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 91 TYR OH : rot 180:sc= -0.0149 USER MOD Set 1.2: A 95 LYS NZ :NH3+ -107:sc= -1.04 (180deg=-3.1!) USER MOD Set 1.3: A 102 SER OG : rot 180:sc= -0.0182 USER MOD Set 2.1: A 63 TYR OH : rot 26:sc= 0.0319 USER MOD Set 2.2: A 164 GLN : amide:sc= -0.566 K(o=-0.53,f=-1.6) USER MOD Single : A 89 LYS NZ :NH3+ 160:sc= -0.0687 (180deg=-0.613) USER MOD Single : A 93 SER OG : rot 76:sc= 0.304 USER MOD Single : A 96 ASN : amide:sc= -0.25 X(o=-0.25,f=-0.47) USER MOD Single : A 97 MET CE :methyl -163:sc= -2.04 (180deg=-2.62) USER MOD Single : A 98 SER OG : rot 180:sc= -0.682 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 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+ 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= -1.04 USER MOD Single : A 142 ASN : amide:sc= -0.125 K(o=-0.12,f=-1.6!) USER MOD Single : A 145 ASN : amide:sc=-0.00342 K(o=-0.0034,f=-0.94) USER MOD Single : A 148 LYS NZ :NH3+ -152:sc= -0.057 (180deg=-0.433) 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 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 31 N ARG A 59 0.572 -6.959 4.832 1.00 0.00 N ATOM 32 CA ARG A 59 -0.422 -7.504 3.921 1.00 0.00 C ATOM 33 C ARG A 59 -1.019 -8.791 4.474 1.00 0.00 C ATOM 34 O ARG A 59 -0.315 -9.778 4.672 1.00 0.00 O ATOM 35 CB ARG A 59 0.222 -7.775 2.556 1.00 0.00 C ATOM 36 CG ARG A 59 -0.732 -7.392 1.429 1.00 0.00 C ATOM 37 CD ARG A 59 -1.369 -8.655 0.859 1.00 0.00 C ATOM 38 NE ARG A 59 -1.891 -8.396 -0.477 1.00 0.00 N ATOM 39 CZ ARG A 59 -2.377 -9.378 -1.231 1.00 0.00 C ATOM 40 NH1 ARG A 59 -2.391 -10.608 -0.785 1.00 0.00 N ATOM 41 NH2 ARG A 59 -2.837 -9.116 -2.423 1.00 0.00 N ATOM 0 HA ARG A 59 -1.224 -6.774 3.809 1.00 0.00 H new ATOM 0 HB2 ARG A 59 1.148 -7.207 2.465 1.00 0.00 H new ATOM 0 HB3 ARG A 59 0.485 -8.830 2.475 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -1.503 -6.718 1.803 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -0.193 -6.857 0.647 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -0.632 -9.457 0.820 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.173 -8.992 1.513 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.883 -7.443 -0.841 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.028 -10.817 0.145 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -2.765 -11.357 -1.367 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.824 -8.159 -2.776 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.210 -9.868 -3.002 1.00 0.00 H new ATOM 55 N VAL A 60 -2.323 -8.775 4.712 1.00 0.00 N ATOM 56 CA VAL A 60 -3.017 -9.941 5.234 1.00 0.00 C ATOM 57 C VAL A 60 -4.205 -10.292 4.344 1.00 0.00 C ATOM 58 O VAL A 60 -4.903 -9.413 3.855 1.00 0.00 O ATOM 59 CB VAL A 60 -3.497 -9.684 6.655 1.00 0.00 C ATOM 60 CG1 VAL A 60 -4.234 -10.919 7.174 1.00 0.00 C ATOM 61 CG2 VAL A 60 -2.292 -9.392 7.552 1.00 0.00 C ATOM 0 H VAL A 60 -2.922 -7.965 4.551 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.319 -10.779 5.244 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.173 -8.829 6.664 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.578 -10.736 8.192 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.091 -11.128 6.533 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.559 -11.775 7.168 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.633 -9.207 8.571 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.617 -10.248 7.545 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.766 -8.512 7.180 1.00 0.00 H new ATOM 71 N VAL A 61 -4.421 -11.574 4.129 1.00 0.00 N ATOM 72 CA VAL A 61 -5.527 -12.025 3.287 1.00 0.00 C ATOM 73 C VAL A 61 -6.487 -12.904 4.086 1.00 0.00 C ATOM 74 O VAL A 61 -6.089 -13.908 4.675 1.00 0.00 O ATOM 75 CB VAL A 61 -4.981 -12.823 2.096 1.00 0.00 C ATOM 76 CG1 VAL A 61 -6.143 -13.309 1.228 1.00 0.00 C ATOM 77 CG2 VAL A 61 -4.065 -11.929 1.263 1.00 0.00 C ATOM 0 H VAL A 61 -3.852 -12.324 4.521 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.066 -11.149 2.927 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.419 -13.682 2.463 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.753 -13.876 0.382 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.798 -13.947 1.821 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.707 -12.451 0.861 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.676 -12.495 0.416 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.629 -11.070 0.898 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.236 -11.583 1.880 1.00 0.00 H new ATOM 87 N VAL A 62 -7.759 -12.526 4.091 1.00 0.00 N ATOM 88 CA VAL A 62 -8.772 -13.296 4.809 1.00 0.00 C ATOM 89 C VAL A 62 -9.761 -13.908 3.808 1.00 0.00 C ATOM 90 O VAL A 62 -10.567 -13.204 3.217 1.00 0.00 O ATOM 91 CB VAL A 62 -9.522 -12.383 5.789 1.00 0.00 C ATOM 92 CG1 VAL A 62 -10.567 -13.196 6.558 1.00 0.00 C ATOM 93 CG2 VAL A 62 -8.519 -11.773 6.774 1.00 0.00 C ATOM 0 H VAL A 62 -8.114 -11.699 3.611 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.286 -14.096 5.368 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.024 -11.589 5.236 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.097 -12.544 7.252 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.278 -13.632 5.856 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.072 -13.992 7.114 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.045 -11.123 7.473 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.019 -12.570 7.325 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.778 -11.191 6.225 1.00 0.00 H new ATOM 103 N TYR A 63 -9.711 -15.222 3.652 1.00 0.00 N ATOM 104 CA TYR A 63 -10.595 -15.924 2.747 1.00 0.00 C ATOM 105 C TYR A 63 -11.969 -16.091 3.375 1.00 0.00 C ATOM 106 O TYR A 63 -12.096 -16.290 4.580 1.00 0.00 O ATOM 107 CB TYR A 63 -10.010 -17.298 2.415 1.00 0.00 C ATOM 108 CG TYR A 63 -8.761 -17.124 1.582 1.00 0.00 C ATOM 109 CD1 TYR A 63 -7.538 -16.837 2.207 1.00 0.00 C ATOM 110 CD2 TYR A 63 -8.822 -17.257 0.190 1.00 0.00 C ATOM 111 CE1 TYR A 63 -6.379 -16.680 1.440 1.00 0.00 C ATOM 112 CE2 TYR A 63 -7.660 -17.101 -0.577 1.00 0.00 C ATOM 113 CZ TYR A 63 -6.439 -16.811 0.046 1.00 0.00 C ATOM 114 OH TYR A 63 -5.297 -16.655 -0.711 1.00 0.00 O ATOM 0 H TYR A 63 -9.057 -15.826 4.150 1.00 0.00 H new ATOM 0 HA TYR A 63 -10.695 -15.341 1.831 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.776 -17.837 3.333 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -10.742 -17.896 1.872 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.492 -16.737 3.281 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.763 -17.479 -0.292 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.438 -16.458 1.922 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.706 -17.205 -1.651 1.00 0.00 H new ATOM 0 HH TYR A 63 -4.511 -16.869 -0.166 1.00 0.00 H new ATOM 124 N ILE A 64 -12.988 -16.007 2.542 1.00 0.00 N ATOM 125 CA ILE A 64 -14.369 -16.135 3.004 1.00 0.00 C ATOM 126 C ILE A 64 -14.999 -17.426 2.483 1.00 0.00 C ATOM 127 O ILE A 64 -14.823 -17.790 1.322 1.00 0.00 O ATOM 128 CB ILE A 64 -15.199 -14.944 2.525 1.00 0.00 C ATOM 129 CG1 ILE A 64 -14.494 -13.639 2.911 1.00 0.00 C ATOM 130 CG2 ILE A 64 -16.581 -14.977 3.188 1.00 0.00 C ATOM 131 CD1 ILE A 64 -15.265 -12.438 2.340 1.00 0.00 C ATOM 0 H ILE A 64 -12.892 -15.850 1.539 1.00 0.00 H new ATOM 0 HA ILE A 64 -14.357 -16.160 4.094 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.309 -14.999 1.442 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -14.429 -13.558 3.996 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.473 -13.641 2.530 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -17.170 -14.127 2.844 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -17.091 -15.903 2.921 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -16.466 -14.925 4.271 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -14.758 -11.514 2.619 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -15.307 -12.516 1.254 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -16.278 -12.431 2.742 1.00 0.00 H new ATOM 143 N ARG A 65 -15.725 -18.114 3.352 1.00 0.00 N ATOM 144 CA ARG A 65 -16.371 -19.365 2.978 1.00 0.00 C ATOM 145 C ARG A 65 -17.135 -19.204 1.672 1.00 0.00 C ATOM 146 O ARG A 65 -17.565 -18.105 1.322 1.00 0.00 O ATOM 147 CB ARG A 65 -17.329 -19.814 4.086 1.00 0.00 C ATOM 148 CG ARG A 65 -16.653 -20.870 4.965 1.00 0.00 C ATOM 149 CD ARG A 65 -16.603 -20.378 6.404 1.00 0.00 C ATOM 150 NE ARG A 65 -17.902 -20.534 7.045 1.00 0.00 N ATOM 151 CZ ARG A 65 -18.045 -20.389 8.360 1.00 0.00 C ATOM 152 NH1 ARG A 65 -17.014 -20.102 9.112 1.00 0.00 N ATOM 153 NH2 ARG A 65 -19.224 -20.536 8.904 1.00 0.00 N ATOM 0 H ARG A 65 -15.882 -17.829 4.319 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.599 -20.123 2.841 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.623 -18.958 4.693 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -18.240 -20.222 3.648 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -17.202 -21.810 4.910 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -15.644 -21.069 4.602 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -15.848 -20.936 6.959 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -16.304 -19.330 6.425 1.00 0.00 H new ATOM 0 HE ARG A 65 -18.717 -20.759 6.475 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -16.092 -19.988 8.691 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -17.132 -19.992 10.119 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -20.030 -20.761 8.321 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -19.338 -20.426 9.912 1.00 0.00 H new ATOM 517 N LYS A 89 -20.658 -7.505 6.248 1.00 0.00 N ATOM 518 CA LYS A 89 -20.440 -7.576 7.687 1.00 0.00 C ATOM 519 C LYS A 89 -18.968 -7.831 7.995 1.00 0.00 C ATOM 520 O LYS A 89 -18.412 -7.274 8.939 1.00 0.00 O ATOM 521 CB LYS A 89 -21.299 -8.687 8.292 1.00 0.00 C ATOM 522 CG LYS A 89 -22.776 -8.288 8.226 1.00 0.00 C ATOM 523 CD LYS A 89 -23.096 -7.306 9.353 1.00 0.00 C ATOM 524 CE LYS A 89 -24.573 -6.909 9.284 1.00 0.00 C ATOM 525 NZ LYS A 89 -25.421 -8.117 9.481 1.00 0.00 N ATOM 0 HA LYS A 89 -20.727 -6.621 8.128 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -21.139 -9.620 7.751 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -21.006 -8.865 9.327 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -22.997 -7.833 7.261 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -23.406 -9.173 8.312 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -22.876 -7.761 10.319 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -22.466 -6.420 9.267 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -24.797 -6.166 10.049 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -24.793 -6.450 8.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -26.377 -7.827 9.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -25.476 -8.651 8.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -25.003 -8.718 10.220 1.00 0.00 H new ATOM 539 N VAL A 90 -18.347 -8.673 7.186 1.00 0.00 N ATOM 540 CA VAL A 90 -16.937 -9.010 7.368 1.00 0.00 C ATOM 541 C VAL A 90 -16.068 -7.783 7.125 1.00 0.00 C ATOM 542 O VAL A 90 -15.089 -7.547 7.828 1.00 0.00 O ATOM 543 CB VAL A 90 -16.527 -10.136 6.421 1.00 0.00 C ATOM 544 CG1 VAL A 90 -15.017 -10.360 6.518 1.00 0.00 C ATOM 545 CG2 VAL A 90 -17.260 -11.423 6.811 1.00 0.00 C ATOM 0 H VAL A 90 -18.793 -9.138 6.395 1.00 0.00 H new ATOM 0 HA VAL A 90 -16.794 -9.349 8.394 1.00 0.00 H new ATOM 0 HB VAL A 90 -16.789 -9.864 5.398 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.724 -11.164 5.842 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.495 -9.444 6.241 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -14.754 -10.632 7.540 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -16.968 -12.227 6.136 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -16.998 -11.695 7.834 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -18.336 -11.264 6.742 1.00 0.00 H new ATOM 555 N TYR A 91 -16.446 -7.003 6.123 1.00 0.00 N ATOM 556 CA TYR A 91 -15.710 -5.792 5.787 1.00 0.00 C ATOM 557 C TYR A 91 -15.717 -4.822 6.952 1.00 0.00 C ATOM 558 O TYR A 91 -14.706 -4.213 7.280 1.00 0.00 O ATOM 559 CB TYR A 91 -16.308 -5.120 4.553 1.00 0.00 C ATOM 560 CG TYR A 91 -15.690 -3.757 4.361 1.00 0.00 C ATOM 561 CD1 TYR A 91 -14.390 -3.633 3.853 1.00 0.00 C ATOM 562 CD2 TYR A 91 -16.426 -2.613 4.685 1.00 0.00 C ATOM 563 CE1 TYR A 91 -13.825 -2.367 3.674 1.00 0.00 C ATOM 564 CE2 TYR A 91 -15.861 -1.344 4.508 1.00 0.00 C ATOM 565 CZ TYR A 91 -14.559 -1.221 4.004 1.00 0.00 C ATOM 566 OH TYR A 91 -14.002 0.028 3.833 1.00 0.00 O ATOM 0 H TYR A 91 -17.255 -7.186 5.530 1.00 0.00 H new ATOM 0 HA TYR A 91 -14.680 -6.076 5.569 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -16.132 -5.736 3.671 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -17.388 -5.027 4.666 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -13.824 -4.517 3.599 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -17.430 -2.708 5.072 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -12.823 -2.273 3.282 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -16.428 -0.460 4.760 1.00 0.00 H new ATOM 0 HH TYR A 91 -14.645 0.714 4.109 1.00 0.00 H new ATOM 576 N ASP A 92 -16.877 -4.676 7.565 1.00 0.00 N ATOM 577 CA ASP A 92 -17.025 -3.756 8.695 1.00 0.00 C ATOM 578 C ASP A 92 -16.203 -4.233 9.881 1.00 0.00 C ATOM 579 O ASP A 92 -15.597 -3.434 10.588 1.00 0.00 O ATOM 580 CB ASP A 92 -18.498 -3.642 9.098 1.00 0.00 C ATOM 581 CG ASP A 92 -19.276 -2.877 8.032 1.00 0.00 C ATOM 582 OD1 ASP A 92 -18.639 -2.278 7.180 1.00 0.00 O ATOM 583 OD2 ASP A 92 -20.494 -2.901 8.084 1.00 0.00 O ATOM 0 H ASP A 92 -17.729 -5.175 7.308 1.00 0.00 H new ATOM 0 HA ASP A 92 -16.663 -2.775 8.387 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -18.925 -4.636 9.228 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -18.582 -3.131 10.057 1.00 0.00 H new ATOM 588 N SER A 93 -16.187 -5.542 10.090 1.00 0.00 N ATOM 589 CA SER A 93 -15.427 -6.115 11.199 1.00 0.00 C ATOM 590 C SER A 93 -13.931 -5.916 10.981 1.00 0.00 C ATOM 591 O SER A 93 -13.187 -5.563 11.903 1.00 0.00 O ATOM 592 CB SER A 93 -15.738 -7.609 11.325 1.00 0.00 C ATOM 593 OG SER A 93 -17.111 -7.775 11.662 1.00 0.00 O ATOM 0 H SER A 93 -16.684 -6.223 9.516 1.00 0.00 H new ATOM 0 HA SER A 93 -15.716 -5.607 12.119 1.00 0.00 H new ATOM 0 HB2 SER A 93 -15.517 -8.119 10.387 1.00 0.00 H new ATOM 0 HB3 SER A 93 -15.106 -8.061 12.090 1.00 0.00 H new ATOM 0 HG SER A 93 -17.664 -7.622 10.867 1.00 0.00 H new ATOM 599 N LEU A 94 -13.503 -6.132 9.746 1.00 0.00 N ATOM 600 CA LEU A 94 -12.092 -5.972 9.402 1.00 0.00 C ATOM 601 C LEU A 94 -11.708 -4.496 9.373 1.00 0.00 C ATOM 602 O LEU A 94 -10.577 -4.130 9.694 1.00 0.00 O ATOM 603 CB LEU A 94 -11.800 -6.616 8.044 1.00 0.00 C ATOM 