USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1052 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: B 41 ASN : amide:sc= -0.81 K(o=-3.5,f=-7.2!) USER MOD Set 1.2: B 46 MET CE :methyl 154:sc= -2.67 (180deg=-4.63!) USER MOD Set 2.1: B 26 TYR OH : rot 28:sc= 0.366 USER MOD Set 2.2: B 39 HIS : no HE2:sc= -0.107 K(o=0.26,f=-7.2!) USER MOD Set 3.1: B 6 HIS :FLIP no HD1:sc= -0.418 F(o=-3.8,f=-1.8) USER MOD Set 3.2: B 18 THR OG1 : rot -172:sc= -1.39! USER MOD Set 4.1: B 17 HIS : no HD1:sc= 0.91 K(o=0.91,f=-5.5!) USER MOD Set 4.2: B 20 THR OG1 : rot -150:sc= 0 USER MOD Set 5.1: A 41 ASN : amide:sc= -0.886 K(o=-3.6,f=-7.7!) USER MOD Set 5.2: A 46 MET CE :methyl 157:sc= -2.7 (180deg=-4.58!) USER MOD Set 6.1: A 26 TYR OH : rot 30:sc= 0.278 USER MOD Set 6.2: A 39 HIS : no HE2:sc= -0.215 K(o=0.063,f=-7.4!) USER MOD Set 7.1: A 6 HIS :FLIP no HD1:sc= -0.424 F(o=-4,f=-1.8) USER MOD Set 7.2: A 18 THR OG1 : rot -171:sc= -1.38! USER MOD Set 8.1: A 17 HIS : no HD1:sc= 0.832 K(o=0.83,f=-5.4!) USER MOD Set 8.2: A 20 THR OG1 : rot -150:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ -166:sc= -0.053 (180deg=-0.283) USER MOD Single : A 4 THR OG1 : rot -76:sc= 0.0398 USER MOD Single : A 19 SER OG : rot 180:sc= 0.00048 USER MOD Single : A 24 ASN : amide:sc= 0.359 K(o=0.36,f=-0.75) USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 THR OG1 : rot -79:sc= 1.14 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 180:sc=0.000851 USER MOD Single : A 44 ASN : amide:sc= -0.359 X(o=-0.36,f=-0.079) USER MOD Single : A 49 GLN : amide:sc= 0.129 X(o=0.13,f=0) USER MOD Single : A 50 HIS : no HE2:sc= -0.43 K(o=-0.43,f=-6!) USER MOD Single : A 53 LYS NZ :NH3+ -171:sc= 1.35 (180deg=1.11) USER MOD Single : A 56 THR OG1 : rot 72:sc= -0.103 USER MOD Single : A 64 TYR OH : rot 40:sc= -0.868! USER MOD Single : B 3 LYS NZ :NH3+ -167:sc= -0.0335 (180deg=-0.251) USER MOD Single : B 4 THR OG1 : rot -70:sc= 0.0973 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 24 ASN : amide:sc= 0.285 K(o=0.28,f=-0.7) USER MOD Single : B 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 28 THR OG1 : rot -71:sc= 1.15 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0.00199 USER MOD Single : B 44 ASN : amide:sc= -0.374 X(o=-0.37,f=-0.08) USER MOD Single : B 49 GLN : amide:sc= 0.119 X(o=0.12,f=0) USER MOD Single : B 50 HIS : no HE2:sc= -0.249 K(o=-0.25,f=-6!) USER MOD Single : B 53 LYS NZ :NH3+ -162:sc= 1.24 (180deg=1.1) USER MOD Single : B 56 THR OG1 : rot 82:sc= -0.141 USER MOD Single : B 64 TYR OH : rot 42:sc= -0.766! USER MOD ----------------------------------------------------------------- ATOM 10 N PRO A 2 -4.458 9.575 -7.726 1.00 0.00 N ATOM 11 CA PRO A 2 -5.815 9.162 -7.374 1.00 0.00 C ATOM 12 C PRO A 2 -6.406 10.024 -6.269 1.00 0.00 C ATOM 13 O PRO A 2 -5.846 10.131 -5.177 1.00 0.00 O ATOM 14 CB PRO A 2 -5.654 7.719 -6.881 1.00 0.00 C ATOM 15 CG PRO A 2 -4.301 7.293 -7.332 1.00 0.00 C ATOM 16 CD PRO A 2 -3.472 8.540 -7.387 1.00 0.00 C ATOM 0 HA PRO A 2 -6.493 9.258 -8.222 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -5.742 7.663 -5.796 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -6.428 7.074 -7.297 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -3.870 6.568 -6.641 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -4.349 6.813 -8.309 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -2.984 8.743 -6.434 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -2.686 8.470 -8.139 1.00 0.00 H new ATOM 24 N LYS A 3 -7.524 10.656 -6.563 1.00 0.00 N ATOM 25 CA LYS A 3 -8.244 11.425 -5.567 1.00 0.00 C ATOM 26 C LYS A 3 -9.489 10.668 -5.159 1.00 0.00 C ATOM 27 O LYS A 3 -10.149 11.001 -4.173 1.00 0.00 O ATOM 28 CB LYS A 3 -8.628 12.798 -6.114 1.00 0.00 C ATOM 29 CG LYS A 3 -7.439 13.644 -6.549 1.00 0.00 C ATOM 30 CD LYS A 3 -6.546 14.040 -5.379 1.00 0.00 C ATOM 31 CE LYS A 3 -7.257 14.968 -4.404 1.00 0.00 C ATOM 32 NZ LYS A 3 -7.705 16.229 -5.054 1.00 0.00 N ATOM 0 H LYS A 3 -7.956 10.652 -7.487 1.00 0.00 H new ATOM 0 HA LYS A 3 -7.599 11.572 -4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -9.297 12.665 -6.964 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -9.186 13.339 -5.350 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -6.850 13.089 -7.280 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -7.800 14.544 -7.047 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -6.220 13.143 -4.853 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -5.650 14.531 -5.758 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -8.119 14.454 -3.979 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.588 15.205 -3.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -7.965 16.922 -4.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.933 16.612 -5.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.530 16.035 -5.657 1.00 0.00 H new ATOM 46 N THR A 4 -9.803 9.641 -5.929 1.00 0.00 N ATOM 47 CA THR A 4 -10.979 8.846 -5.678 1.00 0.00 C ATOM 48 C THR A 4 -10.628 7.382 -5.453 1.00 0.00 C ATOM 49 O THR A 4 -9.516 6.941 -5.768 1.00 0.00 O ATOM 50 CB THR A 4 -11.990 8.961 -6.829 1.00 0.00 C ATOM 51 OG1 THR A 4 -11.357 8.649 -8.073 1.00 0.00 O ATOM 52 CG2 THR A 4 -12.577 10.360 -6.894 1.00 0.00 C ATOM 0 H THR A 4 -9.254 9.342 -6.735 1.00 0.00 H new ATOM 0 HA THR A 4 -11.434 9.239 -4.769 1.00 0.00 H new ATOM 0 HB THR A 4 -12.797 8.251 -6.644 1.00 0.00 H new ATOM 0 HG1 THR A 4 -10.805 9.407 -8.358 1.00 0.00 H new ATOM 0 HG21 THR A 4 -13.290 10.418 -7.716 1.00 0.00 H new ATOM 0 HG22 THR A 4 -13.085 10.585 -5.957 1.00 0.00 H new ATOM 0 HG23 THR A 4 -11.777 11.083 -7.056 1.00 0.00 H new ATOM 60 N LEU A 5 -11.580 6.641 -4.917 1.00 0.00 N ATOM 61 CA LEU A 5 -11.377 5.246 -4.565 1.00 0.00 C ATOM 62 C LEU A 5 -10.966 4.428 -5.789 1.00 0.00 C ATOM 63 O LEU A 5 -9.927 3.763 -5.785 1.00 0.00 O ATOM 64 CB LEU A 5 -12.667 4.702 -3.931 1.00 0.00 C ATOM 65 CG LEU A 5 -12.561 3.366 -3.191 1.00 0.00 C ATOM 66 CD1 LEU A 5 -12.744 2.194 -4.139 1.00 0.00 C ATOM 67 CD2 LEU A 5 -11.230 3.268 -2.470 1.00 0.00 C ATOM 0 H LEU A 5 -12.517 6.989 -4.713 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.564 5.165 -3.843 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -13.043 5.449 -3.232 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -13.414 4.597 -4.718 1.00 0.00 H new ATOM 0 HG LEU A 5 -13.363 3.324 -2.454 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.663 1.260 -3.583 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -13.727 2.254 -4.606 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.973 2.225 -4.909 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -11.168 2.313 -1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.418 3.339 -3.194 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -11.146 4.081 -1.749 1.00 0.00 H new ATOM 79 N HIS A 6 -11.765 4.518 -6.845 1.00 0.00 N ATOM 80 CA HIS A 6 -11.532 3.748 -8.062 1.00 0.00 C ATOM 81 C HIS A 6 -10.133 3.988 -8.615 1.00 0.00 C ATOM 82 O HIS A 6 -9.450 3.044 -9.003 1.00 0.00 O ATOM 83 CB HIS A 6 -12.581 4.099 -9.117 1.00 0.00 C ATOM 84 CG HIS A 6 -12.492 3.284 -10.377 1.00 0.00 C ATOM 85 ND1 HIS A 6 -12.205 1.973 -10.572 1.00 0.00 N flip ATOM 86 CD2 HIS A 6 -12.736 3.804 -11.628 1.00 0.00 C flip ATOM 87 CE1 HIS A 6 -12.285 1.735 -11.919 1.00 0.00 C flip ATOM 88 NE2 HIS A 6 -12.608 2.854 -12.532 1.00 0.00 N flip ATOM 0 H HIS A 6 -12.586 5.121 -6.883 1.00 0.00 H new ATOM 0 HA HIS A 6 -11.616 2.691 -7.809 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -13.572 3.968 -8.683 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -12.482 5.154 -9.373 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -12.993 