USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1106 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 52 ASN : amide:sc= -4.93! C(o=-6.6!,f=-7.6!) USER MOD Set 1.2: A 57 HIS : no HD1:sc= -1.7 K(o=-6.6,f=-8.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc=-0.000467 (180deg=-0.053) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.25 USER MOD Single : A 23 LYS NZ :NH3+ -160:sc= 1.1 (180deg=0.739) USER MOD Single : A 29 LYS NZ :NH3+ -149:sc= -0.118 (180deg=-0.874) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 80:sc= -1.73! USER MOD Single : A 35 GLN : amide:sc= -5.1! K(o=-5.1!,f=-2.1) USER MOD Single : A 37 ASN : amide:sc= -0.825 K(o=-0.82,f=-0.23) USER MOD Single : A 39 THR OG1 : rot 159:sc= 1.12 USER MOD Single : A 42 GLN : amide:sc= -0.674 K(o=-0.67,f=-0.0045) USER MOD Single : A 43 ASN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 56 GLN : amide:sc= -1.49 K(o=-1.5,f=-0.45) USER MOD Single : A 60 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0257) USER MOD Single : A 68 THR OG1 : rot -41:sc= -1.44 USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 GLN : amide:sc= -0.725 K(o=-0.73,f=-6.3!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 53:sc= 1.2 USER MOD Single : A 85 HIS : no HD1:sc= -4.59 K(o=-4.6,f=-2.3) USER MOD Single : A 89 ASN : amide:sc= -1.63 K(o=-1.6,f=-0.18) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= -0.525 X(o=-0.52,f=-0.52) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 HIS : no HD1:sc= -0.751 K(o=-0.75,f=0.22) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 175:sc= -2.48! USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ -140:sc= 0.132 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 154:sc= 0.366 (180deg=0.0263) USER MOD Single : A 133 LYS NZ :NH3+ -107:sc=-0.00605 (180deg=-0.43) USER MOD Single : A 134 ASN : amide:sc= -0.522 K(o=-0.52,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -30.185 -2.136 -29.741 1.00 0.00 N ATOM 2 CA MET A 1 -29.626 -3.411 -30.284 1.00 0.00 C ATOM 3 C MET A 1 -28.153 -3.605 -29.908 1.00 0.00 C ATOM 4 O MET A 1 -27.705 -4.733 -29.700 1.00 0.00 O ATOM 5 CB MET A 1 -29.792 -3.420 -31.810 1.00 0.00 C ATOM 6 CG MET A 1 -30.835 -4.414 -32.303 1.00 0.00 C ATOM 7 SD MET A 1 -32.475 -3.681 -32.466 1.00 0.00 S ATOM 8 CE MET A 1 -33.483 -4.910 -31.637 1.00 0.00 C ATOM 0 H1 MET A 1 -31.203 -2.088 -29.947 1.00 0.00 H new ATOM 0 H2 MET A 1 -30.038 -2.103 -28.712 1.00 0.00 H new ATOM 0 H3 MET A 1 -29.703 -1.329 -30.185 1.00 0.00 H new ATOM 0 HA MET A 1 -30.177 -4.240 -29.841 1.00 0.00 H new ATOM 0 HB2 MET A 1 -30.069 -2.420 -32.143 1.00 0.00 H new ATOM 0 HB3 MET A 1 -28.832 -3.655 -32.270 1.00 0.00 H new ATOM 0 HG2 MET A 1 -30.523 -4.813 -33.268 1.00 0.00 H new ATOM 0 HG3 MET A 1 -30.885 -5.255 -31.611 1.00 0.00 H new ATOM 0 HE1 MET A 1 -34.527 -4.597 -31.656 1.00 0.00 H new ATOM 0 HE2 MET A 1 -33.382 -5.868 -32.147 1.00 0.00 H new ATOM 0 HE3 MET A 1 -33.154 -5.013 -30.603 1.00 0.00 H new ATOM 18 N ASP A 2 -27.399 -2.508 -29.825 1.00 0.00 N ATOM 19 CA ASP A 2 -25.981 -2.581 -29.476 1.00 0.00 C ATOM 20 C ASP A 2 -25.782 -3.275 -28.132 1.00 0.00 C ATOM 21 O ASP A 2 -25.821 -2.634 -27.080 1.00 0.00 O ATOM 22 CB ASP A 2 -25.368 -1.179 -29.428 1.00 0.00 C ATOM 23 CG ASP A 2 -24.815 -0.740 -30.771 1.00 0.00 C ATOM 24 OD1 ASP A 2 -23.750 -1.255 -31.171 1.00 0.00 O ATOM 25 OD2 ASP A 2 -25.447 0.120 -31.420 1.00 0.00 O ATOM 0 H ASP A 2 -27.745 -1.563 -29.994 1.00 0.00 H new ATOM 0 HA ASP A 2 -25.479 -3.166 -30.247 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -26.125 -0.466 -29.100 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -24.569 -1.160 -28.686 1.00 0.00 H new ATOM 30 N ASP A 3 -25.565 -4.586 -28.171 1.00 0.00 N ATOM 31 CA ASP A 3 -25.354 -5.364 -26.956 1.00 0.00 C ATOM 32 C ASP A 3 -23.885 -5.336 -26.544 1.00 0.00 C ATOM 33 O ASP A 3 -23.070 -4.659 -27.171 1.00 0.00 O ATOM 34 CB ASP A 3 -25.809 -6.810 -27.165 1.00 0.00 C ATOM 35 CG ASP A 3 -27.293 -6.916 -27.458 1.00 0.00 C ATOM 36 OD1 ASP A 3 -28.098 -6.454 -26.622 1.00 0.00 O ATOM 37 OD2 ASP A 3 -27.651 -7.462 -28.522 1.00 0.00 O ATOM 0 H ASP A 3 -25.531 -5.132 -29.032 1.00 0.00 H new ATOM 0 HA ASP A 3 -25.947 -4.916 -26.159 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -25.247 -7.249 -27.990 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -25.575 -7.393 -26.274 1.00 0.00 H new ATOM 42 N TYR A 4 -23.551 -6.075 -25.490 1.00 0.00 N ATOM 43 CA TYR A 4 -22.177 -6.129 -25.002 1.00 0.00 C ATOM 44 C TYR A 4 -21.238 -6.663 -26.077 1.00 0.00 C ATOM 45 O TYR A 4 -21.204 -7.864 -26.348 1.00 0.00 O ATOM 46 CB TYR A 4 -22.084 -7.009 -23.752 1.00 0.00 C ATOM 47 CG TYR A 4 -22.227 -6.245 -22.454 1.00 0.00 C ATOM 48 CD1 TYR A 4 -21.622 -5.007 -22.280 1.00 0.00 C ATOM 49 CD2 TYR A 4 -22.970 -6.765 -21.401 1.00 0.00 C ATOM 50 CE1 TYR A 4 -21.752 -4.309 -21.095 1.00 0.00 C ATOM 51 CE2 TYR A 4 -23.106 -6.072 -20.213 1.00 0.00 C ATOM 52 CZ TYR A 4 -22.495 -4.844 -20.065 1.00 0.00 C ATOM 53 OH TYR A 4 -22.628 -4.146 -18.883 1.00 0.00 O ATOM 0 H TYR A 4 -24.211 -6.643 -24.959 1.00 0.00 H new ATOM 0 HA TYR A 4 -21.874 -5.114 -24.746 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -22.859 -7.774 -23.799 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -21.125 -7.526 -23.754 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -21.040 -4.583 -23.085 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -23.449 -7.726 -21.513 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -21.273 -3.348 -20.976 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -23.688 -6.490 -19.405 1.00 0.00 H new ATOM 0 HH TYR A 4 -23.183 -4.660 -18.260 1.00 0.00 H new ATOM 63 N GLU A 5 -20.471 -5.764 -26.685 1.00 0.00 N ATOM 64 CA GLU A 5 -19.527 -6.145 -27.729 1.00 0.00 C ATOM 65 C GLU A 5 -18.488 -7.122 -27.189 1.00 0.00 C ATOM 66 O GLU A 5 -18.561 -7.547 -26.036 1.00 0.00 O ATOM 67 CB GLU A 5 -18.831 -4.905 -28.290 1.00 0.00 C ATOM 68 CG GLU A 5 -19.552 -4.288 -29.477 1.00 0.00 C ATOM 69 CD GLU A 5 -18.793 -4.467 -30.777 1.00 0.00 C ATOM 70 OE1 GLU A 5 -18.517 -5.627 -31.148 1.00 0.00 O ATOM 71 OE2 GLU A 5 -18.472 -3.448 -31.423 1.00 0.00 O ATOM 0 H GLU A 5 -20.485 -4.766 -26.473 1.00 0.00 H new ATOM 0 HA GLU A 5 -20.083 -6.636 -28.528 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -18.744 -4.159 -27.500 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -17.817 -5.172 -28.590 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -20.540 -4.739 -29.572 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -19.704 -3.224 -29.293 1.00 0.00 H new ATOM 78 N LYS A 6 -17.519 -7.470 -28.029 1.00 0.00 N ATOM 79 CA LYS A 6 -16.460 -8.391 -27.636 1.00 0.00 C ATOM 80 C LYS A 6 -15.125 -7.663 -27.547 1.00 0.00 C ATOM 81 O LYS A 6 -14.400 -7.790 -26.561 1.00 0.00 O ATOM 82 CB LYS A 6 -16.358 -9.544 -28.637 1.00 0.00 C ATOM 83 CG LYS A 6 -17.218 -10.744 -28.273 1.00 0.00 C ATOM 84 CD LYS A 6 -17.120 -11.841 -29.324 1.00 0.00 C ATOM 85 CE LYS A 6 -18.495 -12.294 -29.789 1.00 0.00 C ATOM 86 NZ LYS A 6 -18.415 -13.146 -31.008 1.00 0.00 N ATOM 0 H LYS A 6 -17.446 -7.128 -28.987 1.00 0.00 H new ATOM 0 HA LYS A 6 -16.706 -8.795 -26.654 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -16.650 -9.184 -29.624 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -15.318 -9.861 -28.708 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -16.905 -11.137 -27.306 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -18.257 -10.430 -28.169 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -16.548 -11.478 -30.178 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -16.575 -12.691 -28.914 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -18.984 -12.850 -28.989 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -19.114 -11.421 -29.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -19.373 -13.434 -31.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -17.971 -12.608 -31.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -17.845 -13.992 -30.804 1.00 0.00 H new ATOM 100 N LEU A 7 -14.809 -6.901 -28.587 1.00 0.00 N ATOM 101 CA LEU A 7 -13.562 -6.149 -28.634 1.00 0.00 C ATOM 102 C LEU A 7 -13.466 -5.332 -29.920 1.00 0.00 C ATOM 103 O LEU A 7 -12.373 -5.075 -30.424 1.00 0.00 O ATOM 104 CB LEU A 7 -12.371 -7.102 -28.535 1.00 0.00 C ATOM 105 CG LEU A 7 -12.443 -8.313 -29.468 1.00 0.00 C ATOM 106 CD1 LEU A 7 -11.547 -8.108 -30.679 1.00 0.00 C ATOM 107 CD2 LEU A 7 -12.060 -9.584 -28.725 1.00 0.00 C ATOM 0 H LEU A 7 -15.400 -6.788 -29.410 1.00 0.00 H new ATOM 0 HA LEU A 7 -13.546 -5.463 -27.787 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -11.459 -6.546 -28.753 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -12.291 -7.456 -27.507 1.00 0.00 H new ATOM 0 HG LEU A 7 -13.470 -8.418 -29.817 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -11.611 -8.979 -31.331 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -11.870 -7.222 -31.225 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -10.516 -7.976 -30.351 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -12.117 -10.434 -29.405 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -11.043 -9.491 -28.345 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -12.745 -9.739 -27.892 1.00 0.00 H new ATOM 119 N LEU A 8 -14.617 -4.917 -30.445 1.00 0.00 N ATOM 120 CA LEU A 8 -14.658 -4.123 -31.668 1.00 0.00 C ATOM 121 C LEU A 8 -14.688 -2.633 -31.341 1.00 0.00 C ATOM 122 O LEU A 8 -15.227 -1.828 -32.101 1.00 0.00 O ATOM 123 CB LEU A 8 -15.880 -4.505 -32.510 1.00 0.00 C ATOM 124 CG LEU A 8 -15.557 -5.101 -33.883 1.00 0.00 C ATOM 125 CD1 LEU A 8 -16.595 -6.142 -34.277 1.00 0.00 C ATOM 126 CD2 LEU A 8 -15.475 -4.001 -34.931 1.00 0.00 C ATOM 0 H LEU A 8 -15.532 -5.118 -30.042 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.756 -4.332 -32.243 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -16.478 -5.224 -31.950 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -16.497 -3.618 -32.651 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.588 -5.596 -33.824 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -16.346 -6.552 -35.256 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -16.604 -6.944 -33.539 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -17.580 -5.676 -34.319 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -15.245 -4.440 -35.902 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -16.430 -3.479 -34.986 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -14.691 -3.295 -34.657 1.00 0.00 H new ATOM 138 N GLU A 9 -14.104 -2.275 -30.203 1.00 0.00 N ATOM 139 CA GLU A 9 -14.058 -0.888 -29.765 1.00 0.00 C ATOM 140 C GLU A 9 -12.618 -0.447 -29.530 1.00 0.00 C ATOM 141 O GLU A 9 -11.807 -1.206 -28.998 1.00 0.00 O ATOM 142 CB GLU A 9 -14.873 -0.713 -28.480 1.00 0.00 C ATOM 143 CG GLU A 9 -14.696 -1.851 -27.487 1.00 0.00 C ATOM 144 CD GLU A 9 -15.808 -2.879 -27.573 1.00 0.00 C ATOM 145 OE1 GLU A 9 -16.957 -2.489 -27.871 1.00 0.00 O ATOM 146 OE2 GLU A 9 -15.530 -4.075 -27.344 1.00 0.00 O ATOM 0 H GLU A 9 -13.654 -2.931 -29.565 1.00 0.00 H new ATOM 0 HA GLU A 9 -14.490 -0.266 -30.549 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -14.585 0.223 -28.002 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -15.929 -0.628 -28.738 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -13.739 -2.340 -27.668 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -14.660 -1.444 -26.476 1.00 0.00 H new ATOM 153 N ARG A 10 -12.304 0.780 -29.929 1.00 0.00 N ATOM 154 CA ARG A 10 -10.959 1.313 -29.758 1.00 0.00 C ATOM 155 C ARG A 10 -10.855 2.123 -28.469 1.00 0.00 C ATOM 156 O ARG A 10 -11.008 3.344 -28.477 1.00 0.00 O ATOM 157 CB ARG A 10 -10.562 2.183 -30.954 1.00 0.00 C ATOM 158 CG ARG A 10 -11.696 3.035 -31.503 1.00 0.00 C ATOM 159 CD ARG A 10 -12.468 2.299 -32.586 1.00 0.00 C ATOM 160 NE ARG A 10 -11.865 2.474 -33.905 1.00 0.00 N ATOM 161 CZ ARG A 10 -11.863 3.624 -34.575 1.00 0.00 C ATOM 162 NH1 ARG A 10 -12.431 4.705 -34.053 1.00 0.00 N ATOM 163 NH2 ARG A 10 -11.293 3.695 -35.769 1.00 0.00 N ATOM 0 H ARG A 10 -12.961 1.422 -30.372 1.00 0.00 H new ATOM 0 HA ARG A 10 -10.273 0.468 -29.696 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -9.741 2.836 -30.658 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -10.187 1.539 -31.750 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -12.373 3.308 -30.693 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -11.293 3.963 -31.908 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -12.508 1.237 -32.344 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -13.496 2.660 -32.607 1.00 0.00 H new ATOM 0 HE ARG A 10 -11.418 1.666 -34.339 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -12.872 4.656 -33.134 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -12.427 5.584 -34.571 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -10.855 2.868 -36.175 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -11.292 4.577 -36.282 1.00 0.00 H new ATOM 177 N ALA A 11 -10.593 1.432 -27.364 1.00 0.00 N ATOM 178 CA ALA A 11 -10.468 2.081 -26.066 1.00 0.00 C ATOM 179 C ALA A 11 -9.878 1.130 -25.031 1.00 0.00 C ATOM 180 O ALA A 11 -10.218 1.196 -23.849 1.00 0.00 O ATOM 181 CB ALA A 11 -11.823 2.594 -25.603 1.00 0.00 C ATOM 0 H ALA A 11 -10.463 0.421 -27.343 1.00 0.00 H new ATOM 0 HA ALA A 11 -9.788 2.926 -26.172 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -11.717 3.077 -24.632 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -12.206 3.314 -26.326 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.519 1.759 -25.519 1.00 0.00 H new ATOM 187 N ILE A 12 -8.995 0.243 -25.481 1.00 0.00 N ATOM 188 CA ILE A 12 -8.361 -0.722 -24.592 1.00 0.00 C ATOM 189 C ILE A 12 -6.939 -0.285 -24.222 1.00 0.00 C ATOM 190 O ILE A 12 -6.757 0.588 -23.374 1.00 0.00 O ATOM 191 CB ILE A 12 -8.338 -2.135 -25.219 1.00 0.00 C ATOM 192 CG1 ILE A 12 -9.715 -2.490 -25.791 1.00 0.00 C ATOM 193 CG2 ILE A 12 -7.901 -3.166 -24.186 1.00 0.00 C ATOM 194 CD1 ILE A 12 -9.658 -3.516 -26.903 1.00 0.00 C ATOM 0 H ILE A 12 -8.703 0.174 -26.456 1.00 0.00 H new ATOM 0 HA ILE A 12 -8.958 -0.761 -23.681 1.00 0.00 H new ATOM 0 HB ILE A 12 -7.617 -2.141 -26.037 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -10.347 -2.870 -24.988 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -10.189 -1.583 -26.167 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -7.890 -4.156 -24.642 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -6.902 -2.920 -23.827 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -8.599 -3.160 -23.349 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -10.667 -3.721 -27.261 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -9.053 -3.130 -27.723 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -9.213 -4.437 -26.526 1.00 0.00 H new ATOM 206 N ASP A 13 -5.934 -0.885 -24.859 1.00 0.00 N ATOM 207 CA ASP A 13 -4.544 -0.543 -24.587 1.00 0.00 C ATOM 208 C ASP A 13 -3.847 -0.070 -25.857 1.00 0.00 C ATOM 209 O ASP A 13 -3.412 1.078 -25.950 1.00 0.00 O ATOM 210 CB ASP A 13 -3.804 -1.749 -24.007 1.00 0.00 C ATOM 211 CG ASP A 13 -2.887 -1.365 -22.862 1.00 0.00 C ATOM 212 OD1 ASP A 13 -2.139 -0.375 -23.006 1.00 0.00 O ATOM 213 OD2 ASP A 13 -2.918 -2.053 -21.821 1.00 0.00 O ATOM 0 H ASP A 13 -6.059 -1.609 -25.566 1.00 0.00 H new ATOM 0 HA ASP A 13 -4.530 0.268 -23.858 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -4.529 -2.484 -23.658 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -3.219 -2.226 -24.793 1.00 0.00 H new ATOM 218 N GLN A 14 -3.746 -0.964 -26.835 1.00 0.00 N ATOM 219 CA GLN A 14 -3.103 -0.644 -28.104 1.00 0.00 C ATOM 220 C GLN A 14 -4.030 0.185 -28.988 1.00 0.00 C ATOM 221 O GLN A 14 -3.575 1.001 -29.791 1.00 0.00 O ATOM 222 CB GLN A 14 -2.695 -1.929 -28.828 1.00 0.00 C ATOM 223 CG GLN A 14 -1.289 -1.887 -29.402 1.00 0.00 C ATOM 224 CD GLN A 14 -1.084 -2.902 -30.511 1.00 0.00 C ATOM 225 OE1 GLN A 14 -1.124 -2.563 -31.693 1.00 0.00 O ATOM 226 NE2 GLN A 14 -0.865 -4.156 -30.132 1.00 0.00 N ATOM 0 H GLN A 14 -4.102 -1.918 -26.773 1.00 0.00 H new ATOM 0 HA GLN A 14 -2.210 -0.055 -27.896 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -2.769 -2.766 -28.134 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -3.402 -2.121 -29.635 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -1.087 -0.887 -29.787 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -0.569 -2.074 -28.605 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -0.840 -4.392 -29.140 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -0.722 -4.883 -30.833 1.00 0.00 H new ATOM 235 N LEU A 15 -5.335 -0.023 -28.830 1.00 0.00 N ATOM 236 CA LEU A 15 -6.325 0.712 -29.609 1.00 0.00 C ATOM 237 C LEU A 15 -6.147 2.217 -29.419 1.00 0.00 C ATOM 238 O LEU A 15 -5.683 2.663 -28.369 1.00 0.00 O ATOM 239 CB LEU A 15 -7.742 0.299 -29.197 1.00 0.00 C ATOM 240 CG