USER MOD reduce.3.24.130724 H: found=0, std=0, add=472, rem=0, adj=17 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 Set 1.1: A 89 LYS NZ :NH3+ -122:sc= 0.55 (180deg=0) USER MOD Set 1.2: A 93 SER OG : rot 77:sc= 0.976 USER MOD Set 2.1: A 63 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 164 GLN : amide:sc= -1.57 K(o=-1.6,f=-2.7!) USER MOD Single : A 91 TYR OH : rot 13:sc= -0.256 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.385 X(o=-0.39,f=-0.22) USER MOD Single : A 97 MET CE :methyl -157:sc= -0.966 (180deg=-2.37) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.0344 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc=-0.00804 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 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0798) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 30:sc= -0.765 USER MOD Single : A 142 ASN : amide:sc= -0.903 K(o=-0.9,f=-5.4!) USER MOD Single : A 145 ASN : amide:sc= -0.457 K(o=-0.46,f=-1.1) 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+ -176:sc= 0 (180deg=-0.00759) USER MOD Single : A 161 SER OG : rot -161:sc= 0.166 USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.694 -6.648 5.224 1.00 0.00 N ATOM 32 CA ARG A 59 -0.423 -7.080 4.391 1.00 0.00 C ATOM 33 C ARG A 59 -0.941 -8.455 4.829 1.00 0.00 C ATOM 34 O ARG A 59 -0.174 -9.324 5.253 1.00 0.00 O ATOM 35 CB ARG A 59 0.011 -7.052 2.900 1.00 0.00 C ATOM 36 CG ARG A 59 0.117 -8.460 2.274 1.00 0.00 C ATOM 37 CD ARG A 59 -1.185 -8.817 1.552 1.00 0.00 C ATOM 38 NE ARG A 59 -0.897 -9.740 0.450 1.00 0.00 N ATOM 39 CZ ARG A 59 -1.590 -9.735 -0.696 1.00 0.00 C ATOM 40 NH1 ARG A 59 -2.589 -8.908 -0.885 1.00 0.00 N ATOM 41 NH2 ARG A 59 -1.256 -10.565 -1.651 1.00 0.00 N ATOM 0 HA ARG A 59 -1.259 -6.391 4.513 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -0.706 -6.460 2.330 1.00 0.00 H new ATOM 0 HB3 ARG A 59 0.975 -6.551 2.818 1.00 0.00 H new ATOM 0 HG2 ARG A 59 0.951 -8.492 1.573 1.00 0.00 H new ATOM 0 HG3 ARG A 59 0.325 -9.196 3.050 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.886 -9.275 2.250 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -1.660 -7.914 1.169 1.00 0.00 H new ATOM 0 HE ARG A 59 -0.138 -10.413 0.561 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.853 -8.251 -0.151 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.103 -8.922 -1.766 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -0.475 -11.207 -1.518 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -1.777 -10.570 -2.528 1.00 0.00 H new ATOM 55 N VAL A 60 -2.252 -8.638 4.729 1.00 0.00 N ATOM 56 CA VAL A 60 -2.880 -9.896 5.106 1.00 0.00 C ATOM 57 C VAL A 60 -4.111 -10.155 4.244 1.00 0.00 C ATOM 58 O VAL A 60 -4.801 -9.225 3.837 1.00 0.00 O ATOM 59 CB VAL A 60 -3.279 -9.880 6.573 1.00 0.00 C ATOM 60 CG1 VAL A 60 -3.964 -11.200 6.923 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.036 -9.709 7.440 1.00 0.00 C ATOM 0 H VAL A 60 -2.901 -7.929 4.389 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.156 -10.695 4.947 1.00 0.00 H new ATOM 0 HB VAL A 60 -3.963 -9.051 6.755 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.252 -11.193 7.974 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -4.853 -11.324 6.304 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.277 -12.026 6.741 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.324 -9.698 8.491 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.350 -10.537 7.261 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.544 -8.770 7.189 1.00 0.00 H new ATOM 71 N VAL A 61 -4.382 -11.420 3.970 1.00 0.00 N ATOM 72 CA VAL A 61 -5.535 -11.788 3.157 1.00 0.00 C ATOM 73 C VAL A 61 -6.459 -12.721 3.942 1.00 0.00 C ATOM 74 O VAL A 61 -6.024 -13.758 4.445 1.00 0.00 O ATOM 75 CB VAL A 61 -5.069 -12.486 1.879 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.285 -12.859 1.033 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.162 -11.543 1.078 1.00 0.00 C ATOM 0 H VAL A 61 -3.823 -12.209 4.296 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.082 -10.882 2.896 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.514 -13.387 2.141 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.955 -13.357 0.121 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.930 -13.530 1.600 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.838 -11.956 0.774 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.831 -12.043 0.168 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.715 -10.641 0.816 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.294 -11.274 1.680 1.00 0.00 H new ATOM 87 N VAL A 62 -7.735 -12.355 4.039 1.00 0.00 N ATOM 88 CA VAL A 62 -8.701 -13.181 4.761 1.00 0.00 C ATOM 89 C VAL A 62 -9.704 -13.789 3.783 1.00 0.00 C ATOM 90 O VAL A 62 -10.485 -13.081 3.161 1.00 0.00 O ATOM 91 CB VAL A 62 -9.444 -12.339 5.807 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.395 -13.232 6.604 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.427 -11.699 6.753 1.00 0.00 C ATOM 0 H VAL A 62 -8.121 -11.503 3.633 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.163 -13.982 5.268 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.019 -11.560 5.307 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.921 -12.632 7.346 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.118 -13.689 5.928 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -9.825 -14.013 7.107 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.950 -11.100 7.498 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.853 -12.480 7.253 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.751 -11.061 6.183 1.00 0.00 H new ATOM 103 N TYR A 63 -9.688 -15.109 3.669 1.00 0.00 N ATOM 104 CA TYR A 63 -10.590 -15.806 2.781 1.00 0.00 C ATOM 105 C TYR A 63 -11.912 -16.064 3.484 1.00 0.00 C ATOM 106 O TYR A 63 -11.953 -16.375 4.674 1.00 0.00 O ATOM 107 CB TYR A 63 -9.969 -17.131 2.333 1.00 0.00 C ATOM 108 CG TYR A 63 -8.766 -16.862 1.459 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.534 -16.544 2.045 1.00 0.00 C ATOM 110 CD2 TYR A 63 -8.877 -16.947 0.066 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.413 -16.313 1.238 1.00 0.00 C ATOM 112 CE2 TYR A 63 -7.756 -16.712 -0.741 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.525 -16.396 -0.155 1.00 0.00 C ATOM 114 OH TYR A 63 -5.419 -16.169 -0.947 1.00 0.00 O ATOM 0 H TYR A 63 -9.054 -15.717 4.187 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.769 -15.186 1.902 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.674 -17.718 3.203 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -10.704 -17.721 1.785 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.449 -16.477 3.120 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.826 -17.194 -0.386 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.463 -16.071 1.690 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.842 -16.775 -1.816 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.666 -16.267 -1.890 1.00 0.00 H new ATOM 124 N ILE A 64 -12.978 -15.921 2.725 1.00 0.00 N ATOM 125 CA ILE A 64 -14.338 -16.111 3.235 1.00 0.00 C ATOM 126 C ILE A 64 -15.012 -17.296 2.558 1.00 0.00 C ATOM 127 O ILE A 64 -14.789 -17.535 1.375 1.00 0.00 O ATOM 128 CB ILE A 64 -15.162 -14.857 2.957 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.494 -13.653 3.629 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.584 -15.026 3.508 1.00 0.00 C ATOM 131 CD1 ILE A 64 -15.168 -12.343 3.189 1.00 0.00 C ATOM 0 H ILE A 64 -12.936 -15.670 1.737 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.278 -16.301 4.307 