4.832 -11.836 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -12.111 0.784 -12.400 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -12.737 2.967 -13.537 1.00 0.00 H new ATOM 97 N GLU A 7 -9.710 5.246 -8.629 1.00 0.00 N ATOM 98 CA GLU A 7 -8.402 5.607 -9.166 1.00 0.00 C ATOM 99 C GLU A 7 -7.292 4.890 -8.417 1.00 0.00 C ATOM 100 O GLU A 7 -6.326 4.411 -9.014 1.00 0.00 O ATOM 101 CB GLU A 7 -8.173 7.108 -9.067 1.00 0.00 C ATOM 102 CG GLU A 7 -9.077 7.944 -9.943 1.00 0.00 C ATOM 103 CD GLU A 7 -8.787 9.419 -9.791 1.00 0.00 C ATOM 104 OE1 GLU A 7 -8.176 10.010 -10.709 1.00 0.00 O ATOM 105 OE2 GLU A 7 -9.146 9.991 -8.740 1.00 0.00 O ATOM 0 H GLU A 7 -10.253 6.034 -8.275 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.385 5.305 -10.213 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -8.309 7.415 -8.030 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -7.137 7.322 -9.329 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -8.947 7.652 -10.985 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -10.118 7.748 -9.685 1.00 0.00 H new ATOM 112 N LEU A 8 -7.437 4.822 -7.103 1.00 0.00 N ATOM 113 CA LEU A 8 -6.435 4.197 -6.262 1.00 0.00 C ATOM 114 C LEU A 8 -6.393 2.701 -6.527 1.00 0.00 C ATOM 115 O LEU A 8 -5.319 2.112 -6.661 1.00 0.00 O ATOM 116 CB LEU A 8 -6.742 4.494 -4.792 1.00 0.00 C ATOM 117 CG LEU A 8 -5.617 4.193 -3.797 1.00 0.00 C ATOM 118 CD1 LEU A 8 -5.615 2.726 -3.403 1.00 0.00 C ATOM 119 CD2 LEU A 8 -4.272 4.587 -4.383 1.00 0.00 C ATOM 0 H LEU A 8 -8.241 5.193 -6.597 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.452 4.606 -6.496 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.007 5.547 -4.702 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.621 3.918 -4.501 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.793 4.784 -2.898 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.806 2.540 -2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.568 2.473 -2.939 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.469 2.111 -4.291 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.483 4.367 -3.664 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -4.095 4.024 -5.299 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.271 5.654 -4.607 1.00 0.00 H new ATOM 131 N LEU A 9 -7.570 2.099 -6.623 1.00 0.00 N ATOM 132 CA LEU A 9 -7.682 0.681 -6.932 1.00 0.00 C ATOM 133 C LEU A 9 -7.043 0.375 -8.279 1.00 0.00 C ATOM 134 O LEU A 9 -6.359 -0.635 -8.433 1.00 0.00 O ATOM 135 CB LEU A 9 -9.150 0.246 -6.936 1.00 0.00 C ATOM 136 CG LEU A 9 -9.750 -0.111 -5.570 1.00 0.00 C ATOM 137 CD1 LEU A 9 -9.172 -1.413 -5.058 1.00 0.00 C ATOM 138 CD2 LEU A 9 -9.510 0.992 -4.556 1.00 0.00 C ATOM 0 H LEU A 9 -8.464 2.573 -6.491 1.00 0.00 H new ATOM 0 HA LEU A 9 -7.154 0.122 -6.160 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -9.745 1.048 -7.373 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -9.250 -0.619 -7.592 1.00 0.00 H new ATOM 0 HG LEU A 9 -10.826 -0.226 -5.704 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -9.610 -1.649 -4.088 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -9.398 -2.213 -5.763 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -8.091 -1.315 -4.954 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -9.947 0.708 -3.599 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.438 1.147 -4.433 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -9.972 1.915 -4.906 1.00 0.00 H new ATOM 150 N GLU A 10 -7.252 1.259 -9.243 1.00 0.00 N ATOM 151 CA GLU A 10 -6.670 1.096 -10.568 1.00 0.00 C ATOM 152 C GLU A 10 -5.150 1.137 -10.507 1.00 0.00 C ATOM 153 O GLU A 10 -4.471 0.392 -11.216 1.00 0.00 O ATOM 154 CB GLU A 10 -7.171 2.186 -11.512 1.00 0.00 C ATOM 155 CG GLU A 10 -8.661 2.120 -11.790 1.00 0.00 C ATOM 156 CD GLU A 10 -9.114 3.204 -12.742 1.00 0.00 C ATOM 157 OE1 GLU A 10 -9.341 4.345 -12.292 1.00 0.00 O ATOM 158 OE2 GLU A 10 -9.236 2.922 -13.950 1.00 0.00 O ATOM 0 H GLU A 10 -7.821 2.098 -9.133 1.00 0.00 H new ATOM 0 HA GLU A 10 -6.980 0.122 -10.947 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -6.934 3.160 -11.085 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.631 2.112 -12.456 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -8.908 1.145 -12.209 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -9.208 2.211 -10.852 1.00 0.00 H new ATOM 165 N ARG A 11 -4.623 1.995 -9.643 1.00 0.00 N ATOM 166 CA ARG A 11 -3.187 2.185 -9.536 1.00 0.00 C ATOM 167 C ARG A 11 -2.517 0.967 -8.917 1.00 0.00 C ATOM 168 O ARG A 11 -1.479 0.508 -9.392 1.00 0.00 O ATOM 169 CB ARG A 11 -2.873 3.428 -8.707 1.00 0.00 C ATOM 170 CG ARG A 11 -1.396 3.757 -8.678 1.00 0.00 C ATOM 171 CD ARG A 11 -1.122 5.064 -7.962 1.00 0.00 C ATOM 172 NE ARG A 11 0.281 5.451 -8.078 1.00 0.00 N ATOM 173 CZ ARG A 11 0.700 6.666 -8.432 1.00 0.00 C ATOM 174 NH1 ARG A 11 -0.167 7.598 -8.810 1.00 0.00 N ATOM 175 NH2 ARG A 11 1.997 6.937 -8.448 1.00 0.00 N ATOM 0 H ARG A 11 -5.173 2.571 -9.005 1.00 0.00 H new ATOM 0 HA ARG A 11 -2.793 2.320 -10.543 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -3.422 4.278 -9.113 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -3.227 3.278 -7.687 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -0.854 2.951 -8.183 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -1.017 3.816 -9.698 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -1.753 5.849 -8.379 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -1.388 4.967 -6.910 1.00 0.00 H new ATOM 0 HE ARG A 11 0.988 4.744 -7.875 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -1.165 7.388 -8.832 1.00 0.00 H new ATOM 0 HH12 ARG A 11 0.165 8.524 -9.079 1.00 0.00 H new ATOM 0 HH21 ARG A 11 2.672 6.217 -8.190 1.00 0.00 H new ATOM 0 HH22 ARG A 11 2.321 7.866 -8.718 1.00 0.00 H new ATOM 189 N ILE A 12 -3.118 0.440 -7.862 1.00 0.00 N ATOM 190 CA ILE A 12 -2.543 -0.699 -7.164 1.00 0.00 C ATOM 191 C ILE A 12 -2.880 -2.005 -7.874 1.00 0.00 C ATOM 192 O ILE A 12 -2.288 -3.044 -7.597 1.00 0.00 O ATOM 193 CB ILE A 12 -2.997 -0.750 -5.696 1.00 0.00 C ATOM 194 CG1 ILE A 12 -4.509 -0.953 -5.585 1.00 0.00 C ATOM 195 CG2 ILE A 12 -2.582 0.534 -4.999 1.00 0.00 C ATOM 196 CD1 ILE A 12 -4.982 -1.141 -4.160 1.00 0.00 C ATOM 0 H ILE A 12 -3.997 0.780 -7.472 1.00 0.00 H new ATOM 0 HA ILE A 12 -1.460 -0.572 -7.175 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.518 -1.601 -5.213 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -5.018 -0.092 -6.019 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -4.796 -1.824 -6.174 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.902 0.502 -3.957 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.498 0.638 -5.043 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.048 1.385 -5.496 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -6.063 -1.280 -4.151 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -4.500 -2.019 -3.729 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.724 -0.260 -3.572 1.00 0.00 H new ATOM 208 N GLY A 13 -3.834 -1.946 -8.791 1.00 0.00 N ATOM 209 CA GLY A 13 -4.128 -3.095 -9.622 1.00 0.00 C ATOM 210 C GLY A 13 -5.262 -3.938 -9.088 1.00 0.00 C ATOM 211 O GLY A 13 -5.341 -5.133 -9.364 1.00 0.00 O ATOM 0 H GLY A 13 -4.409 -1.124 -8.975 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -4.378 -2.755 -10.627 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.234 -3.712 -9.708 1.00 0.00 H new ATOM 215 N LEU A 14 -6.148 -3.322 -8.326 1.00 0.00 N ATOM 216 CA LEU A 14 -7.293 -4.022 -7.777 1.00 0.00 C ATOM 217 C LEU A 14 -8.585 -3.367 -8.219 1.00 0.00 C ATOM 218 O LEU A 14 -9.592 -3.420 -7.512 1.00 0.00 O ATOM 219 CB LEU A 14 -7.238 -4.080 -6.249 