LEU A 15 -8.257 -1.006 -29.815 1.00 0.00 C ATOM 241 CD1 LEU A 15 -8.367 -0.882 -31.327 1.00 0.00 C ATOM 242 CD2 LEU A 15 -7.354 -2.171 -29.438 1.00 0.00 C ATOM 0 H LEU A 15 -5.730 -0.694 -28.170 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.178 0.471 -30.662 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -7.772 0.203 -28.112 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -8.428 1.103 -29.465 1.00 0.00 H new ATOM 0 HG LEU A 15 -9.253 -1.200 -29.416 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -8.734 -1.820 -31.743 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.060 -0.078 -31.577 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -7.386 -0.659 -31.746 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -7.737 -3.088 -29.886 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -6.345 -1.982 -29.804 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -7.333 -2.279 -28.354 1.00 0.00 H new ATOM 254 N PRO A 16 -6.508 3.024 -30.430 1.00 0.00 N ATOM 255 CA PRO A 16 -6.376 4.480 -30.356 1.00 0.00 C ATOM 256 C PRO A 16 -7.061 5.057 -29.116 1.00 0.00 C ATOM 257 O PRO A 16 -8.262 4.872 -28.922 1.00 0.00 O ATOM 258 CB PRO A 16 -7.059 4.990 -31.635 1.00 0.00 C ATOM 259 CG PRO A 16 -7.768 3.814 -32.225 1.00 0.00 C ATOM 260 CD PRO A 16 -7.066 2.586 -31.717 1.00 0.00 C ATOM 0 HA PRO A 16 -5.332 4.784 -30.279 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -7.760 5.794 -31.408 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -6.326 5.394 -32.334 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -8.818 3.808 -31.932 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -7.741 3.852 -33.314 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.755 1.751 -31.593 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -6.285 2.256 -32.403 1.00 0.00 H new ATOM 268 N PRO A 17 -6.304 5.762 -28.252 1.00 0.00 N ATOM 269 CA PRO A 17 -6.852 6.357 -27.028 1.00 0.00 C ATOM 270 C PRO A 17 -7.958 7.366 -27.318 1.00 0.00 C ATOM 271 O PRO A 17 -7.778 8.290 -28.112 1.00 0.00 O ATOM 272 CB PRO A 17 -5.647 7.056 -26.383 1.00 0.00 C ATOM 273 CG PRO A 17 -4.647 7.202 -27.479 1.00 0.00 C ATOM 274 CD PRO A 17 -4.863 6.033 -28.394 1.00 0.00 C ATOM 0 HA PRO A 17 -7.311 5.603 -26.388 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -5.927 8.027 -25.974 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -5.245 6.467 -25.559 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -4.785 8.144 -28.010 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -3.632 7.205 -27.083 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -4.597 6.272 -29.424 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -4.260 5.174 -28.100 1.00 0.00 H new ATOM 282 N GLU A 18 -9.101 7.183 -26.667 1.00 0.00 N ATOM 283 CA GLU A 18 -10.240 8.076 -26.849 1.00 0.00 C ATOM 284 C GLU A 18 -11.063 8.174 -25.569 1.00 0.00 C ATOM 285 O GLU A 18 -11.485 9.260 -25.173 1.00 0.00 O ATOM 286 CB GLU A 18 -11.122 7.586 -28.000 1.00 0.00 C ATOM 287 CG GLU A 18 -12.002 8.673 -28.597 1.00 0.00 C ATOM 288 CD GLU A 18 -12.253 8.472 -30.078 1.00 0.00 C ATOM 289 OE1 GLU A 18 -11.279 8.202 -30.814 1.00 0.00 O ATOM 290 OE2 GLU A 18 -13.421 8.585 -30.504 1.00 0.00 O ATOM 0 H GLU A 18 -9.264 6.423 -26.007 1.00 0.00 H new ATOM 0 HA GLU A 18 -9.857 9.067 -27.091 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.487 7.173 -28.784 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -11.755 6.774 -27.642 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.956 8.693 -28.070 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -11.531 9.643 -28.441 1.00 0.00 H new ATOM 297 N VAL A 19 -11.288 7.032 -24.926 1.00 0.00 N ATOM 298 CA VAL A 19 -12.060 6.991 -23.690 1.00 0.00 C ATOM 299 C VAL A 19 -11.151 7.103 -22.473 1.00 0.00 C ATOM 300 O VAL A 19 -10.168 6.374 -22.349 1.00 0.00 O ATOM 301 CB VAL A 19 -12.884 5.695 -23.583 1.00 0.00 C ATOM 302 CG1 VAL A 19 -13.853 5.773 -22.412 1.00 0.00 C ATOM 303 CG2 VAL A 19 -13.625 5.429 -24.887 1.00 0.00 C ATOM 0 H VAL A 19 -10.947 6.124 -25.241 1.00 0.00 H new ATOM 0 HA VAL A 19 -12.740 7.843 -23.714 1.00 0.00 H new ATOM 0 HB VAL A 19 -12.203 4.863 -23.402 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -14.427 4.848 -22.352 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -13.295 5.914 -21.487 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -14.533 6.613 -22.557 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -14.203 4.509 -24.796 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -14.297 6.260 -25.100 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -12.906 5.326 -25.700 1.00 0.00 H new ATOM 313 N PHE A 20 -11.487 8.026 -21.579 1.00 0.00 N ATOM 314 CA PHE A 20 -10.704 8.245 -20.368 1.00 0.00 C ATOM 315 C PHE A 20 -10.956 7.144 -19.338 1.00 0.00 C ATOM 316 O PHE A 20 -11.389 7.415 -18.217 1.00 0.00 O ATOM 317 CB PHE A 20 -11.031 9.617 -19.766 1.00 0.00 C ATOM 318 CG PHE A 20 -12.504 9.867 -19.580 1.00 0.00 C ATOM 319 CD1 PHE A 20 -13.277 10.349 -20.625 1.00 0.00 C ATOM 320 CD2 PHE A 20 -13.112 9.621 -18.359 1.00 0.00 C ATOM 321 CE1 PHE A 20 -14.629 10.579 -20.455 1.00 0.00 C ATOM 322 CE2 PHE A 20 -14.464 9.850 -18.185 1.00 0.00 C ATOM 323 CZ PHE A 20 -15.223 10.330 -19.234 1.00 0.00 C ATOM 0 H PHE A 20 -12.299 8.637 -21.670 1.00 0.00 H new ATOM 0 HA PHE A 20 -9.649 8.217 -20.640 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -10.533 9.707 -18.801 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.619 10.393 -20.411 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -12.818 10.547 -21.582 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -12.523 9.246 -17.535 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -15.221 10.953 -21.277 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -14.927 9.654 -17.229 1.00 0.00 H new ATOM 0 HZ PHE A 20 -16.279 10.510 -19.099 1.00 0.00 H new ATOM 333 N GLU A 21 -10.675 5.901 -19.723 1.00 0.00 N ATOM 334 CA GLU A 21 -10.864 4.759 -18.835 1.00 0.00 C ATOM 335 C GLU A 21 -9.754 3.732 -19.032 1.00 0.00 C ATOM 336 O GLU A 21 -9.055 3.747 -20.045 1.00 0.00 O ATOM 337 CB GLU A 21 -12.223 4.100 -19.089 1.00 0.00 C ATOM 338 CG GLU A 21 -13.408 5.018 -18.836 1.00 0.00 C ATOM 339 CD GLU A 21 -14.136 4.688 -17.547 1.00 0.00 C ATOM 340 OE1 GLU A 21 -14.706 3.581 -17.454 1.00 0.00 O ATOM 341 OE2 GLU A 21 -14.136 5.537 -16.631 1.00 0.00 O ATOM 0 H GLU A 21 -10.315 5.660 -20.646 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.830 5.124 -17.808 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -12.260 3.751 -20.121 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -12.314 3.220 -18.452 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -13.062 6.051 -18.799 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -14.104 4.945 -19.671 1.00 0.00 H new ATOM 348 N THR A 22 -9.603 2.836 -18.064 1.00 0.00 N ATOM 349 CA THR A 22 -8.582 1.797 -18.141 1.00 0.00 C ATOM 350 C THR A 22 -9.150 0.540 -18.788 1.00 0.00 C ATOM 351 O THR A 22 -10.248 0.559 -19.345 1.00 0.00 O ATOM 352 CB THR A 22 -8.040 1.473 -16.747 1.00 0.00 C ATOM 353 OG1 THR A 22 -6.970 0.547 -16.828 1.00 0.00 O ATOM 354 CG2 THR A 22 -9.082 0.888 -15.817 1.00 0.00 C ATOM 0 H THR A 22 -10.173 2.807 -17.218 1.00 0.00 H new ATOM 0 HA THR A 22 -7.762 2.167 -18.756 1.00 0.00 H new ATOM 0 HB THR A 22 -7.709 2.428 -16.339 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.636 0.354 -15.927 1.00 0.00 H new ATOM 0 HG21 THR A 22 -8.629 0.682 -14.847 1.00 0.00 H new ATOM 0 HG22 THR A 22 -9.899 1.599 -15.693 1.00 0.00 H new ATOM 0 HG23 THR A 22 -9.469 -0.039 -16.241 1.00 0.00 H new ATOM 362 N LYS A 23 -8.402 -0.553 -18.712 1.00 0.00 N ATOM 363 CA LYS A 23 -8.840 -1.816 -19.291 1.00 0.00 C ATOM 364 C LYS A 23 -9.863 -2.494 -18.388 1.00 0.00 C ATOM 365 O LYS A 23 -10.354 -1.895 -17.430 1.00 0.00 O ATOM 366 CB LYS A 23 -7.642 -2.741 -19.514 1.00 0.00 C ATOM 367 CG LYS A 23 -6.525 -2.099 -20.321 1.00 0.00 C ATOM 368 CD LYS A 23 -5.222 -2.054 -19.538 1.00 0.00 C ATOM 369 CE LYS A 23 -4.473 -0.753 -19.780 1.00 0.00 C ATOM 370 NZ LYS A 23 -3.018 -0.888 -19.495 1.00 0.00 N ATOM 0 H LYS A 23 -7.490 -0.590 -18.256 1.00 0.00 H new ATOM 0 HA LYS A 23 -9.310 -1.608 -20.252 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -7.248 -3.053 -18.547 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.979 -3.642 -20.027 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -6.376 -2.658 -21.245 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -6.815 -1.087 -20.604 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -5.432 -2.162 -18.474 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -4.593 -2.896 -19.826 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -4.613 -0.441 -20.815 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -4.895 0.031 -19.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -2.606 0.054 -19.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -2.884 -1.470 -18.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -2.547 -1.343 -20.303 1.00 0.00 H new ATOM 384 N ARG A 24 -10.178 -3.749 -18.691 1.00 0.00 N ATOM 385 CA ARG A 24 -11.139 -4.507 -17.896 1.00 0.00 C ATOM 386 C ARG A 24 -10.529 -4.943 -16.560 1.00 0.00 C ATOM 387 O ARG A 24 -11.168 -5.652 -15.782 1.00 0.00 O ATOM 388 CB ARG A 24 -11.627 -5.730 -18.679 1.00 0.00 C ATOM 389 CG ARG A 24 -13.140 -5.888 -18.688 1.00 0.00 C ATOM 390 CD ARG A 24 -13.832 -4.679 -19.301 1.00 0.00 C ATOM 391 NE ARG A 24 -13.485 -4.501 -20.711 1.00 0.00 N ATOM 392 CZ ARG A 24 -14.087 -3.628 -21.516 1.00 0.00 C ATOM 393 NH1 ARG A 24 -15.066 -2.858 -21.057 1.00 0.00 N ATOM 394 NH2 ARG A 24 -13.710 -3.524 -22.782 1.00 0.00 N ATOM 0 H ARG A 24 -9.783 -4.262 -19.479 1.00 0.00 H new ATOM 0 HA ARG A 24 -11.989 -3.858 -17.684 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -11.272 -5.657 -19.707 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -11.180 -6.627 -18.250 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -13.408 -6.783 -19.249 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -13.496 -6.032 -17.668 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -14.912 -4.793 -19.206 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -13.556 -3.783 -18.745 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.739 -5.079 -21.099 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -15.360 -2.934 -20.083 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -15.524 -2.191 -21.678 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -12.958 -4.113 -23.140 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -14.172 -2.855 -23.398 1.00 0.00 H new ATOM 408 N PHE A 25 -9.294 -4.516 -16.297 1.00 0.00 N ATOM 409 CA PHE A 25 -8.611 -4.863 -15.056 1.00 0.00 C ATOM 410 C PHE A 25 -9.072 -3.968 -13.911 1.00 0.00 C ATOM 411 O PHE A 25 -8.695 -2.800 -13.834 1.00 0.00 O ATOM 412 CB PHE A 25 -7.099 -4.732 -15.236 1.00 0.00 C ATOM 413 CG PHE A 25 -6.448 -5.980 -15.754 1.00 0.00 C ATOM 414 CD1 PHE A 25 -6.485 -7.150 -15.017 1.00 0.00 C ATOM 415 CD2 PHE A 25 -5.797 -5.982 -16.977 1.00 0.00 C ATOM 416 CE1 PHE A 25 -5.886 -8.301 -15.487 1.00 0.00 C ATOM 417 CE2 PHE A 25 -5.195 -7.131 -17.455 1.00 0.00 C ATOM 418 CZ PHE A 25 -5.240 -8.293 -16.708 1.00 0.00 C ATOM 0 H PHE A 25 -8.748 -3.929 -16.928 1.00 0.00 H new ATOM 0 HA PHE A 25 -8.859 -5.895 -14.809 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.893 -3.912 -15.924 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.649 -4.467 -14.279 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -6.989 -7.163 -14.062 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -5.759 -5.076 -17.563 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -5.922 -9.207 -14.901 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -4.691 -7.121 -18.410 1.00 0.00 H new ATOM 0 HZ PHE A 25 -4.771 -9.193 -17.078 1.00 0.00 H new ATOM 428 N GLU A 26 -9.888 -4.524 -13.023 1.00 0.00 N ATOM 429 CA GLU A 26 -10.397 -3.772 -11.881 1.00 0.00 C ATOM 430 C GLU A 26 -10.870 -4.711 -10.779 1.00 0.00 C ATOM 431 O GLU A 26 -11.857 -5.428 -10.939 1.00 0.00 O ATOM 432 CB GLU A 26 -11.547 -2.846 -12.297 1.00 0.00 C ATOM 433 CG GLU A 26 -12.308 -3.304 -13.535 1.00 0.00 C ATOM 434 CD GLU A 26 -13.728 -3.732 -13.220 1.00 0.00 C ATOM 435 OE1 GLU A 26 -13.899 -4.778 -12.557 1.00 0.00 O ATOM 436 OE2 GLU A 26 -14.669 -3.024 -13.635 1.00 0.00 O ATOM 0 H GLU A 26 -10.211 -5.490 -13.071 1.00 0.00 H new ATOM 0 HA GLU A 26 -9.577 -3.163 -11.500 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -12.247 -2.761 -11.466 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.146 -1.849 -12.480 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -12.330 -2.494 -14.264 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.776 -4.135 -13.998 1.00 0.00 H new ATOM 443 N VAL A 27 -10.157 -4.700 -9.659 1.00 0.00 N ATOM 444 CA VAL A 27 -10.499 -5.552 -8.534 1.00 0.00 C ATOM 445 C VAL A 27 -10.080 -4.916 -7.201 1.00 0.00 C ATOM 446 O VAL A 27 -9.443 -5.562 -6.368 1.00 0.00 O ATOM 447 CB VAL A 27 -9.834 -6.933 -8.701 1.00 0.00 C ATOM 448 CG1 VAL A 27 -8.358 -6.889 -8.325 1.00 0.00 C ATOM 449 CG2 VAL A 27 -10.576 -7.989 -7.900 1.00 0.00 C ATOM 0 H VAL A 27 -9.339 -4.109 -9.509 1.00 0.00 H new ATOM 0 HA VAL A 27 -11.582 -5.673 -8.517 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.892 -7.207 -9.754 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -7.920 -7.879 -8.454 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.840 -6.176 -8.967 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.257 -6.580 -7.285 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.089 -8.955 -8.033 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -10.565 -7.719 -6.844 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -11.607 -8.051 -8.248 1.00 0.00 H new ATOM 459 N PRO A 28 -10.440 -3.637 -6.977 1.00 0.00 N ATOM 460 CA PRO A 28 -10.098 -2.926 -5.739 1.00 0.00 C ATOM 461 C PRO A 28 -10.500 -3.699 -4.488 1.00 0.00 C ATOM 462 O PRO A 28 -11.681 -3.795 -4.160 1.00 0.00 O ATOM 463 CB PRO A 28 -10.902 -1.630 -5.833 1.00 0.00 C ATOM 464 CG PRO A 28 -11.112 -1.414 -7.290 1.00 0.00 C ATOM 465 CD PRO A 28 -11.211 -2.783 -7.905 1.00 0.00 C ATOM 0 HA PRO A 28 -9.022 -2.775 -5.650 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -11.852 -1.715 -5.305 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -10.362 -0.797 -5.384 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.020 -0.839 -7.472 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.286 -0.851 -7.724 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -12.247 -3.112 -7.986 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -10.791 -2.802 -8.911 1.00 0.00 H new ATOM 473 N LYS A 29 -9.509 -4.240 -3.789 1.00 0.00 N ATOM 474 CA LYS A 29 -9.763 -4.996 -2.570 1.00 0.00 C ATOM 475 C LYS A 29 -8.642 -4.781 -1.556 1.00 0.00 C ATOM 476 O LYS A 29 -8.266 -5.698 -0.825 1.00 0.00 O ATOM 477 CB LYS A 29 -9.912 -6.483 -2.889 1.00 0.00 C ATOM 478 CG LYS A 29 -11.228 -7.076 -2.408 1.00 0.00 C ATOM 479 CD LYS A 29 -12.336 -6.896 -3.435 1.00 0.00 C ATOM 480 CE LYS A 29 -13.036 -8.213 -3.731 1.00 0.00 C ATOM 481 NZ LYS A 29 -12.076 -9.264 -4.172 1.00 0.00 N ATOM 0 H LYS A 29 -8.524 -4.169 -4.045 1.00 0.00 H new ATOM 0 HA LYS A 29 -10.694 -4.636 -2.132 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -9.830 -6.626 -3.967 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -9.087 -7.029 -2.432 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.094 -8.137 -2.200 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -11.520 -6.602 -1.471 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -13.062 -6.171 -3.066 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -11.918 -6.489 -4.356 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -13.563 -8.553 -2.839 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -13.787 -8.059 -4.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -12.551 -9.913 -4.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -11.267 -8.817 -4.