604 CG LEU A 94 -11.985 -8.139 8.139 1.00 0.00 C ATOM 605 CD1 LEU A 94 -11.877 -8.753 6.745 1.00 0.00 C ATOM 606 CD2 LEU A 94 -10.907 -8.734 9.048 1.00 0.00 C ATOM 0 H LEU A 94 -14.102 -6.416 8.971 1.00 0.00 H new ATOM 0 HA LEU A 94 -11.496 -6.471 10.166 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -12.467 -6.206 7.286 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -10.782 -6.383 7.732 1.00 0.00 H new ATOM 0 HG LEU A 94 -12.968 -8.358 8.557 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.008 -9.833 6.812 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -12.650 -8.333 6.101 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.896 -8.532 6.325 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.041 -9.814 9.113 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.922 -8.515 8.636 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -10.989 -8.298 10.043 1.00 0.00 H new ATOM 618 N LYS A 95 -12.649 -3.662 8.962 1.00 0.00 N ATOM 619 CA LYS A 95 -12.402 -2.232 8.868 1.00 0.00 C ATOM 620 C LYS A 95 -12.535 -1.566 10.237 1.00 0.00 C ATOM 621 O LYS A 95 -11.920 -0.533 10.499 1.00 0.00 O ATOM 622 CB LYS A 95 -13.394 -1.588 7.900 1.00 0.00 C ATOM 623 CG LYS A 95 -12.821 -0.276 7.375 1.00 0.00 C ATOM 624 CD LYS A 95 -11.832 -0.569 6.242 1.00 0.00 C ATOM 625 CE LYS A 95 -11.183 0.731 5.771 1.00 0.00 C ATOM 626 NZ LYS A 95 -10.704 0.577 4.367 1.00 0.00 N ATOM 0 H LYS A 95 -13.589 -3.949 8.689 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.385 -2.090 8.501 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -13.599 -2.265 7.070 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.343 -1.406 8.404 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -13.625 0.366 7.014 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -12.320 0.262 8.180 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -11.066 -1.264 6.586 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -12.349 -1.050 5.411 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -11.900 1.549 5.832 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -10.349 0.989 6.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.666 0.511 4.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.109 -0.288 3.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -11.003 1.400 3.806 1.00 0.00 H new ATOM 640 N ASN A 96 -13.347 -2.165 11.100 1.00 0.00 N ATOM 641 CA ASN A 96 -13.566 -1.629 12.436 1.00 0.00 C ATOM 642 C ASN A 96 -12.624 -2.271 13.446 1.00 0.00 C ATOM 643 O ASN A 96 -12.613 -1.892 14.618 1.00 0.00 O ATOM 644 CB ASN A 96 -15.014 -1.863 12.865 1.00 0.00 C ATOM 645 CG ASN A 96 -15.316 -1.088 14.143 1.00 0.00 C ATOM 646 OD1 ASN A 96 -15.067 0.115 14.215 1.00 0.00 O ATOM 647 ND2 ASN A 96 -15.838 -1.713 15.162 1.00 0.00 N ATOM 0 H ASN A 96 -13.864 -3.021 10.898 1.00 0.00 H new ATOM 0 HA ASN A 96 -13.363 -0.558 12.406 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.692 -1.548 12.071 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -15.186 -2.927 13.027 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -16.041 -1.205 16.023 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -16.043 -2.710 15.098 1.00 0.00 H new ATOM 654 N MET A 97 -11.829 -3.240 12.987 1.00 0.00 N ATOM 655 CA MET A 97 -10.882 -3.911 13.853 1.00 0.00 C ATOM 656 C MET A 97 -9.997 -2.908 14.574 1.00 0.00 C ATOM 657 O MET A 97 -9.381 -3.269 15.578 1.00 0.00 O ATOM 658 CB MET A 97 -10.010 -4.862 13.045 1.00 0.00 C ATOM 659 CG MET A 97 -10.151 -6.280 13.603 1.00 0.00 C ATOM 660 SD MET A 97 -8.646 -7.216 13.255 1.00 0.00 S ATOM 661 CE MET A 97 -9.262 -8.109 11.809 1.00 0.00 C ATOM 0 H MET A 97 -11.829 -3.570 12.022 1.00 0.00 H new ATOM 0 HA MET A 97 -11.449 -4.475 14.593 1.00 0.00 H new ATOM 0 HB2 MET A 97 -10.305 -4.841 11.996 1.00 0.00 H new ATOM 0 HB3 MET A 97 -8.968 -4.544 13.089 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.329 -6.243 14.678 1.00 0.00 H new ATOM 0 HG3 MET A 97 -11.012 -6.775 13.154 1.00 0.00 H new ATOM 0 HE1 MET A 97 -8.615 -8.962 11.605 1.00 0.00 H new ATOM 0 HE2 MET A 97 -10.275 -8.460 12.003 1.00 0.00 H new ATOM 0 HE3 MET A 97 -9.268 -7.444 10.946 1.00 0.00 H new ATOM 671 N SER A 98 -9.924 -1.670 14.051 1.00 0.00 N ATOM 672 CA SER A 98 -9.108 -0.624 14.650 1.00 0.00 C ATOM 673 C SER A 98 -7.646 -0.806 14.273 1.00 0.00 C ATOM 674 O SER A 98 -7.020 0.104 13.732 1.00 0.00 O ATOM 675 CB SER A 98 -9.262 -0.633 16.170 1.00 0.00 C ATOM 676 OG SER A 98 -10.583 -1.037 16.505 1.00 0.00 O ATOM 0 H SER A 98 -10.426 -1.379 13.212 1.00 0.00 H new ATOM 0 HA SER A 98 -9.450 0.338 14.268 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.537 -1.313 16.617 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.059 0.359 16.574 1.00 0.00 H new ATOM 0 HG SER A 98 -10.685 -1.046 17.480 1.00 0.00 H new ATOM 682 N THR A 99 -7.115 -1.992 14.545 1.00 0.00 N ATOM 683 CA THR A 99 -5.727 -2.293 14.215 1.00 0.00 C ATOM 684 C THR A 99 -5.552 -2.458 12.703 1.00 0.00 C ATOM 685 O THR A 99 -4.430 -2.630 12.209 1.00 0.00 O ATOM 686 CB THR A 99 -5.286 -3.572 14.927 1.00 0.00 C ATOM 687 OG1 THR A 99 -5.556 -3.453 16.318 1.00 0.00 O ATOM 688 CG2 THR A 99 -3.787 -3.790 14.714 1.00 0.00 C ATOM 0 H THR A 99 -7.621 -2.757 14.991 1.00 0.00 H new ATOM 0 HA THR A 99 -5.107 -1.460 14.548 1.00 0.00 H new ATOM 0 HB THR A 99 -5.834 -4.422 14.519 1.00 0.00 H new ATOM 0 HG1 THR A 99 -5.276 -4.272 16.777 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.476 -4.702 15.223 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.580 -3.881 13.648 1.00 0.00 H new ATOM 0 HG23 THR A 99 -3.235 -2.942 15.120 1.00 0.00 H new ATOM 696 N VAL A 100 -6.662 -2.413 11.973 1.00 0.00 N ATOM 697 CA VAL A 100 -6.622 -2.560 10.532 1.00 0.00 C ATOM 698 C VAL A 100 -6.483 -1.208 9.844 1.00 0.00 C ATOM 699 O VAL A 100 -7.301 -0.310 10.042 1.00 0.00 O ATOM 700 CB VAL A 100 -7.900 -3.248 10.046 1.00 0.00 C ATOM 701 CG1 VAL A 100 -8.049 -3.049 8.533 1.00 0.00 C ATOM 702 CG2 VAL A 100 -7.816 -4.748 10.357 1.00 0.00 C ATOM 0 H VAL A 100 -7.596 -2.276 12.360 1.00 0.00 H new ATOM 0 HA VAL A 100 -5.753 -3.168 10.278 1.00 0.00 H new ATOM 0 HB VAL A 100 -8.762 -2.815 10.553 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.960 -3.540 8.189 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.105 -1.984 8.310 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -7.189 -3.482 8.023 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.724 -5.242 10.013 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -6.954 -5.178 9.847 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.710 -4.891 11.432 1.00 0.00 H new ATOM 712 N LYS A 101 -5.448 -1.076 9.022 1.00 0.00 N ATOM 713 CA LYS A 101 -5.222 0.164 8.290 1.00 0.00 C ATOM 714 C LYS A 101 -6.254 0.334 7.175 1.00 0.00 C ATOM 715 O LYS A 101 -6.781 1.425 6.966 1.00 0.00 O ATOM 716 CB LYS A 101 -3.813 0.170 7.691 1.00 0.00 C ATOM 717 CG LYS A 101 -3.587 1.473 6.923 1.00 0.00 C ATOM 718 CD LYS A 101 -2.180 1.479 6.328 1.00 0.00 C ATOM 719 CE LYS A 101 -1.967 2.765 5.528 1.00 0.00 C ATOM 720 NZ LYS A 101 -0.600 2.763 4.937 1.00 0.00 N ATOM 0 H LYS A 101 -4.757 -1.806 8.847 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.324 0.995 8.988 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.070 0.069 8.482 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -3.687 -0.683 7.025 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -4.328 1.573 6.130 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -3.715 2.326 7.589 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.438 1.406 7.123 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -2.043 0.611 5.683 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -2.715 2.843 4.739 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.094 3.633 6.