ATOM 0 HA LYS A 108 -12.202 -15.089 -5.969 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -13.697 -16.969 -6.617 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -14.288 -16.160 -5.180 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -15.771 -14.725 -6.743 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -15.317 -15.814 -8.039 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -17.320 -16.797 -7.209 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -16.073 -17.745 -6.423 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -16.213 -16.087 -4.447 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -17.632 -15.405 -5.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -18.240 -17.116 -3.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -18.673 -17.606 -5.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -17.299 -18.266 -4.438 1.00 0.00 H new ATOM 1237 N TYR A 134 -12.538 -19.109 -3.292 1.00 0.00 N ATOM 1238 CA TYR A 134 -13.515 -18.222 -2.672 1.00 0.00 C ATOM 1239 C TYR A 134 -13.006 -16.782 -2.701 1.00 0.00 C ATOM 1240 O TYR A 134 -12.001 -16.482 -3.343 1.00 0.00 O ATOM 1241 CB TYR A 134 -13.769 -18.649 -1.219 1.00 0.00 C ATOM 1242 CG TYR A 134 -13.397 -20.104 -1.033 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -12.394 -20.452 -0.122 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -14.043 -21.100 -1.778 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -12.031 -21.795 0.042 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -13.683 -22.442 -1.612 1.00 0.00 C ATOM 1247 CZ TYR A 134 -12.674 -22.789 -0.705 1.00 0.00 C ATOM 1248 OH TYR A 134 -12.317 -24.112 -0.548 1.00 0.00 O ATOM 0 HA TYR A 134 -14.448 -18.285 -3.231 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.185 -18.027 -0.541 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.818 -18.498 -0.965 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.899 -19.685 0.455 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -14.819 -20.832 -2.480 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -11.256 -22.063 0.744 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -14.183 -23.210 -2.183 1.00 0.00 H new ATOM 0 HH TYR A 134 -12.862 -24.670 -1.141 1.00 0.00 H new ATOM 1258 N ASP A 135 -13.701 -15.905 -1.991 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.314 -14.500 -1.921 1.00 0.00 C ATOM 1260 C ASP A 135 -12.178 -14.304 -0.925 1.00 0.00 C ATOM 1261 O ASP A 135 -11.850 -15.206 -0.163 1.00 0.00 O ATOM 1262 CB ASP A 135 -14.503 -13.662 -1.500 1.00 0.00 C ATOM 1263 CG ASP A 135 -15.644 -13.845 -2.496 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -15.474 -13.461 -3.639 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -16.666 -14.386 -2.104 1.00 0.00 O ATOM 0 H ASP A 135 -14.536 -16.140 -1.455 1.00 0.00 H new ATOM 0 HA ASP A 135 -12.974 -14.186 -2.908 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -14.829 -13.953 -0.502 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -14.219 -12.611 -1.448 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.576 -13.119 -0.958 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.467 -12.804 -0.065 1.00 0.00 C ATOM 1272 C ALA A 136 -10.559 -11.365 0.424 1.00 0.00 C ATOM 1273 O ALA A 136 -11.052 -10.495 -0.276 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.140 -13.025 -0.796 1.00 0.00 C ATOM 0 H ALA A 136 -11.837 -12.363 -1.592 1.00 0.00 H new ATOM 0 HA ALA A 136 -10.519 -13.463 0.802 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.312 -12.789 -0.127 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -9.067 -14.066 -1.111 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.095 -12.377 -1.672 1.00 0.00 H new ATOM 1280 N TYR A 137 -10.071 -11.123 1.626 1.00 0.00 N ATOM 1281 CA TYR A 137 -10.089 -9.780 2.196 1.00 0.00 C ATOM 1282 C TYR A 137 -8.663 -9.309 2.448 1.00 0.00 C ATOM 1283 O TYR A 137 -8.005 -9.764 3.382 1.00 0.00 O ATOM 1284 CB TYR A 137 -10.872 -9.775 3.519 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.251 -9.217 3.319 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.365 -9.983 3.662 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.416 -7.948 2.769 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -14.645 -9.481 3.455 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -13.693 -7.440 2.566 1.00 0.00 C ATOM 1290 CZ TYR A 137 -14.813 -8.206 2.906 1.00 0.00 C ATOM 1291 OH TYR A 137 -16.081 -7.708 2.691 1.00 0.00 O ATOM 0 H TYR A 137 -9.657 -11.834 2.229 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.576 -9.106 1.491 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -10.939 -10.790 3.911 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.338 -9.181 4.261 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.233 -10.966 4.089 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -11.551 -7.359 2.500 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.508 -10.075 3.718 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -13.821 -6.453 2.146 1.00 0.00 H new ATOM 0 HH TYR A 137 -16.697 -8.084 3.354 1.00 0.00 H new ATOM 1301 N ILE A 138 -8.191 -8.406 1.603 1.00 0.00 N ATOM 1302 CA ILE A 138 -6.838 -7.888 1.733 1.00 0.00 C ATOM 1303 C ILE A 138 -6.807 -6.804 2.805 1.00 0.00 C ATOM 1304 O ILE A 138 -7.235 -5.684 2.566 1.00 0.00 O ATOM 1305 CB ILE A 138 -6.390 -7.283 0.398 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.688 -8.263 -0.745 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -4.888 -6.991 0.441 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -6.310 -7.633 -2.088 1.00 0.00 C ATOM 0 H ILE A 138 -8.722 -8.018 0.823 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.168 -8.701 2.012 1.00 0.00 H new ATOM 0 HB ILE A 138 -6.935 -6.355 0.228 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -6.129 -9.187 -0.598 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.746 -8.526 -0.743 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.574 -6.561 -0.510 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -4.677 -6.286 1.245 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.342 -7.918 0.618 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.525 -8.336 -2.893 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.889 -6.721 -2.238 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.247 -7.393 -2.091 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.297 -7.152 3.978 1.00 0.00 N ATOM 1321 CA VAL A 139 -6.210 -6.231 5.098 1.00 0.00 C ATOM 1322 C VAL A 139 -4.774 -5.780 5.332 1.00 0.00 C ATOM 1323 O VAL A 139 -3.842 -6.580 5.287 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.737 -6.908 6.362 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -6.501 -5.987 7.556 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -8.238 -7.173 6.215 1.00 0.00 C ATOM 0 H VAL A 139 -5.932 -8.083 4.178 1.00 0.00 H new ATOM 0 HA VAL A 139 -6.814 -5.354 4.862 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.217 -7.854 6.515 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -6.875 -6.463 8.462 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -5.433 -5.794 7.661 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.026 -5.045 7.398 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -8.612 -7.656 7.118 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -8.761 -6.229 6.065 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -8.410 -7.823 5.357 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.611 -4.495 5.589 1.00 0.00 N ATOM 1337 CA GLU A 140 -3.290 -3.939 5.842 1.00 0.00 C ATOM 1338 C GLU A 140 -3.087 -3.717 7.337 1.00 0.00 C ATOM 1339 O GLU A 140 -3.680 -2.816 7.928 1.00 0.00 O ATOM 1340 CB GLU A 140 -3.124 -2.609 5.100 1.00 0.00 C ATOM 1341 CG GLU A 140 -3.269 -2.841 3.596 1.00 0.00 C ATOM 1342 CD GLU A 140 -2.076 -3.637 3.078 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -1.096 -3.733 3.799 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -2.158 -4.136 1.969 1.00 0.00 O ATOM 0 H GLU A 140 -5.372 -3.817 5.628 