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.216 -14.697 1.880 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -14.556 -13.754 4.713 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.435 -13.628 3.372 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -17.163 -14.125 3.304 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -17.061 -15.880 3.028 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -16.540 -15.193 4.584 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -14.679 -11.500 3.677 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.083 -12.235 2.108 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -16.221 -12.364 3.469 1.00 0.00 H new ATOM 143 N ARG A 65 -15.838 -18.025 3.315 1.00 0.00 N ATOM 144 CA ARG A 65 -16.546 -19.176 2.767 1.00 0.00 C ATOM 145 C ARG A 65 -17.127 -18.812 1.415 1.00 0.00 C ATOM 146 O ARG A 65 -17.635 -17.700 1.267 1.00 0.00 O ATOM 147 CB ARG A 65 -17.681 -19.590 3.702 1.00 0.00 C ATOM 148 CG ARG A 65 -17.179 -20.640 4.694 1.00 0.00 C ATOM 149 CD ARG A 65 -16.546 -19.950 5.902 1.00 0.00 C ATOM 150 NE ARG A 65 -16.177 -20.944 6.902 1.00 0.00 N ATOM 151 CZ ARG A 65 -17.084 -21.494 7.710 1.00 0.00 C ATOM 152 NH1 ARG A 65 -18.350 -21.149 7.634 1.00 0.00 N ATOM 153 NH2 ARG A 65 -16.711 -22.389 8.582 1.00 0.00 N ATOM 0 H ARG A 65 -16.029 -17.838 4.299 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.846 -20.005 2.662 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.057 -18.720 4.239 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -18.513 -19.992 3.123 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -18.006 -21.273 5.017 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -16.449 -21.290 4.211 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -15.665 -19.389 5.591 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.246 -19.232 6.330 1.00 0.00 H new ATOM 0 HE ARG A 65 -15.200 -21.226 6.986 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -18.649 -20.453 6.951 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -19.034 -21.577 8.258 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -15.731 -22.664 8.643 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -17.400 -22.814 9.203 1.00 0.00 H new ATOM 517 N LYS A 89 -21.143 -6.669 6.244 1.00 0.00 N ATOM 518 CA LYS A 89 -21.018 -7.060 7.640 1.00 0.00 C ATOM 519 C LYS A 89 -19.593 -7.471 7.962 1.00 0.00 C ATOM 520 O LYS A 89 -19.027 -7.063 8.977 1.00 0.00 O ATOM 521 CB LYS A 89 -21.960 -8.230 7.927 1.00 0.00 C ATOM 522 CG LYS A 89 -22.088 -8.442 9.433 1.00 0.00 C ATOM 523 CD LYS A 89 -21.096 -9.516 9.887 1.00 0.00 C ATOM 524 CE LYS A 89 -20.549 -9.149 11.266 1.00 0.00 C ATOM 525 NZ LYS A 89 -19.323 -9.950 11.550 1.00 0.00 N ATOM 0 HA LYS A 89 -21.282 -6.206 8.263 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -22.941 -8.032 7.495 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.581 -9.137 7.455 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.894 -7.508 9.960 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -23.105 -8.743 9.683 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -21.587 -10.488 9.925 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -20.279 -9.599 9.170 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -20.317 -8.085 11.304 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.304 -9.338 12.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -19.461 -10.499 12.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -19.141 -10.599 10.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.511 -9.311 11.668 1.00 0.00 H new ATOM 539 N VAL A 90 -19.019 -8.279 7.089 1.00 0.00 N ATOM 540 CA VAL A 90 -17.656 -8.739 7.285 1.00 0.00 C ATOM 541 C VAL A 90 -16.685 -7.586 7.094 1.00 0.00 C ATOM 542 O VAL A 90 -15.698 -7.460 7.814 1.00 0.00 O ATOM 543 CB VAL A 90 -17.320 -9.869 6.317 1.00 0.00 C ATOM 544 CG1 VAL A 90 -15.841 -10.237 6.473 1.00 0.00 C ATOM 545 CG2 VAL A 90 -18.189 -11.089 6.640 1.00 0.00 C ATOM 0 H VAL A 90 -19.471 -8.628 6.244 1.00 0.00 H new ATOM 0 HA VAL A 90 -17.566 -9.120 8.302 1.00 0.00 H new ATOM 0 HB VAL A 90 -17.512 -9.549 5.293 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -15.592 -11.044 5.784 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -15.224 -9.367 6.250 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -15.653 -10.562 7.496 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -17.951 -11.898 5.950 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -17.994 -11.414 7.662 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -19.241 -10.823 6.539 1.00 0.00 H new ATOM 555 N TYR A 91 -16.980 -6.750 6.109 1.00 0.00 N ATOM 556 CA TYR A 91 -16.144 -5.599 5.809 1.00 0.00 C ATOM 557 C TYR A 91 -16.119 -4.652 6.986 1.00 0.00 C ATOM 558 O TYR A 91 -15.070 -4.134 7.362 1.00 0.00 O ATOM 559 CB TYR A 91 -16.673 -4.863 4.575 1.00 0.00 C ATOM 560 CG TYR A 91 -15.759 -3.706 4.231 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.425 -3.949 3.891 1.00 0.00 C ATOM 562 CD2 TYR A 91 -16.255 -2.397 4.215 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.587 -2.888 3.538 1.00 0.00 C ATOM 564 CE2 TYR A 91 -15.413 -1.332 3.867 1.00 0.00 C ATOM 565 CZ TYR A 91 -14.078 -1.579 3.528 1.00 0.00 C ATOM 566 OH TYR A 91 -13.245 -0.535 3.178 1.00 0.00 O ATOM 0 H TYR A 91 -17.795 -6.849 5.503 1.00 0.00 H new ATOM 0 HA TYR A 91 -15.133 -5.952 5.608 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.737 -5.550 3.731 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.682 -4.496 4.765 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -14.041 -4.959 3.901 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -17.287 -2.208 4.471 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.558 -3.080 3.272 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -15.794 -0.322 3.860 1.00 0.00 H new ATOM 0 HH TYR A 91 -12.426 -0.891 2.773 1.00 0.00 H new ATOM 576 N ASP A 92 -17.289 -4.424 7.557 1.00 0.00 N ATOM 577 CA ASP A 92 -17.394 -3.516 8.685 1.00 0.00 C ATOM 578 C ASP A 92 -16.620 -4.048 9.870 1.00 0.00 C ATOM 579 O ASP A 92 -15.950 -3.296 10.577 1.00 0.00 O ATOM 580 CB ASP A 92 -18.857 -3.319 9.078 1.00 0.00 C ATOM 581 CG ASP A 92 -19.578 -2.498 8.016 1.00 0.00 C ATOM 582 OD1 ASP A 92 -18.901 -1.836 7.247 1.00 0.00 O ATOM 583 OD2 ASP A 92 -20.797 -2.547 7.982 1.00 0.00 O ATOM 0 H ASP A 92 -18.169 -4.849 7.263 1.00 0.00 H new ATOM 0 HA ASP A 92 -16.972 -2.557 8.386 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -19.344 -4.287 9.193 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -18.918 -2.815 10.042 1.00 0.00 H new ATOM 588 N SER A 93 -16.716 -5.346 10.086 1.00 0.00 N ATOM 589 CA SER A 93 -16.016 -5.958 11.201 1.00 0.00 C ATOM 590 C SER A 93 -14.518 -5.909 10.971 1.00 0.00 C ATOM 591 O SER A 93 -13.750 -5.619 11.883 1.00 0.00 O ATOM 592 CB SER A 93 -16.468 -7.404 11.380 1.00 0.00 C ATOM 593 OG SER A 93 -17.856 -7.426 11.689 1.00 0.00 O ATOM 0 H SER A 93 -17.263 -5.990 9.514 1.00 0.00 H new ATOM 0 HA SER A 93 -16.253 -5.400 12.107 1.00 0.00 H new ATOM 0 HB2 SER A 93 -16.277 -7.972 10.470 1.00 0.00 H new ATOM 0 HB3 SER A 93 -15.898 -7.879 12.178 1.00 0.00 H new ATOM 0 HG SER A 93 -18.375 -7.264 10.874 1.00 0.00 H new ATOM 599 N LEU A 94 -14.116 -6.183 9.739 1.00 0.00 N ATOM 600 CA LEU A 94 -12.700 -6.163 9.385 1.00 0.00 C ATOM 601 C LEU A 94 -12.169 -4.736 9.375 1.00 0.00 C ATOM 602 O LEU A 94 -10.976 -4.506 9.556 1.00 0.00 O ATOM 603 CB LEU A 94 -12.474 -6.817 8.016 1.00 0.00 C ATOM 604 CG LEU A 94 -12.677 -8.337 8.116 1.00 0.00 C ATOM 605 CD1 LEU A 94 -12.770 -8.932 6.708 1.00 0.00 C ATOM 606 CD2 LEU A 94 -11.486 -8.972 