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -0.456 3.638 4.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.107 2.708 5.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.495 1.942 4.307 1.00 0.00 H new ATOM 734 N SER A 102 -6.521 -0.749 6.450 1.00 0.00 N ATOM 735 CA SER A 102 -7.472 -0.716 5.347 1.00 0.00 C ATOM 736 C SER A 102 -7.924 -2.124 4.990 1.00 0.00 C ATOM 737 O SER A 102 -7.233 -3.103 5.268 1.00 0.00 O ATOM 738 CB SER A 102 -6.834 -0.049 4.132 1.00 0.00 C ATOM 739 OG SER A 102 -7.786 0.018 3.079 1.00 0.00 O ATOM 0 H SER A 102 -6.091 -1.660 6.608 1.00 0.00 H new ATOM 0 HA SER A 102 -8.344 -0.140 5.656 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.490 0.952 4.391 1.00 0.00 H new ATOM 0 HB3 SER A 102 -5.959 -0.613 3.811 1.00 0.00 H new ATOM 0 HG SER A 102 -7.380 0.448 2.297 1.00 0.00 H new ATOM 745 N VAL A 103 -9.082 -2.214 4.359 1.00 0.00 N ATOM 746 CA VAL A 103 -9.621 -3.510 3.951 1.00 0.00 C ATOM 747 C VAL A 103 -10.074 -3.486 2.490 1.00 0.00 C ATOM 748 O VAL A 103 -10.853 -2.619 2.091 1.00 0.00 O ATOM 749 CB VAL A 103 -10.805 -3.886 4.841 1.00 0.00 C ATOM 750 CG1 VAL A 103 -11.369 -5.243 4.410 1.00 0.00 C ATOM 751 CG2 VAL A 103 -10.349 -3.960 6.294 1.00 0.00 C ATOM 0 H VAL A 103 -9.667 -1.414 4.117 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.828 -4.251 4.057 1.00 0.00 H new ATOM 0 HB VAL A 103 -11.582 -3.128 4.743 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -12.213 -5.506 5.048 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -11.702 -5.186 3.374 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.594 -6.004 4.501 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.194 -4.228 6.927 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.568 -4.714 6.392 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -9.958 -2.990 6.602 1.00 0.00 H new ATOM 761 N THR A 104 -9.593 -4.447 1.701 1.00 0.00 N ATOM 762 CA THR A 104 -9.970 -4.526 0.297 1.00 0.00 C ATOM 763 C THR A 104 -10.631 -5.868 0.009 1.00 0.00 C ATOM 764 O THR A 104 -10.105 -6.918 0.359 1.00 0.00 O ATOM 765 CB THR A 104 -8.740 -4.351 -0.589 1.00 0.00 C ATOM 766 OG1 THR A 104 -8.168 -3.069 -0.366 1.00 0.00 O ATOM 767 CG2 THR A 104 -9.139 -4.496 -2.053 1.00 0.00 C ATOM 0 H THR A 104 -8.947 -5.174 2.010 1.00 0.00 H new ATOM 0 HA THR A 104 -10.678 -3.727 0.078 1.00 0.00 H new ATOM 0 HB THR A 104 -8.004 -5.116 -0.342 1.00 0.00 H new ATOM 0 HG1 THR A 104 -7.377 -2.960 -0.935 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.259 -4.371 -2.684 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.566 -5.485 -2.218 1.00 0.00 H new ATOM 0 HG23 THR A 104 -9.878 -3.736 -2.306 1.00 0.00 H new ATOM 775 N PHE A 105 -11.793 -5.827 -0.619 1.00 0.00 N ATOM 776 CA PHE A 105 -12.518 -7.053 -0.932 1.00 0.00 C ATOM 777 C PHE A 105 -12.129 -7.575 -2.315 1.00 0.00 C ATOM 778 O PHE A 105 -12.480 -6.989 -3.339 1.00 0.00 O ATOM 779 CB PHE A 105 -14.029 -6.778 -0.909 1.00 0.00 C ATOM 780 CG PHE A 105 -14.777 -8.022 -1.330 1.00 0.00 C ATOM 781 CD1 PHE A 105 -14.977 -9.059 -0.416 1.00 0.00 C ATOM 782 CD2 PHE A 105 -15.278 -8.133 -2.632 1.00 0.00 C ATOM 783 CE1 PHE A 105 -15.671 -10.206 -0.798 1.00 0.00 C ATOM 784 CE2 PHE A 105 -15.972 -9.287 -3.016 1.00 0.00 C ATOM 785 CZ PHE A 105 -16.170 -10.324 -2.094 1.00 0.00 C ATOM 0 H PHE A 105 -12.254 -4.969 -0.921 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.261 -7.804 -0.185 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.339 -6.476 0.092 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.269 -5.953 -1.579 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -14.593 -8.972 0.590 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.130 -7.330 -3.339 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -15.822 -11.005 -0.088 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -16.354 -9.378 -4.022 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.708 -11.213 -2.387 1.00 0.00 H new ATOM 795 N SER A 106 -11.409 -8.687 -2.331 1.00 0.00 N ATOM 796 CA SER A 106 -10.979 -9.294 -3.583 1.00 0.00 C ATOM 797 C SER A 106 -11.949 -10.399 -3.997 1.00 0.00 C ATOM 798 O SER A 106 -12.066 -11.419 -3.321 1.00 0.00 O ATOM 799 CB SER A 106 -9.575 -9.877 -3.430 1.00 0.00 C ATOM 800 OG SER A 106 -9.238 -10.606 -4.603 1.00 0.00 O ATOM 0 H SER A 106 -11.111 -9.187 -1.493 1.00 0.00 H new ATOM 0 HA SER A 106 -10.966 -8.524 -4.354 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.853 -9.077 -3.265 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.533 -10.529 -2.558 1.00 0.00 H new ATOM 0 HG SER A 106 -8.337 -10.980 -4.508 1.00 0.00 H new ATOM 806 N SER A 107 -12.643 -10.188 -5.109 1.00 0.00 N ATOM 807 CA SER A 107 -13.602 -11.171 -5.599 1.00 0.00 C ATOM 808 C SER A 107 -12.882 -12.433 -6.071 1.00 0.00 C ATOM 809 O SER A 107 -11.677 -12.420 -6.312 1.00 0.00 O ATOM 810 CB SER A 107 -14.411 -10.579 -6.754 1.00 0.00 C ATOM 811 OG SER A 107 -13.565 -10.429 -7.885 1.00 0.00 O ATOM 0 H SER A 107 -12.561 -9.351 -5.685 1.00 0.00 H new ATOM 0 HA SER A 107 -14.275 -11.435 -4.783 1.00 0.00 H new ATOM 0 HB2 SER A 107 -15.251 -11.229 -6.997 1.00 0.00 H new ATOM 0 HB3 SER A 107 -14.828 -9.614 -6.465 1.00 0.00 H new ATOM 0 HG SER A 107 -14.078 -10.051 -8.630 1.00 0.00 H new ATOM 817 N LYS A 108 -13.627 -13.517 -6.201 1.00 0.00 N ATOM 818 CA LYS A 108 -13.061 -14.785 -6.638 1.00 0.00 C ATOM 819 C LYS A 108 -12.502 -14.647 -8.048 1.00 0.00 C ATOM 820 O LYS A 108 -11.573 -15.353 -8.433 1.00 0.00 O ATOM 821 CB LYS A 108 -14.135 -15.882 -6.607 1.00 0.00 C ATOM 822 CG LYS A 108 -15.121 -15.666 -7.750 1.00 0.00 C ATOM 823 CD LYS A 108 -16.301 -16.628 -7.608 1.00 0.00 C ATOM 824 CE LYS A 108 -17.264 -16.099 -6.544 1.00 0.00 C ATOM 825 NZ LYS A 108 -18.519 -16.904 -6.566 1.00 0.00 N ATOM 0 H LYS A 108 -14.629 -13.546 -6.010 1.00 0.00 H new ATOM 0 HA LYS A 108 -12.254 -15.062 -5.960 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -13.669 -16.863 -6.696 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -14.660 -15.864 -5.652 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -15.478 -14.636 -7.745 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -14.623 -15.826 -8.706 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -16.817 -16.731 -8.562 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -15.944 -17.620 -7.330 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -16.801 -16.155 -5.559 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -17.489 -15.049 -6.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -19.174 -16.545 -5.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -18.963 -16.829 -7.