USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 831 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 137 TYR OH : rot -64:sc= -1.16! USER MOD Set 1.2: A 139 TYR OH : rot -106:sc= -0.692! USER MOD Set 2.1: A 54 SER OG : rot 130:sc= -2.36! USER MOD Set 2.2: A 61 THR OG1 : rot 57:sc= 0.725 USER MOD Set 3.1: A 2 TYR OH : rot 30:sc= -0.268 USER MOD Set 3.2: A 3 GLN : amide:sc= -3.68 K(o=-3.9,f=-6.5!) USER MOD Single : A 1 GLU N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.401 K(o=-0.4,f=-1.4) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= -3! C(o=-3!,f=-2.5!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot -79:sc= -1.18 USER MOD Single : A 20 SER OG : rot -82:sc= 0.263 USER MOD Single : A 23 THR OG1 : rot -170:sc= -1.3 USER MOD Single : A 28 ASN : amide:sc= -14.1! C(o=-14!,f=-10!) USER MOD Single : A 32 SER OG : rot -60:sc= 1.17 USER MOD Single : A 38 THR OG1 : rot 81:sc= 0.595! USER MOD Single : A 44 SER OG : rot 54:sc= -0.376! USER MOD Single : A 49 HIS : no HD1:sc= -0.208 X(o=-0.21,f=-0.013) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 110:sc= -1.96! USER MOD Single : A 58 GLN : amide:sc= -1.03 K(o=-1,f=0) USER MOD Single : A 59 SER OG : rot 58:sc= 0.134 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= -5.95! C(o=-6!,f=-2.4!) USER MOD Single : A 67 GLN : amide:sc= -0.499 K(o=-0.5,f=-2.4!) USER MOD Single : A 68 CYS SG : rot -139:sc= -2.6! USER MOD Single : A 72 SER OG : rot 180:sc= -0.0306 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 141:sc= -0.241 (180deg=-1.34!) USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc= -2.32! K(o=-2.3!,f=-0.085) USER MOD Single : A 98 TYR OH : rot -46:sc= -0.584! USER MOD Single : A 99 MET CE :methyl -168:sc= -3.78! (180deg=-4.2!) USER MOD Single : A 136 TYR OH : rot 100:sc= -3.37! USER MOD Single : A 140 SER OG : rot 28:sc= -2.09! USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 35:sc= 0.86 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : B 165 SER OG : rot -24:sc= 0.836 USER MOD Single : B 166 THR OG1 : rot 180:sc= -0.256 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 1 -6.401 -23.419 7.517 1.00 0.00 N ATOM 2 CA GLU A 1 -5.507 -22.359 8.066 1.00 0.00 C ATOM 3 C GLU A 1 -5.362 -21.216 7.058 1.00 0.00 C ATOM 4 O GLU A 1 -5.843 -20.121 7.271 1.00 0.00 O ATOM 5 CB GLU A 1 -4.162 -23.051 8.289 1.00 0.00 C ATOM 6 CG GLU A 1 -3.126 -22.020 8.742 1.00 0.00 C ATOM 7 CD GLU A 1 -2.845 -22.202 10.235 1.00 0.00 C ATOM 8 OE1 GLU A 1 -3.798 -22.274 10.993 1.00 0.00 O ATOM 9 OE2 GLU A 1 -1.682 -22.264 10.595 1.00 0.00 O ATOM 0 H1 GLU A 1 -6.492 -24.189 8.210 1.00 0.00 H new ATOM 0 H2 GLU A 1 -7.340 -23.015 7.323 1.00 0.00 H new ATOM 0 H3 GLU A 1 -5.996 -23.792 6.635 1.00 0.00 H new ATOM 0 HA GLU A 1 -5.899 -21.924 8.986 1.00 0.00 H new ATOM 0 HB2 GLU A 1 -4.264 -23.834 9.040 1.00 0.00 H new ATOM 0 HB3 GLU A 1 -3.832 -23.533 7.369 1.00 0.00 H new ATOM 0 HG2 GLU A 1 -2.205 -22.138 8.171 1.00 0.00 H new ATOM 0 HG3 GLU A 1 -3.493 -21.012 8.550 1.00 0.00 H new ATOM 15 N TYR A 2 -4.700 -21.461 5.959 1.00 0.00 N ATOM 16 CA TYR A 2 -4.524 -20.388 4.939 1.00 0.00 C ATOM 17 C TYR A 2 -5.883 -19.967 4.374 1.00 0.00 C ATOM 18 O TYR A 2 -6.115 -18.810 4.082 1.00 0.00 O ATOM 19 CB TYR A 2 -3.661 -21.019 3.846 1.00 0.00 C ATOM 20 CG TYR A 2 -4.478 -22.031 3.078 1.00 0.00 C ATOM 21 CD1 TYR A 2 -4.570 -23.350 3.536 1.00 0.00 C ATOM 22 CD2 TYR A 2 -5.145 -21.648 1.908 1.00 0.00 C ATOM 23 CE1 TYR A 2 -5.327 -24.287 2.824 1.00 0.00 C ATOM 24 CE2 TYR A 2 -5.903 -22.586 1.197 1.00 0.00 C ATOM 25 CZ TYR A 2 -5.993 -23.906 1.654 1.00 0.00 C ATOM 26 OH TYR A 2 -6.741 -24.830 0.953 1.00 0.00 O ATOM 0 H TYR A 2 -4.274 -22.357 5.724 1.00 0.00 H new ATOM 0 HA TYR A 2 -4.063 -19.493 5.356 1.00 0.00 H new ATOM 0 HB2 TYR A 2 -3.290 -20.248 3.171 1.00 0.00 H new ATOM 0 HB3 TYR A 2 -2.789 -21.501 4.289 1.00 0.00 H new ATOM 0 HD1 TYR A 2 -4.057 -23.645 4.439 1.00 0.00 H new ATOM 0 HD2 TYR A 2 -5.075 -20.630 1.554 1.00 0.00 H new ATOM 0 HE1 TYR A 2 -5.397 -25.305 3.178 1.00 0.00 H new ATOM 0 HE2 TYR A 2 -6.419 -22.291 0.295 1.00 0.00 H new ATOM 0 HH TYR A 2 -7.101 -25.498 1.573 1.00 0.00 H new ATOM 36 N GLN A 3 -6.785 -20.898 4.219 1.00 0.00 N ATOM 37 CA GLN A 3 -8.129 -20.549 3.674 1.00 0.00 C ATOM 38 C GLN A 3 -8.774 -19.449 4.520 1.00 0.00 C ATOM 39 O GLN A 3 -9.458 -18.583 4.013 1.00 0.00 O ATOM 40 CB GLN A 3 -8.941 -21.841 3.766 1.00 0.00 C ATOM 41 CG GLN A 3 -9.876 -21.945 2.559 1.00 0.00 C ATOM 42 CD GLN A 3 -9.054 -22.219 1.298 1.00 0.00 C ATOM 43 OE1 GLN A 3 -8.343 -21.357 0.823 1.00 0.00 O ATOM 44 NE2 GLN A 3 -9.123 -23.393 0.732 1.00 0.00 N ATOM 0 H GLN A 3 -6.650 -21.883 4.446 1.00 0.00 H new ATOM 0 HA GLN A 3 -8.075 -20.173 2.652 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -8.273 -22.701 3.796 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -9.520 -21.854 4.690 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -10.600 -22.745 2.715 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -10.442 -21.021 2.443 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -9.720 -24.117 1.131 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -8.580 -23.586 -0.109 1.00 0.00 H new ATOM 53 N LEU A 4 -8.561 -19.478 5.807 1.00 0.00 N ATOM 54 CA LEU A 4 -9.162 -18.433 6.686 1.00 0.00 C ATOM 55 C LEU A 4 -8.585 -17.057 6.342 1.00 0.00 C ATOM 56 O LEU A 4 -9.301 -16.080 6.244 1.00 0.00 O ATOM 57 CB LEU A 4 -8.773 -18.838 8.107 1.00 0.00 C ATOM 58 CG LEU A 4 -9.586 -20.062 8.530 1.00 0.00 C ATOM 59 CD1 LEU A 4 -8.703 -21.006 9.348 1.00 0.00 C ATOM 60 CD2 LEU A 4 -10.777 -19.614 9.382 1.00 0.00 C ATOM 0 H LEU A 4 -7.998 -20.179 6.288 1.00 0.00 H new ATOM 0 HA LEU A 4 -10.243 -18.363 6.565 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.707 -19.062 8.154 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.955 -18.012 8.795 1.00 0.00 H new ATOM 0 HG LEU A 4 -9.947 -20.581 7.642 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -9.284 -21.878 9.649 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -7.855 -21.326 8.743 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -8.341 -20.487 10.236 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -11.357 -20.486 9.684 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -10.415 -19.094 10.269 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -11.408 -18.942 8.800 1.00 0.00 H new ATOM 72 N VAL A 5 -7.295 -16.971 6.160 1.00 0.00 N ATOM 73 CA VAL A 5 -6.674 -15.657 5.824 1.00 0.00 C ATOM 74 C VAL A 5 -7.133 -15.196 4.437 1.00 0.00 C ATOM 75 O VAL A 5 -7.544 -14.069 4.253 1.00 0.00 O ATOM 76 CB VAL A 5 -5.168 -15.923 5.836 1.00 0.00 C ATOM 77 CG1 VAL A 5 -4.443 -14.820 5.061 1.00 0.00 C ATOM 78 CG2 VAL A 5 -4.666 -15.941 7.281 1.00 0.00 C ATOM 0 H VAL A 5 -6.644 -17.753 6.229 1.00 0.00 H new ATOM 0 HA VAL A 5 -6.954 -14.871 6.525 1.00 0.00 H new ATOM 0 HB VAL A 5 -4.968 -16.886 5.366 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.370 -15.013 5.072 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -4.799 -14.805 4.031 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -4.643 -13.856 5.528 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.593 -16.131 7.291 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -4.869 -14.977 7.749 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -5.179 -16.728 7.834 1.00 0.00 H new ATOM 88 N VAL A 6 -7.065 -16.061 3.464 1.00 0.00 N ATOM 89 CA VAL A 6 -7.497 -15.678 2.088 1.00 0.00 C ATOM 90 C VAL A 6 -8.964 -15.235 2.095 1.00 0.00 C ATOM 91 O VAL A 6 -9.333 -14.269 1.456 1.00 0.00 O ATOM 92 CB VAL A 6 -7.324 -16.945 1.251 1.00 0.00 C ATOM 93 CG1 VAL A 6 -8.033 -16.770 -0.093 1.00 0.00 C ATOM 94 CG2 VAL A 6 -5.833 -17.196 1.011 1.00 0.00 C ATOM 0 H VAL A 6 -6.728 -17.019 3.561 1.00 0.00 H new ATOM 0 HA VAL A 6 -6.917 -14.845 1.692 1.00 0.00 H new ATOM 0 HB VAL A 6 -7.756 -17.793 1.782 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -7.910 -17.674 -0.690 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -9.094 -16.589 0.076 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -7.601 -15.922 -0.625 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -5.708 -18.099 0.414 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -5.402 -16.347 0.480 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -5.326 -17.320 1.968 1.00 0.00 H new ATOM 104 N ASN A 7 -9.802 -15.928 2.813 1.00 0.00 N ATOM 105 CA ASN A 7 -11.240 -15.536 2.859 1.00 0.00 C ATOM 106 C ASN A 7 -11.400 -14.242 3.660 1.00 0.00 C ATOM 107 O ASN A 7 -12.278 -13.442 3.404 1.00 0.00 O ATOM 108 CB ASN A 7 -11.947 -16.695 3.564 1.00 0.00 C ATOM 109 CG ASN A 7 -13.127 -17.166 2.712 1.00 0.00 C ATOM 110 OD1 ASN A 7 -14.068 -16.429 2.497 1.00 0.00 O ATOM 111 ND2 ASN A 7 -13.118 -18.375 2.217 1.00 0.00 N ATOM 0 H ASN A 7 -9.556 -16.747 3.369 1.00 0.00 H new ATOM 0 HA ASN A 7 -11.654 -15.354 1.867 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -11.249 -17.517 3.724 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -12.297 -16.378 4.546 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -13.901 -18.700 1.650 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -12.328 -18.994 2.397 1.00 0.00 H new ATOM 118 N ALA A 8 -10.554 -14.034 4.631 1.00 0.00 N ATOM 119 CA ALA A 8 -10.643 -12.797 5.458 1.00 0.00 C ATOM 120 C ALA A 8 -10.093 -11.596 4.685 1.00 0.00 C ATOM 121 O ALA A 8 -10.675 -10.530 4.677 1.00 0.00 O ATOM 122 CB ALA A 8 -9.773 -13.083 6.674 1.00 0.00 C ATOM 0 H ALA A 8 -9.800 -14.671 4.889 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.671 -12.555 5.729 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.782 -12.219 7.339 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -10.162 -13.953 7.203 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.751 -13.282 6.352 1.00 0.00 H new ATOM 128 N VAL A 9 -8.976 -11.764 4.033 1.00 0.00 N ATOM 129 CA VAL A 9 -8.390 -10.634 3.257 1.00 0.00 C ATOM 130 C VAL A 9 -9.411 -10.143 2.235 1.00 0.00 C ATOM 131 O VAL A 9 -9.547 -8.959 1.993 1.00 0.00 O ATOM 132 CB VAL A 9 -7.155 -11.210 2.562 1.00 0.00 C ATOM 133 CG1 VAL A 9 -6.121 -11.617 3.614 1.00 0.00 C ATOM 134 CG2 VAL A 9 -7.551 -12.436 1.741 1.00 0.00 C ATOM 0 H VAL A 9 -8.444 -12.634 4.004 1.00 0.00 H new ATOM 0 HA VAL A 9 -8.124 -9.785 3.887 1.00 0.00 H new ATOM 0 HB VAL A 9 -6.728 -10.455 1.902 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.241 -12.028 3.119 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -5.834 -10.743 4.199 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -6.551 -12.371 4.274 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -6.669 -12.844 1.247 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -7.980 -13.191 2.399 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.287 -12.149 0.990 1.00 0.00 H new ATOM 144 N ARG A 10 -10.136 -11.046 1.637 1.00 0.00 N ATOM 145 CA ARG A 10 -11.156 -10.635 0.630 1.00 0.00 C ATOM 146 C ARG A 10 -12.114 -9.617 1.254 1.00 0.00 C ATOM 147 O ARG A 10 -12.495 -8.646 0.632 1.00 0.00 O ATOM 148 CB ARG A 10 -11.899 -11.922 0.270 1.00 0.00 C ATOM 149 CG ARG A 10 -11.557 -12.326 -1.164 1.00 0.00 C ATOM 150 CD ARG A 10 -11.446 -13.849 -1.255 1.00 0.00 C ATOM 151 NE ARG A 10 -12.758 -14.360 -0.769 1.00 0.00 N ATOM 152 CZ ARG A 10 -12.963 -15.645 -0.666 1.00 0.00 C ATOM 153 NH1 ARG A 10 -12.017 -16.486 -0.985 1.00 0.00 N ATOM 154 NH2 ARG A 10 -14.115 -16.090 -0.242 1.00 0.00 N ATOM 0 H ARG A 10 -10.067 -12.050 1.801 1.00 0.00 H new ATOM 0 HA ARG A 10 -10.713 -10.166 -0.248 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -11.621 -12.719 0.959 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -12.974 -11.774 0.370 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -12.326 -11.966 -1.847 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -10.618 -11.864 -1.469 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -11.252 -14.170 -2.278 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -10.625 -14.222 -0.642 1.00 0.00 H new ATOM 0 HE ARG A 10 -13.498 -13.705 -0.516 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -11.116 -16.139 -1.315 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -12.178 -17.490 -0.904 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -14.854 -15.434 0.009 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -14.276 -17.094 -0.161 1.00 0.00 H new ATOM 168 N LYS A 11 -12.498 -9.827 2.483 1.00 0.00 N ATOM 169 CA LYS A 11 -13.422 -8.866 3.150 1.00 0.00 C ATOM 170 C LYS A 11 -12.685 -7.561 3.458 1.00 0.00 C ATOM 171 O LYS A 11 -13.207 -6.481 3.267 1.00 0.00 O ATOM 172 CB LYS A 11 -13.850 -9.561 4.444 1.00 0.00 C ATOM 173 CG LYS A 11 -15.333 -9.925 4.362 1.00 0.00 C ATOM 174 CD LYS A 11 -16.127 -9.055 5.338 1.00 0.00 C ATOM 175 CE LYS A 11 -17.563 -9.574 5.434 1.00 0.00 C ATOM 176 NZ LYS A 11 -18.254 -8.627 6.353 1.00 0.00 N ATOM 0 H LYS A 11 -12.212 -10.622 3.054 1.00 0.00 H new ATOM 0 HA LYS A 11 -14.278 -8.610 2.525 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -13.253 -10.459 4.602 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -13.672 -8.906 5.297 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -15.699 -9.777 3.346 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -15.473 -10.979 4.601 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -15.657 -9.071 6.321 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -16.126 -8.018 5.001 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -18.042 -9.594 4.455 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -17.590 -10.592 5.