8.845 1.00 0.00 C ATOM 0 H LEU A 94 -14.743 -6.421 8.971 1.00 0.00 H new ATOM 0 HA LEU A 94 -12.156 -6.733 10.138 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -13.166 -6.397 7.285 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -11.466 -6.600 7.662 1.00 0.00 H new ATOM 0 HG LEU A 94 -13.595 -8.539 8.668 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.914 -10.010 6.777 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -13.613 -8.487 6.180 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -11.849 -8.723 6.163 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.634 -10.050 8.914 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.569 -8.766 8.292 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -11.407 -8.552 9.848 1.00 0.00 H new ATOM 618 N LYS A 95 -13.059 -3.780 9.148 1.00 0.00 N ATOM 619 CA LYS A 95 -12.656 -2.380 9.111 1.00 0.00 C ATOM 620 C LYS A 95 -12.630 -1.780 10.514 1.00 0.00 C ATOM 621 O LYS A 95 -11.865 -0.859 10.794 1.00 0.00 O ATOM 622 CB LYS A 95 -13.621 -1.579 8.241 1.00 0.00 C ATOM 623 CG LYS A 95 -13.088 -1.519 6.808 1.00 0.00 C ATOM 624 CD LYS A 95 -12.605 -0.100 6.486 1.00 0.00 C ATOM 625 CE LYS A 95 -11.115 0.021 6.814 1.00 0.00 C ATOM 626 NZ LYS A 95 -10.851 1.351 7.436 1.00 0.00 N ATOM 0 H LYS A 95 -14.053 -3.944 8.988 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.652 -2.332 8.689 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -14.608 -2.041 8.254 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -13.736 -0.571 8.640 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -12.268 -2.227 6.686 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -13.870 -1.813 6.108 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -12.775 0.123 5.433 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -13.175 0.629 7.062 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.815 -0.777 7.494 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -10.521 -0.093 5.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.839 1.435 7.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.123 2.105 6.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -11.407 1.442 8.310 1.00 0.00 H new ATOM 640 N ASN A 96 -13.472 -2.313 11.394 1.00 0.00 N ATOM 641 CA ASN A 96 -13.539 -1.827 12.768 1.00 0.00 C ATOM 642 C ASN A 96 -12.833 -2.782 13.731 1.00 0.00 C ATOM 643 O ASN A 96 -12.850 -2.569 14.946 1.00 0.00 O ATOM 644 CB ASN A 96 -15.000 -1.673 13.187 1.00 0.00 C ATOM 645 CG ASN A 96 -15.696 -0.662 12.283 1.00 0.00 C ATOM 646 OD1 ASN A 96 -15.178 0.432 12.055 1.00 0.00 O ATOM 647 ND2 ASN A 96 -16.847 -0.966 11.744 1.00 0.00 N ATOM 0 H ASN A 96 -14.114 -3.077 11.182 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.034 -0.862 12.810 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.507 -2.636 13.128 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -15.057 -1.345 14.225 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -17.317 -0.297 11.134 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -17.275 -1.872 11.933 1.00 0.00 H new ATOM 654 N MET A 97 -12.215 -3.835 13.198 1.00 0.00 N ATOM 655 CA MET A 97 -11.517 -4.802 14.036 1.00 0.00 C ATOM 656 C MET A 97 -10.389 -4.136 14.812 1.00 0.00 C ATOM 657 O MET A 97 -9.882 -4.714 15.775 1.00 0.00 O ATOM 658 CB MET A 97 -10.957 -5.942 13.185 1.00 0.00 C ATOM 659 CG MET A 97 -9.915 -5.395 12.210 1.00 0.00 C ATOM 660 SD MET A 97 -9.603 -6.612 10.903 1.00 0.00 S ATOM 661 CE MET A 97 -9.324 -8.048 11.966 1.00 0.00 C ATOM 0 H MET A 97 -12.184 -4.037 12.199 1.00 0.00 H new ATOM 0 HA MET A 97 -12.236 -5.208 14.747 1.00 0.00 H new ATOM 0 HB2 MET A 97 -10.506 -6.700 13.826 1.00 0.00 H new ATOM 0 HB3 MET A 97 -11.763 -6.428 12.635 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.267 -4.460 11.773 1.00 0.00 H new ATOM 0 HG3 MET A 97 -8.989 -5.171 12.740 1.00 0.00 H new ATOM 0 HE1 MET A 97 -8.732 -8.789 11.429 1.00 0.00 H new ATOM 0 HE2 MET A 97 -8.790 -7.738 12.864 1.00 0.00 H new ATOM 0 HE3 MET A 97 -10.282 -8.484 12.247 1.00 0.00 H new ATOM 671 N SER A 98 -9.988 -2.937 14.364 1.00 0.00 N ATOM 672 CA SER A 98 -8.902 -2.190 14.995 1.00 0.00 C ATOM 673 C SER A 98 -7.567 -2.785 14.579 1.00 0.00 C ATOM 674 O SER A 98 -7.497 -3.967 14.240 1.00 0.00 O ATOM 675 CB SER A 98 -9.028 -2.205 16.521 1.00 0.00 C ATOM 676 OG SER A 98 -8.577 -0.963 17.042 1.00 0.00 O ATOM 0 H SER A 98 -10.406 -2.466 13.562 1.00 0.00 H new ATOM 0 HA SER A 98 -8.962 -1.153 14.664 1.00 0.00 H new ATOM 0 HB2 SER A 98 -10.065 -2.379 16.810 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.440 -3.022 16.938 1.00 0.00 H new ATOM 0 HG SER A 98 -8.658 -0.969 18.019 1.00 0.00 H new ATOM 682 N THR A 99 -6.531 -1.946 14.565 1.00 0.00 N ATOM 683 CA THR A 99 -5.195 -2.372 14.152 1.00 0.00 C ATOM 684 C THR A 99 -5.133 -2.564 12.631 1.00 0.00 C ATOM 685 O THR A 99 -4.118 -3.011 12.095 1.00 0.00 O ATOM 686 CB THR A 99 -4.801 -3.671 14.868 1.00 0.00 C ATOM 687 OG1 THR A 99 -5.195 -3.599 16.230 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.288 -3.864 14.784 1.00 0.00 C ATOM 0 H THR A 99 -6.593 -0.965 14.836 1.00 0.00 H new ATOM 0 HA THR A 99 -4.487 -1.591 14.430 1.00 0.00 H new ATOM 0 HB THR A 99 -5.300 -4.514 14.389 1.00 0.00 H new ATOM 0 HG1 THR A 99 -4.945 -4.429 16.687 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.010 -4.787 15.293 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.986 -3.921 13.738 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.787 -3.022 15.261 1.00 0.00 H new ATOM 696 N VAL A 100 -6.221 -2.206 11.939 1.00 0.00 N ATOM 697 CA VAL A 100 -6.271 -2.336 10.485 1.00 0.00 C ATOM 698 C VAL A 100 -6.205 -0.964 9.815 1.00 0.00 C ATOM 699 O VAL A 100 -6.898 -0.027 10.211 1.00 0.00 O ATOM 700 CB VAL A 100 -7.564 -3.048 10.068 1.00 0.00 C ATOM 701 CG1 VAL A 100 -8.764 -2.374 10.742 1.00 0.00 C ATOM 702 CG2 VAL A 100 -7.724 -2.974 8.545 1.00 0.00 C ATOM 0 H VAL A 100 -7.069 -1.828 12.361 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.411 -2.923 10.164 1.00 0.00 H new ATOM 0 HB VAL A 100 -7.515 -4.092 10.377 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -9.681 -2.882 10.444 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.653 -2.431 11.825 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.813 -1.329 10.437 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.643 -3.480 8.251 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -7.769 -1.930 8.234 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -6.873 -3.459 8.066 1.00 0.00 H new ATOM 712 N LYS A 101 -5.353 -0.855 8.803 1.00 0.00 N ATOM 713 CA LYS A 101 -5.189 0.403 8.082 1.00 0.00 C ATOM 714 C LYS A 101 -6.225 0.533 6.966 1.00 0.00 C ATOM 715 O LYS A 101 -6.930 1.537 6.874 1.00 0.00 O ATOM 716 CB LYS A 101 -3.775 0.479 7.500 1.00 0.00 C ATOM 717 CG LYS A 101 -3.530 1.878 6.939 1.00 0.00 C ATOM 718 CD LYS A 101 -2.024 2.151 6.886 1.00 0.00 C ATOM 719 CE LYS A 101 -1.359 1.216 5.876 1.00 0.00 C ATOM 720 NZ LYS A 101 0.105 1.490 5.846 1.00 0.00 N ATOM 0 H LYS A 101 -4.767 -1.618 8.464 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.340 1.227 8.780 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.040 0.251 8.272 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.653 -0.266 6.714 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -3.961 1.962 5.941 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.024 2.623 7.563 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.844 3.189 6.607 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.585 2.006 7.873 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.541 0.177 6.150 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -1.790 1.365 4.