1.00 0.00 C ATOM 220 CG LEU A 14 -6.257 -5.095 -5.662 1.00 0.00 C ATOM 221 CD1 LEU A 14 -6.334 -6.402 -6.421 1.00 0.00 C ATOM 222 CD2 LEU A 14 -4.840 -4.567 -5.663 1.00 0.00 C ATOM 0 H LEU A 14 -6.095 -2.335 -8.073 1.00 0.00 H new ATOM 0 HA LEU A 14 -7.261 -5.042 -8.159 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -6.976 -3.090 -5.875 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -8.236 -4.308 -5.876 1.00 0.00 H new ATOM 0 HG LEU A 14 -6.543 -5.270 -4.625 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.630 -7.114 -5.991 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -7.345 -6.804 -6.352 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.083 -6.230 -7.468 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -4.172 -5.317 -5.238 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -4.535 -4.347 -6.686 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.790 -3.657 -5.065 1.00 0.00 H new ATOM 234 N GLU A 15 -8.559 -2.764 -9.400 1.00 0.00 N ATOM 235 CA GLU A 15 -9.746 -2.137 -9.962 1.00 0.00 C ATOM 236 C GLU A 15 -10.862 -3.162 -10.144 1.00 0.00 C ATOM 237 O GLU A 15 -12.040 -2.809 -10.199 1.00 0.00 O ATOM 238 CB GLU A 15 -9.427 -1.455 -11.291 1.00 0.00 C ATOM 239 CG GLU A 15 -8.808 -2.379 -12.327 1.00 0.00 C ATOM 240 CD GLU A 15 -8.625 -1.704 -13.669 1.00 0.00 C ATOM 241 OE1 GLU A 15 -7.538 -1.150 -13.923 1.00 0.00 O ATOM 242 OE2 GLU A 15 -9.574 -1.721 -14.475 1.00 0.00 O ATOM 0 H GLU A 15 -7.728 -2.696 -9.987 1.00 0.00 H new ATOM 0 HA GLU A 15 -10.087 -1.375 -9.261 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -10.344 -1.031 -11.699 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -8.746 -0.624 -11.107 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -7.841 -2.730 -11.965 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -9.441 -3.258 -12.449 1.00 0.00 H new ATOM 249 N GLU A 16 -10.475 -4.432 -10.208 1.00 0.00 N ATOM 250 CA GLU A 16 -11.423 -5.534 -10.302 1.00 0.00 C ATOM 251 C GLU A 16 -12.297 -5.617 -9.051 1.00 0.00 C ATOM 252 O GLU A 16 -13.397 -6.160 -9.085 1.00 0.00 O ATOM 253 CB GLU A 16 -10.669 -6.851 -10.494 1.00 0.00 C ATOM 254 CG GLU A 16 -9.726 -7.186 -9.348 1.00 0.00 C ATOM 255 CD GLU A 16 -8.857 -8.389 -9.636 1.00 0.00 C ATOM 256 OE1 GLU A 16 -9.064 -9.445 -9.000 1.00 0.00 O ATOM 257 OE2 GLU A 16 -7.961 -8.280 -10.496 1.00 0.00 O ATOM 0 H GLU A 16 -9.498 -4.725 -10.196 1.00 0.00 H new ATOM 0 HA GLU A 16 -12.071 -5.354 -11.160 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -11.391 -7.660 -10.608 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -10.098 -6.801 -11.421 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -9.090 -6.325 -9.144 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -10.309 -7.373 -8.446 1.00 0.00 H new ATOM 264 N HIS A 17 -11.804 -5.070 -7.948 1.00 0.00 N ATOM 265 CA HIS A 17 -12.519 -5.137 -6.684 1.00 0.00 C ATOM 266 C HIS A 17 -13.074 -3.783 -6.280 1.00 0.00 C ATOM 267 O HIS A 17 -13.653 -3.656 -5.205 1.00 0.00 O ATOM 268 CB HIS A 17 -11.617 -5.670 -5.570 1.00 0.00 C ATOM 269 CG HIS A 17 -11.397 -7.151 -5.618 1.00 0.00 C ATOM 270 ND1 HIS A 17 -12.420 -8.071 -5.512 1.00 0.00 N ATOM 271 CD2 HIS A 17 -10.259 -7.874 -5.751 1.00 0.00 C ATOM 272 CE1 HIS A 17 -11.921 -9.290 -5.572 1.00 0.00 C ATOM 273 NE2 HIS A 17 -10.615 -9.200 -5.718 1.00 0.00 N ATOM 0 H HIS A 17 -10.913 -4.576 -7.904 1.00 0.00 H new ATOM 0 HA HIS A 17 -13.353 -5.824 -6.830 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -10.651 -5.168 -5.627 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -12.055 -5.409 -4.606 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -9.259 -7.481 -5.862 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -12.488 -10.207 -5.512 1.00 0.00 H new ATOM 0 HE2 HIS A 17 -9.972 -9.988 -5.794 1.00 0.00 H new ATOM 282 N THR A 18 -12.909 -2.780 -7.138 1.00 0.00 N ATOM 283 CA THR A 18 -13.407 -1.441 -6.840 1.00 0.00 C ATOM 284 C THR A 18 -14.881 -1.476 -6.465 1.00 0.00 C ATOM 285 O THR A 18 -15.292 -0.891 -5.466 1.00 0.00 O ATOM 286 CB THR A 18 -13.247 -0.488 -8.031 1.00 0.00 C ATOM 287 OG1 THR A 18 -11.905 -0.526 -8.523 1.00 0.00 O ATOM 288 CG2 THR A 18 -13.609 0.929 -7.619 1.00 0.00 C ATOM 0 H THR A 18 -12.438 -2.868 -8.038 1.00 0.00 H new ATOM 0 HA THR A 18 -12.811 -1.077 -6.003 1.00 0.00 H new ATOM 0 HB THR A 18 -13.920 -0.810 -8.826 1.00 0.00 H new ATOM 0 HG1 THR A 18 -11.780 0.183 -9.188 1.00 0.00 H new ATOM 0 HG21 THR A 18 -13.492 1.597 -8.472 1.00 0.00 H new ATOM 0 HG22 THR A 18 -14.644 0.955 -7.277 1.00 0.00 H new ATOM 0 HG23 THR A 18 -12.952 1.252 -6.812 1.00 0.00 H new ATOM 296 N SER A 19 -15.664 -2.176 -7.274 1.00 0.00 N ATOM 297 CA SER A 19 -17.090 -2.291 -7.049 1.00 0.00 C ATOM 298 C SER A 19 -17.370 -2.935 -5.696 1.00 0.00 C ATOM 299 O SER A 19 -18.267 -2.514 -4.979 1.00 0.00 O ATOM 300 CB SER A 19 -17.715 -3.112 -8.165 1.00 0.00 C ATOM 301 OG SER A 19 -17.278 -2.649 -9.433 1.00 0.00 O ATOM 0 H SER A 19 -15.328 -2.675 -8.098 1.00 0.00 H new ATOM 0 HA SER A 19 -17.530 -1.294 -7.047 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.448 -4.162 -8.044 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.802 -3.050 -8.104 1.00 0.00 H new ATOM 0 HG SER A 19 -17.689 -3.191 -10.139 1.00 0.00 H new ATOM 307 N THR A 20 -16.577 -3.941 -5.349 1.00 0.00 N ATOM 308 CA THR A 20 -16.705 -4.610 -4.066 1.00 0.00 C ATOM 309 C THR A 20 -16.583 -3.606 -2.924 1.00 0.00 C ATOM 310 O THR A 20 -17.421 -3.567 -2.021 1.00 0.00 O ATOM 311 CB THR A 20 -15.625 -5.692 -3.905 1.00 0.00 C ATOM 312 OG1 THR A 20 -15.652 -6.584 -5.027 1.00 0.00 O ATOM 313 CG2 THR A 20 -15.831 -6.472 -2.619 1.00 0.00 C ATOM 0 H THR A 20 -15.835 -4.311 -5.944 1.00 0.00 H new ATOM 0 HA THR A 20 -17.689 -5.079 -4.032 1.00 0.00 H new ATOM 0 HB THR A 20 -14.653 -5.202 -3.859 1.00 0.00 H new ATOM 0 HG1 THR A 20 -15.356 -7.474 -4.744 1.00 0.00 H new ATOM 0 HG21 THR A 20 -15.055 -7.232 -2.526 1.00 0.00 H new ATOM 0 HG22 THR A 20 -15.777 -5.792 -1.769 1.00 0.00 H new ATOM 0 HG23 THR A 20 -16.809 -6.952 -2.638 1.00 0.00 H new ATOM 321 N LEU A 21 -15.543 -2.786 -2.984 1.00 0.00 N ATOM 322 CA LEU A 21 -15.348 -1.727 -2.009 1.00 0.00 C ATOM 323 C LEU A 21 -16.512 -0.746 -2.066 1.00 0.00 C ATOM 324 O LEU A 21 -17.176 -0.497 -1.061 1.00 0.00 O ATOM 325 CB LEU A 21 -14.026 -0.987 -2.268 1.00 0.00 C ATOM 326 CG LEU A 21 -12.749 -1.665 -1.751 1.00 0.00 C ATOM 327 CD1 LEU A 21 -12.958 -2.219 -0.354 1.00 0.00 C ATOM 328 CD2 LEU A 21 -12.277 -2.755 -2.693 1.00 0.00 C ATOM 0 H LEU A 21 -14.820 -2.836 -3.701 1.00 0.00 H new ATOM 0 HA LEU A 21 -15.305 -2.176 -1.017 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -13.923 -0.839 -3.343 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -14.094 0.002 -1.815 1.00 0.00 H new ATOM 0 HG LEU A 21 -11.970 -0.904 -1.707 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -12.039 -2.694 -0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -13.222 -1.407 0.324 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -13.763 -2.954 -0.371 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -11.371 -3.213 -2.295 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -13.054 -3.513 -2.791 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -12.066 -2.324 -3.672 1.00 0.00 H new ATOM 340 N LEU A 22 -16.765 -0.235 -3.265 1.00 0.00 N ATOM 341 CA LEU A 22 -17.798 0.767 -3.509 1.00 0.00 C ATOM 342 C LEU A 22 -19.146 0.345 -2.924 1.00 0.00 C ATOM 343 O LEU A 22 -19.796 1.110 -2.210 1.00 0.00 O ATOM 344 CB LEU A 22 -17.937 0.974 -5.018 1.00 0.00 C ATOM 345 CG LEU A 22 -18.772 2.177 -5.445 1.00 0.00 C ATOM 346 CD1 LEU A 22 -18.039 3.468 -5.131 1.00 0.00 C ATOM 347 CD2 LEU A 22 -19.101 