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.544 -4.647 5.481 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.872 -1.894 5.442 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -2.147 -2.178 5.319 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -4.194 -3.379 3.389 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -3.333 -1.885 3.076 1.00 0.00 H new ATOM 1351 N ALA A 141 -2.248 -4.550 7.943 1.00 0.00 N ATOM 1352 CA ALA A 141 -1.980 -4.438 9.371 1.00 0.00 C ATOM 1353 C ALA A 141 -1.183 -3.177 9.672 1.00 0.00 C ATOM 1354 O ALA A 141 -0.306 -2.787 8.901 1.00 0.00 O ATOM 1355 CB ALA A 141 -1.199 -5.662 9.848 1.00 0.00 C ATOM 0 H ALA A 141 -1.746 -5.303 7.473 1.00 0.00 H new ATOM 0 HA ALA A 141 -2.933 -4.383 9.897 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.001 -5.574 10.916 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -1.784 -6.563 9.661 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.254 -5.724 9.308 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.490 -2.543 10.802 1.00 0.00 N ATOM 1362 CA ASN A 142 -0.782 -1.327 11.189 1.00 0.00 C ATOM 1363 C ASN A 142 0.725 -1.549 11.154 1.00 0.00 C ATOM 1364 O ASN A 142 1.491 -0.634 10.856 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.200 -0.908 12.597 1.00 0.00 C ATOM 1366 CG ASN A 142 -1.994 0.391 12.541 1.00 0.00 C ATOM 1367 OD1 ASN A 142 -1.650 1.296 11.780 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -3.042 0.539 13.304 1.00 0.00 N ATOM 0 H ASN A 142 -2.212 -2.845 11.456 1.00 0.00 H new ATOM 0 HA ASN A 142 -1.039 -0.539 10.481 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -1.803 -1.693 13.055 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -0.318 -0.778 13.223 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -3.579 1.406 13.271 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -3.325 -0.212 13.933 1.00 0.00 H new ATOM 1375 N ALA A 143 1.143 -2.770 11.464 1.00 0.00 N ATOM 1376 CA ALA A 143 2.561 -3.101 11.465 1.00 0.00 C ATOM 1377 C ALA A 143 2.789 -4.575 11.113 1.00 0.00 C ATOM 1378 O ALA A 143 1.868 -5.400 11.176 1.00 0.00 O ATOM 1379 CB ALA A 143 3.174 -2.809 12.835 1.00 0.00 C ATOM 0 H ALA A 143 0.525 -3.542 11.716 1.00 0.00 H new ATOM 0 HA ALA A 143 3.043 -2.483 10.708 1.00 0.00 H new ATOM 0 HB1 ALA A 143 4.234 -3.061 12.820 1.00 0.00 H new ATOM 0 HB2 ALA A 143 3.056 -1.751 13.068 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.669 -3.406 13.594 1.00 0.00 H new ATOM 1385 N PRO A 144 3.997 -4.921 10.750 1.00 0.00 N ATOM 1386 CA PRO A 144 4.357 -6.323 10.389 1.00 0.00 C ATOM 1387 C PRO A 144 4.074 -7.294 11.524 1.00 0.00 C ATOM 1388 O PRO A 144 3.803 -8.469 11.292 1.00 0.00 O ATOM 1389 CB PRO A 144 5.857 -6.258 10.090 1.00 0.00 C ATOM 1390 CG PRO A 144 6.137 -4.826 9.790 1.00 0.00 C ATOM 1391 CD PRO A 144 5.159 -4.022 10.640 1.00 0.00 C ATOM 0 HA PRO A 144 3.770 -6.688 9.546 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.443 -6.603 10.942 1.00 0.00 H new ATOM 0 HB3 PRO A 144 6.117 -6.895 9.245 1.00 0.00 H new ATOM 0 HG2 PRO A 144 7.168 -4.570 10.034 1.00 0.00 H new ATOM 0 HG3 PRO A 144 5.998 -4.615 8.730 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.577 -3.782 11.618 1.00 0.00 H new ATOM 0 HD3 PRO A 144 4.894 -3.077 10.166 1.00 0.00 H new ATOM 1399 N ASN A 145 4.140 -6.801 12.752 1.00 0.00 N ATOM 1400 CA ASN A 145 3.881 -7.642 13.913 1.00 0.00 C ATOM 1401 C ASN A 145 2.384 -7.690 14.241 1.00 0.00 C ATOM 1402 O ASN A 145 1.965 -8.429 15.131 1.00 0.00 O ATOM 1403 CB ASN A 145 4.651 -7.099 15.114 1.00 0.00 C ATOM 1404 CG ASN A 145 6.151 -7.256 14.892 1.00 0.00 C ATOM 1405 OD1 ASN A 145 6.625 -8.359 14.618 1.00 0.00 O ATOM 1406 ND2 ASN A 145 6.928 -6.212 14.982 1.00 0.00 N ATOM 0 H ASN A 145 4.369 -5.831 12.970 1.00 0.00 H new ATOM 0 HA ASN A 145 4.211 -8.655 13.684 1.00 0.00 H new ATOM 0 HB2 ASN A 145 4.407 -6.048 15.267 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.352 -7.630 16.017 1.00 0.00 H new ATOM 0 HD21 ASN A 145 7.931 -6.308 