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.563 0.856 5.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.268 2.478 5.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 0.508 1.327 6.791 1.00 0.00 H new ATOM 734 N SER A 102 -6.314 -0.493 6.126 1.00 0.00 N ATOM 735 CA SER A 102 -7.269 -0.495 5.023 1.00 0.00 C ATOM 736 C SER A 102 -7.721 -1.912 4.719 1.00 0.00 C ATOM 737 O SER A 102 -7.007 -2.869 4.997 1.00 0.00 O ATOM 738 CB SER A 102 -6.635 0.126 3.778 1.00 0.00 C ATOM 739 OG SER A 102 -6.305 1.481 4.047 1.00 0.00 O ATOM 0 H SER A 102 -5.738 -1.332 6.187 1.00 0.00 H new ATOM 0 HA SER A 102 -8.137 0.097 5.314 1.00 0.00 H new ATOM 0 HB2 SER A 102 -5.741 -0.429 3.496 1.00 0.00 H new ATOM 0 HB3 SER A 102 -7.325 0.068 2.936 1.00 0.00 H new ATOM 0 HG SER A 102 -5.897 1.882 3.252 1.00 0.00 H new ATOM 745 N VAL A 103 -8.907 -2.030 4.140 1.00 0.00 N ATOM 746 CA VAL A 103 -9.456 -3.338 3.776 1.00 0.00 C ATOM 747 C VAL A 103 -10.024 -3.325 2.353 1.00 0.00 C ATOM 748 O VAL A 103 -10.827 -2.462 2.004 1.00 0.00 O ATOM 749 CB VAL A 103 -10.559 -3.742 4.753 1.00 0.00 C ATOM 750 CG1 VAL A 103 -11.184 -5.070 4.303 1.00 0.00 C ATOM 751 CG2 VAL A 103 -9.978 -3.893 6.166 1.00 0.00 C ATOM 0 H VAL A 103 -9.510 -1.240 3.910 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.642 -4.061 3.822 1.00 0.00 H new ATOM 0 HB VAL A 103 -11.326 -2.968 4.767 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -11.971 -5.357 5.001 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.609 -4.953 3.306 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.417 -5.844 4.282 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.771 -4.181 6.856 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.204 -4.661 6.161 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -9.546 -2.944 6.485 1.00 0.00 H new ATOM 761 N THR A 104 -9.604 -4.293 1.543 1.00 0.00 N ATOM 762 CA THR A 104 -10.072 -4.401 0.166 1.00 0.00 C ATOM 763 C THR A 104 -10.660 -5.782 -0.093 1.00 0.00 C ATOM 764 O THR A 104 -10.059 -6.797 0.244 1.00 0.00 O ATOM 765 CB THR A 104 -8.908 -4.167 -0.799 1.00 0.00 C ATOM 766 OG1 THR A 104 -8.393 -2.857 -0.614 1.00 0.00 O ATOM 767 CG2 THR A 104 -9.386 -4.343 -2.242 1.00 0.00 C ATOM 0 H THR A 104 -8.939 -5.015 1.818 1.00 0.00 H new ATOM 0 HA THR A 104 -10.843 -3.647 0.007 1.00 0.00 H new ATOM 0 HB THR A 104 -8.120 -4.893 -0.597 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.646 -2.709 -1.231 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.553 -4.175 -2.924 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.768 -5.355 -2.378 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.178 -3.625 -2.453 1.00 0.00 H new ATOM 775 N PHE A 105 -11.833 -5.816 -0.702 1.00 0.00 N ATOM 776 CA PHE A 105 -12.480 -7.085 -1.007 1.00 0.00 C ATOM 777 C PHE A 105 -12.070 -7.557 -2.391 1.00 0.00 C ATOM 778 O PHE A 105 -12.359 -6.910 -3.398 1.00 0.00 O ATOM 779 CB PHE A 105 -13.997 -6.913 -0.975 1.00 0.00 C ATOM 780 CG PHE A 105 -14.684 -8.221 -1.302 1.00 0.00 C ATOM 781 CD1 PHE A 105 -14.850 -9.193 -0.309 1.00 0.00 C ATOM 782 CD2 PHE A 105 -15.183 -8.449 -2.591 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.514 -10.386 -0.602 1.00 0.00 C ATOM 784 CE2 PHE A 105 -15.841 -9.649 -2.884 1.00 0.00 C ATOM 785 CZ PHE A 105 -16.009 -10.615 -1.887 1.00 0.00 C ATOM 0 H PHE A 105 -12.354 -4.989 -0.994 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.175 -7.821 -0.263 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.309 -6.567 0.010 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.298 -6.148 -1.691 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -14.464 -9.020 0.685 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.060 -7.699 -3.358 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -15.645 -11.133 0.167 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -16.219 -9.829 -3.880 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.522 -11.539 -2.111 1.00 0.00 H new ATOM 795 N SER A 106 -11.403 -8.692 -2.431 1.00 0.00 N ATOM 796 CA SER A 106 -10.956 -9.262 -3.688 1.00 0.00 C ATOM 797 C SER A 106 -11.785 -10.494 -4.028 1.00 0.00 C ATOM 798 O SER A 106 -11.942 -11.390 -3.201 1.00 0.00 O ATOM 799 CB SER A 106 -9.488 -9.655 -3.588 1.00 0.00 C ATOM 800 OG SER A 106 -9.073 -10.211 -4.826 1.00 0.00 O ATOM 0 H SER A 106 -11.157 -9.240 -1.606 1.00 0.00 H new ATOM 0 HA SER A 106 -11.080 -8.516 -4.473 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.881 -8.783 -3.344 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.346 -10.377 -2.784 1.00 0.00 H new ATOM 0 HG SER A 106 -8.128 -10.465 -4.770 1.00 0.00 H new ATOM 806 N SER A 107 -12.328 -10.528 -5.235 1.00 0.00 N ATOM 807 CA SER A 107 -13.149 -11.659 -5.647 1.00 0.00 C ATOM 808 C SER A 107 -12.309 -12.936 -5.744 1.00 0.00 C ATOM 809 O SER A 107 -11.084 -12.885 -5.856 1.00 0.00 O ATOM 810 CB SER A 107 -13.800 -11.369 -6.999 1.00 0.00 C ATOM 811 OG SER A 107 -12.802 -11.358 -8.011 1.00 0.00 O ATOM 0 H SER A 107 -12.218 -9.798 -5.939 1.00 0.00 H new ATOM 0 HA SER A 107 -13.924 -11.808 -4.895 1.00 0.00 H new ATOM 0 HB2 SER A 107 -14.552 -12.126 -7.223 1.00 0.00 H new ATOM 0 HB3 SER A 107 -14.314 -10.408 -6.969 1.00 0.00 H new ATOM 0 HG SER A 107 -13.218 -11.174 -8.879 1.00 0.00 H new ATOM 817 N LYS A 108 -12.984 -14.077 -5.691 1.00 0.00 N ATOM 818 CA LYS A 108 -12.314 -15.373 -5.761 1.00 0.00 C ATOM 819 C LYS A 108 -11.635 -15.543 -7.110 1.00 0.00 C ATOM 820 O LYS A 108 -10.586 -16.178 -7.221 1.00 0.00 O ATOM 821 CB LYS A 108 -13.346 -16.489 -5.550 1.00 0.00 C ATOM 822 CG LYS A 108 -14.325 -16.522 -6.726 1.00 0.00 C ATOM 823 CD LYS A 108 -15.587 -17.287 -6.314 1.00 0.00 C ATOM 824 CE LYS A 108 -16.630 -17.210 -7.433 1.00 0.00 C ATOM 825 NZ LYS A 108 -16.184 -18.031 -8.593 1.00 0.00 N ATOM 0 H LYS A 108 -13.998 -14.133 -5.599 1.00 0.00 H new ATOM 0 HA LYS A 108 -11.554 -15.427 -4.981 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -12.841 -17.451 -5.459 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -13.888 -16.324 -4.619 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -14.583 -15.507 -7.027 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -13.860 -17.002 -7.587 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -15.340 -18.328 -6.106 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -15.995 -16.866 -5.395 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -17.593 -17.569 -7.070 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -16.771 -16.174 -7.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -16.956 -18.101 -9.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -15.359 -17.582 -9.