2.092 -6.924 1.00 0.00 C ATOM 0 H LEU A 22 -16.254 -0.507 -4.105 1.00 0.00 H new ATOM 0 HA LEU A 22 -17.501 1.694 -3.019 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -16.940 1.077 -5.446 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -18.379 0.076 -5.450 1.00 0.00 H new ATOM 0 HG LEU A 22 -19.707 2.170 -4.885 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -18.648 4.317 -5.442 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -17.852 3.529 -4.059 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -17.090 3.487 -5.667 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -19.697 2.957 -7.214 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -18.177 2.078 -7.502 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -19.665 1.180 -7.119 1.00 0.00 H new ATOM 359 N LEU A 23 -19.549 -0.881 -3.227 1.00 0.00 N ATOM 360 CA LEU A 23 -20.834 -1.407 -2.793 1.00 0.00 C ATOM 361 C LEU A 23 -20.896 -1.537 -1.282 1.00 0.00 C ATOM 362 O LEU A 23 -21.940 -1.319 -0.673 1.00 0.00 O ATOM 363 CB LEU A 23 -21.084 -2.773 -3.426 1.00 0.00 C ATOM 364 CG LEU A 23 -21.161 -2.783 -4.952 1.00 0.00 C ATOM 365 CD1 LEU A 23 -21.356 -4.199 -5.463 1.00 0.00 C ATOM 366 CD2 LEU A 23 -22.279 -1.878 -5.437 1.00 0.00 C ATOM 0 H LEU A 23 -18.996 -1.537 -3.779 1.00 0.00 H new ATOM 0 HA LEU A 23 -21.604 -0.705 -3.113 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -20.289 -3.450 -3.115 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -22.017 -3.173 -3.029 1.00 0.00 H new ATOM 0 HG LEU A 23 -20.220 -2.402 -5.348 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -21.409 -4.189 -6.552 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -20.517 -4.819 -5.146 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -22.282 -4.607 -5.059 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -22.317 -1.899 -6.526 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -23.230 -2.226 -5.034 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -22.094 -0.858 -5.100 1.00 0.00 H new ATOM 378 N ASN A 24 -19.773 -1.878 -0.678 1.00 0.00 N ATOM 379 CA ASN A 24 -19.735 -2.134 0.750 1.00 0.00 C ATOM 380 C ASN A 24 -19.404 -0.874 1.536 1.00 0.00 C ATOM 381 O ASN A 24 -19.057 -0.933 2.714 1.00 0.00 O ATOM 382 CB ASN A 24 -18.751 -3.256 1.065 1.00 0.00 C ATOM 383 CG ASN A 24 -19.323 -4.622 0.730 1.00 0.00 C ATOM 384 OD1 ASN A 24 -19.988 -5.249 1.554 1.00 0.00 O ATOM 385 ND2 ASN A 24 -19.058 -5.101 -0.474 1.00 0.00 N ATOM 0 H ASN A 24 -18.876 -1.984 -1.153 1.00 0.00 H new ATOM 0 HA ASN A 24 -20.730 -2.454 1.060 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -17.831 -3.100 0.502 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -18.488 -3.222 2.122 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -19.409 -6.019 -0.746 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -18.503 -4.552 -1.131 1.00 0.00 H new ATOM 392 N GLY A 25 -19.500 0.267 0.873 1.00 0.00 N ATOM 393 CA GLY A 25 -19.405 1.534 1.567 1.00 0.00 C ATOM 394 C GLY A 25 -18.071 2.213 1.380 1.00 0.00 C ATOM 395 O GLY A 25 -17.890 3.359 1.781 1.00 0.00 O ATOM 0 H GLY A 25 -19.642 0.339 -0.134 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -20.195 2.196 1.213 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -19.578 1.372 2.631 1.00 0.00 H new ATOM 399 N TYR A 26 -17.138 1.514 0.764 1.00 0.00 N ATOM 400 CA TYR A 26 -15.823 2.066 0.514 1.00 0.00 C ATOM 401 C TYR A 26 -15.829 2.818 -0.799 1.00 0.00 C ATOM 402 O TYR A 26 -15.326 2.342 -1.815 1.00 0.00 O ATOM 403 CB TYR A 26 -14.783 0.959 0.503 1.00 0.00 C ATOM 404 CG TYR A 26 -14.683 0.238 1.817 1.00 0.00 C ATOM 405 CD1 TYR A 26 -15.256 -1.013 1.990 1.00 0.00 C ATOM 406 CD2 TYR A 26 -14.027 0.816 2.890 1.00 0.00 C ATOM 407 CE1 TYR A 26 -15.175 -1.669 3.198 1.00 0.00 C ATOM 408 CE2 TYR A 26 -13.938 0.168 4.101 1.00 0.00 C ATOM 409 CZ TYR A 26 -14.513 -1.072 4.251 1.00 0.00 C ATOM 410 OH TYR A 26 -14.427 -1.715 5.460 1.00 0.00 O ATOM 0 H TYR A 26 -17.268 0.560 0.427 1.00 0.00 H new ATOM 0 HA TYR A 26 -15.565 2.762 1.312 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -15.030 0.243 -0.281 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -13.811 1.383 0.252 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -15.774 -1.480 1.165 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -13.578 1.791 2.775 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -15.626 -2.643 3.320 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -13.420 0.630 4.928 1.00 0.00 H new ATOM 0 HH TYR A 26 -14.428 -2.684 5.316 1.00 0.00 H new ATOM 420 N GLN A 27 -16.418 3.994 -0.763 1.00 0.00 N ATOM 421 CA GLN A 27 -16.632 4.776 -1.959 1.00 0.00 C ATOM 422 C GLN A 27 -15.551 5.823 -2.113 1.00 0.00 C ATOM 423 O GLN A 27 -15.343 6.365 -3.199 1.00 0.00 O ATOM 424 CB GLN A 27 -18.004 5.436 -1.895 1.00 0.00 C ATOM 425 CG GLN A 27 -19.120 4.448 -1.602 1.00 0.00 C ATOM 426 CD GLN A 27 -20.486 5.097 -1.539 1.00 0.00 C ATOM 427 OE1 GLN A 27 -20.932 5.536 -0.478 1.00 0.00 O ATOM 428 NE2 GLN A 27 -21.164 5.159 -2.671 1.00 0.00 N ATOM 0 H GLN A 27 -16.760 4.432 0.092 1.00 0.00 H new ATOM 0 HA GLN A 27 -16.589 4.117 -2.826 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -17.996 6.207 -1.124 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -18.206 5.935 -2.843 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -19.126 3.677 -2.372 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -18.917 3.950 -0.654 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -20.759 4.784 -3.529 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -22.092 5.582 -2.687 1.00 0.00 H new ATOM 437 N THR A 28 -14.868 6.108 -1.021 1.00 0.00 N ATOM 438 CA THR A 28 -13.804 7.086 -1.028 1.00 0.00 C ATOM 439 C THR A 28 -12.545 6.514 -0.405 1.00 0.00 C ATOM 440 O THR A 28 -12.572 5.446 0.214 1.00 0.00 O ATOM 441 CB THR A 28 -14.206 8.360 -0.260 1.00 0.00 C ATOM 442 OG1 THR A 28 -14.391 8.057 1.126 1.00 0.00 O ATOM 443 CG2 THR A 28 -15.487 8.947 -0.827 1.00 0.00 C ATOM 0 H THR A 28 -15.035 5.672 -0.114 1.00 0.00 H new ATOM 0 HA THR A 28 -13.614 7.345 -2.070 1.00 0.00 H new ATOM 0 HB THR A 28 -13.406 9.093 -0.369 1.00 0.00 H new ATOM 0 HG1 THR A 28 -15.268 7.640 1.255 1.00 0.00 H new ATOM 0 HG21 THR A 28 -15.753 9.846 -0.270 1.00 0.00 H new ATOM 0 HG22 THR A 28 -15.338 9.201 -1.876 1.00 0.00 H new ATOM 0 HG23 THR A 28 -16.291 8.216 -0.742 1.00 0.00 H new ATOM 451 N LEU A 29 -11.449 7.231 -0.560 1.00 0.00 N ATOM 452 CA LEU A 29 -10.201 6.872 0.086 1.00 0.00 C ATOM 453 C LEU A 29 -10.340 7.037 1.593 1.00 0.00 C ATOM 454 O LEU A 29 -9.651 6.385 2.375 1.00 0.00 O ATOM 455 CB LEU A 29 -9.074 7.751 -0.450 1.00 0.00 C ATOM 456 CG LEU A 29 -8.881 7.685 -1.965 1.00 0.00 C ATOM 457 CD1 LEU A 29 -7.798 8.651 -2.411 1.00 0.00 C ATOM 458 CD2 LEU A 29 -8.548 6.270 -2.394 1.00 0.00 C ATOM 0 H LEU A 29 -11.398 8.073 -1.133 1.00 0.00 H new ATOM 0 HA LEU A 29 -9.962 5.831 -0.130 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -9.271 8.785 -0.167 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -8.142 7.460 0.035 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.815 7.979 -2.444 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.677 8.588 -3.492 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.081 9.667 -2.136 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.857 8.393 -1.925 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -8.414 6.240 -3.475 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.629 5.948 -1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -9.362 5.603 -2.111 1.00 0.00 H new ATOM 470 N GLU A 30 -11.263 7.909 1.983 1.00 0.00 N ATOM 471 CA GLU A 30 -11.559 8.152 3.385 1.00 0.00 C ATOM 