14.825 1.00 0.00 H new ATOM 0 HD22 ASN A 145 6.532 -5.300 15.209 1.00 0.00 H new ATOM 1413 N ASP A 146 1.587 -6.903 13.525 1.00 0.00 N ATOM 1414 CA ASP A 146 0.148 -6.862 13.745 1.00 0.00 C ATOM 1415 C ASP A 146 -0.572 -7.757 12.743 1.00 0.00 C ATOM 1416 O ASP A 146 -1.730 -8.111 12.934 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.352 -5.425 13.572 1.00 0.00 C ATOM 1418 CG ASP A 146 0.169 -4.547 14.706 1.00 0.00 C ATOM 1419 OD1 ASP A 146 0.585 -5.097 15.711 1.00 0.00 O ATOM 1420 OD2 ASP A 146 0.150 -3.335 14.550 1.00 0.00 O ATOM 0 H ASP A 146 1.916 -6.283 12.785 1.00 0.00 H new ATOM 0 HA ASP A 146 -0.059 -7.216 14.755 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -0.019 -5.029 12.613 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.442 -5.410 13.562 1.00 0.00 H new ATOM 1425 N VAL A 147 0.127 -8.119 11.670 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.456 -8.965 10.635 1.00 0.00 C ATOM 1427 C VAL A 147 -0.916 -10.273 11.250 1.00 0.00 C ATOM 1428 O VAL A 147 -1.924 -10.852 10.843 1.00 0.00 O ATOM 1429 CB VAL A 147 0.587 -9.250 9.546 1.00 0.00 C ATOM 1430 CG1 VAL A 147 1.118 -7.932 8.976 1.00 0.00 C ATOM 1431 CG2 VAL A 147 1.748 -10.077 10.129 1.00 0.00 C ATOM 0 H VAL A 147 1.093 -7.841 11.496 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.308 -8.451 10.190 1.00 0.00 H new ATOM 0 HB VAL A 147 0.116 -9.820 8.745 1.00 0.00 H new ATOM 0 HG11 VAL A 147 1.858 -8.142 8.204 1.00 0.00 H new ATOM 0 HG12 VAL A 147 0.294 -7.364 8.545 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.581 -7.351 9.774 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.483 -10.274 9.348 1.00 0.00 H new ATOM 0 HG22 VAL A 147 2.220 -9.521 10.939 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.364 -11.022 10.513 1.00 0.00 H new ATOM 1441 N LYS A 148 -0.171 -10.721 12.247 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.506 -11.965 12.932 1.00 0.00 C ATOM 1443 C LYS A 148 -1.708 -11.775 13.844 1.00 0.00 C ATOM 1444 O LYS A 148 -2.520 -12.682 14.019 1.00 0.00 O ATOM 1445 CB LYS A 148 0.683 -12.458 13.769 1.00 0.00 C ATOM 1446 CG LYS A 148 1.233 -11.322 14.644 1.00 0.00 C ATOM 1447 CD LYS A 148 1.102 -11.700 16.117 1.00 0.00 C ATOM 1448 CE LYS A 148 2.248 -12.630 16.512 1.00 0.00 C ATOM 1449 NZ LYS A 148 3.423 -11.815 16.929 1.00 0.00 N ATOM 0 H LYS A 148 0.662 -10.250 12.600 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.747 -12.706 12.170 1.00 0.00 H new ATOM 0 HB2 LYS A 148 0.371 -13.291 14.399 1.00 0.00 H new ATOM 0 HB3 LYS A 148 1.468 -12.831 13.112 1.00 0.00 H new ATOM 0 HG2 LYS A 148 2.278 -11.134 14.398 1.00 0.00 H new ATOM 0 HG3 LYS A 148 0.687 -10.400 14.445 1.00 0.00 H new ATOM 0 HD2 LYS A 148 1.119 -10.803 16.736 1.00 0.00 H new ATOM 0 HD3 LYS A 148 0.145 -12.191 16.293 1.00 0.00 H new ATOM 0 HE2 LYS A 148 1.937 -13.283 17.327 1.00 0.00 H new ATOM 0 HE3 LYS A 148 2.516 -13.272 15.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 4.205 -12.446 17.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 3.723 -11.209 16.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 3.162 -11.220 17.741 1.00 0.00 H new ATOM 1463 N THR A 149 -1.810 -10.587 14.419 1.00 0.00 N ATOM 1464 CA THR A 149 -2.911 -10.273 15.317 1.00 0.00 C ATOM 1465 C THR A 149 -4.210 -10.132 14.543 1.00 0.00 C ATOM 1466 O THR A 149 -5.271 -10.553 15.000 1.00 0.00 O ATOM 1467 CB THR A 149 -2.615 -8.979 16.090 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.410 -9.147 16.828 1.00 0.00 O ATOM 1469 CG2 THR A 149 -3.762 -8.678 17.062 1.00 0.00 C ATOM 0 H THR A 149 -1.146 -9.826 14.281 1.00 0.00 H new ATOM 0 HA THR A 149 -3.018 -11.093 16.027 1.00 0.00 H new ATOM 0 HB THR A 149 -2.513 -8.152 15.387 1.00 0.00 H new ATOM 0 HG1 THR A 149 -1.212 -8.325 17.323 1.00 0.00 H new ATOM 0 HG21 THR A 149 -3.546 -7.759 17.607 1.00 0.00 H new ATOM 0 HG22 THR A 149 -4.690 -8.559 16.503 1.00 0.00 H new ATOM 0 HG23 THR A 149 -3.867 -9.502 17.768 1.00 0.00 H new ATOM 1477 N ILE A 150 -4.112 -9.521 13.375 