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -18.296 -17.900 -6.367 1.00 0.00 H new ATOM 1237 N TYR A 134 -12.315 -18.693 -3.260 1.00 0.00 N ATOM 1238 CA TYR A 134 -13.488 -17.891 -2.933 1.00 0.00 C ATOM 1239 C TYR A 134 -13.091 -16.431 -2.729 1.00 0.00 C ATOM 1240 O TYR A 134 -11.992 -16.019 -3.094 1.00 0.00 O ATOM 1241 CB TYR A 134 -14.150 -18.423 -1.661 1.00 0.00 C ATOM 1242 CG TYR A 134 -13.646 -19.818 -1.376 1.00 0.00 C ATOM 1243 CD1 TYR A 134 -12.824 -20.048 -0.266 1.00 0.00 C ATOM 1244 CD2 TYR A 134 -13.998 -20.878 -2.218 1.00 0.00 C ATOM 1245 CE1 TYR A 134 -12.353 -21.338 0.003 1.00 0.00 C ATOM 1246 CE2 TYR A 134 -13.528 -22.167 -1.954 1.00 0.00 C ATOM 1247 CZ TYR A 134 -12.705 -22.400 -0.843 1.00 0.00 C ATOM 1248 OH TYR A 134 -12.239 -23.673 -0.583 1.00 0.00 O ATOM 0 HA TYR A 134 -14.194 -17.956 -3.761 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.927 -17.766 -0.820 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -15.234 -18.433 -1.779 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -12.553 -19.229 0.383 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -14.634 -20.700 -3.073 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -11.720 -21.515 0.860 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -13.799 -22.984 -2.606 1.00 0.00 H new ATOM 0 HH TYR A 134 -12.577 -24.291 -1.265 1.00 0.00 H new ATOM 1258 N ASP A 135 -13.991 -15.656 -2.134 1.00 0.00 N ATOM 1259 CA ASP A 135 -13.723 -14.245 -1.875 1.00 0.00 C ATOM 1260 C ASP A 135 -12.593 -14.085 -0.858 1.00 0.00 C ATOM 1261 O ASP A 135 -12.489 -14.853 0.091 1.00 0.00 O ATOM 1262 CB ASP A 135 -14.982 -13.573 -1.334 1.00 0.00 C ATOM 1263 CG ASP A 135 -16.033 -13.473 -2.435 1.00 0.00 C ATOM 1264 OD1 ASP A 135 -15.663 -13.585 -3.593 1.00 0.00 O ATOM 1265 OD2 ASP A 135 -17.193 -13.290 -2.105 1.00 0.00 O ATOM 0 H ASP A 135 -14.908 -15.978 -1.823 1.00 0.00 H new ATOM 0 HA ASP A 135 -13.423 -13.776 -2.812 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -15.377 -14.144 -0.494 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -14.741 -12.579 -0.958 1.00 0.00 H new ATOM 1270 N ALA A 136 -11.738 -13.097 -1.080 1.00 0.00 N ATOM 1271 CA ALA A 136 -10.613 -12.851 -0.187 1.00 0.00 C ATOM 1272 C ALA A 136 -10.626 -11.408 0.301 1.00 0.00 C ATOM 1273 O ALA A 136 -10.991 -10.502 -0.431 1.00 0.00 O ATOM 1274 CB ALA A 136 -9.295 -13.138 -0.915 1.00 0.00 C ATOM 0 H ALA A 136 -11.801 -12.453 -1.869 1.00 0.00 H new ATOM 0 HA ALA A 136 -10.702 -13.514 0.674 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -8.459 -12.952 -0.241 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -9.276 -14.179 -1.237 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -9.211 -12.487 -1.786 1.00 0.00 H new ATOM 1280 N TYR A 137 -10.217 -11.204 1.535 1.00 0.00 N ATOM 1281 CA TYR A 137 -10.177 -9.861 2.108 1.00 0.00 C ATOM 1282 C TYR A 137 -8.734 -9.423 2.347 1.00 0.00 C ATOM 1283 O TYR A 137 -8.059 -9.927 3.242 1.00 0.00 O ATOM 1284 CB TYR A 137 -10.942 -9.833 3.437 1.00 0.00 C ATOM 1285 CG TYR A 137 -12.319 -9.264 3.235 1.00 0.00 C ATOM 1286 CD1 TYR A 137 -13.444 -10.004 3.612 1.00 0.00 C ATOM 1287 CD2 TYR A 137 -12.472 -8.005 2.653 1.00 0.00 C ATOM 1288 CE1 TYR A 137 -14.718 -9.479 3.410 1.00 0.00 C ATOM 1289 CE2 TYR A 137 -13.745 -7.478 2.453 1.00 0.00 C ATOM 1290 CZ TYR A 137 -14.871 -8.215 2.830 1.00 0.00 C ATOM 1291 OH TYR A 137 -16.130 -7.700 2.622 1.00 0.00 O ATOM 0 H TYR A 137 -9.907 -11.944 2.165 1.00 0.00 H new ATOM 0 HA TYR A 137 -10.645 -9.174 1.403 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -11.014 -10.842 3.844 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.397 -9.233 4.166 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -13.325 -10.980 4.059 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -11.601 -7.438 2.357 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -15.589 -10.048 3.701 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -13.862 -6.501 2.007 1.00 0.00 H new ATOM 0 HH TYR A 137 -16.742 -8.046 3.305 1.00 0.00 H new ATOM 1301 N ILE A 138 -8.264 -8.480 1.542 1.00 0.00 N ATOM 1302 CA ILE A 138 -6.897 -7.993 1.675 1.00 0.00 C ATOM 1303 C ILE A 138 -6.850 -6.869 2.713 1.00 0.00 C ATOM 1304 O ILE A 138 -7.276 -5.748 2.449 1.00 0.00 O ATOM 1305 CB ILE A 138 -6.410 -7.457 0.325 1.00 0.00 C ATOM 1306 CG1 ILE A 138 -6.592 -8.525 -0.751 1.00 0.00 C ATOM 1307 CG2 ILE A 138 -4.933 -7.082 0.427 1.00 0.00 C ATOM 1308 CD1 ILE A 138 -6.266 -7.939 -2.125 1.00 0.00 C ATOM 0 H ILE A 138 -8.803 -8.040 0.796 1.00 0.00 H new ATOM 0 HA ILE A 138 -6.253 -8.812 1.996 1.00 0.00 H new ATOM 0 HB ILE A 138 -6.992 -6.575 0.058 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -5.942 -9.376 -0.545 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -7.617 -8.896 -0.738 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -4.587 -6.701 -0.534 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -4.804 -6.314 1.190 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -4.352 -7.963 0.698 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -6.398 -8.706 -2.888 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -6.934 -7.103 -2.332 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -5.233 -7.590 -2.136 1.00 0.00 H new ATOM 1320 N VAL A 139 -6.347 -7.186 3.895 1.00 0.00 N ATOM 1321 CA VAL A 139 -6.264 -6.227 4.976 1.00 0.00 C ATOM 1322 C VAL A 139 -4.820 -5.852 5.264 1.00 0.00 C ATOM 1323 O VAL A 139 -3.938 -6.706 5.308 1.00 0.00 O ATOM 1324 CB VAL A 139 -6.902 -6.813 6.244 1.00 0.00 C ATOM 1325 CG1 VAL A 139 -6.709 -5.837 7.404 1.00 0.00 C ATOM 1326 CG2 VAL A 139 -8.404 -7.047 6.004 1.00 0.00 C ATOM 0 H VAL A 139 -5.987 -8.112 4.128 1.00 0.00 H new ATOM 0 HA VAL A 139 -6.802 -5.329 4.674 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.427 -7.763 6.488 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -7.161 -6.250 8.306 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -5.644 -5.678 7.572 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.184 -4.886 7.163 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -8.856 -7.463 6.905 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -8.885 -6.100 5.761 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -8.536 -7.744 5.177 1.00 0.00 H new ATOM 1336 N GLU A 140 -4.588 -4.567 5.484 1.00 0.00 N ATOM 1337 CA GLU A 140 -3.242 -4.093 5.792 1.00 0.00 C ATOM 1338 C GLU A 140 -3.102 -3.848 7.294 1.00 0.00 C ATOM 1339 O GLU A 140 -3.619 -2.864 7.822 1.00 0.00 O ATOM 1340 CB GLU A 140 -2.957 -2.796 5.034 1.00 0.00 C ATOM 1341 CG GLU A 140 -3.079 -3.049 3.529 1.00 0.00 C ATOM 1342 CD GLU A 140 -2.775 -1.770 2.756 1.00 0.00 C ATOM 1343 OE1 GLU A 140 -3.363 -0.752 3.083 1.00 0.00 O ATOM 1344 OE2 GLU A 140 -1.960 -1.828 1.852 1.00 0.00 O ATOM 0 H GLU A 140 -5.302 -3.839 5.456 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.525 -4.854 5.485 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.659 -2.021 5.342 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -1.957 -2.434 5.273 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -2.389 -3.838 3.228 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -4.084 -3.397 3.291 1.00 0.00 H new ATOM 1351 N ALA A 141 -2.395 -4.750 7.971 1.00 0.00 N ATOM 1352 CA ALA A 141 -2.198 -4.624 9.410 1.00 0.00 C ATOM 1353 C ALA A 141 -1.268 -3.464 9.729 1.00 0.00 C ATOM 1354 O ALA A 141 -0.321 -3.192 8.987 1.00 0.00 O ATOM 1355 CB ALA A 141 -1.613 -5.920 9.969 1.00 0.00 C ATOM 0 H ALA A 141 -1.954 -5.568 7.550 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.166 -4.431 9.873 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.468 -5.820 11.045 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.298 -6.744 9.771 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.654 -6.122 9.491 1.00 0.00 H new ATOM 1361 N ASN A 142 -1.535 -2.786 10.840 1.00 0.00 N