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -19.246 -8.917 6.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -17.781 -8.634 7.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -18.219 -7.667 5.953 1.00 0.00 H new ATOM 190 N LEU A 12 -11.471 -7.652 3.932 1.00 0.00 N ATOM 191 CA LEU A 12 -10.697 -6.416 4.249 1.00 0.00 C ATOM 192 C LEU A 12 -10.271 -5.721 2.950 1.00 0.00 C ATOM 193 O LEU A 12 -10.311 -4.512 2.841 1.00 0.00 O ATOM 194 CB LEU A 12 -9.482 -6.908 5.051 1.00 0.00 C ATOM 195 CG LEU A 12 -8.182 -6.358 4.453 1.00 0.00 C ATOM 196 CD1 LEU A 12 -8.125 -4.841 4.645 1.00 0.00 C ATOM 197 CD2 LEU A 12 -6.987 -7.001 5.163 1.00 0.00 C ATOM 0 H LEU A 12 -10.982 -8.528 4.113 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.275 -5.685 4.814 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.573 -6.592 6.090 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -9.456 -7.998 5.051 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.149 -6.589 3.388 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -7.199 -4.455 4.218 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.976 -4.379 4.144 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.159 -4.607 5.709 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.060 -6.612 4.740 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.027 -6.767 6.227 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.022 -8.082 5.028 1.00 0.00 H new ATOM 209 N GLN A 13 -9.869 -6.477 1.965 1.00 0.00 N ATOM 210 CA GLN A 13 -9.448 -5.860 0.675 1.00 0.00 C ATOM 211 C GLN A 13 -10.654 -5.238 -0.034 1.00 0.00 C ATOM 212 O GLN A 13 -10.541 -4.232 -0.706 1.00 0.00 O ATOM 213 CB GLN A 13 -8.869 -7.011 -0.150 1.00 0.00 C ATOM 214 CG GLN A 13 -10.006 -7.878 -0.695 1.00 0.00 C ATOM 215 CD GLN A 13 -9.444 -8.880 -1.706 1.00 0.00 C ATOM 216 OE1 GLN A 13 -9.614 -8.719 -2.897 1.00 0.00 O ATOM 217 NE2 GLN A 13 -8.775 -9.916 -1.276 1.00 0.00 N ATOM 0 H GLN A 13 -9.814 -7.495 1.998 1.00 0.00 H new ATOM 0 HA GLN A 13 -8.721 -5.061 0.819 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -8.273 -6.617 -0.973 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -8.203 -7.614 0.467 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -10.498 -8.406 0.122 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -10.761 -7.251 -1.170 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -8.632 -10.051 -0.275 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -8.395 -10.590 -1.941 1.00 0.00 H new ATOM 226 N GLU A 14 -11.809 -5.830 0.108 1.00 0.00 N ATOM 227 CA GLU A 14 -13.018 -5.271 -0.560 1.00 0.00 C ATOM 228 C GLU A 14 -13.250 -3.826 -0.113 1.00 0.00 C ATOM 229 O GLU A 14 -13.909 -3.056 -0.783 1.00 0.00 O ATOM 230 CB GLU A 14 -14.171 -6.164 -0.103 1.00 0.00 C ATOM 231 CG GLU A 14 -15.387 -5.930 -1.001 1.00 0.00 C ATOM 232 CD GLU A 14 -16.329 -4.926 -0.332 1.00 0.00 C ATOM 233 OE1 GLU A 14 -15.941 -4.362 0.677 1.00 0.00 O ATOM 234 OE2 GLU A 14 -17.422 -4.740 -0.840 1.00 0.00 O ATOM 0 H GLU A 14 -11.967 -6.675 0.657 1.00 0.00 H new ATOM 0 HA GLU A 14 -12.919 -5.255 -1.645 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -13.872 -7.211 -0.144 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -14.425 -5.946 0.934 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -15.068 -5.554 -1.973 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -15.908 -6.871 -1.179 1.00 0.00 H new ATOM 241 N SER A 15 -12.710 -3.451 1.014 1.00 0.00 N ATOM 242 CA SER A 15 -12.897 -2.054 1.502 1.00 0.00 C ATOM 243 C SER A 15 -12.080 -1.083 0.647 1.00 0.00 C ATOM 244 O SER A 15 -12.415 0.078 0.517 1.00 0.00 O ATOM 245 CB SER A 15 -12.384 -2.066 2.941 1.00 0.00 C ATOM 246 OG SER A 15 -11.590 -0.909 3.166 1.00 0.00 O ATOM 0 H SER A 15 -12.148 -4.050 1.618 1.00 0.00 H new ATOM 0 HA SER A 15 -13.936 -1.730 1.444 1.00 0.00 H new ATOM 0 HB2 SER A 15 -13.222 -2.087 3.638 1.00 0.00 H new ATOM 0 HB3 SER A 15 -11.796 -2.966 3.122 1.00 0.00 H new ATOM 0 HG SER A 15 -11.261 -0.913 4.089 1.00 0.00 H new ATOM 252 N GLY A 16 -11.010 -1.548 0.063 1.00 0.00 N ATOM 253 CA GLY A 16 -10.172 -0.652 -0.782 1.00 0.00 C ATOM 254 C GLY A 16 -8.953 -0.187 0.015 1.00 0.00 C ATOM 255 O GLY A 16 -8.523 0.944 -0.092 1.00 0.00 O ATOM 0 H GLY A 16 -10.680 -2.510 0.135 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.852 -1.178 -1.681 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -10.756 0.209 -1.107 1.00 0.00 H new ATOM 259 N PHE A 17 -8.393 -1.052 0.818 1.00 0.00 N ATOM 260 CA PHE A 17 -7.202 -0.657 1.625 1.00 0.00 C ATOM 261 C PHE A 17 -6.209 -1.821 1.709 1.00 0.00 C ATOM 262 O PHE A 17 -5.229 -1.762 2.424 1.00 0.00 O ATOM 263 CB PHE A 17 -7.759 -0.319 3.009 1.00 0.00 C ATOM 264 CG PHE A 17 -6.644 -0.354 4.027 1.00 0.00 C ATOM 265 CD1 PHE A 17 -5.733 0.707 4.105 1.00 0.00 C ATOM 266 CD2 PHE A 17 -6.521 -1.447 4.894 1.00 0.00 C ATOM 267 CE1 PHE A 17 -4.699 0.675 5.049 1.00 0.00 C ATOM 268 CE2 PHE A 17 -5.487 -1.479 5.837 1.00 0.00 C ATOM 269 CZ PHE A 17 -4.576 -0.419 5.915 1.00 0.00 C ATOM 0 H PHE A 17 -8.708 -2.013 0.950 1.00 0.00 H new ATOM 0 HA PHE A 17 -6.664 0.184 1.187 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.221 0.668 2.995 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.537 -1.031 3.283 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -5.828 1.550 3.437 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.224 -2.265 4.835 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -3.997 1.493 5.109 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.392 -2.322 6.505 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.778 -0.445 6.643 1.00 0.00 H new ATOM 279 N TYR A 18 -6.453 -2.879 0.985 1.00 0.00 N ATOM 280 CA TYR A 18 -5.519 -4.043 1.027 1.00 0.00 C ATOM 281 C TYR A 18 -4.529 -3.968 -0.137 1.00 0.00 C ATOM 282 O TYR A 18 -4.895 -3.677 -1.259 1.00 0.00 O ATOM 283 CB TYR A 18 -6.411 -5.276 0.896 1.00 0.00 C ATOM 284 CG TYR A 18 -5.556 -6.521 0.930 1.00 0.00 C ATOM 285 CD1 TYR A 18 -4.697 -6.810 -0.136 1.00 0.00 C ATOM 286 CD2 TYR A 18 -5.623 -7.383 2.029 1.00 0.00 C ATOM 287 CE1 TYR A 18 -3.904 -7.963 -0.103 1.00 0.00 C ATOM 288 CE2 TYR A 18 -4.832 -8.538 2.063 1.00 0.00 C ATOM 289 CZ TYR A 18 -3.972 -8.827 0.997 1.00 0.00 C ATOM 290 OH TYR A 18 -3.192 -9.965 1.031 1.00 0.00 O ATOM 0 H TYR A 18 -7.257 -2.989 0.367 1.00 0.00 H new ATOM 0 HA TYR A 18 -4.930 -4.065 1.944 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -7.139 -5.299 1.707 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -6.974 -5.234 -0.036 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -4.646 -6.143 -0.984 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -6.285 -7.158 2.852 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -3.240 -8.186 -0.925 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -4.885 -9.205 2.911 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.603 -10.660 0.475 1.00 0.00 H new ATOM 300 N TRP A 19 -3.278 -4.226 0.122 1.00 0.00 N ATOM 301 CA TRP A 19 -2.262 -4.167 -0.968 1.00 0.00 C ATOM 302 C TRP A 19 -1.749 -5.570 -1.298 1.00 0.00 C ATOM 303 O TRP A 19 -1.663 -6.429 -0.446 1.00 0.00 O ATOM 304 CB TRP A 19 -1.128 -3.313 -0.403 1.00 0.00 C ATOM 305 CG TRP A 19 -1.475 -1.864 -0.522 1.00 0.00 C ATOM 306 CD1 TRP A 19 -2.364 -1.211 0.261 1.00 0.00 C ATOM 307 CD2 TRP A 19 -0.951 -0.878 -1.457 1.00 0.00 C ATOM 308 NE1 TRP A 19 -2.418 0.113 -0.133 1.00 0.00 N ATOM 309 CE2 TRP A 19 -1.565 0.367 -1.190 1.00 0.00 C ATOM 310 CE3 TRP A 19 -0.010 -0.943 -2.501 1.00 0.00 C ATOM 311 CZ2 TRP A 19 -1.257 1.509 -1.932 1.00 0.00 C ATOM 312 CZ3 TRP A 19 0.302 0.203 -3.250 1.00 0.00 C ATOM 313 CH2 TRP A 19 -0.320 1.427 -2.965 1.00 0.00 C ATOM 0 H TRP A 19 -2.914 -4.475 1.042 1.00 0.00 H new ATOM 0 HA TRP A 19 -2.674 -3.753 -1.888 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -0.954 -3.570 0.642 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -0.203 -3.520 -0.941 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -2.938 -1.652 1.063 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -3.014 0.816 0.303 1.00 0.00 H new ATOM 0 HE3 TRP A 19 0.476 -1.881 -2.728 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 -1.740 2.449 -1.709 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 1.025 0.141 -4.050 1.00 0.00 H new ATOM 0 HH2 TRP A 19 -0.075 2.305 -3.543 1.00 0.00 H new ATOM 324 N SER A 20 -1.396 -5.803 -2.531 1.00 0.00 N ATOM 325 CA SER A 20 -0.872 -7.143 -2.920 1.00 0.00 C ATOM 326 C SER A 20 0.144 -6.990 -4.053 1.00 0.00 C ATOM 327 O SER A 20 -0.203 -6.667 -5.170 1.00 0.00 O ATOM 328 CB SER A 20 -2.086 -7.933 -3.399 1.00 0.00 C ATOM 329 OG SER A 20 -3.267 -7.174 -3.167 1.00 0.00 O ATOM 0 H SER A 20 -1.448 -5.122 -3.288 1.00 0.00 H new ATOM 0 HA SER A 20 -0.369 -7.644 -2.093 1.00 0.00 H new ATOM 0 HB2 SER A 20 -1.990 -8.160 -4.461 1.00 0.00 H new ATOM 0 HB3 SER A 20 -2.144 -8.886 -2.873 1.00 0.00 H new ATOM 0 HG SER A 20 -3.551 -7.287 -2.236 1.00 0.00 H new ATOM 335 N ALA A 21 1.399 -7.216 -3.774 1.00 0.00 N ATOM 336 CA ALA A 21 2.426 -7.076 -4.846 1.00 0.00 C ATOM 337 C ALA A 21 3.837 -7.302 -4.291 1.00 0.00 C ATOM 338 O ALA A 21 4.728 -7.716 -5.005 1.00 0.00 O ATOM 339 CB ALA A 21 2.276 -5.641 -5.350 1.00 0.00 C ATOM 0 H ALA A 21 1.756 -7.489 -2.858 1.00 0.00 H new ATOM 0 HA ALA A 21 2.285 -7.812 -5.638 1.00 0.00 H new ATOM 0 HB1 ALA A 21 3.000 -5.457 -6.144 1.00 0.00 H new ATOM 0 HB2 ALA A 21 1.268 -5.495 -5.737 1.00 0.00 H new ATOM 0 HB3 ALA A 21 2.454 -4.947 -4.529 1.00 0.00 H new ATOM 345 N VAL A 22 4.057 -7.035 -3.032 1.00 0.00 N ATOM 346 CA VAL A 22 5.420 -7.242 -2.468 1.00 0.00 C ATOM 347 C VAL A 22 5.369 -8.242 -1.312 1.00 0.00 C ATOM 348 O VAL A 22 4.439 -9.014 -1.186 1.00 0.00 O ATOM 349 CB VAL A 22 5.875 -5.864 -1.975 1.00 0.00 C ATOM 350 CG1 VAL A 22 6.714 -5.187 -3.060 1.00 0.00 C ATOM 351 CG2 VAL A 22 4.655 -4.993 -1.664 1.00 0.00 C ATOM 0 H VAL A 22 3.359 -6.686 -2.376 1.00 0.00 H new ATOM 0 HA VAL A 22 6.110 -7.649 -3.208 1.00 0.00 H new ATOM 0 HB VAL A 22 6.471 -5.987 -1.070 1.00 0.00 H new ATOM 0 HG11 VAL A 22 7.038 -4.207 -2.711 1.00 0.00 H new ATOM 0 HG12 VAL A 22 7.587 -5.801 -3.281 1.00 0.00 H new ATOM 0 HG13 VAL A 22 6.115 -5.070 -3.963 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.986 -4.015 -1.314 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.055 -4.872 -2.566 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.054 -5.471 -0.890 1.00 0.00 H new ATOM 361 N THR A 23 6.363 -8.235 -0.470 1.00 0.00 N ATOM 362 CA THR A 23 6.373 -9.187 0.677 1.00 0.00 C ATOM 363 C THR A 23 5.602 -8.596 1.856 1.00 0.00 C ATOM 364 O THR A 23 5.304 -7.419 1.886 1.00 0.00 O ATOM 365 CB THR A 23 7.850 -9.364 1.033 1.00 0.00 C ATOM 366 OG1 THR A 23 8.654 -8.918 -0.049 1.00 0.00 O ATOM 367 CG2 THR A 23 8.137 -10.842 1.309 1.00 0.00 C ATOM 0 H THR A 23 7.169 -7.612 -0.525 1.00 0.00 H new ATOM 0 HA THR A 23 5.899 -10.137 0.432 1.00 0.00 H new ATOM 0 HB THR A 23 8.082 -8.779 1.923 1.00 0.00 H new ATOM 0 HG1 THR A 23 9.587 -9.174 0.109 1.00 0.00 H new ATOM 0 HG21 THR A 23 9.190 -10.967 1.563 1.00 0.00 H new ATOM 0 HG22 THR A 23 7.520 -11.183 2.141 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.906 -11.430 0.421 1.00 0.00 H new ATOM 375 N GLY A 24 5.277 -9.399 2.830 1.00 0.00 N ATOM 376 CA GLY A 24 4.526 -8.873 4.001 1.00 0.00 C ATOM 377 C GLY A 24 5.251 -7.650 4.562 1.00 0.00 C ATOM 378 O GLY A 24 