472 C GLU A 30 -12.285 6.958 3.993 1.00 0.00 C ATOM 473 O GLU A 30 -12.234 6.737 5.201 1.00 0.00 O ATOM 474 CB GLU A 30 -12.388 9.426 3.534 1.00 0.00 C ATOM 475 CG GLU A 30 -11.653 10.670 3.062 1.00 0.00 C ATOM 476 CD GLU A 30 -12.455 11.939 3.254 1.00 0.00 C ATOM 477 OE1 GLU A 30 -13.080 12.405 2.282 1.00 0.00 O ATOM 478 OE2 GLU A 30 -12.462 12.480 4.377 1.00 0.00 O ATOM 0 H GLU A 30 -11.824 8.464 1.337 1.00 0.00 H new ATOM 0 HA GLU A 30 -10.621 8.286 3.924 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -13.313 9.320 2.967 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -12.668 9.551 4.580 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -10.711 10.756 3.604 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -11.404 10.560 2.006 1.00 0.00 H new ATOM 485 N ASP A 31 -12.967 6.196 3.150 1.00 0.00 N ATOM 486 CA ASP A 31 -13.588 4.955 3.586 1.00 0.00 C ATOM 487 C ASP A 31 -12.560 3.836 3.569 1.00 0.00 C ATOM 488 O ASP A 31 -12.431 3.070 4.524 1.00 0.00 O ATOM 489 CB ASP A 31 -14.755 4.567 2.674 1.00 0.00 C ATOM 490 CG ASP A 31 -15.853 5.606 2.610 1.00 0.00 C ATOM 491 OD1 ASP A 31 -16.496 5.872 3.645 1.00 0.00 O ATOM 492 OD2 ASP A 31 -16.094 6.144 1.512 1.00 0.00 O ATOM 0 H ASP A 31 -13.104 6.415 2.163 1.00 0.00 H new ATOM 0 HA ASP A 31 -13.968 5.107 4.596 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -14.375 4.392 1.668 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -15.179 3.625 3.023 1.00 0.00 H new ATOM 497 N PHE A 32 -11.814 3.772 2.474 1.00 0.00 N ATOM 498 CA PHE A 32 -10.869 2.689 2.229 1.00 0.00 C ATOM 499 C PHE A 32 -9.739 2.673 3.256 1.00 0.00 C ATOM 500 O PHE A 32 -9.147 1.634 3.512 1.00 0.00 O ATOM 501 CB PHE A 32 -10.295 2.818 0.819 1.00 0.00 C ATOM 502 CG PHE A 32 -9.529 1.609 0.355 1.00 0.00 C ATOM 503 CD1 PHE A 32 -10.152 0.614 -0.381 1.00 0.00 C ATOM 504 CD2 PHE A 32 -8.186 1.471 0.647 1.00 0.00 C ATOM 505 CE1 PHE A 32 -9.446 -0.492 -0.814 1.00 0.00 C ATOM 506 CE2 PHE A 32 -7.477 0.369 0.218 1.00 0.00 C ATOM 507 CZ PHE A 32 -8.107 -0.613 -0.513 1.00 0.00 C ATOM 0 H PHE A 32 -11.847 4.469 1.730 1.00 0.00 H new ATOM 0 HA PHE A 32 -11.408 1.747 2.324 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -11.111 3.007 0.122 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -9.638 3.687 0.784 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -11.202 0.704 -0.619 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -7.684 2.237 1.219 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -9.943 -1.260 -1.387 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.428 0.276 0.455 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.553 -1.476 -0.850 1.00 0.00 H new ATOM 517 N LYS A 33 -9.441 3.816 3.853 1.00 0.00 N ATOM 518 CA LYS A 33 -8.377 3.886 4.849 1.00 0.00 C ATOM 519 C LYS A 33 -8.733 3.099 6.114 1.00 0.00 C ATOM 520 O LYS A 33 -7.891 2.895 6.987 1.00 0.00 O ATOM 521 CB LYS A 33 -8.063 5.338 5.202 1.00 0.00 C ATOM 522 CG LYS A 33 -9.275 6.134 5.642 1.00 0.00 C ATOM 523 CD LYS A 33 -8.894 7.501 6.192 1.00 0.00 C ATOM 524 CE LYS A 33 -8.164 8.360 5.168 1.00 0.00 C ATOM 525 NZ LYS A 33 -7.823 9.700 5.721 1.00 0.00 N ATOM 0 H LYS A 33 -9.914 4.701 3.670 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.490 3.429 4.410 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.319 5.356 5.998 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -7.615 5.824 4.336 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -9.952 6.260 4.797 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.818 5.575 6.405 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.794 8.020 6.521 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -8.261 7.372 7.070 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.252 7.854 4.851 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -8.787 8.479 4.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.327 10.258 4.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -8.695 10.192 6.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.208 9.586 6.552 1.00 0.00 H new ATOM 539 N GLU A 34 -9.983 2.661 6.207 1.00 0.00 N ATOM 540 CA GLU A 34 -10.424 1.838 7.323 1.00 0.00 C ATOM 541 C GLU A 34 -10.664 0.408 6.861 1.00 0.00 C ATOM 542 O GLU A 34 -11.180 -0.428 7.605 1.00 0.00 O ATOM 543 CB GLU A 34 -11.691 2.412 7.945 1.00 0.00 C ATOM 544 CG GLU A 34 -11.505 3.811 8.499 1.00 0.00 C ATOM 545 CD GLU A 34 -12.714 4.302 9.262 1.00 0.00 C ATOM 546 OE1 GLU A 34 -12.868 3.937 10.446 1.00 0.00 O ATOM 547 OE2 GLU A 34 -13.513 5.065 8.686 1.00 0.00 O ATOM 0 H GLU A 34 -10.710 2.864 5.520 1.00 0.00 H new ATOM 0 HA GLU A 34 -9.640 1.835 8.080 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -12.481 2.428 7.194 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -12.025 1.753 8.746 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -10.636 3.824 9.156 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -11.295 4.497 7.679 1.00 0.00 H new ATOM 554 N LEU A 35 -10.282 0.140 5.625 1.00 0.00 N ATOM 555 CA LEU A 35 -10.422 -1.174 5.033 1.00 0.00 C ATOM 556 C LEU A 35 -9.422 -2.135 5.671 1.00 0.00 C ATOM 557 O LEU A 35 -8.226 -1.864 5.717 1.00 0.00 O ATOM 558 CB LEU A 35 -10.217 -1.052 3.515 1.00 0.00 C ATOM 559 CG LEU A 35 -10.385 -2.314 2.673 1.00 0.00 C ATOM 560 CD1 LEU A 35 -9.128 -3.168 2.726 1.00 0.00 C ATOM 561 CD2 LEU A 35 -11.604 -3.099 3.128 1.00 0.00 C ATOM 0 H LEU A 35 -9.864 0.832 5.003 1.00 0.00 H new ATOM 0 HA LEU A 35 -11.419 -1.576 5.214 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.916 -0.304 3.141 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -9.213 -0.665 3.342 1.00 0.00 H new ATOM 0 HG LEU A 35 -10.543 -2.020 1.635 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -9.270 -4.062 2.119 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.284 -2.597 2.339 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -8.928 -3.458 3.758 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -11.708 -3.995 2.517 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.484 -3.384 4.173 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.495 -2.481 3.021 1.00 0.00 H new ATOM 573 N ARG A 36 -9.924 -3.250 6.179 1.00 0.00 N ATOM 574 CA ARG A 36 -9.080 -4.217 6.861 1.00 0.00 C ATOM 575 C ARG A 36 -9.216 -5.593 6.234 1.00 0.00 C ATOM 576 O ARG A 36 -10.148 -5.833 5.464 1.00 0.00 O ATOM 577 CB ARG A 36 -9.436 -4.284 8.345 1.00 0.00 C ATOM 578 CG ARG A 36 -9.250 -2.967 9.080 1.00 0.00 C ATOM 579 CD ARG A 36 -7.822 -2.464 8.958 1.00 0.00 C ATOM 580 NE ARG A 36 -7.606 -1.224 9.699 1.00 0.00 N ATOM 581 CZ ARG A 36 -6.425 -0.617 9.790 1.00 0.00 C ATOM 582 NH1 ARG A 36 -5.364 -1.148 9.195 1.00 0.00 N ATOM 583 NH2 ARG A 36 -6.303 0.511 10.477 1.00 0.00 N ATOM 0 H ARG A 36 -10.910 -3.507 6.132 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.045 -3.891 6.759 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -10.473 -4.603 8.446 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -8.820 -5.046 8.823 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -9.936 -2.222 8.676 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -9.504 -3.096 10.132 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -7.137 -3.228 9.326 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -7.585 -2.302 7.907 1.00 0.00 H new ATOM 0 HE ARG A 36 -8.404 -0.800 10.173 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -5.456 -2.018 8.670 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -4.457 -0.686 9.262 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -7.117 0.917 10.939 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -5.396 0.972 10.544 1.00 0.00 H new ATOM 597 N GLU A 37 -8.301 -6.494 6.560 