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.275 -9.301 12.539 1.00 0.00 C ATOM 1479 C ILE A 150 -5.829 -10.619 12.038 1.00 0.00 C ATOM 1480 O ILE A 150 -7.040 -10.816 11.988 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.900 -8.411 11.350 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.461 -7.028 11.848 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -6.107 -8.255 10.429 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.657 -6.220 12.366 1.00 0.00 C ATOM 0 H ILE A 150 -3.238 -9.169 12.986 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.041 -8.805 13.135 1.00 0.00 H new ATOM 0 HB ILE A 150 -4.078 -8.875 10.805 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.724 -7.142 12.643 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -3.975 -6.484 11.038 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.840 -7.622 9.583 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.416 -9.235 10.065 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.928 -7.797 10.980 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.315 -5.245 12.712 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.381 -6.086 11.562 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -6.126 -6.754 13.192 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.935 -11.520 11.666 1.00 0.00 N ATOM 1497 CA ALA A 151 -5.359 -12.815 11.167 1.00 0.00 C ATOM 1498 C ALA A 151 -6.077 -13.597 12.256 1.00 0.00 C ATOM 1499 O ALA A 151 -7.100 -14.249 12.015 1.00 0.00 O ATOM 1500 CB ALA A 151 -4.140 -13.603 10.662 1.00 0.00 C ATOM 0 H ALA A 151 -3.925 -11.381 11.699 1.00 0.00 H new ATOM 0 HA ALA A 151 -6.053 -12.663 10.340 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -4.464 -14.574 10.289 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.656 -13.048 9.858 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.435 -13.746 11.481 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.537 -13.516 13.461 1.00 0.00 N ATOM 1507 CA GLU A 152 -6.129 -14.223 14.590 1.00 0.00 C ATOM 1508 C GLU A 152 -7.468 -13.614 14.967 1.00 0.00 C ATOM 1509 O GLU A 152 -8.418 -14.324 15.299 1.00 0.00 O ATOM 1510 CB GLU A 152 -5.176 -14.188 15.793 1.00 0.00 C ATOM 1511 CG GLU A 152 -3.949 -15.062 15.512 1.00 0.00 C ATOM 1512 CD GLU A 152 -4.366 -16.515 15.303 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -5.096 -17.025 16.136 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -3.952 -17.092 14.312 1.00 0.00 O ATOM 0 H GLU A 152 -4.701 -12.976 13.684 1.00 0.00 H new ATOM 0 HA GLU A 152 -6.295 -15.260 14.296 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -4.865 -13.162 15.992 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -5.690 -14.544 16.686 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -3.429 -14.696 14.627 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -3.248 -14.994 16.344 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.534 -12.295 14.912 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.759 -11.592 15.248 1.00 0.00 C ATOM 1523 C ASP A 153 -9.819 -11.808 14.172 1.00 0.00 C ATOM 1524 O ASP A 153 -11.009 -11.914 14.465 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.485 -10.095 15.412 1.00 0.00 C ATOM 1526 CG ASP A 153 -7.680 -9.852 16.685 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -7.549 -10.780 17.465 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -7.215 -8.736 16.867 1.00 0.00 O ATOM 0 H ASP A 153 -6.758 -11.692 14.639 1.00 0.00 H new ATOM 0 HA ASP A 153 -9.132 -11.992 16.191 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -7.937 -9.720 14.548 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -9.426 -9.547 15.456 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.367 -11.868 12.926 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.263 -12.061 11.796 1.00 0.00 C ATOM 1535 C ALA A 154 -10.976 -13.398 11.910 1.00 0.00 C ATOM 1536 O ALA A 154 -12.140 -13.530 11.529 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.496 -11.980 10.472 