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -15.925 -18.983 -8.265 1.00 0.00 H new ATOM 1237 N TYR A 134 -11.959 -18.943 -2.818 1.00 0.00 N ATOM 1238 CA TYR A 134 -13.126 -18.108 -2.568 1.00 0.00 C ATOM 1239 C TYR A 134 -12.727 -16.640 -2.466 1.00 0.00 C ATOM 1240 O TYR A 134 -11.616 -16.257 -2.832 1.00 0.00 O ATOM 1241 CB TYR A 134 -13.804 -18.530 -1.267 1.00 0.00 C ATOM 1242 CG TYR A 134 -13.389 -19.935 -0.915 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -12.592 -20.153 0.212 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -13.791 -21.013 -1.713 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -12.190 -21.453 0.543 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -13.393 -22.314 -1.380 1.00 0.00 C ATOM 1247 CZ TYR A 134 -12.592 -22.534 -0.251 1.00 0.00 C ATOM 1248 OH TYR A 134 -12.198 -23.815 0.077 1.00 0.00 O ATOM 0 HA TYR A 134 -13.816 -18.234 -3.402 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.529 -17.847 -0.463 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.887 -18.476 -1.375 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -12.286 -19.320 0.827 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -14.407 -20.842 -2.584 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -11.570 -21.622 1.411 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -13.703 -23.147 -1.993 1.00 0.00 H new ATOM 0 HH TYR A 134 -12.564 -24.447 -0.576 1.00 0.00 H new ATOM 1258 N ASP A 135 -13.648 -15.829 -1.958 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.402 -14.404 -1.796 1.00 0.00 C ATOM 1260 C ASP A 135 -12.315 -14.164 -0.765 1.00 0.00 C ATOM 1261 O ASP A 135 -12.166 -14.932 0.181 1.00 0.00 O ATOM 1262 CB ASP A 135 -14.680 -13.708 -1.356 1.00 0.00 C ATOM 1263 CG ASP A 135 -15.774 -13.945 -2.395 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -16.509 -14.907 -2.242 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -15.855 -13.167 -3.329 1.00 0.00 O ATOM 0 H ASP A 135 -14.571 -16.136 -1.652 1.00 0.00 H new ATOM 0 HA ASP A 135 -13.075 -13.998 -2.753 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -14.998 -14.088 -0.385 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -14.502 -12.639 -1.237 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.555 -13.099 -0.969 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.466 -12.760 -0.074 1.00 0.00 C ATOM 1272 C ALA A 136 -10.550 -11.298 0.347 1.00 0.00 C ATOM 1273 O ALA A 136 -10.963 -10.441 -0.424 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.130 -13.022 -0.775 1.00 0.00 C ATOM 0 H ALA A 136 -11.675 -12.454 -1.750 1.00 0.00 H new ATOM 0 HA ALA A 136 -10.540 -13.380 0.819 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.310 -12.767 -0.103 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -9.062 -14.075 -1.047 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.065 -12.410 -1.675 1.00 0.00 H new ATOM 1280 N TYR A 137 -10.136 -11.029 1.568 1.00 0.00 N ATOM 1281 CA TYR A 137 -10.136 -9.671 2.095 1.00 0.00 C ATOM 1282 C TYR A 137 -8.704 -9.221 2.314 1.00 0.00 C ATOM 1283 O TYR A 137 -8.023 -9.706 3.213 1.00 0.00 O ATOM 1284 CB TYR A 137 -10.885 -9.608 3.430 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.263 -9.033 3.242 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.374 -9.765 3.659 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.436 -7.776 2.649 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -14.658 -9.249 3.486 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -13.723 -7.255 2.478 1.00 0.00 C ATOM 1290 CZ TYR A 137 -14.836 -7.994 2.895 1.00 0.00 C ATOM 1291 OH TYR A 137 -16.109 -7.489 2.717 1.00 0.00 O ATOM 0 H TYR A 137 -9.793 -11.734 2.221 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.635 -9.019 1.378 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -10.958 -10.607 3.859 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.325 -8.998 4.138 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.240 -10.734 4.117 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -11.576 -7.209 2.324 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.516 -9.819 3.809 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -13.858 -6.284 2.025 1.00 0.00 H new ATOM 0 HH TYR A 137 -16.698 -7.831 3.422 1.00 0.00 H new ATOM 1301 N ILE A 138 -8.249 -8.306 1.486 1.00 0.00 N ATOM 1302 CA ILE A 138 -6.894 -7.813 1.592 1.00 0.00 C ATOM 1303 C ILE A 138 -6.853 -6.666 2.590 1.00 0.00 C ATOM 1304 O ILE A 138 -7.390 -5.598 2.325 1.00 0.00 O ATOM 1305 CB ILE A 138 -6.425 -7.305 0.226 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.698 -8.372 -0.848 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -4.929 -6.987 0.296 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -6.374 -7.825 -2.240 1.00 0.00 C ATOM 0 H ILE A 138 -8.797 -7.889 0.733 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.241 -8.619 1.927 1.00 0.00 H new ATOM 0 HB ILE A 138 -6.971 -6.400 -0.039 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -6.096 -9.259 -0.650 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.743 -8.680 -0.806 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.588 -6.625 -0.674 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -4.755 -6.221 1.051 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.377 -7.889 0.560 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.573 -8.593 -2.988 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.995 -6.952 -2.442 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.323 -7.540 -2.283 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.219 -6.882 3.733 1.00 0.00 N ATOM 1321 CA VAL A 139 -6.137 -5.848 4.743 1.00 0.00 C ATOM 1322 C VAL A 139 -4.692 -5.500 5.006 1.00 0.00 C ATOM 1323 O VAL A 139 -3.804 -6.346 4.898 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.773 -6.321 6.053 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -8.168 -6.886 5.775 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -5.888 -7.392 6.685 1.00 0.00 C ATOM 0 H VAL A 139 -5.758 -7.758 3.979 1.00 0.00 H new ATOM 0 HA VAL A 139 -6.673 -4.973 4.376 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.865 -5.480 6.741 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -8.617 -7.222 6.710 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -8.792 -6.111 5.330 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -8.089 -7.728 5.087 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -6.338 -7.731 7.618 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -5.792 -8.235 6.001 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -4.901 -6.975 6.888 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.468 -4.258 5.375 1.00 0.00 N ATOM 1337 CA GLU A 140 -3.127 -3.808 5.685 1.00 0.00 C ATOM 1338 C GLU A 140 -2.969 -3.650 7.186 1.00 0.00 C ATOM 1339 O GLU A 140 -3.512 -2.724 7.781 1.00 0.00 O ATOM 1340 CB GLU A 140 -2.824 -2.475 4.995 1.00 0.00 C ATOM 1341 CG GLU A 140 -2.624 -2.701 3.492 1.00 0.00 C ATOM 1342 CD GLU A 140 -3.961 -2.643 2.756 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -4.981 -2.586 3.420 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -3.941 -2.658 1.537 1.00 0.00 O ATOM 0 H GLU A 140 -5.191 -3.545 5.468 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.424 -4.556 5.319 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.643 -1.775 5.161 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -1.929 -2.027 5.427 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -1.950 -1.944 3.092 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -2.152 -3.669 3.324 1.00 0.00 H new ATOM 1351 N ALA A 141 -2.225 -4.563 7.793 1.00 0.00 N ATOM 1352 CA ALA A 141 -2.007 -4.512 9.227 1.00 0.00 C ATOM 1353 C ALA A 141 -1.054 -3.380 9.582 1.00 0.00 C ATOM 1354 O ALA A 141 -0.176 -3.029 8.794 1.00 0.00 O ATOM 1355 CB ALA A 141 -1.427 -5.837 9.712 1.00 0.00 C ATOM 0 H ALA A 141 -1.767 -5.341 7.318 1.00 0.00 H new ATOM 0 HA ALA A 141 -2.965 -4.333 9.716 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.266 -5.791 10.789 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.123 -6.644 9.483 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.477 -6.024 9.211 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.230 -2.808 10.767 1.00 0.00 N ATOM 1362 CA ASN A 142 -0.364 -1.718 11.193 1.00 0.00 C ATOM 1363 C ASN A 142 0.961 -2.275 11.703 1.00 0.00 C ATOM 1364 O ASN A 142 1.098 -2.538 12.896 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.035 -0.909 12.303 1.00 