4.843 -6.525 4.352 1.00 0.00 O ATOM 0 H GLY A 24 5.499 -10.394 2.865 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.512 -8.604 3.706 1.00 0.00 H new ATOM 0 HA3 GLY A 24 4.441 -9.643 4.768 1.00 0.00 H new ATOM 382 N GLY A 25 6.323 -7.864 5.273 1.00 0.00 N ATOM 383 CA GLY A 25 7.079 -6.718 5.856 1.00 0.00 C ATOM 384 C GLY A 25 7.585 -5.802 4.742 1.00 0.00 C ATOM 385 O GLY A 25 7.503 -4.593 4.837 1.00 0.00 O ATOM 0 H GLY A 25 6.710 -8.786 5.477 1.00 0.00 H new ATOM 0 HA2 GLY A 25 6.437 -6.157 6.536 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.919 -7.088 6.443 1.00 0.00 H new ATOM 389 N GLU A 26 8.111 -6.362 3.689 1.00 0.00 N ATOM 390 CA GLU A 26 8.624 -5.510 2.580 1.00 0.00 C ATOM 391 C GLU A 26 7.495 -4.651 2.016 1.00 0.00 C ATOM 392 O GLU A 26 7.723 -3.600 1.452 1.00 0.00 O ATOM 393 CB GLU A 26 9.139 -6.491 1.525 1.00 0.00 C ATOM 394 CG GLU A 26 9.964 -5.733 0.484 1.00 0.00 C ATOM 395 CD GLU A 26 10.352 -6.683 -0.650 1.00 0.00 C ATOM 396 OE1 GLU A 26 11.374 -7.337 -0.525 1.00 0.00 O ATOM 397 OE2 GLU A 26 9.621 -6.742 -1.625 1.00 0.00 O ATOM 0 H GLU A 26 8.208 -7.368 3.548 1.00 0.00 H new ATOM 0 HA GLU A 26 9.408 -4.828 2.910 1.00 0.00 H new ATOM 0 HB2 GLU A 26 9.748 -7.262 1.997 1.00 0.00 H new ATOM 0 HB3 GLU A 26 8.302 -6.996 1.044 1.00 0.00 H new ATOM 0 HG2 GLU A 26 9.390 -4.895 0.090 1.00 0.00 H new ATOM 0 HG3 GLU A 26 10.859 -5.317 0.946 1.00 0.00 H new ATOM 404 N ALA A 27 6.281 -5.089 2.167 1.00 0.00 N ATOM 405 CA ALA A 27 5.137 -4.297 1.645 1.00 0.00 C ATOM 406 C ALA A 27 4.824 -3.132 2.586 1.00 0.00 C ATOM 407 O ALA A 27 4.616 -2.013 2.162 1.00 0.00 O ATOM 408 CB ALA A 27 3.966 -5.274 1.612 1.00 0.00 C ATOM 0 H ALA A 27 6.030 -5.963 2.630 1.00 0.00 H new ATOM 0 HA ALA A 27 5.347 -3.869 0.665 1.00 0.00 H new ATOM 0 HB1 ALA A 27 3.078 -4.765 1.237 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.209 -6.111 0.957 1.00 0.00 H new ATOM 0 HB3 ALA A 27 3.773 -5.645 2.619 1.00 0.00 H new ATOM 414 N ASN A 28 4.782 -3.393 3.862 1.00 0.00 N ATOM 415 CA ASN A 28 4.472 -2.305 4.841 1.00 0.00 C ATOM 416 C ASN A 28 5.619 -1.296 4.911 1.00 0.00 C ATOM 417 O ASN A 28 5.411 -0.101 4.981 1.00 0.00 O ATOM 418 CB ASN A 28 4.299 -3.007 6.187 1.00 0.00 C ATOM 419 CG ASN A 28 3.707 -4.400 5.975 1.00 0.00 C ATOM 420 OD1 ASN A 28 2.620 -4.544 5.452 1.00 0.00 O ATOM 421 ND2 ASN A 28 4.389 -5.440 6.363 1.00 0.00 N ATOM 0 H ASN A 28 4.948 -4.311 4.273 1.00 0.00 H new ATOM 0 HA ASN A 28 3.580 -1.748 4.553 1.00 0.00 H new ATOM 0 HB2 ASN A 28 5.261 -3.085 6.693 1.00 0.00 H new ATOM 0 HB3 ASN A 28 3.646 -2.419 6.832 1.00 0.00 H new ATOM 0 HD21 ASN A 28 4.011 -6.377 6.228 1.00 0.00 H new ATOM 0 HD22 ASN A 28 5.301 -5.317 6.802 1.00 0.00 H new ATOM 428 N LEU A 29 6.830 -1.777 4.912 1.00 0.00 N ATOM 429 CA LEU A 29 8.005 -0.866 4.999 1.00 0.00 C ATOM 430 C LEU A 29 8.022 0.119 3.827 1.00 0.00 C ATOM 431 O LEU A 29 8.469 1.240 3.963 1.00 0.00 O ATOM 432 CB LEU A 29 9.220 -1.792 4.964 1.00 0.00 C ATOM 433 CG LEU A 29 9.552 -2.249 6.391 1.00 0.00 C ATOM 434 CD1 LEU A 29 8.262 -2.400 7.208 1.00 0.00 C ATOM 435 CD2 LEU A 29 10.276 -3.596 6.336 1.00 0.00 C ATOM 0 H LEU A 29 7.058 -2.770 4.856 1.00 0.00 H new ATOM 0 HA LEU A 29 7.987 -0.254 5.901 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.015 -2.656 4.332 1.00 0.00 H new ATOM 0 HB3 LEU A 29 10.074 -1.274 4.528 1.00 0.00 H new ATOM 0 HG LEU A 29 10.191 -1.504 6.865 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.508 -2.725 8.219 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.744 -1.442 7.250 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.617 -3.141 6.736 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.513 -3.923 7.348 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.634 -4.335 5.857 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.198 -3.491 5.764 1.00 0.00 H new ATOM 447 N LEU A 30 7.542 -0.278 2.681 1.00 0.00 N ATOM 448 CA LEU A 30 7.545 0.664 1.524 1.00 0.00 C ATOM 449 C LEU A 30 6.821 1.951 1.917 1.00 0.00 C ATOM 450 O LEU A 30 7.057 3.003 1.358 1.00 0.00 O ATOM 451 CB LEU A 30 6.797 -0.067 0.403 1.00 0.00 C ATOM 452 CG LEU A 30 5.285 0.117 0.577 1.00 0.00 C ATOM 453 CD1 LEU A 30 4.863 1.473 0.007 1.00 0.00 C ATOM 454 CD2 LEU A 30 4.549 -0.995 -0.173 1.00 0.00 C ATOM 0 H LEU A 30 7.152 -1.202 2.495 1.00 0.00 H new ATOM 0 HA LEU A 30 8.551 0.942 1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.110 0.320 -0.567 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.047 -1.128 0.419 1.00 0.00 H new ATOM 0 HG LEU A 30 5.036 0.074 1.637 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.788 1.601 0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.387 2.269 0.536 1.00 0.00 H new ATOM 0 HD13 LEU A 30 5.113 1.516 -1.053 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.474 -0.866 -0.051 1.00 0.00 H new ATOM 0 HD22 LEU A 30 4.802 -0.949 -1.232 1.00 0.00 H new ATOM 0 HD23 LEU A 30 4.846 -1.964 0.229 1.00 0.00 H new ATOM 466 N LEU A 31 5.957 1.881 2.892 1.00 0.00 N ATOM 467 CA LEU A 31 5.240 3.108 3.332 1.00 0.00 C ATOM 468 C LEU A 31 6.252 4.100 3.906 1.00 0.00 C ATOM 469 O LEU A 31 6.147 5.296 3.716 1.00 0.00 O ATOM 470 CB LEU A 31 4.267 2.640 4.416 1.00 0.00 C ATOM 471 CG LEU A 31 3.378 1.524 3.863 1.00 0.00 C ATOM 472 CD1 LEU A 31 2.418 1.049 4.955 1.00 0.00 C ATOM 473 CD2 LEU A 31 2.574 2.054 2.675 1.00 0.00 C ATOM 0 H LEU A 31 5.718 1.030 3.401 1.00 0.00 H new ATOM 0 HA LEU A 31 4.715 3.606 2.517 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.820 2.281 5.284 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.652 3.475 4.752 1.00 0.00 H new ATOM 0 HG LEU A 31 4.001 0.691 3.538 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.784 0.254 4.562 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.990 0.672 5.803 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.795 1.882 5.280 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.941 1.259 2.281 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.951 2.887 3.000 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.257 2.394 1.896 1.00 0.00 H new ATOM 485 N SER A 32 7.239 3.603 4.599 1.00 0.00 N ATOM 486 CA SER A 32 8.275 4.500 5.182 1.00 0.00 C ATOM 487 C SER A 32 9.128 5.105 4.065 1.00 0.00 C ATOM 488 O SER A 32 9.604 6.218 4.167 1.00 0.00 O ATOM 489 CB SER A 32 9.123 3.595 6.074 1.00 0.00 C ATOM 490 OG SER A 32 10.018 2.843 5.265 1.00 0.00 O ATOM 0 H SER A 32 7.373 2.609 4.787 1.00 0.00 H new ATOM 0 HA SER A 32 7.842 5.330 5.740 1.00 0.00 H new ATOM 0 HB2 SER A 32 9.681 4.194 6.794 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.482 2.925 6.646 1.00 0.00 H new ATOM 0 HG SER A 32 9.506 2.290 4.638 1.00 0.00 H new ATOM 496 N ALA A 33 9.330 4.376 3.000 1.00 0.00 N ATOM 497 CA ALA A 33 10.158 4.908 1.881 1.00 0.00 C ATOM 498 C ALA A 33 9.328 5.850 1.005 1.00 0.00 C ATOM 499 O ALA A 33 9.862 6.674 0.290 1.00 0.00 O ATOM 500 CB ALA A 33 10.586 3.674 1.085 1.00 0.00 C ATOM 0 H ALA A 33 8.958 3.437 2.857 1.00 0.00 H new ATOM 0 HA ALA A 33 11.013 5.481 2.238 1.00 0.00 H new ATOM 0 HB1 ALA A 33 11.202 3.982 0.240 1.00 0.00 H new ATOM 0 HB2 ALA A 33 11.160 3.007 1.728 1.00 0.00 H new ATOM 0 HB3 ALA A 33 9.702 3.153 0.719 1.00 0.00 H new ATOM 506 N GLU A 34 8.027 5.746 1.060 1.00 0.00 N ATOM 507 CA GLU A 34 7.182 6.655 0.232 1.00 0.00 C ATOM 508 C GLU A 34 6.028 7.232 1.075 1.00 0.00 C ATOM 509 O GLU A 34 6.152 8.325 1.591 1.00 0.00 O ATOM 510 CB GLU A 34 6.681 5.798 -0.931 1.00 0.00 C ATOM 511 CG GLU A 34 7.739 5.775 -2.037 1.00 0.00 C ATOM 512 CD GLU A 34 7.534 6.974 -2.964 1.00 0.00 C ATOM 513 OE1 GLU A 34 6.400 7.226 -3.334 1.00 0.00 O ATOM 514 OE2 GLU A 34 8.517 7.620 -3.289 1.00 0.00 O ATOM 0 H GLU A 34 7.516 5.077 1.637 1.00 0.00 H new ATOM 0 HA GLU A 34 7.735 7.518 -0.138 1.00 0.00 H new ATOM 0 HB2 GLU A 34 6.475 4.784 -0.588 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.744 6.200 -1.317 1.00 0.00 H new ATOM 0 HG2 GLU A 34 8.737 5.806 -1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 34 7.667 4.847 -2.604 1.00 0.00 H new ATOM 521 N PRO A 35 4.941 6.501 1.205 1.00 0.00 N ATOM 522 CA PRO A 35 3.805 7.008 2.011 1.00 0.00 C ATOM 523 C PRO A 35 4.098 6.833 3.505 1.00 0.00 C ATOM 524 O PRO A 35 3.468 6.047 4.184 1.00 0.00 O ATOM 525 CB PRO A 35 2.635 6.129 1.586 1.00 0.00 C ATOM 526 CG PRO A 35 3.254 4.857 1.097 1.00 0.00 C ATOM 527 CD PRO A 35 4.657 5.175 0.637 1.00 0.00 C ATOM 0 HA PRO A 35 3.610 8.069 1.855 1.00 0.00 H new ATOM 0 HB2 PRO A 35 1.960 5.942 2.421 1.00 0.00 H new ATOM 0 HB3 PRO A 35 2.048 6.608 0.802 1.00 0.00 H new ATOM 0 HG2 PRO A 35 3.272 4.111 1.891 1.00 0.00 H new ATOM 0 HG3 PRO A 35 2.669 4.437 0.278 1.00 0.00 H new ATOM 0 HD2 PRO A 35 5.369 4.430 0.993 1.00 0.00 H new ATOM 0 HD3 PRO A 35 4.725 5.187 -0.451 1.00 0.00 H new ATOM 535 N ALA A 36 5.055 7.557 4.020 1.00 0.00 N ATOM 536 CA ALA A 36 5.391 7.429 5.469 1.00 0.00 C ATOM 537 C ALA A 36 4.208 7.868 6.334 1.00 0.00 C ATOM 538 O ALA A 36 3.516 8.816 6.023 1.00 0.00 O ATOM 539 CB ALA A 36 6.582 8.359 5.685 1.00 0.00 C ATOM 0 H ALA A 36 5.618 8.231 3.502 1.00 0.00 H new ATOM 0 HA ALA A 36 5.620 6.400 5.745 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.889 8.320 6.730 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.411 8.042 5.052 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.298 9.379 5.428 1.00 0.00 H new ATOM 545 N GLY A 37 3.971 7.184 7.420 1.00 0.00 N ATOM 546 CA GLY A 37 2.833 7.559 8.304 1.00 0.00 C ATOM 547 C GLY A 37 1.575 6.825 7.843 1.00 0.00 C ATOM 548 O GLY A 37 0.471 7.169 8.211 1.00 0.00 O ATOM 0 H GLY A 37 4.517 6.381 7.733 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.060 7.301 9.338 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.672 8.637 8.272 1.00 0.00 H new ATOM 552 N THR A 38 1.738 5.814 7.035 1.00 0.00 N ATOM 553 CA THR A 38 0.553 5.051 6.540 1.00 0.00 C ATOM 554 C THR A 38 0.776 3.549 6.731 1.00 0.00 C ATOM 555 O THR A 38 1.887 3.064 6.655 1.00 0.00 O ATOM 556 CB THR A 38 0.444 5.398 5.055 1.00 0.00 C ATOM 557 OG1 THR A 38 1.277 6.511 4.766 1.00 0.00 O ATOM 558 CG2 THR A 38 -1.008 5.743 4.720 1.00 0.00 C ATOM 0 H THR A 38 2.640 5.482 6.695 1.00 0.00 H new ATOM 0 HA THR A 38 -0.358 5.307 7.081 1.00 0.00 H new ATOM 0 HB THR A 38 0.762 4.544 4.456 1.00 0.00 H new ATOM 0 HG1 THR A 38 2.203 6.208 4.661 1.00 0.00 H new ATOM 0 HG21 THR A 38 -1.088 5.991 3.662 1.00 0.00 H new ATOM 0 HG22 THR A 38 -1.646 4.887 4.942 1.00 0.00 H new ATOM 0 HG23 THR A 38 -1.326 6.597 5.318 1.00 0.00 H new ATOM 566 N PHE A 39 -0.268 2.807 6.989 1.00 0.00 N ATOM 567 CA PHE A 39 -0.099 1.339 7.193 1.00 0.00 C ATOM 568 C PHE A 39 -0.970 0.552 6.208 1.00 0.00 C ATOM 569 O PHE A 39 -2.048 0.972 5.838 1.00 0.00 O ATOM 570 CB PHE A 39 -0.541 1.088 8.638 1.00 0.00 C ATOM 571 CG PHE A 39 -2.037 0.886 8.692 1.00 0.00 C ATOM 572 CD1 PHE A 39 -2.900 1.968 8.483 1.00 0.00 C ATOM 573 CD2 PHE A 39 -2.562 -0.385 8.951 1.00 0.00 C ATOM 574 CE1 PHE A 39 -4.286 1.780 8.534 1.00 0.00 C ATOM 575 CE2 PHE A 39 -3.948 -0.574 9.002 1.00 0.00 C ATOM 576 CZ PHE A 39 -4.810 0.509 8.793 1.00 0.00 C ATOM 0 H PHE A 39 -1.225 3.151 7.067 1.00 0.00 H new ATOM 0 HA PHE A 39 0.927 1.015 7.020 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.032 0.210 9.035 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.257 1.932 9.266 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.496 2.949 8.282 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -1.897 -1.221 9.112 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -4.951 2.616 8.373 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -4.352 -1.555 9.203 1.00 0.00 H new ATOM 0 HZ PHE A 39 -5.879 0.363 8.832 1.00 0.00 H new ATOM 586 N LEU A 40 -0.496 -0.586 5.776 1.00 0.00 N ATOM 587 CA LEU A 40 -1.274 -1.412 4.808 1.00 0.00 C ATOM 588 C LEU A 40 -0.916 -2.892 4.983 1.00 0.00 C ATOM 589 O LEU A 40 0.110 -3.226 5.539 1.00 0.00 O ATOM 590 CB LEU A 40 -0.853 -0.896 3.426 1.00 0.00 C ATOM 591 CG LEU A 40 0.062 -1.910 2.736 1.00 0.00 C ATOM 592 CD1 LEU A 40 0.490 -1.364 1.372 1.00 0.00 C ATOM 593 CD2 LEU A 40 1.308 -2.144 3.593 1.00 0.00 C ATOM 0 H LEU A 40 0.402 -0.981 6.054 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.352 -1.333 4.952 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.736 -0.717 2.813 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.337 0.059 3.529 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.476 -2.849 2.606 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.142 -2.086 0.880 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.392 -1.192 0.756 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.026 -0.425 1.508 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.958 -2.866 3.100 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.843 -1.203 3.722 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.012 -2.529 4.569 1.00 0.00 H new ATOM 605 N ILE A 41 -1.749 -3.783 4.522 1.00 0.00 N ATOM 606 CA ILE A 41 -1.432 -5.232 4.683 1.00 0.00 C ATOM 607 C ILE A 41 -1.188 -5.884 3.318 1.00 0.00 C ATOM 608 O ILE A 41 -1.982 -5.765 2.408 1.00 0.00 O ATOM 609 CB ILE A 41 -2.668 -5.832 5.360 1.00 0.00 C ATOM 610 CG1 ILE A 41 -2.248 -7.037 6.203 1.00 0.00 C ATOM 611 CG2 ILE A 41 -3.675 -6.283 4.299 1.00 0.00 C ATOM 612 CD1 ILE A 41 -3.216 -7.201 7.376 1.00 0.00 C ATOM 0 H ILE A 41 -2.627 -3.575 4.046 1.00 0.00 H new ATOM 0 HA ILE A 41 -0.527 -5.394 5.269 1.00 0.00 H new ATOM 0 HB ILE A 41 -3.130 -5.078 5.997 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -2.245 -7.939 5.591 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -1.232 -6.899 6.573 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -4.552 -6.709 4.787 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.976 -5.427 3.696 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.216 -7.035 3.658 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -2.917 -8.060 7.977 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -3.196 -6.302 7.992 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.225 -7.358 6.996 1.00 0.00 H new ATOM 624 N ARG A 42 -0.090 -6.577 3.179 1.00 0.00 N ATOM 625 CA ARG A 42 0.220 -7.247 1.882 1.00 0.00 C ATOM 626 C ARG A 42 0.289 -8.763 2.076 1.00 0.00 C ATOM 627 O ARG A 42 0.634 -9.247 3.136 1.00 0.00 O ATOM 628 CB ARG A 42 1.583 -6.695 1.473 1.00 0.00 C ATOM 629 CG ARG A 42 1.740 -6.789 -0.046 1.00 0.00 C ATOM 630 CD ARG A 42 1.011 -5.619 -0.712 1.00 0.00 C ATOM 631 NE ARG A 42 2.051 -4.565 -0.888 1.00 0.00 N ATOM 632 CZ ARG A 42 2.048 -3.805 -1.953 1.00 0.00 C ATOM 633 NH1 ARG A 42 1.127 -3.954 -2.867 1.00 0.00 N ATOM 634 NH2 ARG A 42 2.968 -2.893 -2.101 1.00 0.00 N ATOM 0 H ARG A 42 0.609 -6.709 3.910 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.540 -7.059 1.124 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.678 -5.658 1.795 1.00 0.00 H new ATOM 0 HB3 ARG A 42 2.377 -7.256 1.966 1.00 0.00 H new ATOM 0 HG2 ARG A 42 2.796 -6.772 -0.314 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.335 -7.735 -0.406 1.00 0.00 H new ATOM 0 HD2 ARG A 42 0.583 -5.915 -1.670 1.00 0.00 H new ATOM 0 HD3 ARG A 42 0.189 -5.262 -0.092 1.00 0.00 H new ATOM 0 HE ARG A 42 2.768 -4.436 -0.174 1.00 0.00 H new ATOM 0 HH11 ARG A 42 0.405 -4.666 -2.752 1.00 0.00 H new ATOM 0 HH12 ARG A 42 1.129 -3.359 -3.695 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.687 -2.774 -1.388 1.00 0.00 H new ATOM 0 HH22 ARG A 42 2.968 -2.299 -2.930 1.00 0.00 H new ATOM 648 N ASP A 43 -0.035 -9.518 1.064 1.00 0.00 N ATOM 649 CA ASP A 43 0.014 -11.003 1.196 1.00 0.00 C ATOM 650 C ASP A 43 1.468 -11.484 1.196 1.00 0.00 C ATOM 651 O ASP A 43 2.241 -11.154 0.319 1.00 0.00 O ATOM 652 CB ASP A 43 -0.727 -11.534 -0.032 1.00 0.00 C ATOM 653 CG ASP A 43 -1.006 -13.028 0.146 1.00 0.00 C ATOM 654 OD1 ASP A 43 -0.051 -13.781 0.242 1.00 0.00 O ATOM 655 OD2 ASP A 43 -2.169 -13.393 0.182 1.00 0.00 O ATOM 0 H ASP A 43 -0.332 -9.173 0.151 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.436 -11.351 2.125 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -1.663 -10.992 -0.167 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.130 -11.369 -0.929 1.00 0.00 H new ATOM 660 N SER A 44 1.846 -12.258 2.176 1.00 0.00 N ATOM 661 CA SER A 44 3.250 -12.758 2.235 1.00 0.00 C ATOM 662 C SER A 44 3.728 -13.167 0.839 1.00 0.00 C ATOM 663 O SER A 44 4.885 -13.012 0.500 1.00 0.00 O ATOM 664 CB SER A 44 3.197 -13.974 3.160 1.00 0.00 C ATOM 665 OG SER A 44 2.629 -13.592 4.406 1.00 0.00 O ATOM 0 H SER A 44 1.243 -12.566 2.939 1.00 0.00 H new ATOM 0 HA SER A 44 3.943 -11.998 2.597 1.00 0.00 H new ATOM 0 HB2 SER A 44 2.603 -14.766 2.704 1.00 0.00 H new ATOM 0 HB3 SER A 44 4.200 -14.374 3.312 1.00 0.00 H new ATOM 0 HG SER A 44 1.762 -13.161 4.252 1.00 0.00 H new ATOM 735 N HIS A 49 0.733 -18.740 2.236 1.00 0.00 N ATOM 736 CA HIS A 49 1.083 -18.164 3.566 1.00 0.00 C ATOM 737 C HIS A 49 -0.058 -17.272 4.071 1.00 0.00 C ATOM 738 O HIS A 49 -1.185 -17.706 4.196 1.00 0.00 O ATOM 739 CB HIS A 49 2.349 -17.342 3.319 1.00 0.00 C ATOM 740 CG HIS A 49 3.474 -18.261 2.931 1.00 0.00 C ATOM 741 ND1 HIS A 49 4.712 -17.785 2.527 1.00 0.00 N ATOM 742 CD2 HIS A 49 3.564 -19.630 2.880 1.00 0.00 C ATOM 743 CE1 HIS A 49 5.487 -18.852 2.253 1.00 0.00 C ATOM 744 NE2 HIS A 49 4.836 -20.001 2.452 1.00 0.00 N ATOM 0 HA HIS A 49 1.241 -18.931 4.324 1.00 0.00 H new ATOM 0 HB2 HIS A 49 2.173 -16.611 2.530 1.00 0.00 H new ATOM 0 HB3 HIS A 49 2.614 -16.784 4.217 1.00 0.00 H new ATOM 0 HD2 HIS A 49 2.769 -20.315 3.133 1.00 0.00 H new ATOM 0 HE1 HIS A 49 6.510 -18.786 1.914 1.00 0.00 H new ATOM 0 HE2 HIS A 49 5.194 -20.947 2.319 1.00 0.00 H new ATOM 752 N PHE A 50 0.223 -16.030 4.361 1.00 0.00 N ATOM 753 CA PHE A 50 -0.851 -15.121 4.856 1.00 0.00 C ATOM 754 C PHE A 50 -0.522 -13.670 4.494 1.00 0.00 C ATOM 755 O PHE A 50 0.278 -13.404 3.620 1.00 0.00 O ATOM 756 CB PHE A 50 -0.857 -15.308 6.374 1.00 0.00 C ATOM 757 CG PHE A 50 0.560 -15.267 6.892 1.00 0.00 C ATOM 758 CD1 PHE A 50 1.216 -14.040 7.041 1.00 0.00 C ATOM 759 CD2 PHE A 50 1.218 -16.458 7.224 1.00 0.00 C ATOM 760 CE1 PHE A 50 2.531 -14.003 7.522 1.00 0.00 C ATOM 761 CE2 PHE A 50 2.532 -16.421 7.705 1.00 0.00 C ATOM 762 CZ PHE A 50 3.189 -15.193 7.854 1.00 0.00 C ATOM 0 H PHE A 50 1.147 -15.606 4.277 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.822 -15.346 4.414 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -1.451 -14.525 6.845 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.322 -16.259 6.632 1.00 0.00 H new ATOM 0 HD1 PHE A 50 0.708 -13.122 6.785 1.00 0.00 H new ATOM 0 HD2 PHE A 50 0.712 -17.405 7.109 1.00 0.00 H new ATOM 0 HE1 PHE A 50 3.037 -13.056 7.637 1.00 0.00 H new ATOM 0 HE2 PHE A 50 3.039 -17.339 7.961 1.00 0.00 H new ATOM 0 HZ PHE A 50 4.203 -15.164 8.225 1.00 0.00 H new ATOM 772 N PHE A 51 -1.134 -12.729 5.160 1.00 0.00 N ATOM 773 CA PHE A 51 -0.855 -11.296 4.853 1.00 0.00 C ATOM 774 C PHE A 51 -0.211 -10.612 6.061 1.00 0.00 C ATOM 775 O PHE A 51 -0.474 -10.959 7.196 1.00 0.00 O ATOM 776 CB PHE A 51 -2.221 -10.681 4.554 1.00 0.00 C ATOM 777 CG PHE A 51 -3.124 -10.860 5.749 1.00 0.00 C ATOM 778 CD1 PHE A 51 -2.983 -10.025 6.867 1.00 0.00 C ATOM 779 CD2 PHE A 51 -4.104 -11.862 5.745 1.00 0.00 C ATOM 780 CE1 PHE A 51 -3.819 -10.191 7.974 1.00 0.00 C ATOM 781 CE2 PHE A 51 -4.939 -12.028 6.854 1.00 0.00 C ATOM 782 CZ PHE A 51 -4.796 -11.192 7.968 1.00 0.00 C ATOM 0 H PHE A 51 -1.814 -12.890 5.903 1.00 0.00 H new ATOM 0 HA PHE A 51 -0.165 -11.180 4.017 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -2.112 -9.622 4.322 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -2.662 -11.156 3.677 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -2.228 -9.253 6.872 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -4.214 -12.506 4.885 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -3.711 -9.547 8.834 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.694 -12.800 6.851 1.00 0.00 H new ATOM 0 HZ PHE A 51 -5.441 -11.320 8.824 1.00 0.00 H new ATOM 792 N THR A 52 0.631 -9.643 5.827 1.00 0.00 N ATOM 793 CA THR A 52 1.290 -8.938 6.962 1.00 0.00 C ATOM 794 C THR A 52 1.067 -7.428 6.848 1.00 0.00 C ATOM 795 O THR A 52 1.122 -6.863 5.774 1.00 0.00 O ATOM 796 CB THR A 52 2.777 -9.272 6.826 1.00 0.00 C ATOM 797 OG1 THR A 52 2.947 -10.683 6.861 1.00 0.00 O ATOM 798 CG2 THR A 52 3.554 -8.633 7.978 1.00 0.00 C ATOM 0 H THR A 52 0.891 -9.309 4.899 1.00 0.00 H new ATOM 0 HA THR A 52 0.889 -9.246 7.928 1.00 0.00 H new ATOM 0 HB THR A 52 3.153 -8.883 5.880 1.00 0.00 H new ATOM 0 HG1 THR A 52 3.899 -10.900 6.773 1.00 0.00 H new ATOM 0 HG21 THR A 52 4.613 -8.872 7.879 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.422 -7.551 7.950 1.00 0.00 H new ATOM 0 HG23 THR A 52 3.182 -9.020 8.927 1.00 0.00 H new ATOM 806 N LEU A 53 0.816 -6.769 7.946 1.00 0.00 N ATOM 807 CA LEU A 53 0.591 -5.296 7.894 1.00 0.00 C ATOM 808 C LEU A 53 1.520 -4.584 8.882 1.00 0.00 C ATOM 809 O LEU A 53 1.543 -4.883 10.059 1.00 0.00 O ATOM 810 CB LEU A 53 -0.879 -5.106 8.281 1.00 0.00 C ATOM 811 CG LEU A 53 -1.089 -3.726 8.914 1.00 0.00 C ATOM 812 CD1 LEU A 53 -0.372 -2.655 8.089 1.00 0.00 C ATOM 813 CD2 LEU A 53 -2.587 -3.413 8.953 1.00 0.00 C ATOM 0 H LEU A 53 0.757 -7.186 8.875 1.00 0.00 H new ATOM 0 HA LEU A 53 0.804 -4.875 6.911 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.510 -5.209 7.399 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.181 -5.885 8.981 1.00 0.00 H new ATOM 0 HG LEU A 53 -0.682 -3.730 9.925 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.527 -1.678 8.547 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.695 -2.875 8.056 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.772 -2.648 7.075 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.742 -2.432 9.402 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -2.986 -3.414 7.938 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.101 -4.169 9.546 1.00 0.00 H new ATOM 825 N SER A 54 2.287 -3.644 8.403 1.00 0.00 N ATOM 826 CA SER A 54 3.224 -2.903 9.297 1.00 0.00 C ATOM 827 C SER A 54 3.127 -1.399 9.028 1.00 0.00 C ATOM 828 O SER A 54 2.754 -0.973 7.953 1.00 0.00 O ATOM 829 CB SER A 54 4.617 -3.428 8.951 1.00 0.00 C ATOM 830 OG SER A 54 5.443 -2.341 8.554 1.00 0.00 O ATOM 0 H SER A 54 2.306 -3.355 7.425 1.00 0.00 H new ATOM 0 HA SER A 54 2.992 -3.053 10.351 1.00 0.00 H new ATOM 0 HB2 SER A 54 5.052 -3.934 9.813 1.00 0.00 H new ATOM 0 HB3 SER A 54 4.552 -4.163 8.149 1.00 0.00 H new ATOM 0 HG SER A 54 6.287 -2.373 9.051 1.00 0.00 H new ATOM 836 N VAL A 55 3.448 -0.591 9.998 1.00 0.00 N ATOM 837 CA VAL A 55 3.362 0.885 9.798 1.00 0.00 C ATOM 838 C VAL A 55 4.657 1.565 10.248 1.00 0.00 C ATOM 839 O VAL A 55 5.543 0.939 10.796 1.00 0.00 O ATOM 840 CB VAL A 55 2.192 1.333 10.672 1.00 0.00 C ATOM 841 CG1 VAL A 55 2.539 1.108 12.146 1.00 0.00 C ATOM 842 CG2 VAL A 55 1.920 2.821 10.436 1.00 0.00 C ATOM 0 H VAL A 55 3.766 -0.887 10.921 1.00 0.00 H new ATOM 0 HA VAL A 55 3.218 1.149 8.750 1.00 0.00 H new ATOM 0 HB VAL A 55 1.305 0.754 10.415 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.704 1.428 12.769 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.734 0.049 12.316 1.00 0.00 H new ATOM 0 HG13 VAL A 55 3.426 1.687 12.403 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.085 3.142 11.059 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.808 3.398 10.694 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.673 2.984 9.387 1.00 0.00 H new ATOM 852 N LYS A 56 4.770 2.845 10.021 1.00 0.00 N ATOM 853 CA LYS A 56 6.004 3.572 10.434 1.00 0.00 C ATOM 854 C LYS A 56 5.659 4.665 11.450 1.00 0.00 C ATOM 855 O LYS A 56 4.669 5.358 11.318 1.00 0.00 O ATOM 856 CB LYS A 56 6.544 4.194 9.146 1.00 0.00 C ATOM 857 CG LYS A 56 8.072 4.223 9.196 1.00 0.00 C ATOM 858 CD LYS A 56 8.551 5.672 9.307 1.00 0.00 C ATOM 859 CE LYS A 56 9.740 5.892 8.368 1.00 0.00 C ATOM 860 NZ LYS A 56 10.338 7.184 8.804 1.00 0.00 N ATOM 0 H LYS A 56 4.060 3.420 9.567 1.00 0.00 H new ATOM 0 HA LYS A 56 6.732 2.914 10.908 1.00 0.00 H new ATOM 0 HB2 LYS A 56 6.209 3.619 8.283 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.154 5.205 9.026 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.430 3.644 10.048 1.00 0.00 H new ATOM 0 HG3 LYS A 56 8.485 3.760 8.300 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.741 6.354 9.050 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.840 5.893 10.335 1.00 0.00 H new ATOM 0 HE2 LYS A 56 10.460 5.077 8.445 1.00 0.00 H new ATOM 0 HE3 LYS A 56 9.419 5.936 7.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 11.161 7.405 8.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 9.631 7.942 8.