1.00 0.00 C ATOM 0 H ALA A 154 -8.382 -11.785 12.673 1.00 0.00 H new ATOM 0 HA ALA A 154 -11.006 -11.264 11.810 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -10.187 -12.127 9.642 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -9.026 -11.001 10.383 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.729 -12.754 10.448 1.00 0.00 H new ATOM 1543 N LYS A 155 -10.264 -14.389 12.432 1.00 0.00 N ATOM 1544 CA LYS A 155 -10.830 -15.727 12.585 1.00 0.00 C ATOM 1545 C LYS A 155 -12.038 -15.710 13.511 1.00 0.00 C ATOM 1546 O LYS A 155 -12.854 -16.633 13.498 1.00 0.00 O ATOM 1547 CB LYS A 155 -9.779 -16.684 13.144 1.00 0.00 C ATOM 1548 CG LYS A 155 -8.844 -17.130 12.020 1.00 0.00 C ATOM 1549 CD LYS A 155 -7.745 -18.018 12.601 1.00 0.00 C ATOM 1550 CE LYS A 155 -7.327 -19.059 11.561 1.00 0.00 C ATOM 1551 NZ LYS A 155 -6.145 -19.816 12.058 1.00 0.00 N ATOM 0 H LYS A 155 -9.301 -14.295 12.755 1.00 0.00 H new ATOM 0 HA LYS A 155 -11.149 -16.067 11.600 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -9.208 -16.193 13.933 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -10.264 -17.551 13.593 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -9.404 -17.675 11.260 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.405 -16.261 11.530 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -6.887 -17.411 12.889 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -8.102 -18.513 13.504 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -8.153 -19.743 11.364 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -7.087 -18.569 10.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -5.863 -20.523 11.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -5.357 -19.159 12.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -6.389 -20.296 12.948 1.00 0.00 H new ATOM 1565 N LYS A 156 -12.156 -14.657 14.306 1.00 0.00 N ATOM 1566 CA LYS A 156 -13.281 -14.534 15.227 1.00 0.00 C ATOM 1567 C LYS A 156 -14.471 -13.868 14.539 1.00 0.00 C ATOM 1568 O LYS A 156 -15.586 -13.887 15.061 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.864 -13.702 16.448 1.00 0.00 C ATOM 1570 CG LYS A 156 -13.535 -12.318 16.409 1.00 0.00 C ATOM 1571 CD LYS A 156 -12.987 -11.449 17.538 1.00 0.00 C ATOM 1572 CE LYS A 156 -11.814 -10.624 17.019 1.00 0.00 C ATOM 1573 NZ LYS A 156 -11.435 -9.611 18.044 1.00 0.00 N ATOM 0 H LYS A 156 -11.495 -13.881 14.334 1.00 0.00 H new ATOM 0 HA LYS A 156 -13.576 -15.533 15.547 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -13.144 -14.223 17.364 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -11.780 -13.587 16.465 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -13.350 -11.840 15.447 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -14.615 -12.424 16.510 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -13.769 -10.791 17.918 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -12.665 -12.075 18.370 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -10.966 -11.273 16.801 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -12.086 -10.130 16.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -10.635 -9.046 17.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -12.245 -8.986 18.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -11.160 -10.093 18.923 1.00 0.00 H new ATOM 1587 N ILE A 157 -14.218 -13.252 13.384 1.00 0.00 N ATOM 1588 CA ILE A 157 -15.271 -12.551 12.658 1.00 0.00 C ATOM 1589 C ILE A 157 -16.425 -13.498 12.329 1.00 0.00 C ATOM 1590 O ILE A 157 -17.253 -13.776 13.194 1.00 0.00 O ATOM 1591 CB ILE A 157 -14.701 -11.925 11.375 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -13.528 -11.003 11.715 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -15.796 -11.111 10.667 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -14.038 -9.671 12.252 1.00 0.00 C ATOM 0 H ILE A 157 -13.302 -13.225 12.937 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.659 -11.754 13.293 1.00 0.00 H new ATOM 0 HB ILE A 157 -14.353 -12.723 10.719 