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -11.740 -9.796 -3.344 1.00 0.00 H new ATOM 495 N ALA A 30 -8.118 -3.561 -1.516 1.00 0.00 N ATOM 496 CA ALA A 30 -7.044 -3.217 -0.591 1.00 0.00 C ATOM 497 C ALA A 30 -7.454 -2.058 0.309 1.00 0.00 C ATOM 498 O ALA A 30 -7.219 -0.893 -0.013 1.00 0.00 O ATOM 499 CB ALA A 30 -5.775 -2.873 -1.353 1.00 0.00 C ATOM 0 H ALA A 30 -8.420 -2.792 -2.115 1.00 0.00 H new ATOM 0 HA ALA A 30 -6.847 -4.085 0.038 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -4.984 -2.619 -0.647 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -5.466 -3.730 -1.951 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -5.963 -2.023 -2.008 1.00 0.00 H new ATOM 505 N TYR A 31 -8.073 -2.388 1.436 1.00 0.00 N ATOM 506 CA TYR A 31 -8.520 -1.377 2.383 1.00 0.00 C ATOM 507 C TYR A 31 -8.950 -2.018 3.696 1.00 0.00 C ATOM 508 O TYR A 31 -9.606 -3.058 3.712 1.00 0.00 O ATOM 509 CB TYR A 31 -9.675 -0.569 1.791 1.00 0.00 C ATOM 510 CG TYR A 31 -10.877 -1.406 1.414 1.00 0.00 C ATOM 511 CD1 TYR A 31 -11.843 -1.732 2.357 1.00 0.00 C ATOM 512 CD2 TYR A 31 -11.045 -1.869 0.116 1.00 0.00 C ATOM 513 CE1 TYR A 31 -12.943 -2.495 2.017 1.00 0.00 C ATOM 514 CE2 TYR A 31 -12.142 -2.633 -0.232 1.00 0.00 C ATOM 515 CZ TYR A 31 -13.089 -2.943 0.722 1.00 0.00 C ATOM 516 OH TYR A 31 -14.182 -3.703 0.379 1.00 0.00 O ATOM 0 H TYR A 31 -8.276 -3.348 1.715 1.00 0.00 H new ATOM 0 HA TYR A 31 -7.685 -0.706 2.584 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.983 0.188 2.512 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -9.320 -0.041 0.906 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -11.732 -1.383 3.373 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -10.306 -1.628 -0.634 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -13.685 -2.739 2.763 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -12.258 -2.986 -1.246 1.00 0.00 H new ATOM 0 HH TYR A 31 -14.133 -3.936 -0.572 1.00 0.00 H new ATOM 526 N SER A 32 -8.572 -1.382 4.795 1.00 0.00 N ATOM 527 CA SER A 32 -8.909 -1.874 6.122 1.00 0.00 C ATOM 528 C SER A 32 -10.418 -1.838 6.341 1.00 0.00 C ATOM 529 O SER A 32 -11.182 -1.598 5.409 1.00 0.00 O ATOM 530 CB SER A 32 -8.204 -1.037 7.190 1.00 0.00 C ATOM 531 OG SER A 32 -7.452 0.011 6.606 1.00 0.00 O ATOM 0 H SER A 32 -8.028 -0.519 4.793 1.00 0.00 H new ATOM 0 HA SER A 32 -8.572 -2.907 6.202 1.00 0.00 H new ATOM 0 HB2 SER A 32 -8.942 -0.620 7.875 1.00 0.00 H new ATOM 0 HB3 SER A 32 -7.546 -1.675 7.780 1.00 0.00 H new ATOM 0 HG SER A 32 -8.050 0.752 6.373 1.00 0.00 H new ATOM 537 N VAL A 33 -10.843 -2.072 7.576 1.00 0.00 N ATOM 538 CA VAL A 33 -12.262 -2.058 7.904 1.00 0.00 C ATOM 539 C VAL A 33 -12.496 -1.425 9.273 1.00 0.00 C ATOM 540 O VAL A 33 -11.744 -1.665 10.217 1.00 0.00 O ATOM 541 CB VAL A 33 -12.889 -3.472 7.876 1.00 0.00 C ATOM 542 CG1 VAL A 33 -13.702 -3.668 6.605 1.00 0.00 C ATOM 543 CG2 VAL A 33 -11.838 -4.568 8.006 1.00 0.00 C ATOM 0 H VAL A 33 -10.228 -2.273 8.364 1.00 0.00 H new ATOM 0 HA VAL A 33 -12.751 -1.460 7.135 1.00 0.00 H new ATOM 0 HB VAL A 33 -13.550 -3.550 8.739 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -14.136 -4.668 6.601 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -14.499 -2.926 6.565 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -13.054 -3.551 5.737 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -12.324 -5.543 7.981 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -11.131 -4.494 7.180 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -11.306 -4.452 8.950 1.00 0.00 H new ATOM 553 N ILE A 34 -13.533 -0.601 9.363 1.00 0.00 N ATOM 554 CA ILE A 34 -13.864 0.088 10.598 1.00 0.00 C ATOM 555 C ILE A 34 -14.762 -0.759 11.496 1.00 0.00 C ATOM 556 O ILE A 34 -15.844 -1.179 11.088 1.00 0.00 O ATOM 557 CB ILE A 34 -14.554 1.431 10.291 1.00 0.00 C ATOM 558 CG1 ILE A 34 -14.659 2.280 11.560 1.00 0.00 C ATOM 559 CG2 ILE A 34 -15.925 1.205 9.660 1.00 0.00 C ATOM 560 CD1 ILE A 34 -15.815 1.898 12.457 1.00 0.00 C ATOM 0 H ILE A 34 -14.162 -0.395 8.587 1.00 0.00 H new ATOM 0 HA ILE A 34 -12.931 0.270 11.131 1.00 0.00 H new ATOM 0 HB ILE A 34 -13.945 1.976 9.570 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -13.730 2.191 12.123 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -14.762 3.328 11.277 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -16.393 2.167 9.452 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -15.810 0.649 8.730 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -16.553 0.637 10.347 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -15.823 2.544 13.335 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -16.752 2.014 11.912 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -15.704 0.860 12.771 1.00 0.00 H new ATOM 572 N GLN A 35 -14.306 -1.003 12.722 1.00 0.00 N ATOM 573 CA GLN A 35 -15.069 -1.799 13.679 1.00 0.00 C ATOM 574 C GLN A 35 -15.070 -1.139 15.054 1.00 0.00 C ATOM 575 O GLN A 35 -14.095 -1.233 15.794 1.00 0.00 O ATOM 576 CB GLN A 35 -14.477 -3.208 13.777 1.00 0.00 C ATOM 577 CG GLN A 35 -15.324 -4.271 13.098 1.00 0.00 C ATOM 578 CD GLN A 35 -15.632 -3.933 11.654 1.00 0.00 C ATOM 579 OE1 GLN A 35 -16.773 -4.047 11.207 1.00 0.00 O ATOM 580 NE2 GLN A 35 -14.612 -3.517 10.913 1.00 0.00 N ATOM 0 H GLN A 35 -13.413 -0.661 13.076 1.00 0.00 H new ATOM 0 HA GLN A 35 -16.099 -1.865 13.328 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -13.483 -3.207 13.330 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -14.354 -3.469 14.828 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -14.803 -5.228 13.141 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -16.258 -4.392 13.647 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -13.682 -3.437 11.324 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -14.758 -3.277 9.932 1.00 0.00 H new ATOM 589 N GLY A 36 -16.167 -0.471 15.392 1.00 0.00 N ATOM 590 CA GLY A 36 -16.257 0.194 16.681 1.00 0.00 C ATOM 591 C GLY A 36 -15.216 1.286 16.828 1.00 0.00 C ATOM 592 O GLY A 36 -15.515 2.467 16.645 1.00 0.00 O ATOM 0 H GLY A 36 -16.993 -0.377 14.801 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -17.252 0.623 16.799 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -16.129 -0.539 17.477 1.00 0.00 H new ATOM 596 N ASN A 37 -13.991 0.890 17.152 1.00 0.00 N ATOM 597 CA ASN A 37 -12.898 1.841 17.315 1.00 0.00 C ATOM 598 C ASN A 37 -11.561 1.220 16.901 1.00 0.00 C ATOM 599 O ASN A 37 -10.499 1.669 17.334 1.00 0.00 O ATOM 600 CB ASN A 37 -12.830 2.327 18.767 1.00 0.00 C ATOM 601 CG ASN A 37 -12.577 3.820 18.868 1.00 0.00 C ATOM 602 OD1 ASN A 37 -11.762 4.269 19.675 1.00 0.00 O ATOM 603 ND2 ASN A 37 -13.277 4.599 18.051 1.00 0.00 N ATOM 0 H ASN A 37 -13.729 -0.084 17.307 1.00 0.00 H new ATOM 0 HA ASN A 37 -13.091 2.694 16.664 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -13.765 2.085 19.272 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -12.038 1.791 19.290 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -13.149 5.611 18.077 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -13.942 4.186 17.397 1.00 0.00 H new ATOM 610 N ARG A 38 -11.620 0.190 16.056 1.00 0.00 N ATOM 611 CA ARG A 38 -10.409 -0.483 15.582 1.00 0.00 C ATOM 612 C ARG A 38 -10.480 -0.779 14.090 1.00 0.00 C ATOM 613 O ARG A 38 -11.562 -0.925 13.522 1.00 0.00 O ATOM 614 CB ARG A 38 -10.178 -1.798 16.331 1.00 0.00 C ATOM 615 CG ARG A 38 -11.450 -2.556 16.663 1.00 0.00 C ATOM 616 CD ARG A 38 -11.633 -2.723 18.160 1.00 0.00 C ATOM 617 NE ARG A 38 -12.963 -3.232 18.489 1.00 0.00 N ATOM 618 CZ ARG A 38 -13.249 -3.896 19.605 1.00 0.00 C ATOM 619 NH1 ARG A 38 -12.305 -4.131 20.510 1.00 0.00 N ATOM 620 NH2 ARG A 38 -14.484 -4.326 19.818 1.00 0.00 N ATOM 0 H ARG A 38 -12.489 -0.196 15.687 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.580 0.198 15.773 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -9.534 -2.438 15.728 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -9.642 -1.587 17.256 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -12.308 -2.026 16.249 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -11.423 -3.537 16.189 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.876 -3.407 18.545 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.478 -1.764 18.655 1.00 0.00 H new ATOM 0 HE ARG A 38 -13.717 -3.068 17.822 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -11.353 -3.801 20.351 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -12.532 -4.641 21.364 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -15.213 -4.147 19.127 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -14.706 -4.836 20.673 1.00 0.00 H new ATOM 634 N THR A 39 -9.310 -0.879 13.467 1.00 0.00 N ATOM 635 CA THR A 39 -9.221 -1.175 12.041 1.00 0.00 C ATOM 636 C THR A 39 -8.716 -2.605 11.826 1.00 0.00 C ATOM 637 O THR A 39 -7.723 -3.015 12.427 1.00 0.00 O ATOM 638 CB THR A 39 -8.329 -0.124 11.341 1.00 0.00 C ATOM 639 OG1 THR A 39 -9.002 0.432 10.226 1.00 0.00 O ATOM 640 CG2 THR A 39 -6.989 -0.640 10.844 1.00 0.00 C ATOM 0 H THR A 39 -8.408 -0.759 13.928 1.00 0.00 H new ATOM 0 HA THR A 39 -10.212 -1.115 11.591 1.00 0.00 H new ATOM 0 HB THR A 39 -8.129 0.613 12.119 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.603 1.298 10.001 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.440 0.173 10.369 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.413 -1.025 11.685 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.152 -1.439 10.121 1.00 0.00 H new ATOM 648 N PHE A 40 -9.408 -3.366 10.981 1.00 0.00 N ATOM 649 CA PHE A 40 -9.023 -4.753 10.709 1.00 0.00 C ATOM 650 C PHE A 40 -8.321 -4.865 9.360 1.00 0.00 C ATOM 651 O PHE A 40 -8.919 -5.301 8.377 1.00 0.00 O ATOM 652 CB PHE A 40 -10.254 -5.662 10.713 1.00 0.00 C ATOM 653 CG PHE A 40 -10.898 -5.837 12.055 1.00 0.00 C ATOM 654 CD1 PHE A 40 -11.292 -4.737 12.796 1.00 0.00 C ATOM 655 CD2 PHE A 40 -11.121 -7.105 12.568 1.00 0.00 C ATOM 656 CE1 PHE A 40 -11.894 -4.897 14.027 1.00 0.00 C ATOM 657 CE2 PHE A 40 -11.725 -7.272 13.800 1.00 0.00 C ATOM 658 CZ PHE A 40 -12.111 -6.165 14.531 1.00 0.00 C ATOM 0 H PHE A 40 -10.235 -3.050 10.474 1.00 0.00 H new ATOM 0 HA PHE A 40 -8.338 -5.069 11.496 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -10.992 -5.255 10.021 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -9.967 -6.642 10.332 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -11.127 -3.743 12.407 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -10.820 -7.972 11.999 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -12.196 -4.031 14.597 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -11.895 -8.265 14.190 1.00 0.00 H new ATOM 0 HZ PHE A 40 -12.582 -6.291 15.495 1.00 0.00 H new ATOM 668 N ILE A 41 -7.055 -4.468 9.317 1.00 0.00 N ATOM 669 CA ILE A 41 -6.281 -4.522 8.080 1.00 0.00 C ATOM 670 C ILE A 41 -5.914 -5.960 7.708 1.00 0.00 C ATOM 671 O ILE A 41 -5.335 -6.697 8.508 1.00 0.00 O ATOM 672 CB ILE A 41 -5.003 -3.657 8.181 1.00 0.00 C ATOM 673 CG1 ILE A 41 -4.502 -3.298 6.782 1.00 0.00 C ATOM 674 CG2 ILE A 41 -3.913 -4.361 8.982 1.00 0.00 C ATOM 675 CD1 ILE A 41 -4.628 -1.826 6.451 1.00 0.00 C ATOM 0 H ILE A 41 -6.542 -4.106 10.121 1.00 0.00 H new ATOM 0 HA ILE A 41 -6.914 -4.117 7.290 1.00 0.00 H new ATOM 0 HB ILE A 41 -5.255 -2.739 8.712 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -3.457 -3.593 6.693 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -5.061 -3.876 6.046 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -3.030 -3.724 9.032 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -4.274 -4.561 9.991 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.655 -5.302 8.496 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -4.253 -1.646 5.443 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -5.675 -1.529 6.507 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.046 -1.242 7.164 1.00 0.00 H new ATOM 687 N GLN A 42 -6.258 -6.354 6.486 1.00 0.00 N ATOM 688 CA GLN A 42 -5.966 -7.701 6.008 1.00 0.00 C ATOM 689 C GLN A 42 -4.926 -7.668 4.896 1.00 0.00 C ATOM 690 O GLN A 42 -4.142 -8.603 4.739 1.00 0.00 O ATOM 691 CB GLN A 42 -7.238 -8.384 5.505 1.00 0.00 C ATOM 692 CG GLN A 42 -8.300 -7.412 5.016 1.00 0.00 C ATOM 693 CD GLN A 42 -9.564 -8.109 4.555 1.00 0.00 C ATOM 694 OE1 GLN A 42 -10.152 -7.741 3.539 1.00 0.00 O ATOM 695 NE2 GLN A 42 -9.989 -9.122 5.301 1.00 0.00 N ATOM 0 H GLN A 42 -6.739 -5.761 5.810 1.00 0.00 H new ATOM 0 HA GLN A 42 -5.566 -8.272 6.846 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.978 -9.064 4.693 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -7.656 -8.991 6.308 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -8.546 -6.716 5.818 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.895 -6.822 4.194 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -9.470 -9.393 6.136 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -10.835 -9.629 5.039 1.00 0.00 H new ATOM 704 N ASN A 43 -4.924 -6.586 4.129 1.00 0.00 N ATOM 705 CA ASN A 43 -3.977 -6.431 3.036 1.00 0.00 C ATOM 706 C ASN A 43 -2.828 -5.532 3.461 1.00 0.00 C ATOM 707 O ASN A 43 -2.342 -4.710 2.686 1.00 0.00 O ATOM 708 CB ASN A 43 -4.669 -5.851 1.803 1.00 0.00 C ATOM 709 CG ASN A 43 -5.210 -6.930 0.889 1.00 0.00 C ATOM 710 OD1 ASN A 43 -4.740 -7.101 -0.236 1.00 0.00 O ATOM 711 ND2 ASN A 43 -6.204 -7.667 1.370 1.00 0.00 N ATOM 0 H ASN A 43 -5.568 -5.803 4.244 1.00 0.00 H new ATOM 0 HA ASN A 43 -3.582 -7.414 2.781 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -5.486 -5.202 2.119 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -3.963 -5.230 1.251 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -6.609 -8.410 0.801 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -6.562 -7.490 2.308 1.00 0.00 H new ATOM 718 N PHE A 44 -2.395 -5.697 4.707 1.00 0.00 N ATOM 719 CA PHE A 44 -1.303 -4.898 5.254 1.00 0.00 C ATOM 720 C PHE A 44 -0.135 -4.806 4.278 1.00 0.00 C ATOM 721 O PHE A 44 0.631 -3.856 4.326 1.00 0.00 O ATOM 722 CB PHE A 44 -0.823 -5.497 6.577 1.00 0.00 C ATOM 723 CG PHE A 44 -0.458 -6.952 6.483 1.00 0.00 C ATOM 724 CD1 PHE A 44 -1.429 -7.932 6.617 1.00 0.00 C ATOM 725 CD2 PHE A 44 0.854 -7.341 6.262 1.00 0.00 C ATOM 726 CE1 PHE A 44 -1.098 -9.272 6.535 1.00 0.00 C ATOM 727 CE2 PHE A 44 1.191 -8.679 6.179 1.00 0.00 C ATOM 728 CZ PHE A 44 0.214 -9.645 6.316 1.00 0.00 C ATOM 0 H PHE A 44 -2.784 -6.378 5.359 1.00 0.00 H new ATOM 0 HA PHE A 44 -1.683 -3.891 5.426 1.00 0.00 H new ATOM 0 HB2 PHE A 44 0.043 -4.936 6.927 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -1.605 -5.375 7.326 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -2.456 -7.646 6.787 1.00 0.00 H new ATOM 0 HD2 PHE A 44 1.622 -6.590 6.153 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -1.864 -10.026 6.642 1.00 0.00 H new ATOM 0 HE2 PHE A 44 2.217 -8.968 6.007 1.00 0.00 H new ATOM 0 HZ PHE A 44 0.475 -10.691 6.252 1.00 0.00 H new ATOM 738 N ARG A 45 -0.007 -5.789 3.392 1.00 0.00 N ATOM 739 CA ARG A 45 1.073 -5.789 2.409 1.00 0.00 C ATOM 740 C ARG A 45 0.706 -4.924 1.207 1.00 0.00 C ATOM 741 O ARG A 45 1.414 -3.972 0.876 1.00 0.00 O ATOM 742 CB ARG A 45 1.374 -7.213 1.948 1.00 0.00 C ATOM 743 CG ARG A 45 2.804 -7.412 1.472 1.00 0.00 C ATOM 744 CD ARG A 45 3.113 -6.578 0.237 1.00 0.00 C ATOM 745 NE ARG A 45 4.509 -6.704 -0.171 1.00 0.00 N ATOM 746 CZ ARG A 45 5.528 -6.192 0.515 1.00 0.00 C ATOM 747 NH1 ARG A 45 5.310 -5.523 1.640 1.00 0.00 N ATOM 748 NH2 ARG A 45 6.770 -6.349 0.076 1.00 0.00 N ATOM 0 H ARG A 45 -0.633 -6.592 3.334 1.00 0.00 H new ATOM 0 HA ARG A 45 1.963 -5.373 2.882 1.00 0.00 H new ATOM 0 HB2 ARG A 45 1.175 -7.901 2.770 1.00 0.00 H new ATOM 0 HB3 ARG A 45 0.692 -7.476 1.140 1.00 0.00 H new ATOM 0 HG2 ARG A 45 3.494 -7.144 2.273 1.00 0.00 H new ATOM 0 HG3 ARG A 45 2.969 -8.466 1.249 1.00 0.00 H new ATOM 0 HD2 ARG A 45 2.466 -6.890 -0.583 1.00 0.00 H new ATOM 0 HD3 ARG A 45 2.888 -5.531 0.440 1.00 0.00 H new ATOM 0 HE ARG A 45 4.715 -7.213 -1.030 1.00 0.00 H new ATOM 0 HH11 ARG A 45 4.358 -5.399 1.983 1.00 0.00 H new ATOM 0 HH12 ARG A 45 6.095 -5.133 2.162 1.00 0.00 H new ATOM 0 HH21 ARG A 45 6.944 -6.862 -0.788 1.00 0.00 H new ATOM 0 HH22 ARG A 45 7.550 -5.956 0.602 1.00 0.00 H new ATOM 762 N GLU A 46 -0.414 -5.249 0.568 1.00 0.00 N ATOM 763 CA GLU A 46 -0.879 -4.486 -0.585 1.00 0.00 C ATOM 764 C GLU A 46 -1.143 -3.046 -0.176 1.00 0.00 C ATOM 765 O GLU A 46 -0.766 -2.105 -0.874 1.00 0.00 O ATOM 766 CB GLU A 46 -2.147 -5.108 -1.169 1.00 0.00 C ATOM 767 CG GLU A 46 -2.197 -5.081 -2.689 1.00 0.00 C ATOM 768 CD GLU A 46 -2.593 -6.418 -3.285 1.00 0.00 C ATOM 769 OE1 GLU A 46 -2.008 -7.445 -2.880 1.00 0.00 O ATOM 770 OE2 GLU A 46 -3.490 -6.440 -4.155 1.00 0.00 O ATOM 0 H GLU A 46 -1.014 -6.032 0.828 1.00 0.00 H new ATOM 0 HA GLU A 46 -0.104 -4.506 -1.352 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -2.224 -6.141 -0.830 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.015 -4.578 -0.776 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -2.907 -4.319 -3.012 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.220 -4.790 -3.076 1.00 0.00 H new ATOM 777 N VAL A 47 -1.779 -2.891 0.976 1.00 0.00 N ATOM 778 CA VAL A 47 -2.087 -1.578 1.511 1.00 0.00 C ATOM 779 C VAL A 47 -0.805 -0.861 1.932 1.00 0.00 C ATOM 780 O VAL A 47 -0.667 0.345 1.740 1.00 0.00 O ATOM 781 CB VAL A 47 -3.061 -1.685 2.713 1.00 0.00 C ATOM 782 CG1 VAL A 47 -2.768 -0.629 3.776 1.00 0.00 C ATOM 783 CG2 VAL A 47 -4.502 -1.582 2.232 1.00 0.00 C ATOM 0 H VAL A 47 -2.093 -3.666 1.560 1.00 0.00 H new ATOM 0 HA VAL A 47 -2.574 -0.998 0.727 1.00 0.00 H new ATOM 0 HB VAL A 47 -2.912 -2.660 3.178 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.472 -0.738 4.601 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.751 -0.759 4.147 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -2.871 0.365 3.340 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -5.177 -1.658 3.085 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.652 -0.623 1.735 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -4.710 -2.390 1.531 1.00 0.00 H new ATOM 793 N ALA A 48 0.128 -1.613 2.513 1.00 0.00 N ATOM 794 CA ALA A 48 1.392 -1.042 2.966 1.00 0.00 C ATOM 795 C ALA A 48 2.143 -0.346 1.833 1.00 0.00 C ATOM 796 O ALA A 48 2.805 0.672 2.045 1.00 0.00 O ATOM 797 CB ALA A 48 2.275 -2.114 3.582 1.00 0.00 C ATOM 0 H ALA A 48 0.032 -2.615 2.680 1.00 0.00 H new ATOM 0 HA ALA A 48 1.151 -0.294 3.721 1.00 0.00 H new ATOM 0 HB1 ALA A 48 3.212 -1.667 3.913 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.764 -2.560 4.435 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.483 -2.885 2.840 1.00 0.00 H new ATOM 803 N ASP A 49 2.039 -0.895 0.630 1.00 0.00 N ATOM 804 CA ASP A 49 2.723 -0.312 -0.517 1.00 0.00 C ATOM 805 C ASP A 49 1.968 0.890 -1.065 1.00 0.00 C ATOM 806 O ASP A 49 2.464 2.014 -1.022 1.00 0.00 O ATOM 807 CB ASP A 49 2.907 -1.357 -1.619 1.00 0.00 C ATOM 808 CG ASP A 49 4.209 -1.175 -2.375 1.00 0.00 C ATOM 809 OD1 ASP A 49 4.722 -0.037 -2.410 1.00 0.00 O ATOM 810 OD2 ASP A 49 4.717 -2.170 -2.934 1.00 0.00 O ATOM 0 H ASP A 49 1.495 -1.733 0.424 1.00 0.00 H new ATOM 0 HA ASP A 49 3.702 0.027 -0.177 1.00 0.00 H new ATOM 0 HB2 ASP A 49 2.882 -2.354 -1.179 1.00 0.00 H new ATOM 0 HB3 ASP A 49 2.072 -1.296 -2.318 1.00 0.00 H new ATOM 815 N ALA A 50 0.779 0.649 -1.605 1.00 0.00 N ATOM 816 CA ALA A 50 -0.024 1.717 -2.185 1.00 0.00 C ATOM 817 C ALA A 50 -0.134 2.928 -1.256 1.00 0.00 C ATOM 818 O ALA A 50 0.150 4.054 -1.670 1.00 0.00 O ATOM 819 CB ALA A 50 -1.403 1.202 -2.561 1.00 0.00 C ATOM 0 H ALA A 50 0.351 -0.276 -1.653 1.00 0.00 H new ATOM 0 HA ALA A 50 0.486 2.052 -3.088 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -1.989 2.013 -2.993 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.305 0.398 -3.290 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -1.906 0.825 -1.670 1.00 0.00 H new ATOM 825 N LEU A 51 -0.552 2.713 -0.006 1.00 0.00 N ATOM 826 CA LEU A 51 -0.693 3.813 0.932 1.00 0.00 C ATOM 827 C LEU A 51 0.671 4.423 1.248 1.00 0.00 C ATOM 828 O LEU A 51 0.790 5.641 1.378 1.00 0.00 O ATOM 829 CB LEU A 51 -1.400 3.356 2.222 1.00 0.00 C ATOM 830 CG LEU A 51 -1.021 4.148 3.475 1.00 0.00 C ATOM 831 CD1 LEU A 51 -1.344 5.611 3.282 1.00 0.00 C ATOM 832 CD2 LEU A 51 -1.705 3.595 4.721 1.00 0.00 C ATOM 0 H LEU A 51 -0.794 1.796 0.370 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.314 4.578 0.466 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.478 3.429 2.075 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.172 2.304 2.391 1.00 0.00 H new ATOM 0 HG LEU A 51 0.053 4.044 3.628 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.070 6.166 4.180 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.783 5.998 2.431 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.412 5.726 3.096 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.410 4.184 5.590 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.787 3.648 4.596 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.407 2.557 4.869 1.00 0.00 H new ATOM 844 N ASN A 52 1.706 3.589 1.360 1.00 0.00 N ATOM 845 CA ASN A 52 3.040 4.102 1.644 1.00 0.00 C ATOM 846 C ASN A 52 4.126 3.193 1.080 1.00 0.00 C ATOM 847 O ASN A 52 4.595 2.278 1.756 1.00 0.00 O ATOM 848 CB ASN A 52 3.236 4.291 3.146 1.00 0.00 C ATOM 849 CG ASN A 52 3.691 5.695 3.482 1.00 0.00 C ATOM 850 OD1 ASN A 52 4.424 6.321 2.718 1.00 0.00 O ATOM 851 ND2 ASN A 52 3.263 6.197 4.632 1.00 0.00 N ATOM 0 H ASN A 52 1.646 2.576 1.260 1.00 0.00 H new ATOM 0 HA ASN A 52 3.128 5.071 1.152 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.301 4.078 3.664 1.00 0.00 H new ATOM 0 HB3 ASN A 52 3.972 3.574 3.509 1.00 0.00 H new ATOM 0 HD21 ASN A 52 3.541 7.137 4.913 1.00 0.00 H new ATOM 0 HD22 ASN A 52 2.656 5.643 5.236 1.00 0.00 H new ATOM 858 N ARG A 53 4.519 3.470 -0.165 1.00 0.00 N ATOM 859 CA ARG A 53 5.554 2.709 -0.869 1.00 0.00 C ATOM 860 C ARG A 53 6.522 2.029 0.095 1.00 0.00 C ATOM 861 O ARG A 53 6.781 0.831 -0.016 1.00 0.00 O ATOM 862 CB ARG A 53 6.314 3.635 -1.823 1.00 0.00 C ATOM 863 CG ARG A 53 5.414 4.293 -2.858 1.00 0.00 C ATOM 864 CD ARG A 53 5.631 5.796 -2.928 1.00 0.00 C ATOM 865 NE ARG A 53 4.466 6.491 -3.463 1.00 0.00 N ATOM 866 CZ ARG A 53 3.328 6.629 -2.791 1.00 0.00 C ATOM 867 NH1 ARG A 53 3.195 6.075 -1.598 1.00 0.00 N ATOM 868 NH2 ARG A 53 2.322 7.314 -3.313 1.00 0.00 N ATOM 0 H ARG A 53 4.126 4.233 -0.716 1.00 0.00 H new ATOM 0 HA ARG A 53 5.061 1.920 -1.438 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.818 4.409 -1.244 1.00 0.00 H new ATOM 0 HB3 ARG A 53 7.089 3.064 -2.334 1.00 0.00 H new ATOM 0 HG2 ARG A 53 5.605 3.853 -3.837 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.371 4.088 -2.615 1.00 0.00 H new ATOM 0 HD2 ARG A 53 5.855 6.177 -1.932 1.00 0.00 H new ATOM 0 HD3 ARG A 53 6.499 6.009 -3.553 1.00 0.00 H new ATOM 0 HE ARG A 53 4.528 6.891 -4.399 1.00 0.00 H new ATOM 0 HH11 ARG A 53 3.966 5.542 -1.194 1.00 0.00 H new ATOM 0 HH12 ARG A 53 2.322 6.180 -1.081 1.00 0.00 H new ATOM 0 HH21 ARG A 53 2.418 7.739 -4.235 1.00 0.00 H new ATOM 0 HH22 ARG A 53 1.451 7.417 -2.793 1.00 0.00 H new ATOM 882 N ASP A 54 7.045 2.795 1.046 1.00 0.00 N ATOM 883 CA ASP A 54 7.972 2.254 2.032 1.00 0.00 C ATOM 884 C ASP A 54 7.208 1.728 3.247 1.00 0.00 C ATOM 885 O ASP A 54 6.244 2.348 3.695 1.00 0.00 O ATOM 886 CB ASP A 54 8.980 3.325 2.456 1.00 0.00 C ATOM 887 CG ASP A 54 10.412 2.895 2.207 1.00 0.00 C ATOM 888 OD1 ASP A 54 10.719 2.480 1.068 1.00 0.00 O ATOM 889 OD2 ASP A 54 11.227 2.972 3.150 1.00 0.00 O ATOM 0 H ASP A 54 6.844 3.789 1.155 1.00 0.00 H new ATOM 0 HA ASP A 54 8.517 1.425 1.581 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.779 4.247 1.910 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.848 3.547 3.515 1.00 0.00 H new ATOM 894 N PRO A 55 7.621 0.571 3.799 1.00 0.00 N ATOM 895 CA PRO A 55 6.950 -0.020 4.957 1.00 0.00 C ATOM 896 C PRO A 55 7.206 0.763 6.243 1.00 0.00 C ATOM 897 O PRO A 55 6.345 0.829 7.119 1.00 0.00 O ATOM 898 CB PRO A 55 7.541 -1.430 5.038 1.00 0.00 C ATOM 899 CG PRO A 55 8.867 -1.343 4.361 1.00 0.00 C ATOM 900 CD PRO A 55 8.758 -0.247 3.333 1.00 0.00 C ATOM 0 HA PRO A 55 5.866 -0.015 4.846 1.00 0.00 H new ATOM 0 HB2 PRO A 55 7.649 -1.752 6.074 1.00 0.00 H new ATOM 0 HB3 PRO A 55 6.895 -2.156 4.544 1.00 0.00 H new ATOM 0 HG2 PRO A 55 9.655 -1.121 5.081 1.00 0.00 H new ATOM 0 HG3 PRO A 55 9.124 -2.292 3.889 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.675 0.340 3.277 1.00 0.00 H new ATOM 0 HD3 PRO A 55 8.577 -0.651 2.337 1.00 0.00 H new ATOM 908 N GLN A 56 8.386 1.367 6.349 1.00 0.00 N ATOM 909 CA GLN A 56 8.736 2.153 7.524 1.00 0.00 C ATOM 910 C GLN A 56 7.797 3.346 7.679 1.00 0.00 C ATOM 911 O GLN A 56 7.444 3.734 8.793 1.00 0.00 O ATOM 912 CB GLN A 56 10.174 2.652 7.411 1.00 0.00 C ATOM 913 CG GLN A 56 11.179 1.772 8.125 1.00 0.00 C ATOM 914 CD GLN A 56 11.847 0.787 7.191 1.00 0.00 C ATOM 915 OE1 GLN A 56 13.045 0.886 6.918 1.00 0.00 O ATOM 916 NE2 GLN A 56 11.071 -0.170 6.691 1.00 0.00 N ATOM 0 H GLN A 56 9.114 1.326 5.636 1.00 0.00 H new ATOM 0 HA GLN A 56 8.639 1.513 8.401 1.00 0.00 H new ATOM 0 HB2 GLN A 56 10.445 2.718 6.357 1.00 0.00 H new ATOM 0 HB3 GLN A 56 10.233 3.661 7.819 1.00 0.00 H new ATOM 0 HG2 GLN A 56 11.939 2.398 8.593 1.00 0.00 H new ATOM 0 HG3 GLN A 56 10.678 1.228 8.925 1.00 0.00 H new ATOM 0 HE21 GLN A 56 10.084 -0.212 6.946 1.00 0.00 H new ATOM 0 HE22 GLN A 56 11.462 -0.862 6.052 1.00 0.00 H new ATOM 925 N HIS A 57 7.399 3.920 6.551 1.00 0.00 N ATOM 926 CA HIS A 57 6.504 5.073 6.560 1.00 0.00 C ATOM 927 C HIS A 57 5.107 4.670 7.028 1.00 0.00 C ATOM 928 O HIS A 57 4.626 5.147 8.053 1.00 0.00 O ATOM 929 CB HIS A 57 6.435 5.686 5.163 1.00 0.00 C ATOM 930 CG HIS A 57 6.526 7.183 5.143 1.00 0.00 C ATOM 931 ND1 HIS A 57 6.424 7.967 6.272 1.00 0.00 N ATOM 932 CD2 HIS A 57 6.711 8.040 4.110 1.00 0.00 C ATOM 933 CE1 HIS A 57 6.542 9.241 5.937 1.00 0.00 C ATOM 934 NE2 HIS A 57 6.718 9.310 4.630 1.00 0.00 N ATOM 0 H HIS A 57 7.680 3.609 5.621 1.00 0.00 H new ATOM 0 HA HIS A 57 6.897 5.813 7.257 1.00 0.00 H new ATOM 0 HB2 HIS A 57 7.244 5.276 4.558 1.00 0.00 H new ATOM 0 HB3 HIS A 57 5.500 5.384 4.692 1.00 0.00 H new ATOM 0 HD2 HIS A 57 6.831 7.773 3.070 1.00 0.00 H new ATOM 0 HE1 HIS A 57 6.501 10.080 6.615 1.00 0.00 H new ATOM 0 HE2 HIS A 57 6.840 10.169 4.093 1.00 0.00 H new ATOM 942 N LEU A 58 4.453 3.794 6.271 1.00 0.00 N ATOM 943 CA LEU A 58 3.109 3.344 6.624 1.00 0.00 C ATOM 944 C LEU A 58 3.033 2.957 8.099 1.00 0.00 C ATOM 945 O LEU A 58 2.029 3.204 8.766 1.00 0.00 O ATOM 946 CB LEU A 58 2.695 2.156 5.761 1.00 0.00 C ATOM 947 CG LEU A 58 1.192 2.047 5.507 1.00 0.00 C ATOM 948 CD1 LEU A 58 0.910 1.994 4.017 1.00 0.00 C ATOM 949 CD2 LEU A 58 0.620 0.823 6.201 1.00 0.00 C ATOM 0 H LEU A 58 4.828 3.384 5.416 1.00 0.00 H new ATOM 0 HA LEU A 58 2.424 4.172 6.442 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.208 2.224 4.802 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.037 1.239 6.241 1.00 0.00 H new ATOM 0 HG LEU A 58 0.708 2.932 5.920 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.165 1.916 3.853 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.285 2.901 3.543 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.407 1.126 3.583 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.451 0.763 6.008 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.108 -0.073 5.819 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.792 0.900 7.275 1.00 0.00 H new ATOM 961 N LEU A 59 4.105 2.351 8.601 1.00 0.00 N ATOM 962 CA LEU A 59 4.161 1.931 9.997 1.00 0.00 C ATOM 963 C LEU A 59 3.970 3.123 10.928 1.00 0.00 C ATOM 964 O LEU A 59 3.040 3.150 11.734 1.00 0.00 O ATOM 965 CB LEU A 59 5.497 1.248 10.294 1.00 0.00 C ATOM 966 CG LEU A 59 5.510 0.361 11.545 1.00 0.00 C ATOM 967 CD1 LEU A 59 5.825 -1.082 11.178 1.00 0.00 C ATOM 968 CD2 LEU A 59 6.516 0.880 12.563 1.00 0.00 C ATOM 0 H LEU A 59 4.945 2.140 8.063 1.00 0.00 H new ATOM 0 HA LEU A 59 3.352 1.221 10.170 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.776 0.640 9.433 1.00 0.00 H new ATOM 0 HB3 LEU A 59 6.263 2.015 10.404 1.00 0.00 H new ATOM 0 HG LEU A 59 4.517 0.394 11.994 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.829 -1.694 12.080 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.067 -1.456 10.489 1.00 0.00 H new ATOM 0 HD13 LEU A 59 6.804 -1.131 10.702 1.00 0.00 H new ATOM 0 HD21 LEU A 59 6.509 0.236 13.442 1.00 0.00 H new ATOM 0 HD22 LEU A 59 7.513 0.881 12.122 1.00 0.00 H new ATOM 0 HD23 LEU A 59 6.248 1.895 12.855 1.00 0.00 H new ATOM 980 N LYS A 60 4.855 4.111 10.813 1.00 0.00 N ATOM 981 CA LYS A 60 4.770 5.301 11.651 1.00 0.00 C ATOM 982 C LYS A 60 3.422 5.993 11.475 1.00 0.00 C ATOM 983 O LYS A 60 2.930 6.641 12.395 1.00 0.00 O ATOM 984 CB LYS A 60 5.911 6.275 11.335 1.00 0.00 C ATOM 985 CG LYS A 60 6.144 6.487 9.850 1.00 0.00 C ATOM 986 CD LYS A 60 7.094 7.645 9.590 1.00 0.00 C ATOM 987 CE LYS A 60 6.344 8.892 9.157 1.00 0.00 C ATOM 988 NZ LYS A 60 5.780 9.634 10.318 1.00 0.00 N ATOM 0 H LYS A 60 5.633 4.110 10.153 1.00 0.00 H new ATOM 0 HA LYS A 60 4.864 4.985 12.690 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.694 7.237 11.800 1.00 0.00 H new ATOM 0 HB3 LYS A 60 6.830 5.902 11.788 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.552 5.576 9.412 1.00 0.00 H new ATOM 0 HG3 LYS A 60 5.192 6.680 9.356 1.00 0.00 H new ATOM 0 HD2 LYS A 60 7.666 7.858 10.493 1.00 0.00 H new ATOM 0 HD3 LYS A 60 7.810 7.363 8.818 1.00 0.00 H new ATOM 0 HE2 LYS A 60 7.017 9.545 8.601 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.538 8.613 8.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.350 10.521 9.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.056 9.051 10.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.540 9.849 10.995 1.00 0.00 H new ATOM 1002 N PHE A 61 2.829 5.846 10.292 1.00 0.00 N ATOM 1003 CA PHE A 61 1.535 6.457 9.998 1.00 0.00 C ATOM 1004 C PHE A 61 0.413 5.776 10.785 1.00 0.00 C ATOM 1005 O PHE A 61 -0.433 6.444 11.380 1.00 0.00 O ATOM 1006 CB PHE A 61 1.242 6.385 8.496 1.00 0.00 C ATOM 1007 CG PHE A 61 0.879 7.712 7.886 1.00 0.00 C ATOM 1008 CD1 PHE A 61 -0.073 8.527 8.478 1.00 0.00 C ATOM 1009 CD2 PHE A 61 1.489 8.141 6.718 1.00 0.00 C ATOM 1010 CE1 PHE A 61 -0.411 9.743 7.916 1.00 0.00 C ATOM 1011 CE2 PHE A 61 1.156 9.358 6.152 1.00 0.00 C ATOM 1012 CZ PHE A 61 0.205 10.160 6.751 1.00 0.00 C ATOM 0 H PHE A 61 3.225 5.308 9.521 1.00 0.00 H new ATOM 0 HA PHE A 61 1.579 7.503 10.302 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.117 5.987 7.983 1.00 0.00 H new ATOM 0 HB3 PHE A 61 0.426 5.682 8.327 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.556 8.208 9.389 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.233 7.518 6.244 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -1.156 10.367 8.387 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.640 9.681 5.242 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.057 11.111 6.310 1.00 0.00 H new ATOM 1022 N LEU A 62 0.411 4.445 10.784 1.00 0.00 N ATOM 1023 CA LEU A 62 -0.610 3.679 11.494 1.00 0.00 C ATOM 1024 C LEU A 62 -0.638 4.048 12.974 1.00 0.00 C ATOM 1025 O LEU A 62 -1.708 4.206 13.558 1.00 0.00 O ATOM 1026 CB LEU A 62 -0.356 2.175 11.333 1.00 0.00 C ATOM 1027 CG LEU A 62 -1.237 1.472 10.295 1.00 0.00 C ATOM 1028 CD1 LEU A 62 -1.134 2.161 8.944 1.00 0.00 C ATOM 1029 CD2 LEU A 62 -0.846 0.007 10.173 1.00 0.00 C ATOM 0 H LEU A 62 1.105 3.875 10.300 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.579 3.924 11.060 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.689 2.026 11.060 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.505 1.692 12.299 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.272 1.531 10.631 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.768 1.645 8.223 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.461 3.197 9.038 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.100 2.136 8.601 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.481 -0.479 9.432 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.196 -0.067 9.862 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.973 -0.485 11.137 1.00 0.00 H new ATOM 1041 N LEU A 63 0.537 4.181 13.574 1.00 0.00 N ATOM 1042 CA LEU A 63 0.628 4.530 14.987 1.00 0.00 C ATOM 1043 C LEU A 63 0.494 6.039 15.188 1.00 0.00 C ATOM 1044 O LEU A 63 0.165 6.501 16.281 1.00 0.00 O ATOM 1045 CB LEU A 63 1.949 4.033 15.575 1.00 0.00 C ATOM 1046 CG LEU A 63 1.931 2.585 16.075 1.00 0.00 C ATOM 1047 CD1 LEU A 63 1.028 2.450 17.292 1.00 0.00 C ATOM 1048 CD2 LEU A 63 1.483 1.638 14.969 1.00 0.00 C ATOM 0 H LEU A 63 1.436 4.054 13.109 1.00 0.00 H new ATOM 0 HA LEU A 63 -0.195 4.042 15.509 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.726 4.130 14.817 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.229 4.684 16.403 1.00 0.00 H new ATOM 0 HG LEU A 63 2.945 2.313 16.367 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.028 1.414 17.632 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.395 3.095 18.091 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.013 2.744 17.026 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.478 0.615 15.346 1.00 0.00 H new ATOM 0 HD22 LEU A 63 0.479 1.910 14.642 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.171 1.711 14.127 1.00 0.00 H new ATOM 1060 N ARG A 64 0.748 6.806 14.129 1.00 0.00 N ATOM 1061 CA ARG A 64 0.653 8.263 14.197 1.00 0.00 C ATOM 1062 C ARG A 64 -0.783 8.705 14.451 1.00 0.00 C ATOM 1063 O ARG A 64 -1.040 9.559 15.300 1.00 0.00 O ATOM 1064 CB ARG A 64 1.163 8.904 12.901 1.00 0.00 C ATOM 1065 CG ARG A 64 1.958 10.184 13.122 1.00 0.00 C ATOM 1066 CD ARG A 64 1.107 11.423 12.886 1.00 0.00 C ATOM 1067 NE ARG A 64 0.893 11.691 11.464 1.00 0.00 N ATOM 1068 CZ ARG A 64 1.845 12.116 10.636 1.00 0.00 C ATOM 1069 NH1 ARG A 64 3.086 12.291 11.072 1.00 0.00 N ATOM 1070 NH2 ARG A 64 1.556 12.362 9.367 1.00 0.00 N ATOM 0 H ARG A 64 1.021 6.444 13.215 1.00 0.00 H new ATOM 0 HA ARG A 64 1.277 8.594 15.027 1.00 0.00 H new ATOM 0 HB2 ARG A 64 1.789 8.185 12.372 1.00 0.00 H new ATOM 0 HB3 ARG A 64 0.313 9.122 12.255 1.00 0.00 H new ATOM 0 HG2 ARG A 64 2.348 10.199 14.140 1.00 0.00 H new ATOM 0 HG3 ARG A 64 2.817 10.199 12.451 1.00 0.00 H new ATOM 0 HD2 ARG A 64 0.143 11.297 13.378 1.00 0.00 H new ATOM 0 HD3 ARG A 64 1.590 12.285 13.347 1.00 0.00 H new ATOM 0 HE ARG A 64 -0.042 11.543 11.084 1.00 0.00 H new ATOM 0 HH11 ARG A 64 3.316 12.100 12.047 1.00 0.00 H new ATOM 0 HH12 ARG A 64 3.810 12.617 10.432 1.00 0.00 H new ATOM 0 HH21 ARG A 64 0.605 12.226 9.025 1.00 0.00 H