1.00 0.00 N ATOM 598 CA GLU A 37 -8.314 -7.829 5.981 1.00 0.00 C ATOM 599 C GLU A 37 -9.565 -8.578 6.418 1.00 0.00 C ATOM 600 O GLU A 37 -10.175 -9.307 5.632 1.00 0.00 O ATOM 601 CB GLU A 37 -7.066 -8.611 6.380 1.00 0.00 C ATOM 602 CG GLU A 37 -6.968 -9.960 5.696 1.00 0.00 C ATOM 603 CD GLU A 37 -5.732 -10.732 6.096 1.00 0.00 C ATOM 604 OE1 GLU A 37 -4.771 -10.778 5.301 1.00 0.00 O ATOM 605 OE2 GLU A 37 -5.715 -11.311 7.198 1.00 0.00 O ATOM 0 H GLU A 37 -7.542 -6.326 7.221 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.320 -7.729 4.896 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.182 -8.022 6.137 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -7.065 -8.757 7.460 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.853 -10.549 5.937 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.966 -9.815 4.616 1.00 0.00 H new ATOM 612 N THR A 38 -9.960 -8.362 7.665 1.00 0.00 N ATOM 613 CA THR A 38 -11.182 -8.942 8.193 1.00 0.00 C ATOM 614 C THR A 38 -12.373 -8.503 7.349 1.00 0.00 C ATOM 615 O THR A 38 -13.342 -9.238 7.176 1.00 0.00 O ATOM 616 CB THR A 38 -11.409 -8.506 9.648 1.00 0.00 C ATOM 617 OG1 THR A 38 -10.203 -8.680 10.403 1.00 0.00 O ATOM 618 CG2 THR A 38 -12.533 -9.301 10.288 1.00 0.00 C ATOM 0 H THR A 38 -9.447 -7.785 8.332 1.00 0.00 H new ATOM 0 HA THR A 38 -11.084 -10.027 8.159 1.00 0.00 H new ATOM 0 HB THR A 38 -11.691 -7.453 9.647 1.00 0.00 H new ATOM 0 HG1 THR A 38 -10.354 -8.399 11.330 1.00 0.00 H new ATOM 0 HG21 THR A 38 -12.671 -8.971 11.318 1.00 0.00 H new ATOM 0 HG22 THR A 38 -13.455 -9.142 9.729 1.00 0.00 H new ATOM 0 HG23 THR A 38 -12.280 -10.361 10.278 1.00 0.00 H new ATOM 626 N HIS A 39 -12.266 -7.304 6.797 1.00 0.00 N ATOM 627 CA HIS A 39 -13.324 -6.746 5.978 1.00 0.00 C ATOM 628 C HIS A 39 -13.304 -7.413 4.615 1.00 0.00 C ATOM 629 O HIS A 39 -14.343 -7.662 4.026 1.00 0.00 O ATOM 630 CB HIS A 39 -13.163 -5.230 5.834 1.00 0.00 C ATOM 631 CG HIS A 39 -13.137 -4.489 7.141 1.00 0.00 C ATOM 632 ND1 HIS A 39 -13.048 -3.119 7.225 1.00 0.00 N ATOM 633 CD2 HIS A 39 -13.147 -4.937 8.419 1.00 0.00 C ATOM 634 CE1 HIS A 39 -12.994 -2.759 8.491 1.00 0.00 C ATOM 635 NE2 HIS A 39 -13.057 -3.843 9.239 1.00 0.00 N ATOM 0 H HIS A 39 -11.452 -6.699 6.904 1.00 0.00 H new ATOM 0 HA HIS A 39 -14.283 -6.933 6.461 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -12.240 -5.023 5.293 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -13.982 -4.845 5.226 1.00 0.00 H new ATOM 0 HD1 HIS A 39 -13.027 -2.480 6.430 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -13.214 -5.968 8.734 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -12.912 -1.746 8.855 1.00 0.00 H new ATOM 644 N LEU A 40 -12.104 -7.721 4.136 1.00 0.00 N ATOM 645 CA LEU A 40 -11.931 -8.439 2.877 1.00 0.00 C ATOM 646 C LEU A 40 -12.516 -9.835 2.968 1.00 0.00 C ATOM 647 O LEU A 40 -13.020 -10.365 1.983 1.00 0.00 O ATOM 648 CB LEU A 40 -10.453 -8.509 2.496 1.00 0.00 C ATOM 649 CG LEU A 40 -9.981 -7.420 1.536 1.00 0.00 C ATOM 650 CD1 LEU A 40 -10.512 -6.073 1.955 1.00 0.00 C ATOM 651 CD2 LEU A 40 -8.468 -7.386 1.479 1.00 0.00 C ATOM 0 H LEU A 40 -11.230 -7.483 4.604 1.00 0.00 H new ATOM 0 HA LEU A 40 -12.465 -7.892 2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -9.856 -8.453 3.406 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -10.256 -9.481 2.044 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.367 -7.652 0.543 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -10.164 -5.311 1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -11.602 -6.095 1.954 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.155 -5.837 2.958 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -8.147 -6.604 0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.071 -7.179 2.473 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.095 -8.350 1.133 1.00 0.00 H new ATOM 663 N ASN A 41 -12.446 -10.424 4.154 1.00 0.00 N ATOM 664 CA ASN A 41 -13.109 -11.696 4.408 1.00 0.00 C ATOM 665 C ASN A 41 -14.597 -11.551 4.129 1.00 0.00 C ATOM 666 O ASN A 41 -15.219 -12.412 3.506 1.00 0.00 O ATOM 667 CB ASN A 41 -12.899 -12.154 5.855 1.00 0.00 C ATOM 668 CG ASN A 41 -11.447 -12.450 6.188 1.00 0.00 C ATOM 669 OD1 ASN A 41 -10.646 -12.786 5.315 1.00 0.00 O ATOM 670 ND2 ASN A 41 -11.109 -12.361 7.463 1.00 0.00 N ATOM 0 H ASN A 41 -11.939 -10.043 4.953 1.00 0.00 H new ATOM 0 HA ASN A 41 -12.675 -12.448 3.749 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -13.269 -11.382 6.530 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -13.495 -13.048 6.036 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -10.155 -12.574 7.754 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -11.802 -12.079 8.156 1.00 0.00 H new ATOM 677 N GLU A 42 -15.144 -10.427 4.567 1.00 0.00 N ATOM 678 CA GLU A 42 -16.552 -10.116 4.376 1.00 0.00 C ATOM 679 C GLU A 42 -16.839 -9.788 2.912 1.00 0.00 C ATOM 680 O GLU A 42 -17.895 -10.124 2.378 1.00 0.00 O ATOM 681 CB GLU A 42 -16.928 -8.932 5.259 1.00 0.00 C ATOM 682 CG GLU A 42 -16.701 -9.183 6.739 1.00 0.00 C ATOM 683 CD GLU A 42 -17.587 -10.281 7.285 1.00 0.00 C ATOM 684 OE1 GLU A 42 -17.187 -11.461 7.225 1.00 0.00 O ATOM 685 OE2 GLU A 42 -18.687 -9.966 7.787 1.00 0.00 O ATOM 0 H GLU A 42 -14.624 -9.705 5.065 1.00 0.00 H new ATOM 0 HA GLU A 42 -17.148 -10.985 4.653 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -16.347 -8.062 4.953 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -17.978 -8.687 5.097 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -15.657 -9.449 6.903 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -16.886 -8.263 7.293 1.00 0.00 H new ATOM 692 N LEU A 43 -15.877 -9.137 2.273 1.00 0.00 N ATOM 693 CA LEU A 43 -16.002 -8.728 0.879 1.00 0.00 C ATOM 694 C LEU A 43 -15.725 -9.897 -0.062 1.00 0.00 C ATOM 695 O LEU A 43 -15.789 -9.752 -1.286 1.00 0.00 O ATOM 696 CB LEU A 43 -15.024 -7.594 0.585 1.00 0.00 C ATOM 697 CG LEU A 43 -15.082 -6.412 1.549 1.00 0.00 C ATOM 698 CD1 LEU A 43 -14.104 -5.335 1.134 1.00 0.00 C ATOM 699 CD2 LEU A 43 -16.483 -5.848 1.628 1.00 0.00 C ATOM 0 H LEU A 43 -14.990 -8.878 2.704 1.00 0.00 H new ATOM 0 HA LEU A 43 -17.024 -8.387 0.714 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -14.012 -7.999 0.594 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -15.212 -7.227 -0.424 1.00 0.00 H new ATOM 0 HG LEU A 43 -14.801 -6.772 2.539 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -14.162 -4.502 1.834 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -13.093 -5.742 1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -14.352 -4.985 0.132 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -16.498 -5.007 2.321 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -16.795 -5.510 0.640 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -17.167 -6.620 1.980 1.00 0.00 H new ATOM 711 N ASN A 44 -15.385 -11.041 0.529 1.00 0.00 N ATOM 712 CA ASN A 44 -15.101 -12.272 -0.211 1.00 0.00 C ATOM 713 C ASN A 44 -13.818 -12.125 -1.027 1.00 0.00 C ATOM 714 O ASN A 44 -13.579 -12.850 -1.989 1.00 0.00 O ATOM 715 CB ASN A 44 -16.280 -12.646 -1.117 1.00 0.00 C ATOM 716 CG ASN A 44 -16.313 -14.122 -1.474 1.00 0.00 C ATOM 717 OD1 ASN A 44 -16.921 -14.929 -0.769 1.00 0.00 O ATOM 718 ND2 ASN A 44 -15.675 -14.492 -2.570 1.00 0.00 N ATOM 0 H ASN A 44 -15.298 -11.142 1.540 1.00 0.00 H new ATOM 0 HA ASN A 44 -14.958 -13.078 0.509 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -17.212 -12.378 -0.619 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -16.227 -12.058 -2.033 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -15.676 -15.471 -2.855 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -15.181 -13.798 -3.131 1.00 0.00 H new ATOM 725 N ILE A 45 -12.984 -11.183 -0.627 1.00 0.00 N ATOM 726 CA ILE A 45 -11.707 -10.978 -1.277 1.00 0.00 C ATOM 727 C ILE A 45 -10.668 -11.873 -0.629 1.00 0.00 C ATOM 728 O ILE A 45 -9.857 -11.434 0.183 1.00 0.00 O ATOM 729 CB ILE A 45 -11.255 -9.505 -1.218 1.00 0.00 C ATOM 730 CG1 ILE A 45 -12.348 -8.604 -1.797 1.00 0.00 C ATOM 731 CG2 ILE A 45 -9.948 -9.319 -1.982 1.00 0.00 C ATOM 732 CD1 ILE A 45 -12.051 -7.127 -1.682 1.00 0.00 C ATOM 0 H ILE A 45 -13.171 -10.547 0.148 1.00 0.00 H new ATOM 0 HA ILE A 45 -11.818 -11.236 -2.330 1.00 0.00 H new ATOM 0 HB ILE A 45 -11.084 -9.228 -0.178 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.492 -8.854 -2.848 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -13.288 -8.816 -1.287 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -9.642 -8.274 -1.931 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.175 -9.945 -1.538 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -10.092 -9.604 -3.024 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -12.872 -6.556 -2.115 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -11.937 -6.860 -0.632 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -11.129 -6.899 -2.217 1.00 0.00 H new ATOM 744 N MET A 46 -10.734 -13.149 -0.962 1.00 0.00 N ATOM 745 CA MET A 46 -9.831 -14.137 -0.396 1.00 0.00 C ATOM 746 C MET A 46 -8.512 -14.121 -1.151 1.00 0.00 C ATOM 747 O MET A 46 -7.540 -14.749 -0.738 1.00 0.00 O ATOM 748 CB MET A 46 -10.468 -15.524 -0.461 1.00 0.00 C ATOM 749 CG MET A 46 -11.879 -15.588 0.115 1.00 0.00 C ATOM 750 SD MET A 46 -11.933 -15.851 1.905 1.00 0.00 S ATOM 751 CE MET A 46 -11.314 -14.293 2.536 1.00 0.00 C ATOM 0 H MET A 46 -11.408 -13.528 -1.626 1.00 0.00 H new ATOM 0 HA MET A 46 -9.639 -13.892 0.649 1.00 0.00 H new ATOM 0 HB2 MET A 46 -10.496 -15.851 -1.500 1.00 0.00 H new ATOM 0 HB3 MET A 46 -9.835 -16.229 0.078 1.00 0.00 H new ATOM 0 HG2 MET A 46 -12.399 -14.660 -0.121 1.00 0.00 H new ATOM 0 HG3 MET A 46 -12.425 -16.393 -0.377 1.00 0.00 H new ATOM 0 HE1 MET A 46 -11.662 -14.151 3.559 1.00 0.00 H new ATOM 0 HE2 MET A 46 -10.224 -14.302 2.522 1.00 0.00 H new ATOM 0 HE3 MET A 46 -11.678 -13.477 1.912 1.00 0.00 H new ATOM 761 N ASP A 47 -8.512 -13.380 -2.257 1.00 0.00 N ATOM 762 CA ASP A 47 -7.331 -13.160 -3.089 1.00 0.00 C ATOM 763 C ASP A 47 -6.155 -12.704 -2.231 1.00 0.00 C ATOM 764 O ASP A 47 -6.102 -11.554 -1.817 1.00 0.00 O ATOM 765 CB ASP A 47 -7.628 -12.056 -4.107 1.00 0.00 C ATOM 766 CG ASP A 47 -8.784 -12.337 -5.047 1.00 0.00 C ATOM 767 OD1 ASP A 47 -9.343 -13.449 -5.011 1.00 0.00 O ATOM 768 OD2 ASP A 47 -9.142 -11.420 -5.826 1.00 0.00 O ATOM 0 H ASP A 47 -9.346 -12.908 -2.606 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.082 -14.095 -3.591 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -7.836 -11.133 -3.567 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.731 -11.882 -4.702 1.00 0.00 H new ATOM 773 N PRO A 48 -5.180 -13.595 -1.990 1.00 0.00 N ATOM 774 CA PRO A 48 -4.090 -13.358 -1.033 1.00 0.00 C ATOM 775 C PRO A 48 -3.215 -12.155 -1.371 1.00 0.00 C ATOM 776 O PRO A 48 -2.966 -11.307 -0.515 1.00 0.00 O ATOM 777 CB PRO A 48 -3.259 -14.639 -1.096 1.00 0.00 C ATOM 778 CG PRO A 48 -4.160 -15.656 -1.697 1.00 0.00 C ATOM 779 CD PRO A 48 -5.060 -14.911 -2.632 1.00 0.00 C ATOM 0 HA PRO A 48 -4.495 -13.131 -0.047 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -2.364 -14.499 -1.702 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -2.928 -14.943 -0.103 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -3.589 -16.417 -2.229 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -4.736 -16.170 -0.928 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -4.632 -14.836 -3.631 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -6.029 -15.400 -2.736 1.00 0.00 H new ATOM 787 N GLN A 49 -2.734 -12.083 -2.605 1.00 0.00 N ATOM 788 CA GLN A 49 -1.888 -10.970 -3.019 1.00 0.00 C ATOM 789 C GLN A 49 -2.714 -9.704 -3.134 1.00 0.00 C ATOM 790 O GLN A 49 -2.260 -8.617 -2.795 1.00 0.00 O ATOM 791 CB GLN A 49 -1.193 -11.267 -4.346 1.00 0.00 C ATOM 792 CG GLN A 49 -0.036 -12.244 -4.223 1.00 0.00 C ATOM 793 CD GLN A 49 0.612 -12.553 -5.557 1.00 0.00 C ATOM 794 OE1 GLN A 49 0.213 -13.486 -6.254 1.00 0.00 O ATOM 795 NE2 GLN A 49 1.622 -11.780 -5.918 1.00 0.00 N ATOM 0 H GLN A 49 -2.913 -12.776 -3.332 1.00 0.00 H new ATOM 0 HA GLN A 49 -1.119 -10.829 -2.260 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -1.924 -11.670 -5.047 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -0.825 -10.333 -4.771 1.00 0.00 H new ATOM 0 HG2 GLN A 49 0.713 -11.831 -3.547 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -0.394 -13.171 -3.774 1.00 0.00 H new ATOM 0 HE21 GLN A 49 1.922 -11.017 -5.312 1.00 0.00 H new ATOM 0 HE22 GLN A 49 2.101 -11.947 -6.803 1.00 0.00 H new ATOM 804 N HIS A 50 -3.944 -9.863 -3.586 1.00 0.00 N ATOM 805 CA HIS A 50 -4.845 -8.734 -3.741 1.00 0.00 C ATOM 806 C HIS A 50 -5.180 -8.152 -2.378 1.00 0.00 C ATOM 807 O HIS A 50 -5.223 -6.937 -2.208 1.00 0.00 O ATOM 808 CB HIS A 50 -6.112 -9.162 -4.477 1.00 0.00 C ATOM 809 CG HIS A 50 -5.859 -9.655 -5.874 1.00 0.00 C ATOM 810 ND1 HIS A 50 -6.827 -10.245 -6.662 1.00 0.00 N ATOM 811 CD2 HIS A 50 -4.734 -9.628 -6.629 1.00 0.00 C ATOM 812 CE1 HIS A 50 -6.308 -10.551 -7.835 1.00 0.00 C ATOM 813 NE2 HIS A 50 -5.043 -10.188 -7.840 1.00 0.00 N ATOM 0 H HIS A 50 -4.343 -10.763 -3.853 1.00 0.00 H new ATOM 0 HA HIS A 50 -4.354 -7.964 -4.336 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -6.605 -9.949 -3.907 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -6.801 -8.318 -4.518 1.00 0.00 H new ATOM 0 HD1 HIS A 50 -7.792 -10.417 -6.381 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -3.772 -9.237 -6.331 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -6.833 -11.021 -8.654 1.00 0.00 H new ATOM 822 N ARG A 51 -5.410 -9.038 -1.414 1.00 0.00 N ATOM 823 CA ARG A 51 -5.550 -8.650 -0.017 1.00 0.00 C ATOM 824 C ARG A 51 -4.348 -7.836 0.409 1.00 0.00 C ATOM 825 O ARG A 51 -4.475 -6.708 0.879 1.00 0.00 O ATOM 826 CB ARG A 51 -5.647 -9.891 0.876 1.00 0.00 C ATOM 827 CG ARG A 51 -6.989 -10.594 0.836 1.00 0.00 C ATOM 828 CD ARG A 51 -6.879 -12.033 1.314 1.00 0.00 C ATOM 829 NE ARG A 51 -6.216 -12.145 2.612 1.00 0.00 N ATOM 830 CZ ARG A 51 -6.013 -13.301 3.246 1.00 0.00 C ATOM 831 NH1 ARG A 51 -6.443 -14.444 2.717 1.00 0.00 N ATOM 832 NH2 ARG A 51 -5.376 -13.312 4.409 1.00 0.00 N ATOM 0 H ARG A 51 -5.504 -10.040 -1.579 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.459 -8.058 0.087 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -4.872 -10.598 0.579 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -5.435 -9.600 1.905 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -7.702 -10.056 1.461 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -7.380 -10.576 -0.181 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -7.877 -12.467 1.381 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -6.327 -12.616 0.577 1.00 0.00 H new ATOM 0 HE ARG A 51 -5.889 -11.289 3.059 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -6.931 -14.440 1.821 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.284 -15.324 3.207 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.043 -12.438 4.816 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -5.219 -14.194 4.896 1.00 0.00 H new ATOM 846 N ALA A 52 -3.180 -8.425 0.203 1.00 0.00 N ATOM 847 CA ALA A 52 -1.922 -7.824 0.590 1.00 0.00 C ATOM 848 C ALA A 52 -1.803 -6.393 0.066 1.00 0.00 C ATOM 849 O ALA A 52 -1.381 -5.491 0.791 1.00 0.00 O ATOM 850 CB ALA A 52 -0.787 -8.693 0.080 1.00 0.00 C ATOM 0 H ALA