ATOM 1362 CA ASN A 142 -0.708 -1.658 11.241 1.00 0.00 C ATOM 1363 C ASN A 142 0.657 -2.143 11.668 1.00 0.00 C ATOM 1364 O ASN A 142 0.877 -2.362 12.851 1.00 0.00 O ATOM 1365 CB ASN A 142 -1.349 -0.931 12.422 1.00 0.00 C ATOM 1366 CG ASN A 142 -0.787 0.481 12.541 1.00 0.00 C ATOM 1367 OD1 ASN A 142 0.428 0.667 12.621 1.00 0.00 O ATOM 1368 ND2 ASN A 142 -1.607 1.495 12.554 1.00 0.00 N ATOM 0 H ASN A 142 -2.308 -2.996 11.471 1.00 0.00 H new ATOM 0 HA ASN A 142 -0.616 -0.982 10.391 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -2.430 -0.890 12.289 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -1.162 -1.483 13.343 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -1.243 2.445 12.631 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -2.613 1.338 12.488 1.00 0.00 H new ATOM 1375 N ALA A 143 1.551 -2.327 10.687 1.00 0.00 N ATOM 1376 CA ALA A 143 2.904 -2.788 10.937 1.00 0.00 C ATOM 1377 C ALA A 143 2.980 -4.311 10.832 1.00 0.00 C ATOM 1378 O ALA A 143 2.003 -5.005 11.110 1.00 0.00 O ATOM 1379 CB ALA A 143 3.401 -2.339 12.307 1.00 0.00 C ATOM 0 H ALA A 143 1.347 -2.158 9.702 1.00 0.00 H new ATOM 0 HA ALA A 143 3.547 -2.344 10.177 1.00 0.00 H new ATOM 0 HB1 ALA A 143 4.417 -2.701 12.462 1.00 0.00 H new ATOM 0 HB2 ALA A 143 3.392 -1.250 12.358 1.00 0.00 H new ATOM 0 HB3 ALA A 143 2.749 -2.744 13.081 1.00 0.00 H new ATOM 1385 N PRO A 144 4.110 -4.835 10.429 1.00 0.00 N ATOM 1386 CA PRO A 144 4.306 -6.307 10.278 1.00 0.00 C ATOM 1387 C PRO A 144 4.054 -7.070 11.573 1.00 0.00 C ATOM 1388 O PRO A 144 3.817 -8.276 11.553 1.00 0.00 O ATOM 1389 CB PRO A 144 5.767 -6.441 9.840 1.00 0.00 C ATOM 1390 CG PRO A 144 6.155 -5.098 9.322 1.00 0.00 C ATOM 1391 CD PRO A 144 5.330 -4.092 10.096 1.00 0.00 C ATOM 0 HA PRO A 144 3.601 -6.734 9.565 1.00 0.00 H new ATOM 0 HB2 PRO A 144 6.401 -6.737 10.676 1.00 0.00 H new ATOM 0 HB3 PRO A 144 5.877 -7.205 9.070 1.00 0.00 H new ATOM 0 HG2 PRO A 144 7.221 -4.919 9.464 1.00 0.00 H new ATOM 0 HG3 PRO A 144 5.959 -5.022 8.253 1.00 0.00 H new ATOM 0 HD2 PRO A 144 5.849 -3.751 10.991 1.00 0.00 H new ATOM 0 HD3 PRO A 144 5.111 -3.207 9.498 1.00 0.00 H new ATOM 1399 N ASN A 145 4.138 -6.365 12.695 1.00 0.00 N ATOM 1400 CA ASN A 145 3.931 -6.993 13.993 1.00 0.00 C ATOM 1401 C ASN A 145 2.441 -7.100 14.326 1.00 0.00 C ATOM 1402 O ASN A 145 2.067 -7.704 15.327 1.00 0.00 O ATOM 1403 CB ASN A 145 4.638 -6.175 15.073 1.00 0.00 C ATOM 1404 CG ASN A 145 6.148 -6.230 14.868 1.00 0.00 C ATOM 1405 OD1 ASN A 145 6.685 -7.266 14.479 1.00 0.00 O ATOM 1406 ND2 ASN A 145 6.868 -5.168 15.107 1.00 0.00 N ATOM 0 H ASN A 145 4.346 -5.367 12.732 1.00 0.00 H new ATOM 0 HA ASN A 145 4.345 -8.000 13.956 1.00 0.00 H new ATOM 0 HB2 ASN A 145 4.296 -5.141 15.039 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.383 -6.563 16.059 1.00 0.00 H new ATOM 0 HD21 ASN A 145 7.879 -5.196 14.971 1.00 0.00 H new ATOM 0 HD22 ASN A 145 6.420 -4.310 15.429 1.00 0.00 H new ATOM 1413 N ASP A 146 1.601 -6.510 13.483 1.00 0.00 N ATOM 1414 CA ASP A 146 0.165 -6.544 13.692 1.00 0.00 C ATOM 1415 C ASP A 146 -0.500 -7.531 12.741 1.00 0.00 C ATOM 1416 O ASP A 146 -1.656 -7.886 12.917 1.00 0.00 O ATOM 1417 CB ASP A 146 -0.423 -5.146 13.480 1.00 0.00 C ATOM 1418 CG ASP A 146 -0.206 -4.296 14.733 1.00 0.00 C ATOM 1419 OD1 ASP A 146 0.286 -4.830 15.711 1.00 0.00 O ATOM 1420 OD2 ASP A 146 -0.550 -3.132 14.704 1.00 0.00 O ATOM 0 H ASP A 146 1.894 -6.002 12.648 1.00 0.00 H new ATOM 0 HA ASP A 146 -0.025 -6.869 14.715 1.00 0.00 H new ATOM 0 HB2 ASP A 146 0.049 -4.670 12.620 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -1.488 -5.219 13.259 1.00 0.00 H new ATOM 1425 N VAL A 147 0.237 -7.968 11.735 1.00 0.00 N ATOM 1426 CA VAL A 147 -0.292 -8.908 10.752 1.00 0.00 C ATOM 1427 C VAL A 147 -0.741 -10.180 11.452 1.00 0.00 C ATOM 1428 O VAL A 147 -1.686 -10.838 11.020 1.00 0.00 O ATOM 1429 CB VAL A 147 0.790 -9.241 9.721 1.00 0.00 C ATOM 1430 CG1 VAL A 147 1.384 -7.948 9.151 1.00 0.00 C ATOM 1431 CG2 VAL A 147 1.904 -10.074 10.382 1.00 0.00 C ATOM 0 H VAL A 147 1.205 -7.689 11.574 1.00 0.00 H new ATOM 0 HA VAL A 147 -1.144 -8.456 10.244 1.00 0.00 H new ATOM 0 HB VAL A 147 0.342 -9.817 8.911 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.153 -8.193 8.418 1.00 0.00 H new ATOM 0 HG12 VAL A 147 0.597 -7.367 8.671 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.825 -7.363 9.958 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.671 -10.308 9.643 1.00 0.00 H new ATOM 0 HG22 VAL A 147 2.348 -9.505 11.198 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.483 -11.000 10.773 1.00 0.00 H new ATOM 1441 N LYS A 148 -0.066 -10.508 12.546 1.00 0.00 N ATOM 1442 CA LYS A 148 -0.424 -11.704 13.310 1.00 0.00 C ATOM 1443 C LYS A 148 -1.687 -11.464 14.126 1.00 0.00 C ATOM 1444 O LYS A 148 -2.492 -12.375 14.331 1.00 0.00 O ATOM 1445 CB LYS A 148 0.725 -12.093 14.248 1.00 0.00 C ATOM 1446 CG LYS A 148 0.866 -11.040 15.349 1.00 0.00 C ATOM 1447 CD LYS A 148 2.105 -11.337 16.190 1.00 0.00 C ATOM 1448 CE LYS A 148 1.706 -12.141 17.429 1.00 0.00 C ATOM 1449 NZ LYS A 148 0.965 -11.257 18.373 1.00 0.00 N ATOM 0 H LYS A 148 0.719 -9.976 12.922 1.00 0.00 H new ATOM 0 HA LYS A 148 -0.609 -12.515 12.606 1.00 0.00 H new ATOM 0 HB2 LYS A 148 0.533 -13.071 14.689 1.00 0.00 H new ATOM 0 HB3 LYS A 148 1.656 -12.173 13.686 1.00 0.00 H new ATOM 0 HG2 LYS A 148 0.944 -10.047 14.907 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -0.022 -11.039 15.981 1.00 0.00 H new ATOM 0 HD2 LYS A 148 2.831 -11.896 15.600 1.00 0.00 H new ATOM 0 HD3 LYS A 148 2.586 -10.405 16.488 1.00 0.00 H new ATOM 0 HE2 LYS A 148 1.083 -12.988 17.142 1.00 0.00 H new ATOM 0 HE3 LYS A 148 2.593 -12.547 17.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 1.101 -11.597 19.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 1.325 -10.285 18.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -0.048 -11.272 18.139 1.00 0.00 H new ATOM 1463 N THR A 149 -1.856 -10.233 14.582 1.00 0.00 N ATOM 1464 CA THR A 149 -3.027 -9.873 15.376 1.00 0.00 C ATOM 1465 C THR A 149 -4.272 -9.812 14.501 1.00 0.00 C ATOM 1466 O THR A 149 -5.354 -10.240 14.901 1.00 0.00 O ATOM 1467 CB THR A 149 -2.804 -8.527 16.068 1.00 0.00 C ATOM 1468 OG1 THR A 149 -1.644 -8.606 16.892 1.00 0.00 O ATOM 1469 CG2 THR A 149 -4.017 -8.191 16.939 1.00 0.00 C ATOM 0 H THR A 149 -1.202 -9.467 14.419 1.00 0.00 H new ATOM 0 HA THR A 149 -3.176 -10.641 16.135 1.00 0.00 H new ATOM 0 HB THR A 149 -2.669 -7.751 15.315 1.00 0.00 H new ATOM 0 HG1 THR A 149 -1.498 -7.744 17.335 1.00 0.00 H new ATOM 0 HG21 THR A 149 -3.857 -7.232 17.431 1.00 0.00 H new ATOM 0 HG22 THR A 149 -4.909 -8.134 16.315 1.00 0.00 H new ATOM 0 HG23 THR A 149 -4.151 -8.968 17.692 1.00 0.00 H new ATOM 1477 N ILE A 150 -4.107 -9.271 13.305 1.00 0.00 N ATOM 1478 CA ILE A 150 -5.216 -9.146 12.371 1.00 0.00 C ATOM 1479 C ILE A 150 -5.656 -10.509 11.874 1.00 0.00 C ATOM 1480 O ILE A 150 -6.848 -10.771 11.724 1.00 0.00 O ATOM 1481 CB ILE A 150 -4.818 -8.261 11.185 1.00 0.00 C ATOM 1482 CG1 ILE A 150 -4.450 -6.857 11.685 1.00 0.00 C ATOM 1483 CG2 ILE A 150 -5.979 -8.162 10.198 1.00 0.00 C ATOM 1484 CD1 ILE A 150 -5.626 -6.236 12.447 1.00 0.00 C ATOM 0 H ILE A 150 -3.218 -8.912 12.958 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.051 -8.681 12.896 1.00 0.00 H new ATOM 0 HB ILE A 150 -3.957 -8.704 10.685 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -3.576 -6.913 12.334 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -4.180 -6.223 10.841 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.689 -7.531 9.357 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -6.233 -9.158 9.834 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.845 -7.726 10.697 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.349 -5.241 12.795 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.490 -6.162 11.786 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.877 -6.863 13.303 1.00 0.00 H new ATOM 1496 N ALA A 151 -4.685 -11.370 11.616 1.00 0.00 N ATOM 1497 CA ALA A 151 -4.977 -12.708 11.127 1.00 0.00 C ATOM 1498 C ALA A 151 -5.755 -13.502 12.166 1.00 0.00 C ATOM 1499 O ALA A 151 -6.678 -14.250 11.836 1.00 0.00 O ATOM 1500 CB ALA A 151 -3.679 -13.438 10.781 1.00 0.00 C ATOM 0 H ALA A 151 -3.692 -11.168 11.736 1.00 0.00 H new ATOM 0 HA ALA A 151 -5.587 -12.618 10.228 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -3.911 -14.439 10.416 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -3.145 -12.885 10.009 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.055 -13.512 11.671 1.00 0.00 H new ATOM 1506 N GLU A 152 -5.372 -13.329 13.421 1.00 0.00 N ATOM 1507 CA GLU A 152 -6.045 -14.030 14.516 1.00 0.00 C ATOM 1508 C GLU A 152 -7.450 -13.488 14.730 1.00 0.00 C ATOM 1509 O GLU A 152 -8.381 -14.234 15.023 1.00 0.00 O ATOM 1510 CB GLU A 152 -5.234 -13.904 15.807 1.00 0.00 C ATOM 1511 CG GLU A 152 -3.934 -14.701 15.678 1.00 0.00 C ATOM 1512 CD GLU A 152 -4.240 -16.195 15.655 1.00 0.00 C ATOM 1513 OE1 GLU A 152 -5.320 -16.564 16.083 1.00 0.00 O ATOM 1514 OE2 GLU A 152 -3.390 -16.946 15.208 1.00 0.00 O ATOM 0 H GLU A 152 -4.608 -12.718 13.710 1.00 0.00 H new ATOM 0 HA GLU A 152 -6.121 -15.083 14.244 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.011 -12.856 16.007 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -5.816 -14.273 16.651 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -3.411 -14.414 14.766 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -3.271 -14.470 16.512 1.00 0.00 H new ATOM 1521 N ASP A 153 -7.590 -12.181 14.597 1.00 0.00 N ATOM 1522 CA ASP A 153 -8.886 -11.534 14.782 1.00 0.00 C ATOM 1523 C ASP A 153 -9.828 -11.866 13.630 1.00 0.00 C ATOM 1524 O ASP A 153 -11.032 -12.034 13.824 1.00 0.00 O ATOM 1525 CB ASP A 153 -8.708 -10.020 14.890 1.00 0.00 C ATOM 1526 CG ASP A 153 -8.049 -9.665 16.219 1.00 0.00 C ATOM 1527 OD1 ASP A 153 -7.984 -10.530 17.076 1.00 0.00 O ATOM 1528 OD2 ASP A 153 -7.622 -8.531 16.362 1.00 0.00 O ATOM 0 H ASP A 153 -6.828 -11.545 14.363 1.00 0.00 H new ATOM 0 HA ASP A 153 -9.326 -11.910 15.706 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -8.097 -9.658 14.063 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -9.676 -9.525 14.811 1.00 0.00 H new ATOM 1533 N ALA A 154 -9.267 -11.949 12.429 1.00 0.00 N ATOM 1534 CA ALA A 154 -10.056 -12.252 11.245 1.00 0.00 C ATOM 1535 C ALA A 154 -10.624 -13.663 11.320 1.00 0.00 C ATOM 1536 O ALA A 154 -11.753 -13.914 10.900 1.00 0.00 O ATOM 1537 CB ALA A 154 -9.200 -12.107 9.986 1.00 0.00 C ATOM 0 H ALA A 154 -8.272 -11.811 12.252 1.00 0.00 H new ATOM 0 HA ALA A 154 -10.884 -11.544 11.200 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -9.803 -12.337 9.108 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -8.829 -11.085 9.914 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -8.357 -12.796 10.038 1.00 0.00 H new ATOM 1543 N LYS A 155 -9.821 -14.582 11.844 1.00 0.00 N ATOM 1544 CA LYS A 155 -10.244 -15.977 11.950 1.00 0.00 C ATOM 1545 C LYS A 155 -11.413 -16.112 12.923 1.00 0.00 C ATOM 1546 O LYS A 155 -12.109 -17.129 12.935 1.00 0.00 O ATOM 1547 CB LYS A 155 -9.079 -16.845 12.428 1.00 0.00 C ATOM 1548 CG LYS A 155 -9.187 -17.066 13.939 1.00 0.00 C ATOM 1549 CD LYS A 155 -7.861 -17.608 14.470 1.00 0.00 C ATOM 1550 CE LYS A 155 -7.616 -19.008 13.908 1.00 0.00 C ATOM 1551 NZ LYS A 155 -6.334 -19.540 14.446 1.00 0.00 N ATOM 0 H LYS A 155 -8.884 -14.392 12.199 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.565 -16.313 10.964 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -9.090 -17.803 11.909 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -8.131 -16.363 12.188 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -9.435 -16.129 14.438 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -9.993 -17.767 14.158 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -7.045 -16.943 14.186 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -7.880 -17.641 15.559 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -8.439 -19.670 14.179 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -7.580 -18.973 12.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -6.166 -20.493 14.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -5.553 -18.912 14.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -6.386 -19.587 15.484 1.00 0.00 H new ATOM 1565 N LYS A 156 -11.618 -15.083 13.738 1.00 0.00 N ATOM 1566 CA LYS A 156 -12.705 -15.093 14.707 1.00 0.00 C ATOM 1567 C LYS A 156 -13.970 -14.469 14.118 1.00 0.00 C ATOM 1568 O LYS A 156 -15.008 -14.415 14.777 1.00 0.00 O ATOM 1569 CB LYS A 156 -12.291 -14.326 15.963 1.00 0.00 C ATOM 1570 CG LYS A 156 -11.222 -15.120 16.717 1.00 0.00 C ATOM 1571 CD LYS A 156 -10.939 -14.449 18.063 1.00 0.00 C ATOM 1572 CE LYS A 156 -10.147 -13.162 17.841 1.00 0.00 C ATOM 1573 NZ LYS A 156 -9.823 -12.543 19.157 1.00 0.00 N ATOM 0 H LYS A 156 -11.049 -14.237 13.747 1.00 0.00 H new ATOM 0 HA LYS A 156 -12.919 -16.130 14.966 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -11.905 -13.343 15.691 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -13.157 -14.162 16.604 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -11.559 -16.145 16.874 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -10.308 -15.172 16.125 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -11.876 -14.227 18.574 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -10.378 -15.126 18.707 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -9.230 -13.377 17.293 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -10.726 -12.467 17.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -9.284 -11.667 19.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -10.704 -12.324 19.