0.00 C ATOM 1366 CG ASN A 142 -0.219 0.345 12.599 1.00 0.00 C ATOM 1367 OD1 ASN A 142 1.005 0.335 12.481 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -0.825 1.436 12.979 1.00 0.00 N ATOM 0 H ASN A 142 -1.950 -3.075 11.438 1.00 0.00 H new ATOM 0 HA ASN A 142 -0.180 -1.067 10.338 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -2.046 -0.633 12.003 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -1.124 -1.516 13.204 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -0.284 2.277 13.177 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -1.840 1.448 13.078 1.00 0.00 H new ATOM 1375 N ALA A 143 1.899 -2.452 10.762 1.00 0.00 N ATOM 1376 CA ALA A 143 3.244 -2.981 11.022 1.00 0.00 C ATOM 1377 C ALA A 143 3.269 -4.475 10.742 1.00 0.00 C ATOM 1378 O ALA A 143 2.240 -5.138 10.838 1.00 0.00 O ATOM 1379 CB ALA A 143 3.704 -2.719 12.458 1.00 0.00 C ATOM 0 H ALA A 143 1.740 -2.227 9.780 1.00 0.00 H new ATOM 0 HA ALA A 143 3.934 -2.461 10.357 1.00 0.00 H new ATOM 0 HB1 ALA A 143 4.704 -3.129 12.600 1.00 0.00 H new ATOM 0 HB2 ALA A 143 3.722 -1.645 12.644 1.00 0.00 H new ATOM 0 HB3 ALA A 143 3.014 -3.196 13.154 1.00 0.00 H new ATOM 1385 N PRO A 144 4.406 -5.021 10.399 1.00 0.00 N ATOM 1386 CA PRO A 144 4.527 -6.473 10.094 1.00 0.00 C ATOM 1387 C PRO A 144 4.219 -7.345 11.308 1.00 0.00 C ATOM 1388 O PRO A 144 4.011 -8.549 11.173 1.00 0.00 O ATOM 1389 CB PRO A 144 5.981 -6.642 9.640 1.00 0.00 C ATOM 1390 CG PRO A 144 6.707 -5.469 10.207 1.00 0.00 C ATOM 1391 CD PRO A 144 5.698 -4.330 10.254 1.00 0.00 C ATOM 0 HA PRO A 144 3.810 -6.789 9.336 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.401 -7.579 10.005 1.00 0.00 H new ATOM 0 HB3 PRO A 144 6.054 -6.662 8.553 1.00 0.00 H new ATOM 0 HG2 PRO A 144 7.090 -5.692 11.203 1.00 0.00 H new ATOM 0 HG3 PRO A 144 7.564 -5.205 9.588 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.890 -3.658 11.091 1.00 0.00 H new ATOM 0 HD3 PRO A 144 5.731 -3.727 9.347 1.00 0.00 H new ATOM 1399 N ASN A 145 4.208 -6.742 12.494 1.00 0.00 N ATOM 1400 CA ASN A 145 3.932 -7.494 13.713 1.00 0.00 C ATOM 1401 C ASN A 145 2.425 -7.547 14.007 1.00 0.00 C ATOM 1402 O ASN A 145 1.987 -8.294 14.883 1.00 0.00 O ATOM 1403 CB ASN A 145 4.670 -6.849 14.890 1.00 0.00 C ATOM 1404 CG ASN A 145 4.673 -7.790 16.088 1.00 0.00 C ATOM 1405 OD1 ASN A 145 3.680 -7.884 16.810 1.00 0.00 O ATOM 1406 ND2 ASN A 145 5.740 -8.500 16.344 1.00 0.00 N ATOM 0 H ASN A 145 4.385 -5.747 12.636 1.00 0.00 H new ATOM 0 HA ASN A 145 4.283 -8.516 13.572 1.00 0.00 H new ATOM 0 HB2 ASN A 145 5.694 -6.613 14.601 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.190 -5.908 15.158 1.00 0.00 H new ATOM 0 HD21 ASN A 145 5.751 -9.134 17.143 1.00 0.00 H new ATOM 0 HD22 ASN A 145 6.561 -8.421 15.745 1.00 0.00 H new ATOM 1413 N ASP A 146 1.634 -6.758 13.273 1.00 0.00 N ATOM 1414 CA ASP A 146 0.184 -6.732 13.467 1.00 0.00 C ATOM 1415 C ASP A 146 -0.515 -7.650 12.477 1.00 0.00 C ATOM 1416 O ASP A 146 -1.684 -7.980 12.656 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.359 -5.312 13.283 1.00 0.00 C ATOM 1418 CG ASP A 146 -0.113 -4.493 14.548 1.00 0.00 C ATOM 1419 OD1 ASP A 146 0.451 -5.041 15.480 1.00 0.00 O ATOM 1420 OD2 ASP A 146 -0.516 -3.342 14.579 1.00 0.00 O ATOM 0 H ASP A 146 1.973 -6.132 12.543 1.00 0.00 H new ATOM 0 HA ASP A 146 -0.014 -7.075 14.482 1.00 0.00 H new ATOM 0 HB2 ASP A 146 0.126 -4.836 12.431 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.426 -5.347 13.064 1.00 0.00 H new ATOM 1425 N VAL A 147 0.191 -8.061 11.434 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.403 -8.944 10.443 1.00 0.00 C ATOM 1427 C VAL A 147 -0.907 -10.199 11.131 1.00 0.00 C ATOM 1428 O VAL A 147 -1.905 -10.792 10.726 1.00 0.00 O ATOM 1429 CB VAL A 147 0.644 -9.321 9.396 1.00 0.00 C ATOM 1430 CG1 VAL A 147 1.136 -8.061 8.688 1.00 0.00 C ATOM 1431 CG2 VAL A 147 1.823 -10.038 10.077 1.00 0.00 C ATOM 0 H VAL A 147 1.161 -7.802 11.254 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.233 -8.435 9.953 1.00 0.00 H new ATOM 0 HB VAL A 147 0.198 -9.991 8.661 1.00 0.00 H new ATOM 0 HG11 VAL A 147 1.883 -8.331 7.941 1.00 0.00 H new ATOM 0 HG12 VAL A 147 0.296 -7.567 8.199 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.581 -7.384 9.417 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.568 -10.306 9.328 1.00 0.00 H new ATOM 0 HG22 VAL A 147 2.274 -9.376 10.816 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.464 -10.941 10.570 1.00 0.00 H new ATOM 1441 N LYS A 148 -0.210 -10.581 12.188 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.589 -11.761 12.959 1.00 0.00 C ATOM 1443 C LYS A 148 -1.815 -11.460 13.817 1.00 0.00 C ATOM 1444 O LYS A 148 -2.669 -12.318 14.024 1.00 0.00 O ATOM 1445 CB LYS A 148 0.596 -12.204 13.840 1.00 0.00 C ATOM 1446 CG LYS A 148 0.109 -12.868 15.140 1.00 0.00 C ATOM 1447 CD LYS A 148 -0.016 -11.803 16.243 1.00 0.00 C ATOM 1448 CE LYS A 148 -1.304 -12.025 17.052 1.00 0.00 C ATOM 1449 NZ LYS A 148 -1.025 -12.890 18.236 1.00 0.00 N ATOM 0 H LYS A 148 0.618 -10.096 12.534 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.843 -12.572 12.276 1.00 0.00 H new ATOM 0 HB2 LYS A 148 1.223 -12.902 13.285 1.00 0.00 H new ATOM 0 HB3 LYS A 148 1.216 -11.340 14.080 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -0.854 -13.352 14.976 1.00 0.00 H new ATOM 0 HG3 LYS A 148 0.808 -13.646 15.448 1.00 0.00 H new ATOM 0 HD2 LYS A 148 0.850 -11.850 16.904 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -0.024 -10.808 15.798 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -1.707 -11.066 17.379 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -2.062 -12.491 16.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -1.902 -13.033 18.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -0.661 -13.810 17.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -0.317 -12.430 18.843 1.00 0.00 H new ATOM 1463 N THR A 149 -1.892 -10.238 14.315 1.00 0.00 N ATOM 1464 CA THR A 149 -3.012 -9.836 15.152 1.00 0.00 C ATOM 1465 C THR A 149 -4.279 -9.735 14.325 1.00 0.00 C ATOM 1466 O THR A 149 -5.361 -10.120 14.767 1.00 0.00 O ATOM 1467 CB THR A 149 -2.713 -8.489 15.812 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.539 -8.603 16.604 1.00 0.00 O ATOM 1469 CG2 THR A 149 -3.890 -8.080 16.701 1.00 0.00 C ATOM 0 H THR A 149 -1.196 -9.509 14.156 1.00 0.00 H new ATOM 0 HA THR A 149 -3.158 -10.590 15.926 1.00 0.00 H new ATOM 0 HB THR A 149 -2.562 -7.733 15.042 1.00 0.00 H new ATOM 0 HG1 THR A 149 -1.344 -7.740 17.027 1.00 0.00 H new ATOM 0 HG21 THR A 149 -3.675 -7.120 17.170 1.00 0.00 H new ATOM 0 HG22 THR A 149 -4.791 -7.994 16.094 1.00 0.00 H new ATOM 0 HG23 THR A 149 -4.043 -8.835 17.472 1.00 0.00 H new ATOM 1477 N ILE A 150 -4.132 -9.204 13.123 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.258 -9.034 12.230 1.00 0.00 C ATOM 1479 C ILE A 150 -5.800 -10.382 11.808 1.00 0.00 C ATOM 1480 O ILE A 150 -7.009 -10.578 11.740 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.835 -8.228 10.997 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.361 -6.835 11.428 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -6.027 -8.090 10.049 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.547 -5.968 11.861 1.00 0.00 C ATOM 0 H ILE A 150 -3.240 -8.884 12.745 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.043 -8.490 12.756 1.00 0.00 H new ATOM 0 HB ILE A 150 -4.020 -8.744 10.489 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.651 -6.925 12.250 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -3.834 -6.354 10.604 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.729 -7.517 9.171 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.362 -9.080 9.740 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.840 -7.575 10.560 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.188 -4.984 12.163 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.242 -5.861 11.029 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -6.056 -6.441 12.700 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.903 -11.311 11.525 1.00 0.00 N ATOM 1497 CA ALA A 151 -5.325 -12.641 11.116 1.00 0.00 C ATOM 1498 C ALA A 151 -6.038 -13.346 12.254 1.00 0.00 C ATOM 1499 O ALA A 151 -7.045 -14.020 12.048 1.00 0.00 O ATOM 1500 CB ALA A 151 -4.132 -13.484 10.662 1.00 0.00 C ATOM 0 H ALA A 151 -3.893 -11.174 11.569 1.00 0.00 H new ATOM 0 HA ALA A 151 -6.011 -12.525 10.276 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -4.478 -14.473 10.362 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.644 -12.999 9.817 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.422 -13.582 11.483 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.510 -13.184 13.457 1.00 0.00 N ATOM 1507 CA GLU A 152 -6.114 -13.821 14.622 1.00 0.00 C ATOM 1508 C GLU A 152 -7.476 -13.219 14.913 1.00 0.00 C ATOM 1509 O GLU A 152 -8.424 -13.928 15.250 1.00 0.00 O ATOM 1510 CB GLU A 152 -5.203 -13.671 15.842 1.00 0.00 C ATOM 1511 CG GLU A 152 -3.949 -14.526 15.648 1.00 0.00 C ATOM 1512 CD GLU A 152 -4.305 -16.005 15.732 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -5.333 -16.315 16.314 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -3.548 -16.808 15.212 1.00 0.00 O ATOM 0 H GLU A 152 -4.678 -12.627 13.654 1.00 0.00 H new ATOM 0 HA GLU A 152 -6.241 -14.882 14.405 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -4.926 -12.625 15.977 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -5.731 -13.980 16.744 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -3.497 -14.307 14.681 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -3.209 -14.278 16.409 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.564 -11.908 14.776 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.821 -11.210 15.019 1.00 0.00 C ATOM 1523 C ASP A 153 -9.832 -11.537 13.924 1.00 0.00 C ATOM 1524 O ASP A 153 -11.018 -11.724 14.187 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.575 -9.701 15.068 1.00 0.00 C ATOM 1526 CG ASP A 153 -9.834 -8.980 15.539 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -10.869 -9.622 15.608 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -9.745 -7.797 15.826 1.00 0.00 O ATOM 0 H ASP A 153 -6.788 -11.306 14.500 1.00 0.00 H new ATOM 0 HA ASP A 153 -9.226 -11.540 15.976 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -7.747 -9.481 15.742 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -8.287 -9.339 14.081 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.341 -11.603 12.695 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.185 -11.911 11.548 1.00 0.00 C ATOM 1535 C ALA A 154 -10.753 -13.322 11.659 1.00 0.00 C ATOM 1536 O ALA A 154 -11.865 -13.597 11.211 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.395 -11.758 10.246 1.00 0.00 C ATOM 0 H ALA A 154 -8.360 -11.447 12.465 1.00 0.00 H new ATOM 0 HA ALA A 154 -11.016 -11.206 11.537 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -10.040 -11.992 9.399 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -9.036 -10.733 10.157 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.545 -12.440 10.254 1.00 0.00 H new ATOM 1543 N LYS A 155 -9.972 -14.215 12.254 1.00 0.00 N ATOM 1544 CA LYS A 155 -10.392 -15.605 12.420 1.00 0.00 C ATOM 1545 C LYS A 155 -11.643 -15.693 13.291 1.00 0.00 C ATOM 1546 O LYS A 155 -12.371 -16.684 13.248 1.00 0.00 O ATOM 1547 CB LYS A 155 -9.262 -16.419 13.050 1.00 0.00 C ATOM 1548 CG LYS A 155 -8.549 -17.227 11.963 1.00 0.00 C ATOM 1549 CD LYS A 155 -7.072 -17.384 12.328 1.00 0.00 C ATOM 1550 CE LYS A 155 -6.519 -18.658 11.682 1.00 0.00 C ATOM 1551 NZ LYS A 155 -6.732 -19.811 12.600 1.00 0.00 N ATOM 0 H LYS A 155 -9.047 -14.005 12.629 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.627 -16.013 11.437 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -8.555 -15.755 13.548 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -9.662 -17.088 13.812 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -9.015 -18.207 11.859 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.645 -16.725 11.000 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -6.508 -16.516 11.987 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -6.957 -17.433 13.411 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -7.016 -18.841 10.729 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -5.456 -18.540 11.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -6.357 -20.677 12.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -6.239 -19.635 13.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -7.750 -19.927 12.781 1.00 0.00 H new ATOM 1565 N LYS A 156 -11.891 -14.646 14.069 1.00 0.00 N ATOM 1566 CA LYS A 156 -13.067 -14.612 14.937 1.00 0.00 C ATOM 1567 C LYS A 156 -14.285 -14.075 14.184 1.00 0.00 C ATOM 1568 O LYS A 156 -15.386 -14.012 14.734 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.798 -13.724 16.152 1.00 0.00 C ATOM 1570 CG LYS A 156 -11.802 -14.415 17.081 1.00 0.00 C ATOM 1571 CD LYS A 156 -11.483 -13.490 18.254 1.00 0.00 C ATOM 1572 CE LYS A 156 -9.984 -13.538 18.544 1.00 0.00 C ATOM 1573 NZ LYS A 156 -9.634 -14.853 19.151 1.00 0.00 N ATOM 0 H LYS A 156 -11.301 -13.815 14.119 1.00 0.00 H new ATOM 0 HA LYS A 156 -13.273 -15.631 15.264 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -12.403 -12.760 15.830 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -13.729 -13.525 16.683 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -12.218 -15.354 17.446 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -10.890 -14.660 16.537 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -11.787 -12.470 18.020 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -12.045 -13.796 19.136 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -9.420 -13.390 17.623 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -9.708 -12.729 19.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -8.627 -14.859 19.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -10.211 -15.007 20.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -9.819 -15.612 18.465 1.00 0.00 H new ATOM 1587 N ILE A 157 -14.083 -13.683 12.929 1.00 0.00 N ATOM 1588 CA ILE A 157 -15.162 -13.149 12.117 1.00 0.00 C ATOM 1589 C ILE A 157 -15.956 -14.283 11.492 1.00 0.00 C ATOM 1590 O ILE A 157 -15.389 -15.199 10.897 1.00 0.00 O ATOM 1591 CB ILE A 157 -14.596 -12.290 10.992 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -13.600 -11.259 11.547 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -15.749 -11.569 10.289 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -14.314 -10.219 12.406 1.00 0.00 C ATOM 0 H ILE A 157 -13.180 -13.727 12.456 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.806 -12.549 12.760 1.00 0.00 H new ATOM 0 HB ILE A 157 -14.069 -12.930 10.284 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -12.839 -11.766 12.140 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -13.085 -10.765 10.723 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -15.354 -10.952 9.482 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -16.441 -12.304 9.878 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -16.274 -10.937 11.006 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -13.588 -9.501 