new ATOM 0 HH22 ARG A 64 2.285 12.688 8.732 1.00 0.00 H new ATOM 1084 N GLU A 65 -1.716 8.122 13.708 1.00 0.00 N ATOM 1085 CA GLU A 65 -3.127 8.463 13.850 1.00 0.00 C ATOM 1086 C GLU A 65 -3.804 7.588 14.903 1.00 0.00 C ATOM 1087 O GLU A 65 -4.902 7.897 15.366 1.00 0.00 O ATOM 1088 CB GLU A 65 -3.845 8.322 12.507 1.00 0.00 C ATOM 1089 CG GLU A 65 -5.177 9.054 12.445 1.00 0.00 C ATOM 1090 CD GLU A 65 -5.078 10.493 12.914 1.00 0.00 C ATOM 1091 OE1 GLU A 65 -4.729 11.364 12.088 1.00 0.00 O ATOM 1092 OE2 GLU A 65 -5.348 10.749 14.106 1.00 0.00 O ATOM 0 H GLU A 65 -1.522 7.412 13.002 1.00 0.00 H new ATOM 0 HA GLU A 65 -3.190 9.500 14.180 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.196 8.700 11.717 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -4.012 7.264 12.304 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -5.550 9.035 11.421 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.906 8.526 13.059 1.00 0.00 H new ATOM 1099 N LEU A 66 -3.142 6.501 15.285 1.00 0.00 N ATOM 1100 CA LEU A 66 -3.682 5.595 16.289 1.00 0.00 C ATOM 1101 C LEU A 66 -3.386 6.115 17.692 1.00 0.00 C ATOM 1102 O LEU A 66 -2.398 5.722 18.312 1.00 0.00 O ATOM 1103 CB LEU A 66 -3.084 4.196 16.122 1.00 0.00 C ATOM 1104 CG LEU A 66 -3.961 3.193 15.366 1.00 0.00 C ATOM 1105 CD1 LEU A 66 -4.413 3.763 14.028 1.00 0.00 C ATOM 1106 CD2 LEU A 66 -3.216 1.881 15.171 1.00 0.00 C ATOM 0 H LEU A 66 -2.232 6.227 14.914 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.762 5.540 16.152 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.132 4.286 15.600 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.868 3.791 17.111 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.852 2.999 15.963 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.034 3.031 13.512 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.989 4.673 14.196 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.540 3.994 13.417 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.852 1.178 14.632 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.307 2.061 14.598 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.955 1.463 16.143 1.00 0.00 H new ATOM 1118 N GLY A 67 -4.249 6.995 18.192 1.00 0.00 N ATOM 1119 CA GLY A 67 -4.059 7.544 19.522 1.00 0.00 C ATOM 1120 C GLY A 67 -4.430 6.559 20.620 1.00 0.00 C ATOM 1121 O GLY A 67 -4.676 6.955 21.759 1.00 0.00 O ATOM 0 H GLY A 67 -5.075 7.337 17.700 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -3.017 7.842 19.643 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.662 8.445 19.629 1.00 0.00 H new ATOM 1125 N THR A 68 -4.471 5.275 20.274 1.00 0.00 N ATOM 1126 CA THR A 68 -4.813 4.227 21.226 1.00 0.00 C ATOM 1127 C THR A 68 -3.763 3.123 21.198 1.00 0.00 C ATOM 1128 O THR A 68 -2.897 3.107 20.322 1.00 0.00 O ATOM 1129 CB THR A 68 -6.198 3.653 20.922 1.00 0.00 C ATOM 1130 OG1 THR A 68 -6.149 2.775 19.811 1.00 0.00 O ATOM 1131 CG2 THR A 68 -7.229 4.719 20.618 1.00 0.00 C ATOM 0 H THR A 68 -4.270 4.936 19.333 1.00 0.00 H new ATOM 0 HA THR A 68 -4.834 4.663 22.225 1.00 0.00 H new ATOM 0 HB THR A 68 -6.496 3.124 21.827 1.00 0.00 H new ATOM 0 HG1 THR A 68 -5.571 3.156 19.118 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.190 4.248 20.411 1.00 0.00 H new ATOM 0 HG22 THR A 68 -7.329 5.384 21.476 1.00 0.00 H new ATOM 0 HG23 THR A 68 -6.912 5.294 19.748 1.00 0.00 H new ATOM 1139 N ALA A 69 -3.839 2.216 22.172 1.00 0.00 N ATOM 1140 CA ALA A 69 -2.896 1.096 22.293 1.00 0.00 C ATOM 1141 C ALA A 69 -2.197 0.770 20.972 1.00 0.00 C ATOM 1142 O ALA A 69 -0.969 0.777 20.896 1.00 0.00 O ATOM 1143 CB ALA A 69 -3.615 -0.135 22.824 1.00 0.00 C ATOM 0 H ALA A 69 -4.553 2.234 22.900 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.121 1.402 22.996 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.908 -0.960 22.910 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.038 0.085 23.804 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.415 -0.413 22.138 1.00 0.00 H new ATOM 1149 N GLY A 70 -2.984 0.488 19.938 1.00 0.00 N ATOM 1150 CA GLY A 70 -2.414 0.166 18.642 1.00 0.00 C ATOM 1151 C GLY A 70 -1.660 -1.151 18.645 1.00 0.00 C ATOM 1152 O GLY A 70 -0.525 -1.222 19.114 1.00 0.00 O ATOM 0 H GLY A 70 -4.003 0.477 19.974 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -3.211 0.122 17.900 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -1.739 0.966 18.338 1.00 0.00 H new ATOM 1156 N ASN A 71 -2.293 -2.197 18.117 1.00 0.00 N ATOM 1157 CA ASN A 71 -1.676 -3.520 18.058 1.00 0.00 C ATOM 1158 C ASN A 71 -2.422 -4.427 17.083 1.00 0.00 C ATOM 1159 O ASN A 71 -3.542 -4.132 16.681 1.00 0.00 O ATOM 1160 CB ASN A 71 -1.652 -4.159 19.448 1.00 0.00 C ATOM 1161 CG ASN A 71 -0.347 -4.876 19.732 1.00 0.00 C ATOM 1162 OD1 ASN A 71 0.700 -4.247 19.885 1.00 0.00 O ATOM 1163 ND2 ASN A 71 -0.403 -6.201 19.804 1.00 0.00 N ATOM 0 H ASN A 71 -3.233 -2.154 17.724 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.652 -3.398 17.704 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -1.811 -3.388 20.202 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -2.478 -4.865 19.535 1.00 0.00 H new ATOM 0 HD21 ASN A 71 0.444 -6.738 19.993 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.293 -6.682 19.671 1.00 0.00 H new ATOM 1170 N LEU A 72 -1.799 -5.540 16.714 1.00 0.00 N ATOM 1171 CA LEU A 72 -2.415 -6.487 15.790 1.00 0.00 C ATOM 1172 C LEU A 72 -3.336 -7.459 16.528 1.00 0.00 C ATOM 1173 O LEU A 72 -2.879 -8.255 17.347 1.00 0.00 O ATOM 1174 CB LEU A 72 -1.335 -7.272 15.042 1.00 0.00 C ATOM 1175 CG LEU A 72 -0.861 -6.651 13.725 1.00 0.00 C ATOM 1176 CD1 LEU A 72 0.167 -5.562 13.986 1.00 0.00 C ATOM 1177 CD2 LEU A 72 -0.283 -7.723 12.814 1.00 0.00 C ATOM 0 H LEU A 72 -0.870 -5.809 17.039 1.00 0.00 H new ATOM 0 HA LEU A 72 -3.012 -5.919 15.077 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.473 -7.388 15.700 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.715 -8.273 14.836 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.719 -6.198 13.228 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.491 -5.133 13.038 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.278 -4.782 14.604 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.026 -5.989 14.504 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.050 -7.267 11.881 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.564 -8.201 13.307 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.048 -8.470 12.600 1.00 0.00 H new ATOM 1189 N GLU A 73 -4.628 -7.407 16.217 1.00 0.00 N ATOM 1190 CA GLU A 73 -5.599 -8.305 16.838 1.00 0.00 C ATOM 1191 C GLU A 73 -5.988 -9.404 15.854 1.00 0.00 C ATOM 1192 O GLU A 73 -5.971 -9.193 14.641 1.00 0.00 O ATOM 1193 CB GLU A 73 -6.850 -7.539 17.288 1.00 0.00 C ATOM 1194 CG GLU A 73 -6.765 -6.978 18.697 1.00 0.00 C ATOM 1195 CD GLU A 73 -6.883 -5.467 18.722 1.00 0.00 C ATOM 1196 OE1 GLU A 73 -5.854 -4.787 18.522 1.00 0.00 O ATOM 1197 OE2 GLU A 73 -8.006 -4.963 18.934 1.00 0.00 O ATOM 0 H GLU A 73 -5.027 -6.755 15.541 1.00 0.00 H new ATOM 0 HA GLU A 73 -5.139 -8.751 17.719 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -7.029 -6.719 16.593 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -7.711 -8.204 17.225 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -7.557 -7.412 19.307 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -5.817 -7.274 19.147 1.00 0.00 H new ATOM 1204 N GLY A 74 -6.335 -10.574 16.380 1.00 0.00 N ATOM 1205 CA GLY A 74 -6.719 -11.684 15.525 1.00 0.00 C ATOM 1206 C GLY A 74 -5.575 -12.172 14.656 1.00 0.00 C ATOM 1207 O GLY A 74 -4.457 -11.665 14.746 1.00 0.00 O ATOM 0 H GLY A 74 -6.357 -10.774 17.380 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -7.078 -12.507 16.143 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -7.549 -11.378 14.889 1.00 0.00 H new ATOM 1211 N GLY A 75 -5.856 -13.160 13.812 1.00 0.00 N ATOM 1212 CA GLY A 75 -4.835 -13.703 12.934 1.00 0.00 C ATOM 1213 C GLY A 75 -4.238 -12.654 12.015 1.00 0.00 C ATOM 1214 O GLY A 75 -3.054 -12.711 11.685 1.00 0.00 O ATOM 0 H GLY A 75 -6.774 -13.595 13.720 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.042 -14.147 13.536 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -5.266 -14.504 12.333 1.00 0.00 H new ATOM 1218 N ARG A 76 -5.059 -11.691 11.602 1.00 0.00 N ATOM 1219 CA ARG A 76 -4.602 -10.625 10.718 1.00 0.00 C ATOM 1220 C ARG A 76 -4.050 -9.453 11.531 1.00 0.00 C ATOM 1221 O ARG A 76 -3.649 -9.627 12.682 1.00 0.00 O ATOM 1222 CB ARG A 76 -5.746 -10.160 9.812 1.00 0.00 C ATOM 1223 CG ARG A 76 -6.847 -9.412 10.551 1.00 0.00 C ATOM 1224 CD ARG A 76 -8.223 -9.930 10.168 1.00 0.00 C ATOM 1225 NE ARG A 76 -8.884 -10.613 11.280 1.00 0.00 N ATOM 1226 CZ ARG A 76 -9.773 -11.593 11.126 1.00 0.00 C ATOM 1227 NH1 ARG A 76 -10.116 -12.004 9.912 1.00 0.00 N ATOM 1228 NH2 ARG A 76 -10.324 -12.164 12.191 1.00 0.00 N ATOM 0 H ARG A 76 -6.042 -11.628 11.866 1.00 0.00 H new ATOM 0 HA ARG A 76 -3.799 -11.014 10.091 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -5.341 -9.515 9.032 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -6.179 -11.028 9.315 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.703 -9.519 11.626 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -6.781 -8.348 10.324 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.843 -9.098 9.834 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -8.130 -10.616 9.326 1.00 0.00 H new ATOM 0 HE ARG A 76 -8.650 -10.322 12.229 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -9.698 -11.569 9.089 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -10.797 -12.755 9.801 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.067 -11.852 13.127 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -11.005 -12.914 12.073 1.00 0.00 H new ATOM 1242 N ALA A 77 -4.023 -8.263 10.934 1.00 0.00 N ATOM 1243 CA ALA A 77 -3.509 -7.081 11.622 1.00 0.00 C ATOM 1244 C ALA A 77 -4.638 -6.133 12.031 1.00 0.00 C ATOM 1245 O ALA A 77 -4.884 -5.121 11.376 1.00 0.00 O ATOM 1246 CB ALA A 77 -2.497 -6.360 10.740 1.00 0.00 C ATOM 0 H ALA A 77 -4.348 -8.092 9.982 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.013 -7.412 12.534 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -2.120 -5.481 11.262 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.668 -7.031 10.514 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -2.978 -6.052 9.811 1.00 0.00 H new ATOM 1252 N ILE A 78 -5.325 -6.465 13.122 1.00 0.00 N ATOM 1253 CA ILE A 78 -6.425 -5.640 13.610 1.00 0.00 C ATOM 1254 C ILE A 78 -5.956 -4.647 14.669 1.00 0.00 C ATOM 1255 O ILE A 78 -5.928 -4.965 15.857 1.00 0.00 O ATOM 1256 CB ILE A 78 -7.545 -6.501 14.222 1.00 0.00 C ATOM 1257 CG1 ILE A 78 -8.020 -7.565 13.238 1.00 0.00 C ATOM 1258 CG2 ILE A 78 -8.712 -5.636 14.684 1.00 0.00 C ATOM 1259 CD1 ILE A 78 -8.748 -8.704 13.918 1.00 0.00 C ATOM 0 H ILE A 78 -5.139 -7.297 13.682 1.00 0.00 H new ATOM 0 HA ILE A 78 -6.807 -5.098 12.744 1.00 0.00 H new ATOM 0 HB ILE A 78 -7.133 -7.007 15.095 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.680 -7.105 12.502 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -7.162 -7.960 12.694 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -9.488 -6.271 15.112 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -8.365 -4.929 15.438 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -9.119 -5.089 13.833 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -9.064 -9.432 13.171 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -8.082 -9.185 14.635 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -9.623 -8.317 14.439 1.00 0.00 H new ATOM 1271 N LEU A 79 -5.597 -3.440 14.240 1.00 0.00 N ATOM 1272 CA LEU A 79 -5.145 -2.413 15.171 1.00 0.00 C ATOM 1273 C LEU A 79 -6.330 -1.751 15.868 1.00 0.00 C ATOM 1274 O LEU A 79 -7.480 -2.130 15.649 1.00 0.00 O ATOM 1275 CB LEU A 79 -4.294 -1.365 14.454 1.00 0.00 C ATOM 1276 CG LEU A 79 -4.977 -0.672 13.277 1.00 0.00 C ATOM 1277 CD1 LEU A 79 -5.717 0.575 13.740 1.00 0.00 C ATOM 1278 CD2 LEU A 79 -3.957 -0.328 12.202 1.00 0.00 C ATOM 0 H LEU A 79 -5.610 -3.152 13.262 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.528 -2.896 15.929 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.993 -0.607 15.177 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.382 -1.843 14.095 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.709 -1.358 12.850 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -6.196 1.052 12.885 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.475 0.297 14.472 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.011 1.269 14.195 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.458 0.165 11.369 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.201 0.339 12.617 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.479 -1.242 11.848 1.00 0.00 H new ATOM 1290 N GLN A 80 -6.042 -0.768 16.714 1.00 0.00 N ATOM 1291 CA GLN A 80 -7.085 -0.067 17.456 1.00 0.00 C ATOM 1292 C GLN A 80 -6.807 1.432 17.489 1.00 0.00 C ATOM 1293 O GLN A 80 -5.659 1.854 17.624 1.00 0.00 O ATOM 1294 CB GLN A 80 -7.155 -0.606 18.891 1.00 0.00 C ATOM 1295 CG GLN A 80 -8.567 -0.822 19.410 1.00 0.00 C ATOM 1296 CD GLN A 80 -8.641 -1.955 20.415 1.00 0.00 C ATOM 1297 OE1 GLN A 80 -9.266 -2.986 20.162 1.00 0.00 O ATOM 1298 NE2 GLN A 80 -7.997 -1.768 21.561 1.00 0.00 N ATOM 0 H GLN A 80 -5.096 -0.438 16.903 1.00 0.00 H new ATOM 0 HA GLN A 80 -8.038 -0.236 16.954 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -6.615 -1.551 18.938 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.639 0.089 19.553 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -8.926 0.097 19.874 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.231 -1.037 18.573 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -7.492 -0.897 21.726 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -8.007 -2.495 22.276 1.00 0.00 H new ATOM 1307 N GLY A 81 -7.863 2.230 17.366 1.00 0.00 N ATOM 1308 CA GLY A 81 -7.709 3.673 17.389 1.00 0.00 C ATOM 1309 C GLY A 81 -8.406 4.367 16.230 1.00 0.00 C ATOM 1310 O GLY A 81 -9.619 4.576 16.265 1.00 0.00 O ATOM 0 H GLY A 81 -8.822 1.903 17.251 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -8.106 4.060 18.328 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.647 3.919 17.366 1.00 0.00 H new ATOM 1314 N LYS A 82 -7.637 4.735 15.207 1.00 0.00 N ATOM 1315 CA LYS A 82 -8.188 5.422 14.039 1.00 0.00 C ATOM 1316 C LYS A 82 -7.752 4.736 12.736 1.00 0.00 C ATOM 1317 O LYS A 82 -7.576 3.518 12.699 1.00 0.00 O ATOM 1318 CB LYS A 82 -7.760 6.893 14.055 1.00 0.00 C ATOM 1319 CG LYS A 82 -8.802 7.853 13.491 1.00 0.00 C ATOM 1320 CD LYS A 82 -10.039 7.934 14.375 1.00 0.00 C ATOM 1321 CE LYS A 82 -11.299 8.170 13.552 1.00 0.00 C ATOM 1322 NZ LYS A 82 -11.844 9.544 13.743 1.00 0.00 N ATOM 0 H LYS A 82 -6.632 4.569 15.163 1.00 0.00 H new ATOM 0 HA LYS A 82 -9.276 5.371 14.085 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -7.533 7.183 15.081 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -6.838 6.998 13.483 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -8.363 8.846 13.389 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -9.091 7.528 12.491 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -10.142 7.010 14.943 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -9.919 8.741 15.098 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -11.077 8.012 12.497 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -12.057 7.438 13.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -12.701 9.661 13.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -12.081 9.687 14.