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 10.640 7.109 9.796 1.00 0.00 H new ATOM 874 N THR A 57 6.467 4.826 12.461 1.00 0.00 N ATOM 875 CA THR A 57 6.183 5.877 13.480 1.00 0.00 C ATOM 876 C THR A 57 7.280 6.943 13.456 1.00 0.00 C ATOM 877 O THR A 57 7.011 8.127 13.513 1.00 0.00 O ATOM 878 CB THR A 57 6.184 5.139 14.821 1.00 0.00 C ATOM 879 OG1 THR A 57 5.316 4.017 14.741 1.00 0.00 O ATOM 880 CG2 THR A 57 5.702 6.082 15.924 1.00 0.00 C ATOM 0 H THR A 57 7.310 4.277 12.626 1.00 0.00 H new ATOM 0 HA THR A 57 5.238 6.387 13.296 1.00 0.00 H new ATOM 0 HB THR A 57 7.195 4.802 15.051 1.00 0.00 H new ATOM 0 HG1 THR A 57 5.846 3.192 14.749 1.00 0.00 H new ATOM 0 HG21 THR A 57 5.703 5.556 16.879 1.00 0.00 H new ATOM 0 HG22 THR A 57 6.368 6.943 15.983 1.00 0.00 H new ATOM 0 HG23 THR A 57 4.691 6.420 15.697 1.00 0.00 H new ATOM 888 N GLN A 58 8.516 6.533 13.368 1.00 0.00 N ATOM 889 CA GLN A 58 9.631 7.522 13.337 1.00 0.00 C ATOM 890 C GLN A 58 10.971 6.797 13.181 1.00 0.00 C ATOM 891 O GLN A 58 11.899 7.309 12.586 1.00 0.00 O ATOM 892 CB GLN A 58 9.563 8.240 14.686 1.00 0.00 C ATOM 893 CG GLN A 58 10.063 7.307 15.790 1.00 0.00 C ATOM 894 CD GLN A 58 9.932 8.003 17.146 1.00 0.00 C ATOM 895 OE1 GLN A 58 9.808 7.353 18.165 1.00 0.00 O ATOM 896 NE2 GLN A 58 9.952 9.306 17.201 1.00 0.00 N ATOM 0 H GLN A 58 8.802 5.555 13.316 1.00 0.00 H new ATOM 0 HA GLN A 58 9.545 8.218 12.502 1.00 0.00 H new ATOM 0 HB2 GLN A 58 10.170 9.145 14.659 1.00 0.00 H new ATOM 0 HB3 GLN A 58 8.539 8.549 14.894 1.00 0.00 H new ATOM 0 HG2 GLN A 58 9.487 6.382 15.787 1.00 0.00 H new ATOM 0 HG3 GLN A 58 11.103 7.035 15.608 1.00 0.00 H new ATOM 0 HE21 GLN A 58 10.056 9.851 16.345 1.00 0.00 H new ATOM 0 HE22 GLN A 58 9.864 9.780 18.100 1.00 0.00 H new ATOM 905 N SER A 59 11.079 5.609 13.709 1.00 0.00 N ATOM 906 CA SER A 59 12.357 4.851 13.588 1.00 0.00 C ATOM 907 C SER A 59 12.174 3.419 14.097 1.00 0.00 C ATOM 908 O SER A 59 13.098 2.800 14.586 1.00 0.00 O ATOM 909 CB SER A 59 13.351 5.609 14.468 1.00 0.00 C ATOM 910 OG SER A 59 14.382 6.149 13.652 1.00 0.00 O ATOM 0 H SER A 59 10.337 5.130 14.219 1.00 0.00 H new ATOM 0 HA SER A 59 12.698 4.779 12.555 1.00 0.00 H new ATOM 0 HB2 SER A 59 12.842 6.408 15.007 1.00 0.00 H new ATOM 0 HB3 SER A 59 13.776 4.940 15.216 1.00 0.00 H new ATOM 0 HG SER A 59 13.989 6.741 12.977 1.00 0.00 H new ATOM 916 N GLY A 60 10.987 2.886 13.986 1.00 0.00 N ATOM 917 CA GLY A 60 10.747 1.495 14.463 1.00 0.00 C ATOM 918 C GLY A 60 9.551 0.896 13.721 1.00 0.00 C ATOM 919 O GLY A 60 8.525 0.609 14.307 1.00 0.00 O ATOM 0 H GLY A 60 10.174 3.354 13.586 1.00 0.00 H new ATOM 0 HA2 GLY A 60 11.634 0.884 14.296 1.00 0.00 H new ATOM 0 HA3 GLY A 60 10.558 1.496 15.537 1.00 0.00 H new ATOM 923 N THR A 61 9.674 0.702 12.436 1.00 0.00 N ATOM 924 CA THR A 61 8.542 0.118 11.658 1.00 0.00 C ATOM 925 C THR A 61 8.582 -1.411 11.736 1.00 0.00 C ATOM 926 O THR A 61 9.470 -2.046 11.203 1.00 0.00 O ATOM 927 CB THR A 61 8.767 0.588 10.220 1.00 0.00 C ATOM 928 OG1 THR A 61 7.817 -0.037 9.367 1.00 0.00 O ATOM 929 CG2 THR A 61 10.180 0.212 9.773 1.00 0.00 C ATOM 0 H THR A 61 10.508 0.922 11.891 1.00 0.00 H new ATOM 0 HA THR A 61 7.571 0.431 12.042 1.00 0.00 H new ATOM 0 HB THR A 61 8.648 1.670 10.168 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.911 0.168 9.680 1.00 0.00 H new ATOM 0 HG21 THR A 61 10.339 0.548 8.748 1.00 0.00 H new ATOM 0 HG22 THR A 61 10.908 0.690 10.428 1.00 0.00 H new ATOM 0 HG23 THR A 61 10.302 -0.870 9.823 1.00 0.00 H new ATOM 937 N LYS A 62 7.627 -2.007 12.398 1.00 0.00 N ATOM 938 CA LYS A 62 7.615 -3.495 12.508 1.00 0.00 C ATOM 939 C LYS A 62 6.293 -4.056 11.975 1.00 0.00 C ATOM 940 O LYS A 62 5.336 -3.335 11.779 1.00 0.00 O ATOM 941 CB LYS A 62 7.754 -3.782 14.003 1.00 0.00 C ATOM 942 CG LYS A 62 9.028 -3.121 14.533 1.00 0.00 C ATOM 943 CD LYS A 62 10.151 -4.157 14.607 1.00 0.00 C ATOM 944 CE LYS A 62 11.490 -3.482 14.306 1.00 0.00 C ATOM 945 NZ LYS A 62 12.486 -4.589 14.299 1.00 0.00 N ATOM 0 H LYS A 62 6.857 -1.530 12.866 1.00 0.00 H new ATOM 0 HA LYS A 62 8.413 -3.958 11.927 1.00 0.00 H new ATOM 0 HB2 LYS A 62 6.884 -3.402 14.539 1.00 0.00 H new ATOM 0 HB3 LYS A 62 7.791 -4.858 14.176 1.00 0.00 H new ATOM 0 HG2 LYS A 62 9.321 -2.298 13.881 1.00 0.00 H new ATOM 0 HG3 LYS A 62 8.846 -2.696 15.520 1.00 0.00 H new ATOM 0 HD2 LYS A 62 10.176 -4.612 15.597 1.00 0.00 H new ATOM 0 HD3 LYS A 62 9.968 -4.959 13.892 1.00 0.00 H new ATOM 0 HE2 LYS A 62 11.465 -2.967 13.346 1.00 0.00 H new ATOM 0 HE3 LYS A 62 11.735 -2.736 15.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 13.431 -4.204 14.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 12.492 -5.056 15.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 12.231 -5.281 13.565 1.00 0.00 H new ATOM 959 N ASN A 63 6.235 -5.340 11.744 1.00 0.00 N ATOM 960 CA ASN A 63 4.977 -5.950 11.225 1.00 0.00 C ATOM 961 C ASN A 63 4.653 -7.227 12.004 1.00 0.00 C ATOM 962 O ASN A 63 5.527 -7.868 12.547 1.00 0.00 O ATOM 963 CB ASN A 63 5.267 -6.275 9.757 1.00 0.00 C ATOM 964 CG ASN A 63 6.134 -7.533 9.671 1.00 0.00 C ATOM 965 OD1 ASN A 63 7.300 -7.460 9.339 1.00 0.00 O ATOM 966 ND2 ASN A 63 5.610 -8.693 9.958 1.00 0.00 N ATOM 0 H ASN A 63 7.004 -5.993 11.892 1.00 0.00 H new ATOM 0 HA ASN A 63 4.120 -5.285 11.331 1.00 0.00 H new ATOM 0 HB2 ASN A 63 4.333 -6.427 9.216 1.00 0.00 H new ATOM 0 HB3 ASN A 63 5.777 -5.437 9.282 1.00 0.00 H new ATOM 0 HD21 ASN A 63 6.180 -9.537 9.903 1.00 0.00 H new ATOM 0 HD22 ASN A 63 4.631 -8.755 10.237 1.00 0.00 H new ATOM 973 N LEU A 64 3.406 -7.602 12.068 1.00 0.00 N ATOM 974 CA LEU A 64 3.042 -8.838 12.817 1.00 0.00 C ATOM 975 C LEU A 64 2.001 -9.648 12.042 1.00 0.00 C ATOM 976 O LEU A 64 0.902 -9.190 11.796 1.00 0.00 O ATOM 977 CB LEU A 64 2.460 -8.343 14.140 1.00 0.00 C ATOM 978 CG LEU A 64 3.539 -8.406 15.221 1.00 0.00 C ATOM 979 CD1 LEU A 64 3.456 -7.158 16.100 1.00 0.00 C ATOM 980 CD2 LEU A 64 3.320 -9.651 16.083 1.00 0.00 C ATOM 0 H LEU A 64 2.625 -7.108 11.636 1.00 0.00 H new ATOM 0 HA LEU A 64 3.900 -9.493 12.967 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.097 -7.321 14.031 1.00 0.00 H new ATOM 0 HB3 LEU A 64 1.605 -8.956 14.427 1.00 0.00 H new ATOM 0 HG LEU A 64 4.522 -8.454 14.752 1.00 0.00 H new ATOM 0 HD11 LEU A 64 4.226 -7.204 16.870 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.609 -6.270 15.487 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.474 -7.109 16.571 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.088 -9.699 16.855 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.337 -9.601 16.552 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.379 -10.542 15.457 1.00 0.00 H new ATOM 992 N ARG A 65 2.336 -10.849 11.660 1.00 0.00 N ATOM 993 CA ARG A 65 1.363 -11.689 10.905 1.00 0.00 C ATOM 994 C ARG A 65 0.294 -12.229 11.857 1.00 0.00 C ATOM 995 O ARG A 65 0.468 -12.240 13.060 1.00 0.00 O ATOM 996 CB ARG A 65 2.194 -12.833 10.324 1.00 0.00 C ATOM 997 CG ARG A 65 2.905 -13.575 11.459 1.00 0.00 C ATOM 998 CD ARG A 65 3.342 -14.958 10.969 1.00 0.00 C ATOM 999 NE ARG A 65 2.072 -15.691 10.710 1.00 0.00 N ATOM 1000 CZ ARG A 65 2.083 -16.990 10.576 1.00 0.00 C ATOM 1001 NH1 ARG A 65 3.207 -17.648 10.669 1.00 0.00 N ATOM 1002 NH2 ARG A 65 0.969 -17.631 10.351 1.00 0.00 N ATOM 0 H ARG A 65 3.241 -11.285 11.838 1.00 0.00 H new ATOM 0 HA ARG A 65 0.845 -11.129 10.126 1.00 0.00 H new ATOM 0 HB2 ARG A 65 1.552 -13.520 9.773 1.00 0.00 H new ATOM 0 HB3 ARG A 65 2.925 -12.443 9.616 1.00 0.00 H new ATOM 0 HG2 ARG A 65 3.772 -13.005 11.793 1.00 0.00 H new ATOM 0 HG3 ARG A 65 2.239 -13.675 12.316 1.00 0.00 H new ATOM 0 HD2 ARG A 65 3.947 -14.884 10.065 1.00 0.00 H new ATOM 0 HD3 ARG A 65 3.948 -15.469 11.717 1.00 0.00 H new ATOM 0 HE ARG A 65 1.193 -15.178 10.637 1.00 0.00 H new ATOM 0 HH11 ARG A 65 4.078 -17.147 10.847 1.00 0.00 H new ATOM 0 HH12 ARG A 65 3.214 -18.663 10.564 1.00 0.00 H new ATOM 0 HH21 ARG A 65 0.091 -17.118 10.280 1.00 0.00 H new ATOM 0 HH22 ARG A 65 0.977 -18.646 10.246 1.00 0.00 H new ATOM 1016 N ILE A 66 -0.813 -12.676 11.331 1.00 0.00 N ATOM 1017 CA ILE A 66 -1.890 -13.212 12.211 1.00 0.00 C ATOM 1018 C ILE A 66 -1.545 -14.634 12.666 1.00 0.00 C ATOM 1019 O ILE A 66 -0.899 -15.383 11.959 1.00 0.00 O ATOM 1020 CB ILE A 66 -3.150 -13.199 11.339 1.00 0.00 C ATOM 1021 CG1 ILE A 66 -4.129 -12.159 11.884 1.00 0.00 C ATOM 1022 CG2 ILE A 66 -3.817 -14.577 11.352 1.00 0.00 C ATOM 1023 CD1 ILE A 66 -4.528 -12.532 13.313 1.00 0.00 C ATOM 0 H ILE A 66 -1.018 -12.693 10.332 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.022 -12.623 13.119 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.872 -12.949 10.315 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -3.671 -11.170 11.870 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.014 -12.109 11.249 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -4.711 -14.554 10.729 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.122 -15.321 10.963 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.093 -14.838 12.374 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -5.226 -11.790 13.701 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -5.003 -13.513 13.314 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.639 -12.559 13.944 1.00 0.00 H new ATOM 1035 N GLN A 67 -1.972 -15.010 13.839 1.00 0.00 N ATOM 1036 CA GLN A 67 -1.673 -16.382 14.338 1.00 0.00 C ATOM 1037 C GLN A 67 -2.941 -17.239 14.311 1.00 0.00 C ATOM 1038 O GLN A 67 -4.008 -16.796 14.687 1.00 0.00 O ATOM 1039 CB GLN A 67 -1.188 -16.183 15.775 1.00 0.00 C ATOM 1040 CG GLN A 67 -0.646 -17.506 16.320 1.00 0.00 C ATOM 1041 CD GLN A 67 0.744 -17.768 15.738 1.00 0.00 C ATOM 1042 OE1 GLN A 67 0.877 -18.091 14.574 1.00 0.00 O ATOM 1043 NE2 GLN A 67 1.794 -17.639 16.502 1.00 0.00 N ATOM 0 H GLN A 67 -2.516 -14.426 14.475 1.00 0.00 H new ATOM 0 HA GLN A 67 -0.930 -16.894 13.726 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -0.411 -15.420 15.805 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -2.007 -15.828 16.401 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -0.595 -17.469 17.408 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -1.320 -18.322 16.060 1.00 0.00 H new ATOM 0 HE21 GLN A 67 1.684 -17.368 17.479 1.00 0.00 H new ATOM 0 HE22 GLN A 67 2.725 -17.809 16.122 1.00 0.00 H new ATOM 1052 N CYS A 68 -2.834 -18.461 13.868 1.00 0.00 N ATOM 1053 CA CYS A 68 -4.036 -19.342 13.817 1.00 0.00 C ATOM 1054 C CYS A 68 -4.214 -20.072 15.149 1.00 0.00 C ATOM 1055 O CYS A 68 -3.356 -20.815 15.582 1.00 0.00 O ATOM 1056 CB CYS A 68 -3.748 -20.339 12.694 1.00 0.00 C ATOM 1057 SG CYS A 68 -2.259 -21.285 13.095 1.00 0.00 S ATOM 0 H CYS A 68 -1.968 -18.888 13.539 1.00 0.00 H new ATOM 0 HA CYS A 68 -4.953 -18.780 13.639 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -4.596 -21.012 12.564 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -3.613 -19.811 11.750 1.00 0.00 H new ATOM 0 HG CYS A 68 -1.531 -21.422 12.027 1.00 0.00 H new ATOM 1063 N GLU A 69 -5.325 -19.866 15.804 1.00 0.00 N ATOM 1064 CA GLU A 69 -5.559 -20.548 17.108 1.00 0.00 C ATOM 1065 C GLU A 69 -6.843 -21.381 17.044 1.00 0.00 C ATOM 1066 O GLU A 69 -7.938 -20.858 17.115 1.00 0.00 O ATOM 1067 CB GLU A 69 -5.706 -19.416 18.126 1.00 0.00 C ATOM 1068 CG GLU A 69 -4.885 -19.745 19.376 1.00 0.00 C ATOM 1069 CD GLU A 69 -3.794 -18.690 19.563 1.00 0.00 C ATOM 1070 OE1 GLU A 69 -3.492 -18.002 18.602 1.00 0.00 O ATOM 1071 OE2 GLU A 69 -3.278 -18.589 20.664 1.00 0.00 O ATOM 0 H GLU A 69 -6.080 -19.255 15.492 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.749 -21.229 17.370 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -5.367 -18.476 17.692 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.755 -19.285 18.391 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.533 -19.773 20.252 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.437 -20.734 19.280 1.00 0.00 H new ATOM 1078 N GLY A 70 -6.717 -22.673 16.909 1.00 0.00 N ATOM 1079 CA GLY A 70 -7.929 -23.536 16.840 1.00 0.00 C ATOM 1080 C GLY A 70 -8.764 -23.149 15.618 1.00 0.00 C ATOM 1081 O GLY A 70 -8.737 -23.811 14.600 1.00 0.00 O ATOM 0 H GLY A 70 -5.827 -23.168 16.844 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.638 -24.585 16.777 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.521 -23.423 17.748 1.00 0.00 H new ATOM 1085 N GLY A 71 -9.506 -22.079 15.710 1.00 0.00 N ATOM 1086 CA GLY A 71 -10.342 -21.651 14.553 1.00 0.00 C ATOM 1087 C GLY A 71 -10.461 -20.125 14.546 1.00 0.00 C ATOM 1088 O GLY A 71 -11.449 -19.573 14.105 1.00 0.00 O ATOM 0 H GLY A 71 -9.569 -21.483 16.536 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -9.895 -21.996 13.621 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -11.332 -22.103 14.619 1.00 0.00 H new ATOM 1092 N SER A 72 -9.462 -19.441 15.031 1.00 0.00 N ATOM 1093 CA SER A 72 -9.520 -17.950 15.051 1.00 0.00 C ATOM 1094 C SER A 72 -8.151 -17.362 14.695 1.00 0.00 C ATOM 1095 O SER A 72 -7.143 -18.038 14.743 1.00 0.00 O ATOM 1096 CB SER A 72 -9.903 -17.590 16.486 1.00 0.00 C ATOM 1097 OG SER A 72 -9.028 -16.578 16.967 1.00 0.00 O ATOM 0 H SER A 72 -8.609 -19.848 15.414 1.00 0.00 H new ATOM 0 HA SER A 72 -10.232 -17.553 14.327 1.00 0.00 H new ATOM 0 HB2 SER A 72 -10.935 -17.242 16.522 1.00 0.00 H new ATOM 0 HB3 SER A 72 -9.842 -18.472 17.123 1.00 0.00 H new ATOM 0 HG SER A 72 -9.273 -16.344 17.887 1.00 0.00 H new ATOM 1103 N PHE A 73 -8.109 -16.107 14.340 1.00 0.00 N ATOM 1104 CA PHE A 73 -6.803 -15.476 13.983 1.00 0.00 C ATOM 1105 C PHE A 73 -6.465 -14.370 14.986 1.00 0.00 C ATOM 1106 O PHE A 73 -7.325 -13.633 15.423 1.00 0.00 O ATOM 1107 CB PHE A 73 -7.015 -14.881 12.590 1.00 0.00 C ATOM 1108 CG PHE A 73 -6.616 -15.878 11.528 1.00 0.00 C ATOM 1109 CD1 PHE A 73 -5.535 -16.745 11.740 1.00 0.00 C ATOM 1110 CD2 PHE A 73 -7.328 -15.931 10.324 1.00 0.00 C ATOM 1111 CE1 PHE A 73 -5.169 -17.663 10.747 1.00 0.00 C ATOM 1112 CE2 PHE A 73 -6.962 -16.848 9.333 1.00 0.00 C ATOM 1113 CZ PHE A 73 -5.883 -17.715 9.545 1.00 0.00 C ATOM 0 H PHE A 73 -8.920 -15.491 14.281 1.00 0.00 H new ATOM 0 HA PHE A 73 -5.981 -16.191 14.000 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -8.061 -14.602 12.462 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -6.426 -13.970 12.483 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.985 -16.705 12.668 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -8.161 -15.263 10.160 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -4.336 -18.331 10.909 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.512 -16.887 8.404 1.00 0.00 H new ATOM 0 HZ PHE A 73 -5.602 -18.424 8.780 1.00 0.00 H new ATOM 1123 N SER A 74 -5.221 -14.243 15.357 1.00 0.00 N ATOM 1124 CA SER A 74 -4.849 -13.178 16.333 1.00 0.00 C ATOM 1125 C SER A 74 -3.431 -12.669 16.061 1.00 0.00 C ATOM 1126 O SER A 74 -2.529 -13.432 15.779 1.00 0.00 O ATOM 1127 CB SER A 74 -4.919 -13.855 17.701 1.00 0.00 C ATOM 1128 OG SER A 74 -3.827 -13.417 18.498 1.00 0.00 O ATOM 0 H SER A 74 -4.450 -14.825 15.030 1.00 0.00 H new ATOM 0 HA SER A 74 -5.510 -12.314 16.267 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.862 -13.613 18.191 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.888 -14.938 17.585 1.00 0.00 H new ATOM 0 HG SER A 74 -3.870 -13.848 19.377 1.00 0.00 H new ATOM 1134 N LEU A 75 -3.230 -11.382 16.153 1.00 0.00 N ATOM 1135 CA LEU A 75 -1.871 -10.821 15.911 1.00 0.00 C ATOM 1136 C LEU A 75 -1.054 -10.865 17.205 1.00 0.00 C ATOM 1137 O LEU A 75 0.097 -10.477 17.241 1.00 0.00 O ATOM 1138 CB LEU A 75 -2.112 -9.374 15.475 1.00 0.00 C ATOM 1139 CG LEU A 75 -0.969 -8.914 14.570 1.00 0.00 C ATOM 1140 CD1 LEU A 75 -1.532 -8.487 13.212 1.00 0.00 C ATOM 1141 CD2 LEU A 75 -0.253 -7.726 15.218 1.00 0.00 C ATOM 0 H LEU A 75 -3.948 -10.696 16.385 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.314 -11.382 15.160 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.062 -9.296 14.946 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -2.180 -8.727 16.349 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.265 -9.734 14.431 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.717 -8.159 12.567 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.044 -9.330 12.749 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.236 -7.667 13.352 1.00 0.00 H new ATOM 0 HD21 LEU A 75 0.562 -7.397 14.574 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.959 -6.907 15.357 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.148 -8.027 16.186 1.00 0.00 H new ATOM 1384 N VAL A 91 -10.392 -12.975 9.588 1.00 0.00 N ATOM 1385 CA VAL A 91 -9.117 -12.369 10.054 1.00 0.00 C ATOM 1386 C VAL A 91 -9.268 -10.847 10.103 1.00 0.00 C ATOM 1387 O VAL A 91 -8.515 -10.151 10.756 1.00 0.00 O ATOM 1388 CB VAL A 91 -8.072 -12.790 9.014 1.00 0.00 C ATOM 1389 CG1 VAL A 91 -7.796 -11.634 8.048 1.00 0.00 C ATOM 1390 CG2 VAL A 91 -6.775 -13.174 9.725 1.00 0.00 C ATOM 0 HA VAL A 91 -8.831 -12.695 11.054 1.00 0.00 H new ATOM 0 HB VAL A 91 -8.453 -13.643 8.452 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.052 -11.943 7.313 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.719 -11.359 7.537 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.420 -10.776 8.605 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -6.031 -13.474 8.987 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -6.403 -12.319 10.290 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -6.965 -14.003 10.406 1.00 0.00 H new ATOM 1400 N LEU A 92 -10.218 -10.329 9.376 1.00 0.00 N ATOM 1401 CA LEU A 92 -10.413 -8.848 9.322 1.00 0.00 C ATOM 1402 C LEU A 92 -10.573 -8.249 10.726 1.00 0.00 C ATOM 1403 O LEU A 92 -10.150 -7.141 10.978 1.00 0.00 O ATOM 1404 CB LEU A 92 -11.693 -8.653 8.508 1.00 0.00 C ATOM 1405 CG LEU A 92 -12.905 -8.939 9.392 1.00 0.00 C ATOM 1406 CD1 LEU A 92 -13.383 -7.639 10.039 1.00 0.00 C ATOM 1407 CD2 LEU A 92 -14.031 -9.531 8.542 1.00 0.00 C ATOM 0 H LEU A 92 -10.874 -10.870 8.812 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.553 -8.346 8.878 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -11.741 -7.634 8.124 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -11.693 -9.319 7.645 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.626 -9.650 10.169 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -14.248 -7.843 10.670 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -12.582 -7.219 10.647 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -13.661 -6.927 9.262 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -14.895 -9.735 9.174 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -14.310 -8.822 7.763 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -13.691 -10.459 8.083 1.00 0.00 H new ATOM 1419 N LYS A 93 -11.175 -8.954 11.643 1.00 0.00 N ATOM 1420 CA LYS A 93 -11.340 -8.382 13.013 1.00 0.00 C ATOM 1421 C LYS A 93 -9.969 -8.015 13.589 1.00 0.00 C ATOM 1422 O LYS A 93 -9.836 -7.089 14.364 1.00 0.00 O ATOM 1423 CB LYS A 93 -11.998 -9.487 13.838 1.00 0.00 C ATOM 1424 CG LYS A 93 -13.156 -8.893 14.644 1.00 0.00 C ATOM 1425 CD LYS A 93 -12.795 -8.885 16.131 1.00 0.00 C ATOM 1426 CE LYS A 93 -13.979 -8.353 16.941 1.00 0.00 C ATOM 1427 NZ LYS A 93 -15.082 -9.323 16.691 1.00 0.00 N ATOM 0 H LYS A 93 -11.556 -9.890 11.508 1.00 0.00 H new ATOM 0 HA LYS A 93 -11.943 -7.474 13.014 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -12.363 -10.278 13.183 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -11.268 -9.940 14.508 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -13.366 -7.879 14.305 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -14.062 -9.477 14.482 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -12.539 -9.892 16.459 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -11.916 -8.262 16.299 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -13.737 -8.295 18.002 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -14.256 -7.348 16.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -15.616 -9.476 17.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -15.718 -8.944 15.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -14.683 -10.227 16.367 1.00 0.00 H new ATOM 1441 N LEU A 94 -8.948 -8.730 13.205 1.00 0.00 N ATOM 1442 CA LEU A 94 -7.578 -8.427 13.712 1.00 0.00 C ATOM 1443 C LEU A 94 -7.186 -6.988 13.349 1.00 0.00 C ATOM 1444 O LEU A 94 -6.466 -6.329 14.071 1.00 0.00 O ATOM 1445 CB LEU A 94 -6.661 -9.430 13.008 1.00 0.00 C ATOM 1446 CG LEU A 94 -6.277 -8.899 11.624 1.00 0.00 C ATOM 1447 CD1 LEU A 94 -5.086 -7.948 11.753 1.00 0.00 C ATOM 1448 CD2 LEU A 94 -5.898 -10.069 10.720 1.00 0.00 C ATOM 0 H LEU A 94 -9.003 -9.516 12.558 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.511 -8.510 14.797 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.764 -9.598 13.605 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.165 -10.392 12.912 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.123 -8.363 11.193 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -4.813 -7.571 10.767 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.356 -7.113 12.400 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.239 -8.482 12.184 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.624 -9.693 9.734 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.052 -10.604 11.152 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.747 -10.747 10.627 1.00 0.00 H new ATOM 1460 N VAL A 95 -7.647 -6.508 12.226 1.00 0.00 N ATOM 1461 CA VAL A 95 -7.295 -5.121 11.798 1.00 0.00 C ATOM 1462 C VAL A 95 -7.627 -4.121 12.908 1.00 0.00 C ATOM 1463 O VAL A 95 -6.935 -3.138 13.090 1.00 0.00 O ATOM 1464 CB VAL A 95 -8.145 -4.847 10.556 1.00 0.00 C ATOM 1465 CG1 VAL A 95 -8.035 -6.026 9.586 1.00 0.00 C ATOM 1466 CG2 VAL A 95 -9.607 -4.656 10.965 1.00 0.00 C ATOM 0 H VAL A 95 -8.254 -7.017 11.584 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.230 -5.020 11.587 1.00 0.00 H new ATOM 0 HB VAL A 95 -7.785 -3.942 10.067 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.642 -5.828 8.702 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.994 -6.158 9.290 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.391 -6.933 10.074 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -10.210 -4.461 10.078 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.968 -5.559 11.458 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -9.686 -3.812 11.650 1.00 0.00 H new ATOM 1476 N HIS A 96 -8.676 -4.347 13.648 1.00 0.00 N ATOM 1477 CA HIS A 96 -9.031 -3.387 14.732 1.00 0.00 C ATOM 1478 C HIS A 96 -7.803 -3.131 15.611 1.00 0.00 C ATOM 1479 O HIS A 96 -7.634 -2.058 16.156 1.00 0.00 O ATOM 1480 CB HIS A 96 -10.134 -4.079 15.532 1.00 0.00 C ATOM 1481 CG HIS A 96 -11.476 -3.674 14.987 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -12.019 -4.256 13.852 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -12.395 -2.747 15.410 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -13.214 -3.678 13.632 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -13.493 -2.751 14.554 1.00 0.00 N ATOM 0 H HIS A 96 -9.299 -5.148 13.551 1.00 0.00 H new ATOM 0 HA HIS A 96 -9.361 -2.422 14.348 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -10.017 -5.161 15.473 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -10.060 -3.807 16.585 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -12.284 -2.111 16.276 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -13.868 -3.932 12.811 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -14.330 -2.171 14.617 1.00 0.00 H new ATOM 1493 N HIS A 97 -6.931 -4.096 15.733 1.00 0.00 N ATOM 1494 CA HIS A 97 -5.702 -3.882 16.552 1.00 0.00 C ATOM 1495 C HIS A 97 -4.753 -2.959 15.786 1.00 0.00 C ATOM 1496 O HIS A 97 -4.076 -2.127 16.358 1.00 0.00 O ATOM 1497 CB HIS A 97 -5.078 -5.267 16.731 1.00 0.00 C ATOM 1498 CG HIS A 97 -4.457 -5.365 18.099 1.00 0.00 C ATOM 1499 ND1 HIS A 97 -5.136 -5.905 19.180 1.00 0.00 N ATOM 1500 CD2 HIS A 97 -3.221 -4.997 18.580 1.00 0.00 C ATOM 1501 CE1 HIS A 97 -4.317 -5.847 20.245 1.00 0.00 C ATOM 1502 NE2 HIS A 97 -3.138 -5.303 19.935 1.00 0.00 N ATOM 0 H HIS A 97 -7.015 -5.018 15.304 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.914 -3.421 17.517 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.838 -6.039 16.609 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -4.323 -5.439 15.964 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -2.436 -4.541 17.995 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -4.581 -6.198 21.232 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -2.346 -5.145 20.558 1.00 0.00 H new ATOM 1510 N TYR A 98 -4.711 -3.100 14.488 1.00 0.00 N ATOM 1511 CA TYR A 98 -3.819 -2.235 13.665 1.00 0.00 C ATOM 1512 C TYR A 98 -4.261 -0.776 13.787 1.00 0.00 C ATOM 1513 O TYR A 98 -3.496 0.139 13.552 1.00 0.00 O ATOM 1514 CB TYR A 98 -4.014 -2.729 12.229 1.00 0.00 C ATOM 1515 CG TYR A 98 -3.003 -3.805 11.916 1.00 0.00 C ATOM 1516 CD1 TYR A 98 -1.674 -3.654 12.324 1.00 0.00 C ATOM 1517 CD2 TYR A 98 -3.393 -4.949 11.209 1.00 0.00 C ATOM 1518 CE1 TYR A 98 -0.734 -4.647 12.029 1.00 0.00 C ATOM 1519 CE2 TYR A 98 -2.453 -5.944 10.913 1.00 0.00 C ATOM 1520 CZ TYR A 98 -1.123 -5.793 11.322 1.00 