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -12.886 -11.479 12.456 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -12.920 -10.835 10.826 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -15.390 -10.668 9.758 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -16.628 -11.766 10.411 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -16.148 -10.320 11.330 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -13.192 -9.026 12.489 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -14.661 -9.189 11.498 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -14.627 -9.843 13.153 1.00 0.00 H new ATOM 1606 N GLU A 158 -16.484 -13.991 11.083 1.00 0.00 N ATOM 1607 CA GLU A 158 -17.541 -14.891 10.664 1.00 0.00 C ATOM 1608 C GLU A 158 -17.464 -15.101 9.156 1.00 0.00 C ATOM 1609 O GLU A 158 -17.229 -14.156 8.404 1.00 0.00 O ATOM 1610 CB GLU A 158 -18.910 -14.315 11.010 1.00 0.00 C ATOM 1611 CG GLU A 158 -18.932 -12.823 10.683 1.00 0.00 C ATOM 1612 CD GLU A 158 -20.369 -12.330 10.610 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -21.026 -12.631 9.626 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -20.795 -11.662 11.537 1.00 0.00 O ATOM 0 H GLU A 158 -15.804 -13.774 10.354 1.00 0.00 H new ATOM 0 HA GLU A 158 -17.411 -15.839 11.186 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -19.687 -14.833 10.448 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -19.125 -14.470 12.067 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -18.386 -12.267 11.445 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -18.428 -12.642 9.734 1.00 0.00 H new ATOM 1621 N GLY A 159 -17.657 -16.338 8.722 1.00 0.00 N ATOM 1622 CA GLY A 159 -17.603 -16.652 7.302 1.00 0.00 C ATOM 1623 C GLY A 159 -16.166 -16.759 6.804 1.00 0.00 C ATOM 1624 O GLY A 159 -15.921 -16.761 5.601 1.00 0.00 O ATOM 0 H GLY A 159 -17.851 -17.135 9.328 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -18.124 -17.592 7.117 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.127 -15.880 6.738 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.215 -16.841 7.729 1.00 0.00 N ATOM 1629 CA VAL A 160 -13.812 -16.947 7.354 1.00 0.00 C ATOM 1630 C VAL A 160 -13.463 -18.392 7.009 1.00 0.00 C ATOM 1631 O VAL A 160 -13.713 -19.304 7.797 1.00 0.00 O ATOM 1632 CB VAL A 160 -12.935 -16.466 8.513 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -11.464 -16.712 8.178 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -13.164 -14.969 8.735 1.00 0.00 C ATOM 0 H VAL A 160 -15.389 -16.836 8.734 1.00 0.00 H new ATOM 0 HA VAL A 160 -13.632 -16.325 6.477 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.196 -17.014 9.418 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -10.841 -16.369 9.004 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -11.301 -17.778 8.018 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -11.200 -16.165 7.273 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -12.541 -14.624 9.560 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -12.902 -14.423 7.829 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -14.213 -14.793 8.974 1.00 0.00 H new ATOM 1644 N SER A 161 -12.879 -18.594 5.832 1.00 0.00 N ATOM 1645 CA SER A 161 -12.492 -19.928 5.401 1.00 0.00 C ATOM 1646 C SER A 161 -11.022 -20.180 5.704 1.00 0.00 C ATOM 1647 O SER A 161 -10.631 -21.302 6.031 1.00 0.00 O ATOM 1648 CB SER A 161 -12.720 -20.064 3.901 1.00 0.00 C ATOM 1649 OG SER A 161 -11.770 -19.271 3.201 1.00 0.00 O ATOM 0 H SER A 161 -12.665 -17.853 5.164 1.00 0.00 H new ATOM 0 HA SER A 161 -13.097 -20.657 5.939 1.00 0.00 H new ATOM 0 HB2 SER A 161 -12.628 -21.108 3.602 1.00 0.00 H new ATOM 0 HB3 SER A 161 -13.731 -19.747 3.646 1.00 0.00 H new ATOM 0 HG SER A 161 -12.213 -18.810 2.458 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.207 -19.133 5.591 1.00 0.00 N ATOM 1656 CA GLU A 162 -8.773 -19.272 5.856 1.00 0.00 C ATOM 1657 C GLU A 162 -8.095 -17.914 5.896 1.00 0.00 C ATOM 1658 O GLU A 162 -8.599 -16.943 5.347 