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -11.132 10.244 13.452 1.00 0.00 H new ATOM 1336 N PHE A 83 -7.591 5.515 11.662 1.00 0.00 N ATOM 1337 CA PHE A 83 -7.193 4.965 10.367 1.00 0.00 C ATOM 1338 C PHE A 83 -8.254 4.004 9.847 1.00 0.00 C ATOM 1339 O PHE A 83 -7.952 2.888 9.423 1.00 0.00 O ATOM 1340 CB PHE A 83 -5.834 4.262 10.467 1.00 0.00 C ATOM 1341 CG PHE A 83 -4.694 5.011 9.824 1.00 0.00 C ATOM 1342 CD1 PHE A 83 -4.877 6.261 9.241 1.00 0.00 C ATOM 1343 CD2 PHE A 83 -3.432 4.451 9.804 1.00 0.00 C ATOM 1344 CE1 PHE A 83 -3.819 6.926 8.653 1.00 0.00 C ATOM 1345 CE2 PHE A 83 -2.372 5.112 9.217 1.00 0.00 C ATOM 1346 CZ PHE A 83 -2.564 6.348 8.640 1.00 0.00 C ATOM 0 H PHE A 83 -7.730 6.525 11.666 1.00 0.00 H new ATOM 0 HA PHE A 83 -7.097 5.791 9.662 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -5.599 4.101 11.519 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -5.913 3.278 10.004 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -5.856 6.716 9.248 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -3.272 3.482 10.254 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -3.972 7.896 8.204 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -1.391 4.660 9.210 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.735 6.864 8.178 1.00 0.00 H new ATOM 1356 N THR A 84 -9.500 4.453 9.878 1.00 0.00 N ATOM 1357 CA THR A 84 -10.616 3.647 9.404 1.00 0.00 C ATOM 1358 C THR A 84 -10.729 3.753 7.887 1.00 0.00 C ATOM 1359 O THR A 84 -11.589 4.465 7.368 1.00 0.00 O ATOM 1360 CB THR A 84 -11.911 4.110 10.077 1.00 0.00 C ATOM 1361 OG1 THR A 84 -12.298 5.390 9.604 1.00 0.00 O ATOM 1362 CG2 THR A 84 -11.801 4.197 11.584 1.00 0.00 C ATOM 0 H THR A 84 -9.764 5.374 10.228 1.00 0.00 H new ATOM 0 HA THR A 84 -10.443 2.603 9.663 1.00 0.00 H new ATOM 0 HB THR A 84 -12.653 3.354 9.821 1.00 0.00 H new ATOM 0 HG1 THR A 84 -12.336 5.379 8.625 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.752 4.531 12.000 1.00 0.00 H new ATOM 0 HG22 THR A 84 -11.553 3.216 11.988 1.00 0.00 H new ATOM 0 HG23 THR A 84 -11.019 4.908 11.851 1.00 0.00 H new ATOM 1370 N HIS A 85 -9.829 3.063 7.188 1.00 0.00 N ATOM 1371 CA HIS A 85 -9.776 3.085 5.724 1.00 0.00 C ATOM 1372 C HIS A 85 -9.995 4.498 5.196 1.00 0.00 C ATOM 1373 O HIS A 85 -10.597 4.695 4.142 1.00 0.00 O ATOM 1374 CB HIS A 85 -10.841 2.154 5.141 1.00 0.00 C ATOM 1375 CG HIS A 85 -12.243 2.536 5.517 1.00 0.00 C ATOM 1376 ND1 HIS A 85 -13.049 1.748 6.312 1.00 0.00 N ATOM 1377 CD2 HIS A 85 -12.983 3.631 5.207 1.00 0.00 C ATOM 1378 CE1 HIS A 85 -14.221 2.339 6.475 1.00 0.00 C ATOM 1379 NE2 HIS A 85 -14.205 3.482 5.814 1.00 0.00 N ATOM 0 H HIS A 85 -9.116 2.473 7.618 1.00 0.00 H new ATOM 0 HA HIS A 85 -8.788 2.743 5.417 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -10.753 2.150 4.055 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -10.647 1.136 5.480 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -12.669 4.464 4.596 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -15.049 1.953 7.050 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -14.977 4.147 5.763 1.00 0.00 H new ATOM 1387 N PHE A 86 -9.474 5.475 5.927 1.00 0.00 N ATOM 1388 CA PHE A 86 -9.586 6.870 5.528 1.00 0.00 C ATOM 1389 C PHE A 86 -8.375 7.303 4.717 1.00 0.00 C ATOM 1390 O PHE A 86 -8.452 7.493 3.503 1.00 0.00 O ATOM 1391 CB PHE A 86 -9.762 7.775 6.748 1.00 0.00 C ATOM 1392 CG PHE A 86 -10.713 8.910 6.504 1.00 0.00 C ATOM 1393 CD1 PHE A 86 -11.989 8.666 6.023 1.00 0.00 C ATOM 1394 CD2 PHE A 86 -10.329 10.219 6.746 1.00 0.00 C ATOM 1395 CE1 PHE A 86 -12.867 9.708 5.791 1.00 0.00 C ATOM 1396 CE2 PHE A 86 -11.203 11.264 6.516 1.00 0.00 C ATOM 1397 CZ PHE A 86 -12.474 11.008 6.038 1.00 0.00 C ATOM 0 H PHE A 86 -8.969 5.326 6.801 1.00 0.00 H new ATOM 0 HA PHE A 86 -10.471 6.966 4.899 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -10.123 7.179 7.586 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -8.791 8.177 7.038 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -12.301 7.651 5.827 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -9.336 10.425 7.118 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -13.860 9.505 5.417 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -10.893 12.280 6.710 1.00 0.00 H new ATOM 0 HZ PHE A 86 -13.159 11.824 5.858 1.00 0.00 H new ATOM 1407 N LEU A 87 -7.253 7.458 5.410 1.00 0.00 N ATOM 1408 CA LEU A 87 -6.010 7.873 4.776 1.00 0.00 C ATOM 1409 C LEU A 87 -5.447 6.756 3.919 1.00 0.00 C ATOM 1410 O LEU A 87 -4.964 6.986 2.810 1.00 0.00 O ATOM 1411 CB LEU A 87 -4.977 8.270 5.832 1.00 0.00 C ATOM 1412 CG LEU A 87 -5.205 9.632 6.493 1.00 0.00 C ATOM 1413 CD1 LEU A 87 -6.287 9.539 7.557 1.00 0.00 C ATOM 1414 CD2 LEU A 87 -3.909 10.157 7.096 1.00 0.00 C ATOM 0 H LEU A 87 -7.180 7.301 6.415 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.228 8.733 4.143 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.964 7.506 6.609 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.990 8.270 5.369 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.538 10.332 5.726 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.433 10.518 8.014 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.220 9.209 7.099 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.985 8.823 8.321 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.090 11.126 7.561 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.547 9.456 7.848 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.160 10.266 6.311 1.00 0.00 H new ATOM 1426 N ILE A 88 -5.505 5.541 4.441 1.00 0.00 N ATOM 1427 CA ILE A 88 -4.989 4.392 3.720 1.00 0.00 C ATOM 1428 C ILE A 88 -5.637 4.283 2.341 1.00 0.00 C ATOM 1429 O ILE A 88 -4.961 4.374 1.318 1.00 0.00 O ATOM 1430 CB ILE A 88 -5.235 3.083 4.498 1.00 0.00 C ATOM 1431 CG1 ILE A 88 -4.849 3.222 5.980 1.00 0.00 C ATOM 1432 CG2 ILE A 88 -4.461 1.946 3.857 1.00 0.00 C ATOM 1433 CD1 ILE A 88 -5.169 1.984 6.794 1.00 0.00 C ATOM 0 H ILE A 88 -5.902 5.327 5.356 1.00 0.00 H new ATOM 0 HA ILE A 88 -3.915 4.539 3.607 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.302 2.863 4.455 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.782 3.433 6.054 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.373 4.077 6.408 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -4.640 1.025 4.412 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -4.790 1.818 2.826 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -3.396 2.177 3.872 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.874 2.144 7.831 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -6.240 1.785 6.748 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -4.624 1.131 6.389 1.00 0.00 H new ATOM 1445 N ASN A 89 -6.951 4.082 2.321 1.00 0.00 N ATOM 1446 CA ASN A 89 -7.692 3.951 1.067 1.00 0.00 C ATOM 1447 C ASN A 89 -7.438 5.135 0.131 1.00 0.00 C ATOM 1448 O ASN A 89 -7.289 4.958 -1.079 1.00 0.00 O ATOM 1449 CB ASN A 89 -9.192 3.838 1.351 1.00 0.00 C ATOM 1450 CG ASN A 89 -9.974 3.318 0.161 1.00 0.00 C ATOM 1451 OD1 ASN A 89 -10.849 4.002 -0.369 1.00 0.00 O ATOM 1452 ND2 ASN A 89 -9.662 2.099 -0.266 1.00 0.00 N ATOM 0 H ASN A 89 -7.527 4.006 3.159 1.00 0.00 H new ATOM 0 HA ASN A 89 -7.340 3.046 0.572 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -9.348 3.174 2.201 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.579 4.817 1.635 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -10.155 1.696 -1.063 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -8.929 1.566 0.203 1.00 0.00 H new ATOM 1459 N GLU A 90 -7.396 6.338 0.695 1.00 0.00 N ATOM 1460 CA GLU A 90 -7.172 7.545 -0.096 1.00 0.00 C ATOM 1461 C GLU A 90 -5.837 7.498 -0.833 1.00 0.00 C ATOM 1462 O GLU A 90 -5.785 7.618 -2.058 1.00 0.00 O ATOM 1463 CB GLU A 90 -7.219 8.778 0.805 1.00 0.00 C ATOM 1464 CG GLU A 90 -8.626 9.284 1.066 1.00 0.00 C ATOM 1465 CD GLU A 90 -8.644 10.639 1.746 1.00 0.00 C ATOM 1466 OE1 GLU A 90 -8.555 10.679 2.991 1.00 0.00 O ATOM 1467 OE2 GLU A 90 -8.749 11.659 1.034 1.00 0.00 O ATOM 0 H GLU A 90 -7.514 6.504 1.695 1.00 0.00 H new ATOM 0 HA GLU A 90 -7.966 7.603 -0.841 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -6.744 8.541 1.757 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -6.634 9.575 0.347 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -9.165 9.349 0.121 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.157 8.563 1.687 1.00 0.00 H new ATOM 1474 N ARG A 91 -4.758 7.323 -0.080 1.00 0.00 N ATOM 1475 CA ARG A 91 -3.421 7.261 -0.658 1.00 0.00 C ATOM 1476 C ARG A 91 -3.329 6.173 -1.720 1.00 0.00 C ATOM 1477 O ARG A 91 -2.826 6.403 -2.820 1.00 0.00 O ATOM 1478 CB ARG A 91 -2.392 6.989 0.435 1.00 0.00 C ATOM 1479 CG ARG A 91 -1.789 8.244 1.042 1.00 0.00 C ATOM 1480 CD ARG A 91 -0.271 8.240 0.942 1.00 0.00 C ATOM 1481 NE ARG A 91 0.250 9.528 0.496 1.00 0.00 N ATOM 1482 CZ ARG A 91 0.000 10.057 -0.700 1.00 0.00 C ATOM 1483 NH1 ARG A 91 -0.756 9.409 -1.578 1.00 0.00 N ATOM 1484 NH2 ARG A 91 0.512 11.237 -1.019 1.00 0.00 N ATOM 0 H ARG A 91 -4.783 7.221 0.935 1.00 0.00 H new ATOM 0 HA ARG A 91 -3.215 8.223 -1.128 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.863 6.405 1.226 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -1.591 6.377 0.021 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -2.186 9.122 0.532 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -2.085 8.322 2.088 1.00 0.00 H new ATOM 0 HD2 ARG A 91 0.156 7.993 1.914 1.00 0.00 H new ATOM 0 HD3 ARG A 91 0.045 7.461 0.248 1.00 0.00 H new ATOM 0 HE ARG A 91 0.841 10.055 1.139 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -1.150 8.499 -1.338 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -0.943 9.821 -2.492 1.00 0.00 H new ATOM 0 HH21 ARG A 91 1.096 11.738 -0.349 1.00 0.00 H new ATOM 0 HH22 ARG A 91 0.322 11.645 -1.935 1.00 0.00 H new ATOM 1498 N ILE A 92 -3.808 4.979 -1.379 1.00 0.00 N ATOM 1499 CA ILE A 92 -3.766 3.854 -2.302 1.00 0.00 C ATOM 1500 C ILE A 92 -4.446 4.204 -3.623 1.00 0.00 C ATOM 1501 O ILE A 92 -3.831 4.132 -4.685 1.00 0.00 O ATOM 1502 CB ILE A 92 -4.463 2.617 -1.699 1.00 0.00 C ATOM 1503 CG1 ILE A 92 -3.835 2.261 -0.349 1.00 0.00 C ATOM 1504 CG2 ILE A 92 -4.386 1.437 -2.660 1.00 0.00 C ATOM 1505 CD1 ILE A 92 -4.766 1.512 0.578 1.00 0.00 C ATOM 0 H ILE A 92 -4.228 4.769 -0.473 1.00 0.00 H new ATOM 0 HA ILE A 92 -2.715 3.627 -2.483 1.00 0.00 H new ATOM 0 HB ILE A 92 -5.515 2.853 -1.538 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -2.945 1.656 -0.521 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -3.508 3.177 0.142 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -4.883 0.574 -2.217 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -4.878 1.698 -3.597 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -3.341 1.194 -2.855 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -4.251 1.295 1.514 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -5.646 2.123 0.781 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -5.074 0.578 0.108 1.00 0.00 H new ATOM 1517 N GLU A 93 -5.717 4.594 -3.544 1.00 0.00 N ATOM 1518 CA GLU A 93 -6.487 4.963 -4.729 1.00 0.00 C ATOM 1519 C GLU A 93 -5.721 5.972 -5.580 1.00 0.00 C ATOM 1520 O GLU A 93 -5.875 6.016 -6.799 1.00 0.00 O ATOM 1521 CB GLU A 93 -7.845 5.534 -4.315 1.00 0.00 C ATOM 1522 CG GLU A 93 -8.994 4.548 -4.471 1.00 0.00 C ATOM 1523 CD GLU A 93 -8.739 3.238 -3.752 1.00 0.00 C ATOM 1524 OE1 GLU A 93 -8.560 3.263 -2.516 1.00 0.00 O ATOM 1525 OE2 GLU A 93 -8.719 2.185 -4.425 1.00 0.00 O ATOM 0 H GLU A 93 -6.236 4.663 -2.669 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.649 4.068 -5.329 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -7.792 5.856 -3.275 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -8.055 6.421 -4.913 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -9.909 4.998 -4.085 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -9.158 4.351 -5.530 1.00 0.00 H new ATOM 1532 N ASP A 94 -4.888 6.771 -4.927 1.00 0.00 N ATOM 1533 CA ASP A 94 -4.091 7.769 -5.625 1.00 0.00 C ATOM 1534 C ASP A 94 -2.954 7.107 -6.401 1.00 0.00 C ATOM 1535 O ASP A 94 -2.552 7.587 -7.461 1.00 0.00 O ATOM 1536 CB ASP A 94 -3.522 8.782 -4.629 1.00 0.00 C ATOM 1537 CG ASP A 94 -2.910 9.988 -5.312 1.00 0.00 C ATOM 1538 OD1 ASP A 94 -3.252 10.244 -6.487 1.00 0.00 O ATOM 1539 OD2 ASP A 94 -2.088 10.679 -4.674 1.00 0.00 O ATOM 0 H ASP A 94 -4.747 6.747 -3.917 1.00 0.00 H new ATOM 0 HA ASP A 94 -4.737 8.289 -6.332 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -4.315 9.112 -3.959 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -2.766 8.295 -4.013 1.00 0.00 H new ATOM 1544 N TYR A 95 -2.435 6.006 -5.864 1.00 0.00 N ATOM 1545 CA TYR A 95 -1.342 5.282 -6.506 1.00 0.00 C ATOM 1546 C TYR A 95 -1.863 4.266 -7.523 1.00 0.00 C ATOM 1547 O TYR A 95 -1.537 4.342 -8.707 1.00 0.00 O ATOM 1548 CB TYR A 95 -0.474 4.581 -5.458 1.00 0.00 C ATOM 1549 CG TYR A 95 0.775 3.951 -6.033 1.00 0.00 C ATOM 1550 CD1 TYR A 95 0.710 2.752 -6.730 1.00 0.00 C ATOM 1551 CD2 TYR A 95 2.016 4.558 -5.884 1.00 0.00 C ATOM 1552 CE1 TYR A 95 1.847 2.175 -7.263 1.00 0.00 C ATOM 1553 CE2 TYR A 95 3.158 3.986 -6.413 1.00 0.00 C ATOM 1554 CZ TYR A 95 3.067 2.795 -7.102 1.00 0.00 C ATOM 1555 OH TYR A 95 4.201 2.223 -7.630 1.00 0.00 O ATOM 0 H TYR A 95 -2.754 5.596 -4.986 1.00 0.00 H new ATOM 0 HA TYR A 95 -0.734 6.011 -7.041 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -0.188 5.303 -4.693 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -1.066 3.810 -4.964 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -0.244 2.263 -6.858 1.00 0.00 H new ATOM 0 HD2 TYR A 95 2.090 5.492 -5.346 1.00 0.00 H new ATOM 0 HE1 TYR A 95 1.780 1.242 -7.803 1.00 0.00 H new ATOM 0 HE2 TYR A 95 4.116 4.469 -6.287 1.00 0.00 H new ATOM 0 HH TYR A 95 4.976 2.787 -7.428 1.00 0.00 H new ATOM 1565 N VAL A 96 -2.673 3.315 -7.059 1.00 0.00 N ATOM 1566 CA VAL A 96 -3.227 2.291 -7.941 1.00 0.00 C ATOM 1567 C VAL A 96 -4.054 2.923 -9.055 1.00 0.00 C ATOM 1568 O VAL A 96 -3.989 2.497 -10.208 1.00 0.00 O ATOM 1569 CB VAL A 96 -4.096 1.271 -7.175 1.00 0.00 C ATOM 1570 CG1 VAL A 96 -3.255 0.489 -6.174 1.00 0.00 C ATOM 1571 CG2 VAL A 96 -5.260 1.962 -6.477 1.00 0.00 C ATOM 0 H VAL A 96 -2.958 3.233 -6.083 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.379 1.760 -8.373 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.506 0.568 -7.899 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.888 -0.224 -5.646 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.466 -0.047 -6.702 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.808 1.178 -5.457 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.857 1.221 -5.945 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -4.876 2.696 -5.768 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -5.882 2.464 -7.218 1.00 0.00 H new ATOM 1581 N ASN A 97 -4.825 3.949 -8.708 1.00 0.00 N ATOM 1582 CA ASN A 97 -5.651 4.641 -9.687 1.00 0.00 C ATOM 1583 C ASN A 97 -5.121 6.048 -9.949 1.00 0.00 C ATOM 1584 O ASN A 97 -5.868 7.024 -9.894 1.00 0.00 O ATOM 1585 CB ASN A 97 -7.112 4.696 -9.227 1.00 0.00 C ATOM 1586 CG ASN A 97 -7.710 3.315 -9.059 1.00 0.00 C ATOM 1587 OD1 ASN A 97 -7.443 2.411 -9.850 1.00 0.00 O ATOM 1588 ND2 ASN A 97 -8.524 3.143 -8.025 1.00 0.00 N ATOM 0 H ASN A 97 -4.894 4.317 -7.759 1.00 0.00 H new ATOM 0 HA ASN A 97 -5.606 4.079 -10.620 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -7.174 5.234 -8.281 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -7.699 5.259 -9.953 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -8.956 2.233 -7.862 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -8.718 3.920 -7.394 1.00 0.00 H new ATOM 1595 N LYS A 98 -3.826 6.143 -10.240 1.00 0.00 N ATOM 1596 CA LYS A 98 -3.192 7.428 -10.518 1.00 0.00 C ATOM 1597 C LYS A 98 -3.464 7.875 -11.950 1.00 0.00 C ATOM 1598 O LYS A 98 -3.185 9.017 -12.317 1.00 0.00 O ATOM 1599 CB LYS A 98 -1.682 7.339 -10.265 1.00 0.00 C ATOM 1600 CG LYS A 98 -0.918 6.547 -11.318 1.00 0.00 C ATOM 1601 CD LYS A 98 0.286 7.321 -11.836 1.00 0.00 C ATOM 1602 CE LYS A 98 1.520 6.437 -11.932 1.00 0.00 C ATOM 1603 NZ LYS A 98 2.574 7.043 -12.793 1.00 0.00 N ATOM 0 H LYS A 98 -3.195 5.344 -10.289 1.00 0.00 H new ATOM 0 HA LYS A 98 -3.620 8.171 -9.845 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -1.273 8.348 -10.218 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -1.515 6.881 -9.290 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -0.587 5.600 -10.893 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -1.583 6.308 -12.148 1.00 0.00 H new ATOM 0 HD2 LYS A 98 0.058 7.736 -12.818 1.00 0.00 H new ATOM 0 HD3 LYS A 98 0.491 8.162 -11.174 1.00 0.00 H new ATOM 0 HE2 LYS A 98 1.922 6.265 -10.933 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.239 5.464 -12.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 3.397 6.409 -12.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 2.200 7.184 -13.