0.00 C ATOM 1521 OH TYR A 98 -0.194 -6.772 11.031 1.00 0.00 O ATOM 0 H TYR A 98 -5.259 -3.780 13.961 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.777 -2.287 13.979 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -5.024 -3.119 12.103 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -3.903 -1.899 11.531 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -1.373 -2.770 12.867 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -4.419 -5.064 10.892 1.00 0.00 H new ATOM 0 HE1 TYR A 98 0.292 -4.531 12.346 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -2.754 -6.827 10.369 1.00 0.00 H new ATOM 0 HH TYR A 98 0.621 -6.356 10.681 1.00 0.00 H new ATOM 1531 N MET A 99 -5.494 -0.556 14.153 1.00 0.00 N ATOM 1532 CA MET A 99 -6.002 0.840 14.295 1.00 0.00 C ATOM 1533 C MET A 99 -6.165 1.488 12.919 1.00 0.00 C ATOM 1534 O MET A 99 -5.507 2.461 12.607 1.00 0.00 O ATOM 1535 CB MET A 99 -4.936 1.572 15.112 1.00 0.00 C ATOM 1536 CG MET A 99 -5.600 2.664 15.954 1.00 0.00 C ATOM 1537 SD MET A 99 -4.328 3.595 16.843 1.00 0.00 S ATOM 1538 CE MET A 99 -4.392 2.651 18.386 1.00 0.00 C ATOM 0 H MET A 99 -6.175 -1.286 14.361 1.00 0.00 H new ATOM 0 HA MET A 99 -6.978 0.875 14.778 1.00 0.00 H new ATOM 0 HB2 MET A 99 -4.411 0.868 15.758 1.00 0.00 H new ATOM 0 HB3 MET A 99 -4.192 2.012 14.448 1.00 0.00 H new ATOM 0 HG2 MET A 99 -6.175 3.333 15.314 1.00 0.00 H new ATOM 0 HG3 MET A 99 -6.300 2.218 16.660 1.00 0.00 H new ATOM 0 HE1 MET A 99 -3.838 3.182 19.160 1.00 0.00 H new ATOM 0 HE2 MET A 99 -5.430 2.534 18.698 1.00 0.00 H new ATOM 0 HE3 MET A 99 -3.947 1.668 18.230 1.00 0.00 H new ATOM 2022 N ARG A 134 -7.760 0.485 22.474 1.00 0.00 N ATOM 2023 CA ARG A 134 -7.206 0.747 21.115 1.00 0.00 C ATOM 2024 C ARG A 134 -5.788 1.314 21.227 1.00 0.00 C ATOM 2025 O ARG A 134 -5.584 2.407 21.718 1.00 0.00 O ATOM 2026 CB ARG A 134 -8.149 1.779 20.495 1.00 0.00 C ATOM 2027 CG ARG A 134 -8.974 1.119 19.389 1.00 0.00 C ATOM 2028 CD ARG A 134 -10.435 1.556 19.513 1.00 0.00 C ATOM 2029 NE ARG A 134 -10.656 2.490 18.373 1.00 0.00 N ATOM 2030 CZ ARG A 134 -11.864 2.874 18.066 1.00 0.00 C ATOM 2031 NH1 ARG A 134 -12.884 2.441 18.758 1.00 0.00 N ATOM 2032 NH2 ARG A 134 -12.056 3.689 17.066 1.00 0.00 N ATOM 0 HA ARG A 134 -7.141 -0.158 20.512 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.809 2.189 21.259 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -7.576 2.612 20.088 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -8.581 1.399 18.411 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -8.900 0.034 19.464 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -11.109 0.701 19.459 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -10.620 2.048 20.468 1.00 0.00 H new ATOM 0 HE ARG A 134 -9.861 2.830 17.832 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -12.736 1.802 19.539 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -13.828 2.742 18.517 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -11.261 4.027 16.523 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -13.001 3.989 16.827 1.00 0.00 H new ATOM 2046 N ALA A 135 -4.805 0.582 20.776 1.00 0.00 N ATOM 2047 CA ALA A 135 -3.406 1.085 20.861 1.00 0.00 C ATOM 2048 C ALA A 135 -2.467 0.153 20.098 1.00 0.00 C ATOM 2049 O ALA A 135 -2.432 -1.036 20.340 1.00 0.00 O ATOM 2050 CB ALA A 135 -3.062 1.072 22.354 1.00 0.00 C ATOM 0 H ALA A 135 -4.911 -0.340 20.354 1.00 0.00 H new ATOM 0 HA ALA A 135 -3.302 2.079 20.427 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -2.043 1.431 22.496 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -3.753 1.720 22.892 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -3.145 0.055 22.738 1.00 0.00 H new ATOM 2056 N TYR A 136 -1.697 0.681 19.189 1.00 0.00 N ATOM 2057 CA TYR A 136 -0.753 -0.187 18.437 1.00 0.00 C ATOM 2058 C TYR A 136 0.653 0.419 18.496 1.00 0.00 C ATOM 2059 O TYR A 136 0.866 1.535 18.075 1.00 0.00 O ATOM 2060 CB TYR A 136 -1.284 -0.165 16.999 1.00 0.00 C ATOM 2061 CG TYR A 136 -0.967 -1.468 16.310 1.00 0.00 C ATOM 2062 CD1 TYR A 136 -1.532 -2.661 16.775 1.00 0.00 C ATOM 2063 CD2 TYR A 136 -0.108 -1.485 15.205 1.00 0.00 C ATOM 2064 CE1 TYR A 136 -1.236 -3.872 16.134 1.00 0.00 C ATOM 2065 CE2 TYR A 136 0.189 -2.695 14.565 1.00 0.00 C ATOM 2066 CZ TYR A 136 -0.376 -3.888 15.030 1.00 0.00 C ATOM 2067 OH TYR A 136 -0.082 -5.083 14.405 1.00 0.00 O ATOM 0 H TYR A 136 -1.681 1.669 18.936 1.00 0.00 H new ATOM 0 HA TYR A 136 -0.688 -1.199 18.838 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.361 0.000 17.003 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -0.836 0.664 16.450 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -2.196 -2.649 17.627 1.00 0.00 H new ATOM 0 HD2 TYR A 136 0.326 -0.564 14.845 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -1.672 -4.793 16.492 1.00 0.00 H new ATOM 0 HE2 TYR A 136 0.853 -2.707 13.714 1.00 0.00 H new ATOM 0 HH TYR A 136 -0.626 -5.171 13.594 1.00 0.00 H new ATOM 2077 N TYR A 137 1.620 -0.301 19.002 1.00 0.00 N ATOM 2078 CA TYR A 137 2.995 0.272 19.055 1.00 0.00 C ATOM 2079 C TYR A 137 4.064 -0.822 19.121 1.00 0.00 C ATOM 2080 O TYR A 137 3.776 -1.982 19.332 1.00 0.00 O ATOM 2081 CB TYR A 137 3.017 1.198 20.271 1.00 0.00 C ATOM 2082 CG TYR A 137 3.200 0.434 21.558 1.00 0.00 C ATOM 2083 CD1 TYR A 137 4.486 0.127 22.023 1.00 0.00 C ATOM 2084 CD2 TYR A 137 2.078 0.067 22.304 1.00 0.00 C ATOM 2085 CE1 TYR A 137 4.643 -0.555 23.232 1.00 0.00 C ATOM 2086 CE2 TYR A 137 2.233 -0.611 23.515 1.00 0.00 C ATOM 2087 CZ TYR A 137 3.518 -0.925 23.981 1.00 0.00 C ATOM 2088 OH TYR A 137 3.672 -1.592 25.179 1.00 0.00 O ATOM 0 H TYR A 137 1.520 -1.245 19.375 1.00 0.00 H new ATOM 0 HA TYR A 137 3.232 0.829 18.148 1.00 0.00 H new ATOM 0 HB2 TYR A 137 3.824 1.922 20.161 1.00 0.00 H new ATOM 0 HB3 TYR A 137 2.086 1.763 20.314 1.00 0.00 H new ATOM 0 HD1 TYR A 137 5.353 0.417 21.448 1.00 0.00 H new ATOM 0 HD2 TYR A 137 1.089 0.308 21.944 1.00 0.00 H new ATOM 0 HE1 TYR A 137 5.633 -0.797 23.590 1.00 0.00 H new ATOM 0 HE2 TYR A 137 1.365 -0.893 24.092 1.00 0.00 H new ATOM 0 HH TYR A 137 4.080 -2.468 25.016 1.00 0.00 H new ATOM 2098 N ILE A 138 5.300 -0.452 18.915 1.00 0.00 N ATOM 2099 CA ILE A 138 6.402 -1.456 18.933 1.00 0.00 C ATOM 2100 C ILE A 138 7.228 -1.332 20.211 1.00 0.00 C ATOM 2101 O ILE A 138 7.361 -0.268 20.781 1.00 0.00 O ATOM 2102 CB ILE A 138 7.257 -1.123 17.711 1.00 0.00 C ATOM 2103 CG1 ILE A 138 6.463 -1.418 16.437 1.00 0.00 C ATOM 2104 CG2 ILE A 138 8.526 -1.978 17.727 1.00 0.00 C ATOM 2105 CD1 ILE A 138 6.090 -0.102 15.750 1.00 0.00 C ATOM 0 H ILE A 138 5.594 0.508 18.734 1.00 0.00 H new ATOM 0 HA ILE A 138 6.022 -2.477 18.906 1.00 0.00 H new ATOM 0 HB ILE A 138 7.528 -0.068 17.736 1.00 0.00 H new ATOM 0 HG12 ILE A 138 7.054 -2.037 15.763 1.00 0.00 H new ATOM 0 HG13 ILE A 138 5.562 -1.982 16.680 1.00 0.00 H new ATOM 0 HG21 ILE A 138 9.136 -1.740 16.855 1.00 0.00 H new ATOM 0 HG22 ILE A 138 9.093 -1.770 18.634 1.00 0.00 H new ATOM 0 HG23 ILE A 138 8.254 -3.033 17.703 1.00 0.00 H new ATOM 0 HD11 ILE A 138 5.524 -0.313 14.842 1.00 0.00 H new ATOM 0 HD12 ILE A 138 5.482 0.501 16.425 1.00 0.00 H new ATOM 0 HD13 ILE A 138 6.998 0.444 15.493 1.00 0.00 H new ATOM 2117 N TYR A 139 7.779 -2.421 20.666 1.00 0.00 N ATOM 2118 CA TYR A 139 8.594 -2.384 21.913 1.00 0.00 C ATOM 2119 C TYR A 139 10.081 -2.254 21.591 1.00 0.00 C ATOM 2120 O TYR A 139 10.613 -2.950 20.749 1.00 0.00 O ATOM 2121 CB TYR A 139 8.304 -3.706 22.606 1.00 0.00 C ATOM 2122 CG TYR A 139 6.864 -3.711 23.031 1.00 0.00 C ATOM 2123 CD1 TYR A 139 5.856 -3.825 22.070 1.00 0.00 C ATOM 2124 CD2 TYR A 139 6.538 -3.588 24.382 1.00 0.00 C ATOM 2125 CE1 TYR A 139 4.515 -3.819 22.460 1.00 0.00 C ATOM 2126 CE2 TYR A 139 5.195 -3.583 24.777 1.00 0.00 C ATOM 2127 CZ TYR A 139 4.182 -3.699 23.815 1.00 0.00 C ATOM 2128 OH TYR A 139 2.859 -3.693 24.204 1.00 0.00 O ATOM 0 H TYR A 139 7.700 -3.339 20.227 1.00 0.00 H new ATOM 0 HA TYR A 139 8.344 -1.528 22.539 1.00 0.00 H new ATOM 0 HB2 TYR A 139 8.504 -4.539 21.932 1.00 0.00 H new ATOM 0 HB3 TYR A 139 8.955 -3.832 23.471 1.00 0.00 H new ATOM 0 HD1 TYR A 139 6.114 -3.918 21.025 1.00 0.00 H new ATOM 0 HD2 TYR A 139 7.320 -3.497 25.121 1.00 0.00 H new ATOM 0 HE1 TYR A 139 3.736 -3.907 21.717 1.00 0.00 H new ATOM 0 HE2 TYR A 139 4.940 -3.490 25.822 1.00 0.00 H new ATOM 0 HH TYR A 139 2.594 -2.782 24.449 1.00 0.00 H new ATOM 2138 N SER A 140 10.750 -1.364 22.262 1.00 0.00 N ATOM 2139 CA SER A 140 12.208 -1.173 22.010 1.00 0.00 C ATOM 2140 C SER A 140 13.025 -2.133 22.878 1.00 0.00 C ATOM 2141 O SER A 140 13.974 -1.741 23.529 1.00 0.00 O ATOM 2142 CB SER A 140 12.491 0.276 22.400 1.00 0.00 C ATOM 2143 OG SER A 140 12.538 1.078 21.228 1.00 0.00 O ATOM 0 H SER A 140 10.352 -0.756 22.978 1.00 0.00 H new ATOM 0 HA SER A 140 12.478 -1.375 20.974 1.00 0.00 H new ATOM 0 HB2 SER A 140 11.716 0.641 23.073 1.00 0.00 H new ATOM 0 HB3 SER A 140 13.437 0.342 22.938 1.00 0.00 H new ATOM 0 HG SER A 140 11.973 0.677 20.534 1.00 0.00 H new ATOM 2149 N GLY A 141 12.665 -3.387 22.894 1.00 0.00 N ATOM 2150 CA GLY A 141 13.422 -4.369 23.720 1.00 0.00 C ATOM 2151 C GLY A 141 13.525 -3.854 25.157 1.00 0.00 C ATOM 2152 O GLY A 141 14.596 -3.548 25.643 1.00 0.00 O ATOM 0 H GLY A 141 11.879 -3.774 22.371 1.00 0.00 H new ATOM 0 HA2 GLY A 141 12.921 -5.337 23.704 1.00 0.00 H new ATOM 0 HA3 GLY A 141 14.418 -4.519 23.304 1.00 0.00 H new ATOM 2156 N GLY A 142 12.417 -3.755 25.841 1.00 0.00 N ATOM 2157 CA GLY A 142 12.452 -3.257 27.246 1.00 0.00 C ATOM 2158 C GLY A 142 11.745 -1.904 27.325 1.00 0.00 C ATOM 2159 O GLY A 142 11.290 -1.490 28.373 1.00 0.00 O ATOM 0 H GLY A 142 11.491 -3.997 25.488 1.00 0.00 H new ATOM 0 HA2 GLY A 142 11.966 -3.973 27.909 1.00 0.00 H new ATOM 0 HA3 GLY A 142 13.484 -3.160 27.583 1.00 0.00 H new ATOM 2163 N GLU A 143 11.648 -1.209 26.224 1.00 0.00 N ATOM 2164 CA GLU A 143 10.970 0.119 26.237 1.00 0.00 C ATOM 2165 C GLU A 143 9.735 0.090 25.332 1.00 0.00 C ATOM 2166 O GLU A 143 9.824 -0.188 24.154 1.00 0.00 O ATOM 2167 CB GLU A 143 12.010 1.101 25.696 1.00 0.00 C ATOM 2168 CG GLU A 143 12.600 1.909 26.853 1.00 0.00 C ATOM 2169 CD GLU A 143 13.973 1.345 27.222 1.00 0.00 C ATOM 2170 OE1 GLU A 143 14.266 0.235 26.810 1.00 0.00 O ATOM 2171 OE2 GLU A 143 14.709 2.033 27.910 1.00 0.00 O ATOM 0 H GLU A 143 12.009 -1.503 25.316 1.00 0.00 H new ATOM 0 HA GLU A 143 10.627 0.398 27.233 1.00 0.00 H new ATOM 0 HB2 GLU A 143 12.801 0.560 25.176 1.00 0.00 H new ATOM 0 HB3 GLU A 143 11.550 1.770 24.969 1.00 0.00 H new ATOM 0 HG2 GLU A 143 12.690 2.958 26.569 1.00 0.00 H new ATOM 0 HG3 GLU A 143 11.935 1.868 27.715 1.00 0.00 H new ATOM 2178 N LYS A 144 8.583 0.376 25.875 1.00 0.00 N ATOM 2179 CA LYS A 144 7.344 0.364 25.043 1.00 0.00 C ATOM 2180 C LYS A 144 7.120 1.734 24.404 1.00 0.00 C ATOM 2181 O LYS A 144 6.713 2.678 25.052 1.00 0.00 O ATOM 2182 CB LYS A 144 6.211 0.032 26.016 1.00 0.00 C ATOM 2183 CG LYS A 144 6.305 0.935 27.248 1.00 0.00 C ATOM 2184 CD LYS A 144 4.909 1.141 27.838 1.00 0.00 C ATOM 2185 CE LYS A 144 4.194 2.262 27.081 1.00 0.00 C ATOM 2186 NZ LYS A 144 2.743 2.022 27.318 1.00 0.00 N ATOM 0 H LYS A 144 8.445 0.617 26.856 1.00 0.00 H new ATOM 0 HA LYS A 144 7.404 -0.358 24.229 1.00 0.00 H new ATOM 0 HB2 LYS A 144 5.247 0.169 25.526 1.00 0.00 H new ATOM 0 HB3 LYS A 144 6.271 -1.014 26.315 1.00 0.00 H new ATOM 0 HG2 LYS A 144 6.963 0.486 27.992 1.00 0.00 H new ATOM 0 HG3 LYS A 144 6.741 1.896 26.975 1.00 0.00 H new ATOM 0 HD2 LYS A 144 4.334 0.218 27.770 1.00 0.00 H new ATOM 0 HD3 LYS A 144 4.983 1.392 28.896 1.00 0.00 H new ATOM 0 HE2 LYS A 144 4.497 3.242 27.449 1.00 0.00 H new ATOM 0 HE3 LYS A 144 4.430 2.233 26.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 2.186 2.752 26.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 2.482 1.084 26.