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.122 -20.139 4.769 1.00 0.00 C ATOM 1660 CG GLU A 162 -6.945 -20.928 5.357 1.00 0.00 C ATOM 1661 CD GLU A 162 -7.025 -22.388 4.925 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -7.394 -22.630 3.786 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -6.713 -23.242 5.737 1.00 0.00 O ATOM 0 H GLU A 162 -10.505 -18.195 5.323 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.651 -19.750 6.828 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.858 -20.826 4.352 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -7.774 -19.509 3.950 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -6.003 -20.493 5.024 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -6.960 -20.861 6.445 1.00 0.00 H new ATOM 1670 N VAL A 163 -6.947 -17.851 6.551 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.208 -16.608 6.647 1.00 0.00 C ATOM 1672 C VAL A 163 -4.756 -16.821 6.239 1.00 0.00 C ATOM 1673 O VAL A 163 -4.155 -17.851 6.543 1.00 0.00 O ATOM 1674 CB VAL A 163 -6.258 -16.091 8.081 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -7.711 -15.832 8.486 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -5.640 -17.125 9.023 1.00 0.00 C ATOM 0 H VAL A 163 -6.510 -18.644 7.021 1.00 0.00 H new ATOM 0 HA VAL A 163 -6.662 -15.879 5.976 1.00 0.00 H new ATOM 0 HB VAL A 163 -5.694 -15.160 8.147 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -7.743 -15.463 9.511 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -8.148 -15.089 7.819 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -8.279 -16.760 8.417 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -5.677 -16.753 10.047 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -6.199 -18.058 8.956 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -4.603 -17.302 8.739 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.197 -15.833 5.552 1.00 0.00 N ATOM 1687 CA GLN A 164 -2.810 -15.904 5.103 1.00 0.00 C ATOM 1688 C GLN A 164 -2.133 -14.541 5.213 1.00 0.00 C ATOM 1689 O GLN A 164 -2.562 -13.575 4.588 1.00 0.00 O ATOM 1690 CB GLN A 164 -2.756 -16.390 3.651 1.00 0.00 C ATOM 1691 CG GLN A 164 -1.465 -15.899 3.002 1.00 0.00 C ATOM 1692 CD GLN A 164 -1.183 -16.694 1.730 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -2.094 -16.955 0.944 1.00 0.00 O ATOM 1694 NE2 GLN A 164 0.032 -17.104 1.483 1.00 0.00 N ATOM 0 H GLN A 164 -4.681 -14.973 5.293 1.00 0.00 H new ATOM 0 HA GLN A 164 -2.279 -16.608 5.743 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -2.802 -17.479 3.618 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -3.619 -16.018 3.099 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -1.548 -14.838 2.766 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -0.634 -16.007 3.699 1.00 0.00 H new ATOM 0 HE21 GLN A 164 0.786 -16.887 2.135 1.00 0.00 H new ATOM 0 HE22 GLN A 164 0.227 -17.641 0.638 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.069 -14.470 6.004 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.347 -13.217 6.175 1.00 0.00 C ATOM 1705 C ASP A 165 0.631 -12.992 5.026 1.00 0.00 C ATOM 1706 O ASP A 165 0.829 -13.870 4.186 1.00 0.00 O ATOM 1707 CB ASP A 165 0.409 -13.239 7.505 1.00 0.00 C ATOM 1708 CG ASP A 165 1.464 -14.344 7.496 1.00 0.00 C ATOM 1709 OD1 ASP A 165 1.516 -15.084 6.529 1.00 0.00 O ATOM 1710 OD2 ASP A 165 2.204 -14.434 8.462 1.00 0.00 O ATOM 0 H ASP A 165 -0.691 -15.257 6.532 1.00 0.00 H new ATOM 0 HA ASP A 165 -1.067 -12.398 6.176 1.00 0.00 H new ATOM 0 HB2 ASP A 165 0.885 -12.274 7.677 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -0.290 -13.400 8.326 1.00 0.00 H new ATOM 1715 N GLY A 166 1.246 -11.814 5.002 1.00 0.00 N ATOM 1716 CA GLY A 166 2.208 -11.490 3.953 1.00 0.00 C ATOM 1717 C GLY A 166 3.517 -12.241 4.166 1.00 0.00 C ATOM 1718 O GLY A 166 3.823 -12.674 5.278 1.00 0.00 O ATOM 0 H GLY A 166 1.098 -11.074 5.689 1.00 0.00 H new ATOM 0 HA2 GLY A 166 1.791 -11.747 2.979 1.00 0.00 H new ATOM 0 HA3 GLY A 166 2.397 -10.416 3.946 1.00 0.00 H new