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.862 7.960 -12.396 1.00 0.00 H new ATOM 1617 N PHE A 99 -4.019 6.971 -12.763 1.00 0.00 N ATOM 1618 CA PHE A 99 -4.334 7.282 -14.147 1.00 0.00 C ATOM 1619 C PHE A 99 -5.614 8.109 -14.255 1.00 0.00 C ATOM 1620 O PHE A 99 -5.635 9.149 -14.910 1.00 0.00 O ATOM 1621 CB PHE A 99 -4.466 6.001 -14.980 1.00 0.00 C ATOM 1622 CG PHE A 99 -5.310 4.929 -14.345 1.00 0.00 C ATOM 1623 CD1 PHE A 99 -4.759 4.036 -13.440 1.00 0.00 C ATOM 1624 CD2 PHE A 99 -6.654 4.808 -14.665 1.00 0.00 C ATOM 1625 CE1 PHE A 99 -5.530 3.045 -12.864 1.00 0.00 C ATOM 1626 CE2 PHE A 99 -7.431 3.819 -14.091 1.00 0.00 C ATOM 1627 CZ PHE A 99 -6.869 2.937 -13.189 1.00 0.00 C ATOM 0 H PHE A 99 -4.257 6.020 -12.480 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.509 7.875 -14.542 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.893 6.256 -15.950 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -3.470 5.599 -15.166 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.713 4.116 -13.182 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -7.099 5.494 -15.371 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.087 2.355 -12.161 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -8.477 3.736 -14.348 1.00 0.00 H new ATOM 0 HZ PHE A 99 -7.475 2.164 -12.739 1.00 0.00 H new ATOM 1637 N VAL A 100 -6.683 7.634 -13.620 1.00 0.00 N ATOM 1638 CA VAL A 100 -7.965 8.330 -13.668 1.00 0.00 C ATOM 1639 C VAL A 100 -8.102 9.376 -12.562 1.00 0.00 C ATOM 1640 O VAL A 100 -9.081 10.121 -12.529 1.00 0.00 O ATOM 1641 CB VAL A 100 -9.146 7.342 -13.585 1.00 0.00 C ATOM 1642 CG1 VAL A 100 -9.123 6.579 -12.269 1.00 0.00 C ATOM 1643 CG2 VAL A 100 -10.467 8.074 -13.765 1.00 0.00 C ATOM 0 H VAL A 100 -6.687 6.775 -13.070 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.992 8.844 -14.629 1.00 0.00 H new ATOM 0 HB VAL A 100 -9.044 6.618 -14.393 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -9.966 5.888 -12.234 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.191 6.019 -12.189 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -9.196 7.282 -11.439 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -11.289 7.361 -13.704 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -10.577 8.824 -12.981 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -10.482 8.563 -14.739 1.00 0.00 H new ATOM 1653 N ILE A 101 -7.122 9.445 -11.665 1.00 0.00 N ATOM 1654 CA ILE A 101 -7.162 10.424 -10.585 1.00 0.00 C ATOM 1655 C ILE A 101 -6.233 11.601 -10.890 1.00 0.00 C ATOM 1656 O ILE A 101 -6.631 12.761 -10.775 1.00 0.00 O ATOM 1657 CB ILE A 101 -6.790 9.798 -9.222 1.00 0.00 C ATOM 1658 CG1 ILE A 101 -7.219 10.712 -8.071 1.00 0.00 C ATOM 1659 CG2 ILE A 101 -5.299 9.528 -9.152 1.00 0.00 C ATOM 1660 CD1 ILE A 101 -8.720 10.849 -7.932 1.00 0.00 C ATOM 0 H ILE A 101 -6.300 8.842 -11.664 1.00 0.00 H new ATOM 0 HA ILE A 101 -8.188 10.784 -10.517 1.00 0.00 H new ATOM 0 HB ILE A 101 -7.321 8.851 -9.125 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -6.810 10.324 -7.138 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -6.785 11.700 -8.222 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -5.054 9.087 -8.186 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -5.016 8.838 -9.947 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -4.754 10.464 -9.273 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -8.949 11.511 -7.097 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -9.134 11.267 -8.850 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -9.159 9.868 -7.749 1.00 0.00 H new ATOM 1672 N CYS A 102 -4.986 11.299 -11.265 1.00 0.00 N ATOM 1673 CA CYS A 102 -4.003 12.338 -11.575 1.00 0.00 C ATOM 1674 C CYS A 102 -4.134 12.829 -13.017 1.00 0.00 C ATOM 1675 O CYS A 102 -3.128 13.070 -13.688 1.00 0.00 O ATOM 1676 CB CYS A 102 -2.580 11.828 -11.346 1.00 0.00 C ATOM 1677 SG CYS A 102 -1.329 13.140 -11.321 1.00 0.00 S ATOM 0 H CYS A 102 -4.636 10.346 -11.361 1.00 0.00 H new ATOM 0 HA CYS A 102 -4.203 13.173 -10.903 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -2.545 11.287 -10.400 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -2.329 11.114 -12.130 1.00 0.00 H new ATOM 1682 N HIS A 103 -5.366 12.976 -13.494 1.00 0.00 N ATOM 1683 CA HIS A 103 -5.608 13.438 -14.860 1.00 0.00 C ATOM 1684 C HIS A 103 -4.724 12.691 -15.857 1.00 0.00 C ATOM 1685 O HIS A 103 -4.113 13.295 -16.737 1.00 0.00 O ATOM 1686 CB HIS A 103 -5.357 14.941 -14.959 1.00 0.00 C ATOM 1687 CG HIS A 103 -5.953 15.715 -13.826 1.00 0.00 C ATOM 1688 ND1 HIS A 103 -7.307 15.760 -13.571 1.00 0.00 N ATOM 1689 CD2 HIS A 103 -5.370 16.471 -12.869 1.00 0.00 C ATOM 1690 CE1 HIS A 103 -7.531 16.510 -12.508 1.00 0.00 C ATOM 1691 NE2 HIS A 103 -6.370 16.953 -12.063 1.00 0.00 N ATOM 0 H HIS A 103 -6.212 12.783 -12.958 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.649 13.233 -15.108 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -4.283 15.122 -14.988 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -5.768 15.310 -15.899 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -4.312 16.661 -12.759 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -8.498 16.724 -12.077 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -6.238 17.556 -11.251 1.00 0.00 H new ATOM 1699 N GLU A 104 -4.660 11.371 -15.700 1.00 0.00 N ATOM 1700 CA GLU A 104 -3.851 10.522 -16.571 1.00 0.00 C ATOM 1701 C GLU A 104 -2.453 11.100 -16.776 1.00 0.00 C ATOM 1702 O GLU A 104 -2.089 11.508 -17.878 1.00 0.00 O ATOM 1703 CB GLU A 104 -4.549 10.306 -17.919 1.00 0.00 C ATOM 1704 CG GLU A 104 -4.723 11.570 -18.752 1.00 0.00 C ATOM 1705 CD GLU A 104 -5.296 11.284 -20.129 1.00 0.00 C ATOM 1706 OE1 GLU A 104 -5.562 10.101 -20.429 1.00 0.00 O ATOM 1707 OE2 GLU A 104 -5.476 12.244 -20.908 1.00 0.00 O ATOM 0 H GLU A 104 -5.163 10.863 -14.972 1.00 0.00 H new ATOM 0 HA GLU A 104 -3.741 9.556 -16.079 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.977 9.581 -18.498 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -5.530 9.867 -17.739 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -5.380 12.261 -18.225 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -3.759 12.066 -18.859 1.00 0.00 H new ATOM 1714 N CYS A 105 -1.665 11.117 -15.707 1.00 0.00 N ATOM 1715 CA CYS A 105 -0.300 11.632 -15.768 1.00 0.00 C ATOM 1716 C CYS A 105 0.612 10.660 -16.515 1.00 0.00 C ATOM 1717 O CYS A 105 1.723 10.369 -16.071 1.00 0.00 O ATOM 1718 CB CYS A 105 0.231 11.869 -14.352 1.00 0.00 C ATOM 1719 SG CYS A 105 1.204 13.381 -14.165 1.00 0.00 S ATOM 0 H CYS A 105 -1.947 10.780 -14.787 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.310 12.578 -16.310 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.612 11.906 -13.662 1.00 0.00 H new ATOM 0 HB3 CYS A 105 0.845 11.017 -14.060 1.00 0.00 H new ATOM 1724 N ASN A 106 0.142 10.166 -17.657 1.00 0.00 N ATOM 1725 CA ASN A 106 0.916 9.239 -18.472 1.00 0.00 C ATOM 1726 C ASN A 106 2.048 9.959 -19.202 1.00 0.00 C ATOM 1727 O ASN A 106 3.220 9.824 -18.851 1.00 0.00 O ATOM 1728 CB ASN A 106 0.002 8.531 -19.474 1.00 0.00 C ATOM 1729 CG ASN A 106 0.692 7.378 -20.171 1.00 0.00 C ATOM 1730 OD1 ASN A 106 1.127 6.423 -19.529 1.00 0.00 O ATOM 1731 ND2 ASN A 106 0.795 7.462 -21.491 1.00 0.00 N ATOM 0 H ASN A 106 -0.776 10.395 -18.039 1.00 0.00 H new ATOM 0 HA ASN A 106 1.362 8.496 -17.811 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -0.883 8.161 -18.956 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -0.341 9.249 -20.219 1.00 0.00 H new ATOM 0 HD21 ASN A 106 1.250 6.715 -22.016 1.00 0.00 H new ATOM 0 HD22 ASN A 106 0.419 8.274 -21.981 1.00 0.00 H new ATOM 1738 N ARG A 107 1.679 10.722 -20.229 1.00 0.00 N ATOM 1739 CA ARG A 107 2.644 11.470 -21.028 1.00 0.00 C ATOM 1740 C ARG A 107 3.147 12.701 -20.275 1.00 0.00 C ATOM 1741 O ARG A 107 2.352 13.462 -19.723 1.00 0.00 O ATOM 1742 CB ARG A 107 2.002 11.900 -22.351 1.00 0.00 C ATOM 1743 CG ARG A 107 2.501 11.120 -23.556 1.00 0.00 C ATOM 1744 CD ARG A 107 1.595 11.316 -24.762 1.00 0.00 C ATOM 1745 NE ARG A 107 2.282 11.997 -25.856 1.00 0.00 N ATOM 1746 CZ ARG A 107 1.810 12.065 -27.099 1.00 0.00 C ATOM 1747 NH1 ARG A 107 0.653 11.492 -27.409 1.00 0.00 N ATOM 1748 NH2 ARG A 107 2.496 12.707 -28.034 1.00 0.00 N ATOM 0 H ARG A 107 0.711 10.838 -20.528 1.00 0.00 H new ATOM 0 HA ARG A 107 3.496 10.820 -21.228 1.00 0.00 H new ATOM 0 HB2 ARG A 107 0.921 11.781 -22.275 1.00 0.00 H new ATOM 0 HB3 ARG A 107 2.196 12.961 -22.511 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.513 11.440 -23.804 1.00 0.00 H new ATOM 0 HG3 ARG A 107 2.554 10.060 -23.308 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.236 10.347 -25.107 1.00 0.00 H new ATOM 0 HD3 ARG A 107 0.719 11.894 -24.468 1.00 0.00 H new ATOM 0 HE ARG A 107 3.175 12.447 -25.656 1.00 0.00 H new ATOM 0 HH11 ARG A 107 0.121 10.997 -26.693 1.00 0.00 H new ATOM 0 HH12 ARG A 107 0.296 11.547 -28.363 1.00 0.00 H new ATOM 0 HH21 ARG A 107 3.385 13.149 -27.801 1.00 0.00 H new ATOM 0 HH22 ARG A 107 2.135 12.759 -28.986 1.00 0.00 H new ATOM 1762 N PRO A 108 4.477 12.914 -20.242 1.00 0.00 N ATOM 1763 CA PRO A 108 5.078 14.062 -19.553 1.00 0.00 C ATOM 1764 C PRO A 108 4.533 15.400 -20.055 1.00 0.00 C ATOM 1765 O PRO A 108 5.198 16.111 -20.808 1.00 0.00 O ATOM 1766 CB PRO A 108 6.571 13.937 -19.870 1.00 0.00 C ATOM 1767 CG PRO A 108 6.773 12.501 -20.209 1.00 0.00 C ATOM 1768 CD PRO A 108 5.499 12.053 -20.868 1.00 0.00 C ATOM 0 HA PRO A 108 4.856 14.050 -18.486 1.00 0.00 H new ATOM 0 HB2 PRO A 108 6.853 14.583 -20.702 1.00 0.00 H new ATOM 0 HB3 PRO A 108 7.182 14.231 -19.016 1.00 0.00 H new ATOM 0 HG2 PRO A 108 7.625 12.373 -20.877 1.00 0.00 H new ATOM 0 HG3 PRO A 108 6.978 11.913 -19.314 1.00 0.00 H new ATOM 0 HD2 PRO A 108 5.534 12.190 -21.949 1.00 0.00 H new ATOM 0 HD3 PRO A 108 5.302 10.996 -20.687 1.00 0.00 H new ATOM 1776 N ASP A 109 3.325 15.735 -19.619 1.00 0.00 N ATOM 1777 CA ASP A 109 2.680 16.988 -20.002 1.00 0.00 C ATOM 1778 C ASP A 109 2.886 18.048 -18.924 1.00 0.00 C ATOM 1779 O ASP A 109 2.562 19.220 -19.118 1.00 0.00 O ATOM 1780 CB ASP A 109 1.179 16.767 -20.216 1.00 0.00 C ATOM 1781 CG ASP A 109 0.780 16.819 -21.678 1.00 0.00 C ATOM 1782 OD1 ASP A 109 0.517 17.930 -22.182 1.00 0.00 O ATOM 1783 OD2 ASP A 109 0.725 15.746 -22.315 1.00 0.00 O ATOM 0 H ASP A 109 2.767 15.152 -18.995 1.00 0.00 H new ATOM 0 HA ASP A 109 3.132 17.333 -20.932 1.00 0.00 H new ATOM 0 HB2 ASP A 109 0.896 15.800 -19.801 1.00 0.00 H new ATOM 0 HB3 ASP A 109 0.623 17.525 -19.665 1.00 0.00 H new ATOM 1788 N THR A 110 3.409 17.624 -17.777 1.00 0.00 N ATOM 1789 CA THR A 110 3.636 18.526 -16.660 1.00 0.00 C ATOM 1790 C THR A 110 5.002 18.276 -16.024 1.00 0.00 C ATOM 1791 O THR A 110 5.715 17.350 -16.411 1.00 0.00 O ATOM 1792 CB THR A 110 2.520 18.348 -15.631 1.00 0.00 C ATOM 1793 OG1 THR A 110 2.526 17.029 -15.107 1.00 0.00 O ATOM 1794 CG2 THR A 110 1.142 18.611 -16.206 1.00 0.00 C ATOM 0 H THR A 110 3.683 16.658 -17.600 1.00 0.00 H new ATOM 0 HA THR A 110 3.627 19.553 -17.026 1.00 0.00 H new ATOM 0 HB THR A 110 2.720 19.080 -14.849 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.859 16.958 -14.393 1.00 0.00 H new ATOM 0 HG21 THR A 110 0.391 18.469 -15.429 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.092 19.635 -16.577 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.952 17.918 -17.026 1.00 0.00 H new ATOM 1802 N ARG A 111 5.365 19.106 -15.051 1.00 0.00 N ATOM 1803 CA ARG A 111 6.650 18.966 -14.374 1.00 0.00 C ATOM 1804 C ARG A 111 6.525 18.042 -13.171 1.00 0.00 C ATOM 1805 O ARG A 111 6.082 18.454 -12.100 1.00 0.00 O ATOM 1806 CB ARG A 111 7.178 20.333 -13.930 1.00 0.00 C ATOM 1807 CG ARG A 111 8.469 20.740 -14.627 1.00 0.00 C ATOM 1808 CD ARG A 111 8.997 22.065 -14.100 1.00 0.00 C ATOM 1809 NE ARG A 111 10.214 21.893 -13.311 1.00 0.00 N ATOM 1810 CZ ARG A 111 11.363 21.446 -13.813 1.00 0.00 C ATOM 1811 NH1 ARG A 111 11.455 21.128 -15.098 1.00 0.00 N ATOM 1812 NH2 ARG A 111 12.425 21.317 -13.028 1.00 0.00 N ATOM 0 H ARG A 111 4.791 19.879 -14.715 1.00 0.00 H new ATOM 0 HA ARG A 111 7.357 18.529 -15.079 1.00 0.00 H new ATOM 0 HB2 ARG A 111 6.416 21.088 -14.123 1.00 0.00 H new ATOM 0 HB3 ARG A 111 7.345 20.317 -12.853 1.00 0.00 H new ATOM 0 HG2 ARG A 111 9.221 19.965 -14.482 1.00 0.00 H new ATOM 0 HG3 ARG A 111 8.295 20.818 -15.700 1.00 0.00 H new ATOM 0 HD2 ARG A 111 9.199 22.734 -14.937 1.00 0.00 H new ATOM 0 HD3 ARG A 111 8.232 22.543 -13.488 1.00 0.00 H new ATOM 0 HE ARG A 111 10.182 22.129 -12.319 1.00 0.00 H new ATOM 0 HH11 ARG A 111 10.643 21.226 -15.707 1.00 0.00 H new ATOM 0 HH12 ARG A 111 12.338 20.786 -15.477 1.00 0.00 H new ATOM 0 HH21 ARG A 111 12.361 21.560 -12.040 1.00 0.00 H new ATOM 0 HH22 ARG A 111 13.305 20.974 -13.413 1.00 0.00 H new ATOM 1826 N ILE A 112 6.918 16.791 -13.366 1.00 0.00 N ATOM 1827 CA ILE A 112 6.850 15.796 -12.308 1.00 0.00 C ATOM 1828 C ILE A 112 8.201 15.626 -11.626 1.00 0.00 C ATOM 1829 O ILE A 112 9.250 15.705 -12.265 1.00 0.00 O ATOM 1830 CB ILE A 112 6.380 14.432 -12.849 1.00 0.00 C ATOM 1831 CG1 ILE A 112 5.196 14.616 -13.802 1.00 0.00 C ATOM 1832 CG2 ILE A 112 6.005 13.508 -11.699 1.00 0.00 C ATOM 1833 CD1 ILE A 112 4.082 15.462 -13.224 1.00 0.00 C ATOM 0 H ILE A 112 7.288 16.442 -14.250 1.00 0.00 H new ATOM 0 HA ILE A 112 6.124 16.157 -11.580 1.00 0.00 H new ATOM 0 HB ILE A 112 7.199 13.975 -13.404 1.00 0.00 H new ATOM 0 HG12 ILE A 112 5.550 15.077 -14.724 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.798 13.637 -14.067 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.675 12.548 -12.096 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.872 13.356 -11.057 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.199 13.957 -11.119 1.00 0.00 H new ATOM 0 HD11 ILE A 112 3.277 15.550 -13.953 1.00 0.00 H new ATOM 0 HD12 ILE A 112 3.701 14.992 -12.317 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.465 16.454 -12.985 1.00 0.00 H new ATOM 1845 N ILE A 113 8.161 15.391 -10.323 1.00 0.00 N ATOM 1846 CA ILE A 113 9.372 15.206 -9.542 1.00 0.00 C ATOM 1847 C ILE A 113 9.181 14.086 -8.529 1.00 0.00 C ATOM 1848 O ILE A 113 8.122 13.969 -7.922 1.00 0.00 O ATOM 1849 CB ILE A 113 9.762 16.501 -8.802 1.00 0.00 C ATOM 1850 CG1 ILE A 113 11.067 16.302 -8.029 1.00 0.00 C ATOM 1851 CG2 ILE A 113 8.642 16.933 -7.865 1.00 0.00 C ATOM 1852 CD1 ILE A 113 11.903 17.560 -7.924 1.00 0.00 C ATOM 0 H ILE A 113 7.298 15.324 -9.783 1.00 0.00 H new ATOM 0 HA ILE A 113 10.174 14.943 -10.232 1.00 0.00 H new ATOM 0 HB ILE A 113 9.918 17.290 -9.538 1.00 0.00 H new ATOM 0 HG12 ILE A 113 10.835 15.944 -7.026 1.00 0.00 H new ATOM 0 HG13 ILE A 113 11.654 15.524 -8.517 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.932 17.849 -7.349 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.734 17.113 -8.441 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.457 16.147 -7.133 1.00 0.00 H new ATOM 0 HD11 ILE A 113 12.813 17.346 -7.364 1.00 0.00 H new ATOM 0 HD12 ILE A 113 12.165 17.907 -8.923 1.00 0.00 H new ATOM 0 HD13 ILE A 113 11.333 18.334 -7.409 1.00 0.00 H new ATOM 1864 N ARG A 114 10.207 13.259 -8.360 1.00 0.00 N ATOM 1865 CA ARG A 114 10.139 12.144 -7.422 1.00 0.00 C ATOM 1866 C ARG A 114 11.360 12.126 -6.510 1.00 0.00 C ATOM 1867 O ARG A 114 12.483 11.911 -6.967 1.00 0.00 O ATOM 1868 CB ARG A 114 10.040 10.825 -8.187 1.00 0.00 C ATOM 1869 CG ARG A 114 9.272 9.737 -7.458 1.00 0.00 C ATOM 1870 CD ARG A 114 9.462 8.389 -8.138 1.00 0.00 C ATOM 1871 NE ARG A 114 8.188 7.736 -8.439 1.00 0.00 N ATOM 1872 CZ ARG A 114 7.797 7.386 -9.664 1.00 0.00 C ATOM 1873 NH1 ARG A 114 8.559 7.644 -10.721 1.00 0.00 N ATOM 1874 NH2 ARG A 114 6.632 6.777 -9.835 1.00 0.00 N ATOM 0 H ARG A 114 11.093 13.339 -8.859 1.00 0.00 H new ATOM 0 HA ARG A 114 9.251 12.270 -6.803 1.00 0.00 H new ATOM 0 HB2 ARG A 114 9.560 11.011 -9.148 1.00 0.00 H new ATOM 0 HB3 ARG A 114 11.047 10.464 -8.398 1.00 0.00 H new ATOM 0 HG2 ARG A 114 9.611 9.678 -6.424 1.00 0.00 H new ATOM 0 HG3 ARG A 114 8.212 9.990 -7.432 1.00 0.00 H new ATOM 0 HD2 ARG A 114 10.025 8.526 -9.061 1.00 0.00 H new ATOM 0 HD3 ARG A 114 10.057 7.741 -7.495 1.00 0.00 H new ATOM 0 HE ARG A 114 7.559 7.536 -7.662 1.00 0.00 H new ATOM 0 HH11 ARG A 114 9.455 8.115 -10.601 1.00 0.00 H new ATOM 0 HH12 ARG A 114 8.248 7.371 -11.653 1.00 0.00 H new ATOM 0 HH21 ARG A 114 6.038 6.578 -9.030 1.00 0.00 H new ATOM 0 HH22 ARG A 114 6.330 6.508 -10.771 1.00 0.00 H new ATOM 1888 N GLU A 115 11.138 12.364 -5.222 1.00 0.00 N ATOM 1889 CA GLU A 115 12.227 12.385 -4.251 1.00 0.00 C ATOM 1890 C GLU A 115 11.925 11.461 -3.075 1.00 0.00 C ATOM 1891 O GLU A 115 10.773 11.318 -2.664 1.00 0.00 O ATOM 1892 CB GLU A 115 12.462 13.810 -3.737 1.00 0.00 C ATOM 1893 CG GLU A 115 12.158 14.901 -4.757 1.00 0.00 C ATOM 1894 CD GLU A 115 13.410 15.589 -5.264 1.00 0.00 C ATOM 1895 OE1 GLU A 115 14.055 15.044 -6.185 1.00 0.00 O ATOM 1896 OE2 GLU A 115 13.745 16.672 -4.741 1.00 0.00 O ATOM 0 H GLU A 115 10.216 12.545 -4.826 1.00 0.00 H new ATOM 0 HA GLU A 115 13.128 12.032 -4.753 1.00 0.00 H new ATOM 0 HB2 GLU A 115 11.844 13.972 -2.854 1.00 0.00 H new ATOM 0 HB3 GLU A 115 13.501 13.903 -3.421 1.00 0.00 H new ATOM 0 HG2 GLU A 115 11.620 14.466 -5.599 1.00 0.00 H new ATOM 0 HG3 GLU A 115 11.498 15.642 -4.306 1.00 0.00 H new ATOM 1903 N GLY A 116 12.967 10.844 -2.532 1.00 0.00 N ATOM 1904 CA GLY A 116 12.793 9.951 -1.403 1.00 0.00 C ATOM 1905 C GLY A 116 12.742 8.494 -1.813 1.00 0.00 C ATOM 1906 O GLY A 116 12.029 7.698 -1.203 1.00 0.00 O ATOM 0 H GLY A 116 13.930 10.946 -2.853 1.00 0.00 H new ATOM 0 HA2 GLY A 116 13.612 10.098 -0.699 1.00 0.00 H new ATOM 0 HA3 GLY A 116 11.873 10.209 -0.879 1.00 0.00 H new ATOM 1910 N ARG A 117 13.495 8.140 -2.851 1.00 0.00 N ATOM 1911 CA ARG A 117 13.522 6.766 -3.333 1.00 0.00 C ATOM 1912 C ARG A 117 12.119 6.316 -3.728 1.00 0.00 C ATOM 1913 O ARG A 117 11.577 5.367 -3.161 1.00 0.00 O ATOM 1914 CB ARG A 117 14.089 5.842 -2.252 1.00 0.00 C ATOM 1915 CG ARG A 117 15.601 5.709 -2.300 1.00 0.00 C ATOM 1916 CD ARG A 117 16.045 4.271 -2.085 1.00 0.00 C ATOM 