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 2.547 2.062 28.339 1.00 0.00 H new ATOM 2200 N ILE A 145 7.372 1.838 23.131 1.00 0.00 N ATOM 2201 CA ILE A 145 7.165 3.132 22.423 1.00 0.00 C ATOM 2202 C ILE A 145 5.782 3.124 21.776 1.00 0.00 C ATOM 2203 O ILE A 145 5.585 2.480 20.767 1.00 0.00 O ATOM 2204 CB ILE A 145 8.254 3.162 21.354 1.00 0.00 C ATOM 2205 CG1 ILE A 145 9.540 3.733 21.951 1.00 0.00 C ATOM 2206 CG2 ILE A 145 7.797 4.028 20.183 1.00 0.00 C ATOM 2207 CD1 ILE A 145 10.437 2.581 22.399 1.00 0.00 C ATOM 0 H ILE A 145 7.715 1.077 22.545 1.00 0.00 H new ATOM 0 HA ILE A 145 7.219 3.999 23.081 1.00 0.00 H new ATOM 0 HB ILE A 145 8.443 2.149 20.998 1.00 0.00 H new ATOM 0 HG12 ILE A 145 10.057 4.347 21.213 1.00 0.00 H new ATOM 0 HG13 ILE A 145 9.307 4.379 22.797 1.00 0.00 H new ATOM 0 HG21 ILE A 145 8.575 4.049 19.420 1.00 0.00 H new ATOM 0 HG22 ILE A 145 6.883 3.612 19.758 1.00 0.00 H new ATOM 0 HG23 ILE A 145 7.605 5.042 20.534 1.00 0.00 H new ATOM 0 HD11 ILE A 145 11.357 2.981 22.826 1.00 0.00 H new ATOM 0 HD12 ILE A 145 9.917 1.986 23.150 1.00 0.00 H new ATOM 0 HD13 ILE A 145 10.678 1.953 21.541 1.00 0.00 H new ATOM 2219 N PRO A 146 4.857 3.811 22.388 1.00 0.00 N ATOM 2220 CA PRO A 146 3.480 3.830 21.852 1.00 0.00 C ATOM 2221 C PRO A 146 3.355 4.738 20.624 1.00 0.00 C ATOM 2222 O PRO A 146 3.678 5.909 20.654 1.00 0.00 O ATOM 2223 CB PRO A 146 2.659 4.385 23.011 1.00 0.00 C ATOM 2224 CG PRO A 146 3.624 5.191 23.828 1.00 0.00 C ATOM 2225 CD PRO A 146 4.999 4.613 23.606 1.00 0.00 C ATOM 0 HA PRO A 146 3.155 2.845 21.517 1.00 0.00 H new ATOM 0 HB2 PRO A 146 1.837 5.003 22.650 1.00 0.00 H new ATOM 0 HB3 PRO A 146 2.219 3.582 23.602 1.00 0.00 H new ATOM 0 HG2 PRO A 146 3.596 6.239 23.530 1.00 0.00 H new ATOM 0 HG3 PRO A 146 3.358 5.152 24.884 1.00 0.00 H new ATOM 0 HD2 PRO A 146 5.746 5.397 23.482 1.00 0.00 H new ATOM 0 HD3 PRO A 146 5.316 4.002 24.451 1.00 0.00 H new ATOM 2233 N LEU A 147 2.836 4.194 19.560 1.00 0.00 N ATOM 2234 CA LEU A 147 2.609 4.977 18.313 1.00 0.00 C ATOM 2235 C LEU A 147 1.147 4.801 17.908 1.00 0.00 C ATOM 2236 O LEU A 147 0.623 3.709 17.960 1.00 0.00 O ATOM 2237 CB LEU A 147 3.550 4.387 17.261 1.00 0.00 C ATOM 2238 CG LEU A 147 3.473 2.864 17.298 1.00 0.00 C ATOM 2239 CD1 LEU A 147 3.067 2.336 15.921 1.00 0.00 C ATOM 2240 CD2 LEU A 147 4.841 2.297 17.679 1.00 0.00 C ATOM 0 H LEU A 147 2.553 3.216 19.501 1.00 0.00 H new ATOM 0 HA LEU A 147 2.806 6.042 18.433 1.00 0.00 H new ATOM 0 HB2 LEU A 147 3.277 4.750 16.270 1.00 0.00 H new ATOM 0 HB3 LEU A 147 4.573 4.714 17.450 1.00 0.00 H new ATOM 0 HG LEU A 147 2.731 2.556 18.035 1.00 0.00 H new ATOM 0 HD11 LEU A 147 3.013 1.248 15.950 1.00 0.00 H new ATOM 0 HD12 LEU A 147 2.092 2.741 15.649 1.00 0.00 H new ATOM 0 HD13 LEU A 147 3.806 2.643 15.181 1.00 0.00 H new ATOM 0 HD21 LEU A 147 4.789 1.209 17.706 1.00 0.00 H new ATOM 0 HD22 LEU A 147 5.581 2.607 16.941 1.00 0.00 H new ATOM 0 HD23 LEU A 147 5.129 2.671 18.661 1.00 0.00 H new ATOM 2252 N VAL A 148 0.463 5.834 17.523 1.00 0.00 N ATOM 2253 CA VAL A 148 -0.964 5.633 17.153 1.00 0.00 C ATOM 2254 C VAL A 148 -1.112 5.485 15.638 1.00 0.00 C ATOM 2255 O VAL A 148 -0.820 6.389 14.880 1.00 0.00 O ATOM 2256 CB VAL A 148 -1.679 6.893 17.640 1.00 0.00 C ATOM 2257 CG1 VAL A 148 -1.610 6.960 19.167 1.00 0.00 C ATOM 2258 CG2 VAL A 148 -0.997 8.127 17.045 1.00 0.00 C ATOM 0 H VAL A 148 0.816 6.788 17.448 1.00 0.00 H new ATOM 0 HA VAL A 148 -1.378 4.728 17.597 1.00 0.00 H new ATOM 0 HB VAL A 148 -2.722 6.865 17.324 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -2.120 7.858 19.515 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -2.094 6.081 19.592 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -0.567 6.989 19.483 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -1.506 9.027 17.391 1.00 0.00 H new ATOM 0 HG22 VAL A 148 0.045 8.155 17.362 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.044 8.080 15.957 1.00 0.00 H new ATOM 2268 N LEU A 149 -1.574 4.344 15.196 1.00 0.00 N ATOM 2269 CA LEU A 149 -1.755 4.125 13.733 1.00 0.00 C ATOM 2270 C LEU A 149 -3.165 4.557 13.318 1.00 0.00 C ATOM 2271 O LEU A 149 -4.147 3.980 13.737 1.00 0.00 O ATOM 2272 CB LEU A 149 -1.575 2.618 13.543 1.00 0.00 C ATOM 2273 CG LEU A 149 -1.310 2.308 12.070 1.00 0.00 C ATOM 2274 CD1 LEU A 149 -0.673 0.922 11.951 1.00 0.00 C ATOM 2275 CD2 LEU A 149 -2.632 2.327 11.299 1.00 0.00 C ATOM 0 H LEU A 149 -1.834 3.554 15.787 1.00 0.00 H new ATOM 0 HA LEU A 149 -1.053 4.699 13.128 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -0.745 2.262 14.154 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -2.468 2.091 13.880 1.00 0.00 H new ATOM 0 HG LEU A 149 -0.636 3.058 11.655 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -0.483 0.698 10.901 1.00 0.00 H new ATOM 0 HD12 LEU A 149 0.267 0.905 12.502 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.349 0.174 12.365 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -2.444 2.106 10.248 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -3.305 1.576 11.713 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -3.090 3.312 11.386 1.00 0.00 H new ATOM 2287 N SER A 150 -3.277 5.572 12.504 1.00 0.00 N ATOM 2288 CA SER A 150 -4.631 6.032 12.081 1.00 0.00 C ATOM 2289 C SER A 150 -4.589 6.621 10.668 1.00 0.00 C ATOM 2290 O SER A 150 -5.476 7.349 10.266 1.00 0.00 O ATOM 2291 CB SER A 150 -5.017 7.106 13.099 1.00 0.00 C ATOM 2292 OG SER A 150 -5.505 8.252 12.413 1.00 0.00 O ATOM 0 H SER A 150 -2.495 6.100 12.116 1.00 0.00 H new ATOM 0 HA SER A 150 -5.350 5.213 12.053 1.00 0.00 H new ATOM 0 HB2 SER A 150 -5.779 6.723 13.778 1.00 0.00 H new ATOM 0 HB3 SER A 150 -4.153 7.373 13.708 1.00 0.00 H new ATOM 0 HG SER A 150 -5.990 7.970 11.609 1.00 0.00 H new ATOM 2298 N ARG A 151 -3.575 6.313 9.907 1.00 0.00 N ATOM 2299 CA ARG A 151 -3.499 6.859 8.523 1.00 0.00 C ATOM 2300 C ARG A 151 -3.828 5.761 7.509 1.00 0.00 C ATOM 2301 O ARG A 151 -3.208 4.716 7.502 1.00 0.00 O ATOM 2302 CB ARG A 151 -2.052 7.326 8.359 1.00 0.00 C ATOM 2303 CG ARG A 151 -1.972 8.834 8.601 1.00 0.00 C ATOM 2304 CD ARG A 151 -2.216 9.128 10.083 1.00 0.00 C ATOM 2305 NE ARG A 151 -3.249 10.200 10.097 1.00 0.00 N ATOM 2306 CZ ARG A 151 -3.479 10.873 11.193 1.00 0.00 C ATOM 2307 NH1 ARG A 151 -2.803 10.607 12.278 1.00 0.00 N ATOM 2308 NH2 ARG A 151 -4.384 11.812 11.203 1.00 0.00 N ATOM 0 H ARG A 151 -2.800 5.710 10.182 1.00 0.00 H new ATOM 0 HA ARG A 151 -4.208 7.670 8.357 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -1.407 6.799 9.062 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -1.693 7.088 7.358 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -0.994 9.210 8.301 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -2.712 9.351 7.990 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -2.562 8.239 10.610 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -1.301 9.455 10.577 1.00 0.00 H new ATOM 0 HE ARG A 151 -3.778 10.409 9.250 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -2.095 9.873 12.270 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -2.983 11.133 13.133 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -4.912 12.021 10.355 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -4.564 12.338 12.058 1.00 0.00 H new ATOM 2322 N PRO A 152 -4.800 6.037 6.684 1.00 0.00 N ATOM 2323 CA PRO A 152 -5.224 5.059 5.655 1.00 0.00 C ATOM 2324 C PRO A 152 -4.231 5.035 4.490 1.00 0.00 C ATOM 2325 O PRO A 152 -3.625 6.035 4.155 1.00 0.00 O ATOM 2326 CB PRO A 152 -6.579 5.588 5.197 1.00 0.00 C ATOM 2327 CG PRO A 152 -6.547 7.057 5.490 1.00 0.00 C ATOM 2328 CD PRO A 152 -5.590 7.271 6.636 1.00 0.00 C ATOM 0 HA PRO A 152 -5.272 4.038 6.033 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -6.736 5.402 4.135 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -7.394 5.098 5.730 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -6.224 7.616 4.612 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -7.542 7.418 5.749 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -4.957 8.142 6.468 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -6.122 7.439 7.572 1.00 0.00 H new ATOM 2336 N LEU A 153 -4.065 3.901 3.869 1.00 0.00 N ATOM 2337 CA LEU A 153 -3.116 3.807 2.723 1.00 0.00 C ATOM 2338 C LEU A 153 -3.763 4.373 1.457 1.00 0.00 C ATOM 2339 O LEU A 153 -4.969 4.362 1.306 1.00 0.00 O ATOM 2340 CB LEU A 153 -2.842 2.312 2.561 1.00 0.00 C ATOM 2341 CG LEU A 153 -1.344 2.085 2.359 1.00 0.00 C ATOM 2342 CD1 LEU A 153 -0.868 2.869 1.133 1.00 0.00 C ATOM 2343 CD2 LEU A 153 -0.584 2.568 3.597 1.00 0.00 C ATOM 0 H LEU A 153 -4.546 3.033 4.105 1.00 0.00 H new ATOM 0 HA LEU A 153 -2.201 4.374 2.894 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -3.187 1.771 3.442 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -3.398 1.920 1.709 1.00 0.00 H new ATOM 0 HG LEU A 153 -1.156 1.022 2.206 1.00 0.00 H new ATOM 0 HD11 LEU A 153 0.200 2.707 0.990 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -1.409 2.527 0.250 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -1.056 3.932 1.285 1.00 0.00 H new ATOM 0 HD21 LEU A 153 0.484 2.407 3.454 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -0.773 3.631 3.749 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -0.921 2.011 4.471 1.00 0.00 H new ATOM 2355 N SER A 154 -2.973 4.866 0.544 1.00 0.00 N ATOM 2356 CA SER A 154 -3.546 5.429 -0.711 1.00 0.00 C ATOM 2357 C SER A 154 -3.624 4.345 -1.789 1.00 0.00 C ATOM 2358 O SER A 154 -3.068 4.480 -2.861 1.00 0.00 O ATOM 2359 CB SER A 154 -2.575 6.533 -1.130 1.00 0.00 C ATOM 2360 OG SER A 154 -2.372 7.418 -0.037 1.00 0.00 O ATOM 0 H SER A 154 -1.956 4.903 0.612 1.00 0.00 H new ATOM 0 HA SER A 154 -4.558 5.809 -0.569 1.00 0.00 H new ATOM 0 HB2 SER A 154 -1.625 6.099 -1.443 1.00 0.00 H new ATOM 0 HB3 SER A 154 -2.973 7.078 -1.986 1.00 0.00 H new ATOM 0 HG SER A 154 -1.749 8.126 -0.301 1.00 0.00 H new ATOM 2510 N SER B 165 7.942 -7.912 16.599 1.00 0.00 N ATOM 2511 CA SER B 165 7.586 -8.513 17.918 1.00 0.00 C ATOM 2512 C SER B 165 6.065 -8.494 18.119 1.00 0.00 C ATOM 2513 O SER B 165 5.356 -9.347 17.627 1.00 0.00 O ATOM 2514 CB SER B 165 8.278 -7.630 18.955 1.00 0.00 C ATOM 2515 OG SER B 165 8.294 -6.286 18.492 1.00 0.00 O ATOM 0 HA SER B 165 7.900 -9.554 17.995 1.00 0.00 H new ATOM 0 HB2 SER B 165 7.755 -7.692 19.909 1.00 0.00 H new ATOM 0 HB3 SER B 165 9.296 -7.980 19.126 1.00 0.00 H new ATOM 0 HG SER B 165 8.228 -6.276 17.514 1.00 0.00 H new ATOM 2521 N THR B 166 5.560 -7.528 18.840 1.00 0.00 N ATOM 2522 CA THR B 166 4.086 -7.461 19.071 1.00 0.00 C ATOM 2523 C THR B 166 3.630 -6.003 19.165 1.00 0.00 C ATOM 2524 O THR B 166 4.432 -5.089 19.136 1.00 0.00 O ATOM 2525 CB THR B 166 3.862 -8.181 20.401 1.00 0.00 C ATOM 2526 OG1 THR B 166 2.515 -7.999 20.814 1.00 0.00 O ATOM 2527 CG2 THR B 166 4.805 -7.606 21.460 1.00 0.00 C ATOM 0 H THR B 166 6.103 -6.784 19.278 1.00 0.00 H new ATOM 0 HA THR B 166 3.519 -7.917 18.260 1.00 0.00 H new ATOM 0 HB THR B 166 4.064 -9.245 20.278 1.00 0.00 H new ATOM 0 HG1 THR B 166 2.369 -8.461 21.666 1.00 0.00 H new ATOM 0 HG21 THR B 166 4.644 -8.120 22.408 1.00 0.00 H new ATOM 0 HG22 THR B 166 5.838 -7.746 21.142 1.00 0.00 H new ATOM 0 HG23 THR B 166 4.605 -6.542 21.586 1.00 0.00 H new ATOM 2535 N VAL B 167 2.348 -5.774 19.276 1.00 0.00 N ATOM 2536 CA VAL B 167 1.849 -4.370 19.369 1.00 0.00 C ATOM 2537 C VAL B 167 0.917 -4.217 20.574 1.00 0.00 C ATOM 2538 O VAL B 167 -0.171 -4.759 20.603 1.00 0.00 O ATOM 2539 CB VAL B 167 1.078 -4.114 18.068 1.00 0.00 C ATOM 2540 CG1 VAL B 167 1.282 -2.664 17.629 1.00 0.00 C ATOM 2541 CG2 VAL B 167 1.587 -5.045 16.967 1.00 0.00 C ATOM 0 H VAL B 167 1.627 -6.495 19.306 1.00 0.00 H new ATOM 0 HA VAL B 167 2.667 -3.661 19.499 1.00 0.00 H new ATOM 0 HB VAL B 167 0.019 -4.303 18.242 1.00 0.00 H new ATOM 0 HG11 VAL B 167 0.734 -2.483 16.704 1.00 0.00 H new ATOM 0 HG12 VAL B 167 0.915 -1.994 18.406 1.00 0.00 H new ATOM 0 HG13 VAL B 167 2.343 -2.480 17.463 1.00 0.00 H new ATOM 0 HG21 VAL B 167 1.034 -4.857 16.047 1.00 0.00 H new ATOM 0 HG22 VAL B 167 2.648 -4.862 16.797 1.00 0.00 H new ATOM 0 HG23 VAL B 167 1.442 -6.082 17.271 1.00 0.00 H new ATOM 2551 N VAL B 168 1.330 -3.475 21.564 1.00 0.00 N ATOM 2552 CA VAL B 168 0.465 -3.276 22.764 1.00 0.00 C ATOM 2553 C VAL B 168 -0.207 -4.594 23.157 1.00 0.00 C ATOM 2554 O VAL B 168 -1.307 -4.891 22.733 1.00 0.00 O ATOM 2555 CB VAL B 168 -0.584 -2.245 22.335 1.00 0.00 C ATOM 2556 CG1 VAL B 168 -0.822 -1.252 23.473 1.00 0.00 C ATOM 2557 CG2 VAL B 168 -0.090 -1.487 21.098 1.00 0.00 C ATOM 0 H VAL B 168 2.230 -2.997 21.595 1.00 0.00 H new ATOM 0 HA VAL B 168 1.035 -2.939 23.630 1.00 0.00 H new ATOM 0 HB VAL B 168 -1.515 -2.760 22.098 1.00 0.00 H new ATOM 0 HG11 VAL B 168 -1.568 -0.519 23.166 1.00 0.00 H new ATOM 0 HG12 VAL B 168 -1.178 -1.786 24.354 1.00 0.00 H new ATOM 0 HG13 VAL B 168 0.111 -0.741 23.711 1.00 0.00 H new ATOM 0 HG21 VAL B 168 -0.839 -0.755 20.797 1.00 0.00 H new ATOM 0 HG22 VAL B 168 0.843 -0.975 21.333 1.00 0.00 H new ATOM 0 HG23 VAL B 168 0.078 -2.191 20.283 1.00 0.00 H new