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -9.254 -13.206 19.722 1.00 0.00 H new ATOM 1587 N ILE A 157 -13.879 -14.004 12.873 1.00 0.00 N ATOM 1588 CA ILE A 157 -15.016 -13.392 12.206 1.00 0.00 C ATOM 1589 C ILE A 157 -15.848 -14.451 11.485 1.00 0.00 C ATOM 1590 O ILE A 157 -15.311 -15.325 10.804 1.00 0.00 O ATOM 1591 CB ILE A 157 -14.534 -12.345 11.207 1.00 0.00 C ATOM 1592 CG1 ILE A 157 -13.757 -11.249 11.946 1.00 0.00 C ATOM 1593 CG2 ILE A 157 -15.735 -11.724 10.495 1.00 0.00 C ATOM 1594 CD1 ILE A 157 -13.131 -10.285 10.933 1.00 0.00 C ATOM 0 H ILE A 157 -13.029 -14.041 12.310 1.00 0.00 H new ATOM 0 HA ILE A 157 -15.640 -12.910 12.959 1.00 0.00 H new ATOM 0 HB ILE A 157 -13.883 -12.820 10.473 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -14.424 -10.705 12.615 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -12.979 -11.696 12.565 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -15.388 -10.976 9.782 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -16.287 -12.501 9.966 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -16.388 -11.251 11.228 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -12.580 -9.508 11.463 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -12.450 -10.833 10.282 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -13.917 -9.827 10.333 1.00 0.00 H new ATOM 1606 N GLU A 158 -17.160 -14.369 11.643 1.00 0.00 N ATOM 1607 CA GLU A 158 -18.055 -15.331 11.007 1.00 0.00 C ATOM 1608 C GLU A 158 -17.951 -15.239 9.490 1.00 0.00 C ATOM 1609 O GLU A 158 -17.780 -14.157 8.932 1.00 0.00 O ATOM 1610 CB GLU A 158 -19.495 -15.056 11.436 1.00 0.00 C ATOM 1611 CG GLU A 158 -19.616 -15.232 12.948 1.00 0.00 C ATOM 1612 CD GLU A 158 -21.022 -14.851 13.407 1.00 0.00 C ATOM 1613 OE1 GLU A 158 -21.813 -14.462 12.562 1.00 0.00 O ATOM 1614 OE2 GLU A 158 -21.289 -14.953 14.593 1.00 0.00 O ATOM 0 H GLU A 158 -17.628 -13.654 12.200 1.00 0.00 H new ATOM 0 HA GLU A 158 -17.764 -16.334 11.318 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -19.784 -14.044 11.152 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -20.175 -15.737 10.924 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -19.403 -16.266 13.220 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -18.878 -14.610 13.455 1.00 0.00 H new ATOM 1621 N GLY A 159 -18.046 -16.388 8.828 1.00 0.00 N ATOM 1622 CA GLY A 159 -17.952 -16.429 7.374 1.00 0.00 C ATOM 1623 C GLY A 159 -16.506 -16.630 6.932 1.00 0.00 C ATOM 1624 O GLY A 159 -16.245 -16.869 5.757 1.00 0.00 O ATOM 0 H GLY A 159 -18.187 -17.296 9.271 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -18.571 -17.238 6.987 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -18.340 -15.501 6.953 1.00 0.00 H new ATOM 1628 N VAL A 160 -15.569 -16.526 7.874 1.00 0.00 N ATOM 1629 CA VAL A 160 -14.160 -16.702 7.554 1.00 0.00 C ATOM 1630 C VAL A 160 -13.860 -18.164 7.231 1.00 0.00 C ATOM 1631 O VAL A 160 -14.335 -19.072 7.913 1.00 0.00 O ATOM 1632 CB VAL A 160 -13.305 -16.256 8.741 1.00 0.00 C ATOM 1633 CG1 VAL A 160 -13.468 -17.252 9.892 1.00 0.00 C ATOM 1634 CG2 VAL A 160 -11.837 -16.202 8.320 1.00 0.00 C ATOM 0 H VAL A 160 -15.761 -16.323 8.855 1.00 0.00 H new ATOM 0 HA VAL A 160 -13.923 -16.095 6.680 1.00 0.00 H new ATOM 0 HB VAL A 160 -13.627 -15.267 9.068 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -12.858 -16.934 10.738 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -14.515 -17.291 10.194 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -13.147 -18.241 9.565 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -11.227 -15.884 9.166 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -11.516 -17.191 7.992 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -11.719 -15.492 7.501 1.00 0.00 H new ATOM 1644 N SER A 161 -13.068 -18.381 6.190 1.00 0.00 N ATOM 1645 CA SER A 161 -12.700 -19.735 5.784 1.00 0.00 C ATOM 1646 C SER A 161 -11.238 -20.010 6.112 1.00 0.00 C ATOM 1647 O SER A 161 -10.910 -21.016 6.746 1.00 0.00 O ATOM 1648 CB SER A 161 -12.936 -19.917 4.289 1.00 0.00 C ATOM 1649 OG SER A 161 -12.740 -21.282 3.947 1.00 0.00 O ATOM 0 H SER A 161 -12.668 -17.642 5.612 1.00 0.00 H new ATOM 0 HA SER A 161 -13.323 -20.441 6.333 1.00 0.00 H new ATOM 0 HB2 SER A 161 -13.948 -19.606 4.028 1.00 0.00 H new ATOM 0 HB3 SER A 161 -12.252 -19.286 3.721 1.00 0.00 H new ATOM 0 HG SER A 161 -12.892 -21.404 2.987 1.00 0.00 H new ATOM 1655 N GLU A 162 -10.361 -19.110 5.678 1.00 0.00 N ATOM 1656 CA GLU A 162 -8.929 -19.269 5.936 1.00 0.00 C ATOM 1657 C GLU A 162 -8.227 -17.921 5.933 1.00 0.00 C ATOM 1658 O GLU A 162 -8.557 -17.056 5.141 1.00 0.00 O ATOM 1659 CB GLU A 162 -8.306 -20.178 4.879 1.00 0.00 C ATOM 1660 CG GLU A 162 -6.900 -20.587 5.326 1.00 0.00 C ATOM 1661 CD GLU A 162 -5.899 -19.486 4.987 1.00 0.00 C ATOM 1662 OE1 GLU A 162 -6.155 -18.745 4.053 1.00 0.00 O ATOM 1663 OE2 GLU A 162 -4.893 -19.399 5.670 1.00 0.00 O ATOM 0 H GLU A 162 -10.610 -18.272 5.152 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.806 -19.721 6.920 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.925 -21.063 4.734 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -8.259 -19.661 3.921 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -6.893 -20.778 6.399 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -6.610 -21.516 4.835 1.00 0.00 H new ATOM 1670 N VAL A 163 -7.274 -17.738 6.833 1.00 0.00 N ATOM 1671 CA VAL A 163 -6.559 -16.471 6.922 1.00 0.00 C ATOM 1672 C VAL A 163 -5.055 -16.690 6.815 1.00 0.00 C ATOM 1673 O VAL A 163 -4.504 -17.595 7.442 1.00 0.00 O ATOM 1674 CB VAL A 163 -6.886 -15.784 8.253 1.00 0.00 C ATOM 1675 CG1 VAL A 163 -6.233 -14.396 8.296 1.00 0.00 C ATOM 1676 CG2 VAL A 163 -8.407 -15.660 8.412 1.00 0.00 C ATOM 0 H VAL A 163 -6.978 -18.443 7.508 1.00 0.00 H new ATOM 0 HA VAL A 163 -6.877 -15.837 6.095 1.00 0.00 H new ATOM 0 HB VAL A 163 -6.493 -16.383 9.074 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -6.469 -13.912 9.244 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -5.152 -14.499 8.200 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -6.614 -13.789 7.475 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -8.635 -15.171 9.359 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -8.812 -15.068 7.591 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -8.856 -16.653 8.399 1.00 0.00 H new ATOM 1686 N GLN A 164 -4.392 -15.852 6.023 1.00 0.00 N ATOM 1687 CA GLN A 164 -2.951 -15.964 5.849 1.00 0.00 C ATOM 1688 C GLN A 164 -2.308 -14.580 5.856 1.00 0.00 C ATOM 1689 O GLN A 164 -2.886 -13.612 5.370 1.00 0.00 O ATOM 1690 CB GLN A 164 -2.637 -16.667 4.527 1.00 0.00 C ATOM 1691 CG GLN A 164 -3.087 -15.787 3.359 1.00 0.00 C ATOM 1692 CD GLN A 164 -2.888 -16.530 2.041 1.00 0.00 C ATOM 1693 OE1 GLN A 164 -3.531 -17.552 1.802 1.00 0.00 O ATOM 1694 NE2 GLN A 164 -2.033 -16.073 1.168 1.00 0.00 N ATOM 0 H GLN A 164 -4.827 -15.095 5.496 1.00 0.00 H new ATOM 0 HA GLN A 164 -2.546 -16.549 6.675 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -1.568 -16.867 4.454 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -3.145 -17.631 4.486 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -4.136 -15.517 3.479 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -2.517 -14.858 3.352 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -1.502 -15.226 1.369 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -1.896 -16.563 0.284 1.00 0.00 H new ATOM 1703 N ASP A 165 -1.110 -14.500 6.413 1.00 0.00 N ATOM 1704 CA ASP A 165 -0.393 -13.228 6.481 1.00 0.00 C ATOM 1705 C ASP A 165 0.813 -13.237 5.546 1.00 0.00 C ATOM 1706 O ASP A 165 1.351 -14.295 5.217 1.00 0.00 O ATOM 1707 CB ASP A 165 0.076 -12.969 7.915 1.00 0.00 C ATOM 1708 CG ASP A 165 1.078 -14.039 8.342 1.00 0.00 C ATOM 1709 OD1 ASP A 165 1.229 -15.004 7.615 1.00 0.00 O ATOM 1710 OD2 ASP A 165 1.683 -13.871 9.386 1.00 0.00 O ATOM 0 H ASP A 165 -0.613 -15.291 6.823 1.00 0.00 H new ATOM 0 HA ASP A 165 -1.073 -12.435 6.170 1.00 0.00 H new ATOM 0 HB2 ASP A 165 0.535 -11.983 7.983 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -0.779 -12.970 8.591 1.00 0.00 H new ATOM 1715 N GLY A 166 1.239 -12.050 5.122 1.00 0.00 N ATOM 1716 CA GLY A 166 2.387 -11.936 4.233 1.00 0.00 C ATOM 1717 C GLY A 166 2.104 -12.601 2.890 1.00 0.00 C ATOM 1718 O GLY A 166 3.004 -13.162 2.264 1.00 0.00 O ATOM 0 H GLY A 166 0.809 -11.161 5.378 1.00 0.00 H new ATOM 0 HA2 GLY A 166 2.629 -10.885 4.079 1.00 0.00 H new ATOM 0 HA3 GLY A 166 3.258 -12.399 4.696 1.00 0.00 H new