1917 NE ARG A 117 17.477 4.177 -1.802 1.00 0.00 N ATOM 1918 CZ ARG A 117 18.264 3.195 -2.242 1.00 0.00 C ATOM 1919 NH1 ARG A 117 17.764 2.203 -2.967 1.00 0.00 N ATOM 1920 NH2 ARG A 117 19.557 3.204 -1.949 1.00 0.00 N ATOM 0 H ARG A 117 14.091 8.784 -3.371 1.00 0.00 H new ATOM 0 HA ARG A 117 14.164 6.715 -4.212 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.796 6.220 -1.272 1.00 0.00 H new ATOM 0 HB3 ARG A 117 13.642 4.854 -2.359 1.00 0.00 H new ATOM 0 HG2 ARG A 117 15.967 6.063 -3.264 1.00 0.00 H new ATOM 0 HG3 ARG A 117 16.047 6.346 -1.536 1.00 0.00 H new ATOM 0 HD2 ARG A 117 15.483 3.838 -1.258 1.00 0.00 H new ATOM 0 HD3 ARG A 117 15.811 3.683 -2.972 1.00 0.00 H new ATOM 0 HE ARG A 117 17.900 4.909 -1.232 1.00 0.00 H new ATOM 0 HH11 ARG A 117 16.769 2.187 -3.192 1.00 0.00 H new ATOM 0 HH12 ARG A 117 18.374 1.456 -3.299 1.00 0.00 H new ATOM 0 HH21 ARG A 117 19.948 3.961 -1.388 1.00 0.00 H new ATOM 0 HH22 ARG A 117 20.161 2.454 -2.284 1.00 0.00 H new ATOM 1934 N ILE A 118 11.531 7.013 -4.694 1.00 0.00 N ATOM 1935 CA ILE A 118 10.185 6.690 -5.151 1.00 0.00 C ATOM 1936 C ILE A 118 9.221 6.654 -3.972 1.00 0.00 C ATOM 1937 O ILE A 118 8.660 5.610 -3.636 1.00 0.00 O ATOM 1938 CB ILE A 118 10.149 5.342 -5.897 1.00 0.00 C ATOM 1939 CG1 ILE A 118 11.197 5.329 -7.013 1.00 0.00 C ATOM 1940 CG2 ILE A 118 8.759 5.079 -6.461 1.00 0.00 C ATOM 1941 CD1 ILE A 118 11.435 3.959 -7.611 1.00 0.00 C ATOM 0 H ILE A 118 11.963 7.802 -5.174 1.00 0.00 H new ATOM 0 HA ILE A 118 9.877 7.470 -5.847 1.00 0.00 H new ATOM 0 HB ILE A 118 10.384 4.546 -5.191 1.00 0.00 H new ATOM 0 HG12 ILE A 118 10.881 6.010 -7.803 1.00 0.00 H new ATOM 0 HG13 ILE A 118 12.138 5.712 -6.619 1.00 0.00 H new ATOM 0 HG21 ILE A 118 8.754 4.123 -6.984 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.035 5.051 -5.647 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.492 5.875 -7.157 1.00 0.00 H new ATOM 0 HD11 ILE A 118 12.190 4.030 -8.394 1.00 0.00 H new ATOM 0 HD12 ILE A 118 11.782 3.278 -6.834 1.00 0.00 H new ATOM 0 HD13 ILE A 118 10.505 3.581 -8.036 1.00 0.00 H new ATOM 1953 N SER A 119 9.046 7.811 -3.344 1.00 0.00 N ATOM 1954 CA SER A 119 8.162 7.933 -2.189 1.00 0.00 C ATOM 1955 C SER A 119 7.390 9.251 -2.218 1.00 0.00 C ATOM 1956 O SER A 119 6.284 9.347 -1.685 1.00 0.00 O ATOM 1957 CB SER A 119 8.970 7.831 -0.893 1.00 0.00 C ATOM 1958 OG SER A 119 8.248 8.353 0.211 1.00 0.00 O ATOM 0 H SER A 119 9.505 8.680 -3.615 1.00 0.00 H new ATOM 0 HA SER A 119 7.442 7.116 -2.231 1.00 0.00 H new ATOM 0 HB2 SER A 119 9.225 6.788 -0.703 1.00 0.00 H new ATOM 0 HB3 SER A 119 9.909 8.373 -1.005 1.00 0.00 H new ATOM 0 HG SER A 119 8.790 8.272 1.024 1.00 0.00 H new ATOM 1964 N LEU A 120 7.982 10.267 -2.837 1.00 0.00 N ATOM 1965 CA LEU A 120 7.360 11.582 -2.933 1.00 0.00 C ATOM 1966 C LEU A 120 7.275 12.025 -4.396 1.00 0.00 C ATOM 1967 O LEU A 120 8.159 11.713 -5.191 1.00 0.00 O ATOM 1968 CB LEU A 120 8.167 12.594 -2.108 1.00 0.00 C ATOM 1969 CG LEU A 120 8.806 12.034 -0.827 1.00 0.00 C ATOM 1970 CD1 LEU A 120 10.012 12.867 -0.411 1.00 0.00 C ATOM 1971 CD2 LEU A 120 7.784 11.972 0.302 1.00 0.00 C ATOM 0 H LEU A 120 8.898 10.204 -3.282 1.00 0.00 H new ATOM 0 HA LEU A 120 6.347 11.529 -2.535 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.956 13.006 -2.738 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.512 13.422 -1.836 1.00 0.00 H new ATOM 0 HG LEU A 120 9.149 11.021 -1.037 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.446 12.450 0.498 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.756 12.854 -1.208 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.698 13.894 -0.225 1.00 0.00 H new ATOM 0 HD21 LEU A 120 8.257 11.573 1.199 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.406 12.974 0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.957 11.325 0.009 1.00 0.00 H new ATOM 1983 N LEU A 121 6.215 12.757 -4.746 1.00 0.00 N ATOM 1984 CA LEU A 121 6.030 13.248 -6.119 1.00 0.00 C ATOM 1985 C LEU A 121 5.156 14.504 -6.134 1.00 0.00 C ATOM 1986 O LEU A 121 4.206 14.607 -5.362 1.00 0.00 O ATOM 1987 CB LEU A 121 5.392 12.180 -7.024 1.00 0.00 C ATOM 1988 CG LEU A 121 5.509 10.730 -6.548 1.00 0.00 C ATOM 1989 CD1 LEU A 121 4.382 10.396 -5.584 1.00 0.00 C ATOM 1990 CD2 LEU A 121 5.500 9.778 -7.740 1.00 0.00 C ATOM 0 H LEU A 121 5.471 13.024 -4.101 1.00 0.00 H new ATOM 0 HA LEU A 121 7.021 13.487 -6.506 1.00 0.00 H new ATOM 0 HB2 LEU A 121 4.335 12.418 -7.141 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.846 12.253 -8.012 1.00 0.00 H new ATOM 0 HG LEU A 121 6.456 10.611 -6.021 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.479 9.361 -5.255 1.00 0.00 H new ATOM 0 HD12 LEU A 121 4.434 11.058 -4.720 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.423 10.528 -6.085 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.584 8.751 -7.386 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.568 9.896 -8.293 1.00 0.00 H new ATOM 0 HD23 LEU A 121 6.342 10.006 -8.394 1.00 0.00 H new ATOM 2002 N LYS A 122 5.484 15.458 -7.011 1.00 0.00 N ATOM 2003 CA LYS A 122 4.718 16.704 -7.108 1.00 0.00 C ATOM 2004 C LYS A 122 4.108 16.887 -8.498 1.00 0.00 C ATOM 2005 O LYS A 122 4.702 16.504 -9.507 1.00 0.00 O ATOM 2006 CB LYS A 122 5.594 17.911 -6.764 1.00 0.00 C ATOM 2007 CG LYS A 122 4.933 18.867 -5.780 1.00 0.00 C ATOM 2008 CD LYS A 122 4.972 20.305 -6.275 1.00 0.00 C ATOM 2009 CE LYS A 122 4.516 21.283 -5.200 1.00 0.00 C ATOM 2010 NZ LYS A 122 5.489 22.396 -5.013 1.00 0.00 N ATOM 0 H LYS A 122 6.269 15.392 -7.659 1.00 0.00 H new ATOM 0 HA LYS A 122 3.905 16.636 -6.386 1.00 0.00 H new ATOM 0 HB2 LYS A 122 6.537 17.560 -6.344 1.00 0.00 H new ATOM 0 HB3 LYS A 122 5.835 18.451 -7.680 1.00 0.00 H new ATOM 0 HG2 LYS A 122 3.898 18.566 -5.620 1.00 0.00 H new ATOM 0 HG3 LYS A 122 5.436 18.801 -4.815 1.00 0.00 H new ATOM 0 HD2 LYS A 122 5.986 20.555 -6.588 1.00 0.00 H new ATOM 0 HD3 LYS A 122 4.334 20.405 -7.153 1.00 0.00 H new ATOM 0 HE2 LYS A 122 3.543 21.693 -5.471 1.00 0.00 H new ATOM 0 HE3 LYS A 122 4.386 20.752 -4.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 5.580 22.611 -4.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 6.416 22.114 -5.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 5.151 23.241 -5.517 1.00 0.00 H new ATOM 2024 N CYS A 123 2.918 17.483 -8.538 1.00 0.00 N ATOM 2025 CA CYS A 123 2.223 17.728 -9.798 1.00 0.00 C ATOM 2026 C CYS A 123 1.533 19.089 -9.777 1.00 0.00 C ATOM 2027 O CYS A 123 0.369 19.211 -10.161 1.00 0.00 O ATOM 2028 CB CYS A 123 1.192 16.627 -10.055 1.00 0.00 C ATOM 2029 SG CYS A 123 1.865 15.154 -10.870 1.00 0.00 S ATOM 0 H CYS A 123 2.415 17.805 -7.711 1.00 0.00 H new ATOM 0 HA CYS A 123 2.959 17.723 -10.602 1.00 0.00 H new ATOM 0 HB2 CYS A 123 0.748 16.332 -9.104 1.00 0.00 H new ATOM 0 HB3 CYS A 123 0.389 17.033 -10.669 1.00 0.00 H new ATOM 2034 N GLU A 124 2.253 20.112 -9.321 1.00 0.00 N ATOM 2035 CA GLU A 124 1.702 21.465 -9.246 1.00 0.00 C ATOM 2036 C GLU A 124 1.048 21.870 -10.567 1.00 0.00 C ATOM 2037 O GLU A 124 0.057 22.599 -10.575 1.00 0.00 O ATOM 2038 CB GLU A 124 2.792 22.474 -8.869 1.00 0.00 C ATOM 2039 CG GLU A 124 2.248 23.822 -8.419 1.00 0.00 C ATOM 2040 CD GLU A 124 2.180 23.955 -6.908 1.00 0.00 C ATOM 2041 OE1 GLU A 124 3.246 23.914 -6.257 1.00 0.00 O ATOM 2042 OE2 GLU A 124 1.059 24.104 -6.376 1.00 0.00 O ATOM 0 H GLU A 124 3.217 20.031 -8.998 1.00 0.00 H new ATOM 0 HA GLU A 124 0.937 21.467 -8.470 1.00 0.00 H new ATOM 0 HB2 GLU A 124 3.403 22.054 -8.070 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.448 22.625 -9.727 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.878 24.615 -8.821 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.251 23.964 -8.837 1.00 0.00 H new ATOM 2049 N ALA A 125 1.602 21.398 -11.683 1.00 0.00 N ATOM 2050 CA ALA A 125 1.055 21.722 -12.999 1.00 0.00 C ATOM 2051 C ALA A 125 -0.329 21.109 -13.190 1.00 0.00 C ATOM 2052 O ALA A 125 -1.328 21.826 -13.215 1.00 0.00 O ATOM 2053 CB ALA A 125 2.000 21.271 -14.102 1.00 0.00 C ATOM 0 H ALA A 125 2.424 20.794 -11.702 1.00 0.00 H new ATOM 0 HA ALA A 125 0.951 22.805 -13.058 1.00 0.00 H new ATOM 0 HB1 ALA A 125 1.573 21.522 -15.073 1.00 0.00 H new ATOM 0 HB2 ALA A 125 2.960 21.774 -13.987 1.00 0.00 H new ATOM 0 HB3 ALA A 125 2.146 20.193 -14.038 1.00 0.00 H new ATOM 2059 N CYS A 126 -0.398 19.784 -13.323 1.00 0.00 N ATOM 2060 CA CYS A 126 -1.684 19.110 -13.501 1.00 0.00 C ATOM 2061 C CYS A 126 -2.390 18.937 -12.157 1.00 0.00 C ATOM 2062 O CYS A 126 -2.861 17.852 -11.819 1.00 0.00 O ATOM 2063 CB CYS A 126 -1.504 17.754 -14.204 1.00 0.00 C ATOM 2064 SG CYS A 126 -0.812 16.440 -13.169 1.00 0.00 S ATOM 0 H CYS A 126 0.411 19.163 -13.311 1.00 0.00 H new ATOM 0 HA CYS A 126 -2.309 19.735 -14.138 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -2.473 17.426 -14.581 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.856 17.894 -15.069 1.00 0.00 H new ATOM 2069 N GLY A 127 -2.454 20.018 -11.390 1.00 0.00 N ATOM 2070 CA GLY A 127 -3.092 19.973 -10.089 1.00 0.00 C ATOM 2071 C GLY A 127 -2.099 20.167 -8.961 1.00 0.00 C ATOM 2072 O GLY A 127 -1.394 21.174 -8.916 1.00 0.00 O ATOM 0 H GLY A 127 -2.074 20.929 -11.647 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -3.858 20.747 -10.034 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.597 19.015 -9.966 1.00 0.00 H new ATOM 2076 N ALA A 128 -2.040 19.203 -8.049 1.00 0.00 N ATOM 2077 CA ALA A 128 -1.118 19.283 -6.925 1.00 0.00 C ATOM 2078 C ALA A 128 -0.736 17.900 -6.413 1.00 0.00 C ATOM 2079 O ALA A 128 -1.504 16.945 -6.534 1.00 0.00 O ATOM 2080 CB ALA A 128 -1.716 20.114 -5.802 1.00 0.00 C ATOM 0 H ALA A 128 -2.617 18.362 -8.066 1.00 0.00 H new ATOM 0 HA ALA A 128 -0.210 19.770 -7.280 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.012 20.162 -4.971 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -1.920 21.122 -6.164 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -2.645 19.655 -5.465 1.00 0.00 H new ATOM 2086 N LYS A 129 0.451 17.804 -5.831 1.00 0.00 N ATOM 2087 CA LYS A 129 0.941 16.545 -5.289 1.00 0.00 C ATOM 2088 C LYS A 129 1.926 16.806 -4.153 1.00 0.00 C ATOM 2089 O LYS A 129 2.556 17.859 -4.105 1.00 0.00 O ATOM 2090 CB LYS A 129 1.599 15.711 -6.388 1.00 0.00 C ATOM 2091 CG LYS A 129 1.152 14.258 -6.400 1.00 0.00 C ATOM 2092 CD LYS A 129 0.762 13.799 -7.798 1.00 0.00 C ATOM 2093 CE LYS A 129 -0.694 13.369 -7.862 1.00 0.00 C ATOM 2094 NZ LYS A 129 -0.829 11.935 -8.231 1.00 0.00 N ATOM 0 H LYS A 129 1.095 18.587 -5.722 1.00 0.00 H new ATOM 0 HA LYS A 129 0.095 15.984 -4.892 1.00 0.00 H new ATOM 0 HB2 LYS A 129 1.375 16.159 -7.356 1.00 0.00 H new ATOM 0 HB3 LYS A 129 2.681 15.748 -6.262 1.00 0.00 H new ATOM 0 HG2 LYS A 129 1.956 13.627 -6.021 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.304 14.133 -5.726 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.934 14.608 -8.508 1.00 0.00 H new ATOM 0 HD3 LYS A 129 1.400 12.969 -8.100 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.167 13.542 -6.895 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -1.223 13.983 -8.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -1.724 11.562 -7.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -0.824 11.841 -9.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -0.034 11.397 -7.830 1.00 0.00 H new ATOM 2108 N ALA A 130 2.045 15.852 -3.236 1.00 0.00 N ATOM 2109 CA ALA A 130 2.949 15.992 -2.099 1.00 0.00 C ATOM 2110 C ALA A 130 4.388 15.661 -2.493 1.00 0.00 C ATOM 2111 O ALA A 130 4.737 14.492 -2.654 1.00 0.00 O ATOM 2112 CB ALA A 130 2.501 15.089 -0.958 1.00 0.00 C ATOM 0 H ALA A 130 1.527 14.973 -3.257 1.00 0.00 H new ATOM 0 HA ALA A 130 2.917 17.030 -1.769 1.00 0.00 H new ATOM 0 HB1 ALA A 130 3.183 15.202 -0.115 1.00 0.00 H new ATOM 0 HB2 ALA A 130 1.493 15.366 -0.649 1.00 0.00 H new ATOM 0 HB3 ALA A 130 2.506 14.051 -1.292 1.00 0.00 H new ATOM 2118 N PRO A 131 5.249 16.685 -2.650 1.00 0.00 N ATOM 2119 CA PRO A 131 6.652 16.479 -3.018 1.00 0.00 C ATOM 2120 C PRO A 131 7.463 15.879 -1.878 1.00 0.00 C ATOM 2121 O PRO A 131 8.545 15.334 -2.093 1.00 0.00 O ATOM 2122 CB PRO A 131 7.154 17.889 -3.327 1.00 0.00 C ATOM 2123 CG PRO A 131 6.279 18.784 -2.519 1.00 0.00 C ATOM 2124 CD PRO A 131 4.932 18.116 -2.470 1.00 0.00 C ATOM 0 HA PRO A 131 6.753 15.782 -3.850 1.00 0.00 H new ATOM 0 HB2 PRO A 131 8.202 18.006 -3.052 1.00 0.00 H new ATOM 0 HB3 PRO A 131 7.076 18.113 -4.391 1.00 0.00 H new ATOM 0 HG2 PRO A 131 6.683 18.922 -1.516 1.00 0.00 H new ATOM 0 HG3 PRO A 131 6.208 19.773 -2.972 1.00 0.00 H new ATOM 0 HD2 PRO A 131 4.428 18.299 -1.521 1.00 0.00 H new ATOM 0 HD3 PRO A 131 4.273 18.483 -3.257 1.00 0.00 H new ATOM 2132 N LEU A 132 6.935 15.992 -0.664 1.00 0.00 N ATOM 2133 CA LEU A 132 7.615 15.468 0.513 1.00 0.00 C ATOM 2134 C LEU A 132 6.627 15.167 1.634 1.00 0.00 C ATOM 2135 O LEU A 132 6.707 14.120 2.277 1.00 0.00 O ATOM 2136 CB LEU A 132 8.669 16.466 0.996 1.00 0.00 C ATOM 2137 CG LEU A 132 9.504 16.003 2.192 1.00 0.00 C ATOM 2138 CD1 LEU A 132 10.981 16.274 1.949 1.00 0.00 C ATOM 2139 CD2 LEU A 132 9.040 16.691 3.467 1.00 0.00 C ATOM 0 H LEU A 132 6.040 16.441 -0.470 1.00 0.00 H new ATOM 0 HA LEU A 132 8.103 14.534 0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 132 9.342 16.689 0.168 1.00 0.00 H new ATOM 0 HB3 LEU A 132 8.170 17.398 1.261 1.00 0.00 H new ATOM 0 HG LEU A 132 9.365 14.928 2.311 1.00 0.00 H new ATOM 0 HD11 LEU A 132 11.559 15.938 2.810 1.00 0.00 H new ATOM 0 HD12 LEU A 132 11.308 15.735 1.060 1.00 0.00 H new ATOM 0 HD13 LEU A 132 11.136 17.343 1.803 1.00 0.00 H new ATOM 0 HD21 LEU A 132 9.646 16.349 4.306 1.00 0.00 H new ATOM 0 HD22 LEU A 132 9.148 17.770 3.358 1.00 0.00 H new ATOM 0 HD23 LEU A 132 7.994 16.448 3.652 1.00 0.00 H new ATOM 2151 N LYS A 133 5.699 16.089 1.868 1.00 0.00 N ATOM 2152 CA LYS A 133 4.703 15.914 2.918 1.00 0.00 C ATOM 2153 C LYS A 133 3.588 16.948 2.794 1.00 0.00 C ATOM 2154 O LYS A 133 2.456 16.616 2.445 1.00 0.00 O ATOM 2155 CB LYS A 133 5.362 16.020 4.295 1.00 0.00 C ATOM 2156 CG LYS A 133 4.486 15.517 5.432 1.00 0.00 C ATOM 2157 CD LYS A 133 4.915 14.136 5.904 1.00 0.00 C ATOM 2158 CE LYS A 133 3.938 13.570 6.922 1.00 0.00 C ATOM 2159 NZ LYS A 133 3.816 12.090 6.817 1.00 0.00 N ATOM 0 H LYS A 133 5.616 16.962 1.347 1.00 0.00 H new ATOM 0 HA LYS A 133 4.265 14.922 2.806 1.00 0.00 H new ATOM 0 HB2 LYS A 133 6.293 15.453 4.287 1.00 0.00 H new ATOM 0 HB3 LYS A 133 5.624 17.061 4.483 1.00 0.00 H new ATOM 0 HG2 LYS A 133 4.534 16.218 6.266 1.00 0.00 H new ATOM 0 HG3 LYS A 133 3.447 15.483 5.103 1.00 0.00 H new ATOM 0 HD2 LYS A 133 4.983 13.463 5.050 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.910 14.193 6.345 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.267 13.836 7.927 1.00 0.00 H new ATOM 0 HE3 LYS A 133 2.959 14.025 6.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 2.898 11.847 6.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 4.583 11.720 6.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 3.881 11.668 7.765 1.00 0.00 H new ATOM 2173 N ASN A 134 3.918 18.202 3.083 1.00 0.00 N ATOM 2174 CA ASN A 134 2.948 19.285 3.006 1.00 0.00 C ATOM 2175 C ASN A 134 3.562 20.510 2.338 1.00 0.00 C ATOM 2176 O ASN A 134 4.773 20.569 2.124 1.00 0.00 O ATOM 2177 CB ASN A 134 2.445 19.644 4.407 1.00 0.00 C ATOM 2178 CG ASN A 134 1.507 18.592 4.968 1.00 0.00 C ATOM 2179 OD1 ASN A 134 1.863 17.418 5.068 1.00 0.00 O ATOM 2180 ND2 ASN A 134 0.302 19.008 5.337 1.00 0.00 N ATOM 0 H ASN A 134 4.852 18.493 3.373 1.00 0.00 H new ATOM 0 HA ASN A 134 2.104 18.950 2.403 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.296 19.763 5.077 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.931 20.604 4.371 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -0.371 18.345 5.721 1.00 0.00 H new ATOM 0 HD22 ASN A 134 0.049 19.991 5.236 1.00 0.00 H new ATOM 2187 N VAL A 135 2.723 21.482 2.005 1.00 0.00 N ATOM 2188 CA VAL A 135 3.187 22.700 1.356 1.00 0.00 C ATOM 2189 C VAL A 135 3.646 23.733 2.380 1.00 0.00 C ATOM 2190 O VAL A 135 4.130 24.806 1.963 1.00 0.00 O ATOM 2191 CB VAL A 135 2.087 23.315 0.467 1.00 0.00 C ATOM 2192 CG1 VAL A 135 0.948 23.866 1.316 1.00 0.00 C ATOM 2193 CG2 VAL A 135 2.672 24.395 -0.431 1.00 0.00 C ATOM 2194 OXT VAL A 135 3.513 23.462 3.592 1.00 0.00 O ATOM 0 H VAL A 135 1.718 21.450 2.174 1.00 0.00 H new ATOM 0 HA VAL A 135 4.034 22.422 0.729 1.00 0.00 H new ATOM 0 HB VAL A 135 1.678 22.529 -0.168 1.00 0.00 H new ATOM 0 HG11 VAL A 135 0.185 24.294 0.667 1.00 0.00 H new ATOM 0 HG12 VAL A 135 0.512 23.060 1.907 1.00 0.00 H new ATOM 0 HG13 VAL A 135 1.332 24.638 1.983 1.00 0.00 H new ATOM 0 HG21 VAL A 135 1.883 24.819 -1.052 1.00 0.00 H new ATOM 0 HG22 VAL A 135 3.111 25.181 0.184 1.00 0.00 H new ATOM 0 HG23 VAL A 135 3.442 23.960 -1.069 1.00 0.00 H new TER 2204 VAL A 135 HETATM 2205 ZN ZN A 136 0.232 14.529 -12.382 1.00 0.00 ZN