12.787 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -15.058 -9.698 11.803 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -14.807 -10.714 13.242 1.00 0.00 H new ATOM 1606 N GLU A 158 -17.265 -14.225 11.638 1.00 0.00 N ATOM 1607 CA GLU A 158 -18.125 -15.260 11.093 1.00 0.00 C ATOM 1608 C GLU A 158 -17.999 -15.302 9.572 1.00 0.00 C ATOM 1609 O GLU A 158 -17.909 -14.263 8.918 1.00 0.00 O ATOM 1610 CB GLU A 158 -19.572 -14.982 11.500 1.00 0.00 C ATOM 1611 CG GLU A 158 -19.657 -14.921 13.028 1.00 0.00 C ATOM 1612 CD GLU A 158 -19.429 -16.307 13.623 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -19.506 -17.271 12.880 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -19.181 -16.382 14.818 1.00 0.00 O ATOM 0 H GLU A 158 -17.756 -13.476 12.127 1.00 0.00 H new ATOM 0 HA GLU A 158 -17.821 -16.229 11.489 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -19.911 -14.041 11.066 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -20.228 -15.764 11.117 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -18.912 -14.225 13.414 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -20.634 -14.543 13.331 1.00 0.00 H new ATOM 1621 N GLY A 159 -17.984 -16.511 9.020 1.00 0.00 N ATOM 1622 CA GLY A 159 -17.856 -16.684 7.576 1.00 0.00 C ATOM 1623 C GLY A 159 -16.391 -16.829 7.156 1.00 0.00 C ATOM 1624 O GLY A 159 -16.105 -17.121 5.995 1.00 0.00 O ATOM 0 H GLY A 159 -18.058 -17.381 9.547 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -18.414 -17.566 7.263 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.299 -15.829 7.065 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.464 -16.638 8.095 1.00 0.00 N ATOM 1629 CA VAL A 160 -14.043 -16.768 7.785 1.00 0.00 C ATOM 1630 C VAL A 160 -13.712 -18.217 7.434 1.00 0.00 C ATOM 1631 O VAL A 160 -14.094 -19.141 8.152 1.00 0.00 O ATOM 1632 CB VAL A 160 -13.200 -16.329 8.985 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -13.477 -17.259 10.167 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -11.707 -16.395 8.627 1.00 0.00 C ATOM 0 H VAL A 160 -15.669 -16.396 9.064 1.00 0.00 H new ATOM 0 HA VAL A 160 -13.814 -16.130 6.932 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.462 -15.305 9.251 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -12.878 -16.948 11.023 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -14.534 -17.211 10.428 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -13.217 -18.282 9.894 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -11.113 -16.081 9.485 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -11.443 -17.417 8.357 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -11.505 -15.733 7.785 1.00 0.00 H new ATOM 1644 N SER A 161 -13.002 -18.407 6.332 1.00 0.00 N ATOM 1645 CA SER A 161 -12.624 -19.745 5.905 1.00 0.00 C ATOM 1646 C SER A 161 -11.142 -19.993 6.175 1.00 0.00 C ATOM 1647 O SER A 161 -10.773 -21.019 6.745 1.00 0.00 O ATOM 1648 CB SER A 161 -12.920 -19.920 4.414 1.00 0.00 C ATOM 1649 OG SER A 161 -12.620 -21.256 4.030 1.00 0.00 O ATOM 0 H SER A 161 -12.678 -17.657 5.721 1.00 0.00 H new ATOM 0 HA SER A 161 -13.207 -20.470 6.473 1.00 0.00 H new ATOM 0 HB2 SER A 161 -13.967 -19.697 4.211 1.00 0.00 H new ATOM 0 HB3 SER A 161 -12.325 -19.219 3.828 1.00 0.00 H new ATOM 0 HG SER A 161 -12.520 -21.302 3.056 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.296 -19.050 5.765 1.00 0.00 N ATOM 1656 CA GLU A 162 -8.855 -19.192 5.976 1.00 0.00 C ATOM 1657 C GLU A 162 -8.158 -17.848 5.849 1.00 0.00 C ATOM 1658 O GLU A 162 -8.578 -17.005 5.081 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.271 -20.172 4.958 1.00 0.00 C ATOM 1660 CG GLU A 162 -6.772 -20.336 5.211 1.00 0.00 C ATOM 1661 CD GLU A 162 -6.202 -21.400 4.281 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -6.971 -21.974 3.528 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -5.004 -21.626 4.333 1.00 0.00 O ATOM 0 H GLU A 162 -10.576 -18.191 5.292 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.693 -19.576 6.983 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.772 -21.137 5.037 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -8.442 -19.806 3.946 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -6.261 -19.387 5.048 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -6.598 -20.618 6.250 1.00 0.00 H new ATOM 1670 N VAL A 163 -7.091 -17.655 6.604 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.359 -16.397 6.550 1.00 0.00 C ATOM 1672 C VAL A 163 -4.865 -16.636 6.393 1.00 0.00 C ATOM 1673 O VAL A 163 -4.301 -17.560 6.982 1.00 0.00 O ATOM 1674 CB VAL A 163 -6.611 -15.583 7.817 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -6.671 -16.518 9.027 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -5.477 -14.572 7.997 1.00 0.00 C ATOM 0 H VAL A 163 -6.713 -18.343 7.255 1.00 0.00 H new ATOM 0 HA VAL A 163 -6.716 -15.843 5.682 1.00 0.00 H new ATOM 0 HB VAL A 163 -7.560 -15.054 7.731 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -6.851 -15.934 9.930 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -7.480 -17.236 8.892 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -5.725 -17.051 9.122 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -5.651 -13.987 8.900 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -4.528 -15.101 8.084 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -5.443 -13.906 7.135 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.229 -15.787 5.597 1.00 0.00 N ATOM 1687 CA GLN A 164 -2.795 -15.896 5.365 1.00 0.00 C ATOM 1688 C GLN A 164 -2.144 -14.513 5.370 1.00 0.00 C ATOM 1689 O GLN A 164 -2.665 -13.567 4.781 1.00 0.00 O ATOM 1690 CB GLN A 164 -2.541 -16.584 4.020 1.00 0.00 C ATOM 1691 CG GLN A 164 -3.103 -15.723 2.884 1.00 0.00 C ATOM 1692 CD GLN A 164 -3.104 -16.519 1.582 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -3.810 -17.519 1.467 1.00 0.00 O ATOM 1694 NE2 GLN A 164 -2.355 -16.130 0.587 1.00 0.00 N ATOM 0 H GLN A 164 -4.681 -15.018 5.103 1.00 0.00 H new ATOM 0 HA GLN A 164 -2.355 -16.490 6.166 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -1.472 -16.739 3.876 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -3.010 -17.568 4.010 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -4.117 -15.403 3.126 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -2.503 -14.821 2.768 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -1.770 -15.300 0.683 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -2.355 -16.656 -0.287 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.003 -14.410 6.045 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.290 -13.142 6.125 1.00 0.00 C ATOM 1705 C ASP A 165 0.708 -13.006 4.981 1.00 0.00 C ATOM 1706 O ASP A 165 1.160 -13.999 4.408 1.00 0.00 O ATOM 1707 CB ASP A 165 0.446 -13.044 7.465 1.00 0.00 C ATOM 1708 CG ASP A 165 1.447 -14.187 7.602 1.00 0.00 C ATOM 1709 OD1 ASP A 165 1.528 -14.991 6.688 1.00 0.00 O ATOM 1710 OD2 ASP A 165 2.117 -14.244 8.620 1.00 0.00 O ATOM 0 H ASP A 165 -0.557 -15.182 6.540 1.00 0.00 H new ATOM 0 HA ASP A 165 -1.018 -12.334 6.047 1.00 0.00 H new ATOM 0 HB2 ASP A 165 0.964 -12.087 7.535 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -0.271 -13.079 8.285 1.00 0.00 H new ATOM 1715 N GLY A 166 1.047 -11.765 4.656 1.00 0.00 N ATOM 1716 CA GLY A 166 1.997 -11.495 3.582 1.00 0.00 C ATOM 1717 C GLY A 166 1.423 -11.909 2.233 1.00 0.00 C ATOM 1718 O GLY A 166 0.251 -12.270 2.129 1.00 0.00 O ATOM 0 H GLY A 166 0.681 -10.932 5.118 1.00 0.00 H new ATOM 0 HA2 GLY A 166 2.243 -10.433 3.567 1.00 0.00 H new ATOM 0 HA3 GLY A 166 2.926 -12.035 3.768 1.00 0.00 H new