A 52 -3.082 -9.338 -0.240 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.872 -7.765 1.677 1.00 0.00 H new ATOM 0 HB1 ALA A 52 0.167 -8.250 0.366 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -0.869 -9.690 0.514 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.843 -8.764 -1.006 1.00 0.00 H new ATOM 856 N LYS A 53 -2.195 -6.185 -1.184 1.00 0.00 N ATOM 857 CA LYS A 53 -2.164 -4.856 -1.777 1.00 0.00 C ATOM 858 C LYS A 53 -3.202 -3.946 -1.129 1.00 0.00 C ATOM 859 O LYS A 53 -2.882 -2.844 -0.688 1.00 0.00 O ATOM 860 CB LYS A 53 -2.409 -4.924 -3.286 1.00 0.00 C ATOM 861 CG LYS A 53 -1.511 -5.927 -3.987 1.00 0.00 C ATOM 862 CD LYS A 53 -1.379 -5.664 -5.478 1.00 0.00 C ATOM 863 CE LYS A 53 -0.308 -4.626 -5.765 1.00 0.00 C ATOM 864 NZ LYS A 53 -0.052 -4.483 -7.220 1.00 0.00 N ATOM 0 H LYS A 53 -2.537 -6.918 -1.805 1.00 0.00 H new ATOM 0 HA LYS A 53 -1.172 -4.441 -1.600 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.451 -5.188 -3.468 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.250 -3.937 -3.719 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -0.522 -5.902 -3.530 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -1.908 -6.931 -3.834 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -1.134 -6.593 -5.993 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -2.335 -5.322 -5.875 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -0.615 -3.664 -5.354 1.00 0.00 H new ATOM 0 HE3 LYS A 53 0.616 -4.908 -5.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 0.784 -3.883 -7.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 0.117 -5.421 -7.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -0.878 -4.045 -7.676 1.00 0.00 H new ATOM 878 N LEU A 54 -4.436 -4.430 -1.057 1.00 0.00 N ATOM 879 CA LEU A 54 -5.548 -3.656 -0.512 1.00 0.00 C ATOM 880 C LEU A 54 -5.250 -3.148 0.896 1.00 0.00 C ATOM 881 O LEU A 54 -5.475 -1.977 1.197 1.00 0.00 O ATOM 882 CB LEU A 54 -6.817 -4.506 -0.503 1.00 0.00 C ATOM 883 CG LEU A 54 -7.371 -4.854 -1.885 1.00 0.00 C ATOM 884 CD1 LEU A 54 -8.469 -5.894 -1.772 1.00 0.00 C ATOM 885 CD2 LEU A 54 -7.893 -3.610 -2.578 1.00 0.00 C ATOM 0 H LEU A 54 -4.695 -5.365 -1.373 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.693 -2.786 -1.153 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.612 -5.432 0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -7.587 -3.976 0.058 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.561 -5.270 -2.484 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -8.851 -6.129 -2.765 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -8.068 -6.798 -1.314 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -9.278 -5.503 -1.155 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -8.283 -3.877 -3.560 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.689 -3.167 -1.979 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -7.082 -2.890 -2.693 1.00 0.00 H new ATOM 897 N LEU A 55 -4.729 -4.020 1.751 1.00 0.00 N ATOM 898 CA LEU A 55 -4.429 -3.637 3.125 1.00 0.00 C ATOM 899 C LEU A 55 -3.300 -2.621 3.185 1.00 0.00 C ATOM 900 O LEU A 55 -3.315 -1.721 4.022 1.00 0.00 O ATOM 901 CB LEU A 55 -4.086 -4.852 3.993 1.00 0.00 C ATOM 902 CG LEU A 55 -5.285 -5.665 4.488 1.00 0.00 C ATOM 903 CD1 LEU A 55 -6.520 -4.790 4.569 1.00 0.00 C ATOM 904 CD2 LEU A 55 -5.541 -6.873 3.606 1.00 0.00 C ATOM 0 H LEU A 55 -4.507 -4.988 1.520 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.333 -3.177 3.525 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -3.432 -5.512 3.423 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.518 -4.510 4.858 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.050 -6.032 5.487 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.364 -5.383 4.922 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.339 -3.968 5.262 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.747 -4.389 3.581 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.399 -7.427 3.987 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.745 -6.543 2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.663 -7.518 3.609 1.00 0.00 H new ATOM 916 N THR A 56 -2.333 -2.757 2.293 1.00 0.00 N ATOM 917 CA THR A 56 -1.228 -1.817 2.233 1.00 0.00 C ATOM 918 C THR A 56 -1.723 -0.456 1.769 1.00 0.00 C ATOM 919 O THR A 56 -1.319 0.583 2.295 1.00 0.00 O ATOM 920 CB THR A 56 -0.138 -2.317 1.282 1.00 0.00 C ATOM 921 OG1 THR A 56 0.248 -3.636 1.662 1.00 0.00 O ATOM 922 CG2 THR A 56 1.073 -1.405 1.313 1.00 0.00 C ATOM 0 H THR A 56 -2.291 -3.507 1.603 1.00 0.00 H new ATOM 0 HA THR A 56 -0.805 -1.728 3.234 1.00 0.00 H new ATOM 0 HB THR A 56 -0.537 -2.320 0.268 1.00 0.00 H new ATOM 0 HG1 THR A 56 -0.469 -4.265 1.435 1.00 0.00 H new ATOM 0 HG21 THR A 56 1.832 -1.784 0.628 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.780 -0.400 1.009 1.00 0.00 H new ATOM 0 HG23 THR A 56 1.480 -1.374 2.324 1.00 0.00 H new ATOM 930 N ALA A 57 -2.614 -0.476 0.788 1.00 0.00 N ATOM 931 CA ALA A 57 -3.231 0.738 0.301 1.00 0.00 C ATOM 932 C ALA A 57 -4.008 1.412 1.419 1.00 0.00 C ATOM 933 O ALA A 57 -3.884 2.612 1.631 1.00 0.00 O ATOM 934 CB ALA A 57 -4.133 0.438 -0.882 1.00 0.00 C ATOM 0 H ALA A 57 -2.923 -1.326 0.316 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.450 1.420 -0.036 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.589 1.363 -1.236 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.545 -0.007 -1.685 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.914 -0.258 -0.577 1.00 0.00 H new ATOM 940 N ALA A 58 -4.783 0.625 2.154 1.00 0.00 N ATOM 941 CA ALA A 58 -5.543 1.139 3.283 1.00 0.00 C ATOM 942 C ALA A 58 -4.620 1.757 4.326 1.00 0.00 C ATOM 943 O ALA A 58 -4.904 2.828 4.860 1.00 0.00 O ATOM 944 CB ALA A 58 -6.378 0.035 3.903 1.00 0.00 C ATOM 0 H ALA A 58 -4.901 -0.374 1.987 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.210 1.919 2.917 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.941 0.435 4.746 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -7.070 -0.359 3.159 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.724 -0.765 4.250 1.00 0.00 H new ATOM 950 N GLU A 59 -3.509 1.079 4.595 1.00 0.00 N ATOM 951 CA GLU A 59 -2.516 1.570 5.542 1.00 0.00 C ATOM 952 C GLU A 59 -2.008 2.945 5.145 1.00 0.00 C ATOM 953 O GLU A 59 -2.070 3.899 5.926 1.00 0.00 O ATOM 954 CB GLU A 59 -1.333 0.605 5.629 1.00 0.00 C ATOM 955 CG GLU A 59 -1.623 -0.640 6.436 1.00 0.00 C ATOM 956 CD GLU A 59 -2.078 -0.318 7.843 1.00 0.00 C ATOM 957 OE1 GLU A 59 -2.748 -1.169 8.458 1.00 0.00 O ATOM 958 OE2 GLU A 59 -1.784 0.793 8.332 1.00 0.00 O ATOM 0 H GLU A 59 -3.274 0.183 4.168 1.00 0.00 H new ATOM 0 HA GLU A 59 -3.002 1.641 6.515 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -1.038 0.313 4.621 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -0.483 1.125 6.072 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -2.392 -1.226 5.933 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -0.727 -1.260 6.479 1.00 0.00 H new ATOM 965 N LEU A 60 -1.513 3.047 3.926 1.00 0.00 N ATOM 966 CA LEU A 60 -0.917 4.282 3.464 1.00 0.00 C ATOM 967 C LEU A 60 -1.969 5.354 3.204 1.00 0.00 C ATOM 968 O LEU A 60 -1.681 6.530 3.306 1.00 0.00 O ATOM 969 CB LEU A 60 -0.060 4.046 2.221 1.00 0.00 C ATOM 970 CG LEU A 60 1.374 3.580 2.493 1.00 0.00 C ATOM 971 CD1 LEU A 60 1.395 2.234 3.198 1.00 0.00 C ATOM 972 CD2 LEU A 60 2.155 3.516 1.199 1.00 0.00 C ATOM 0 H LEU A 60 -1.513 2.291 3.241 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.269 4.647 4.260 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.554 3.302 1.595 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.021 4.971 1.646 1.00 0.00 H new ATOM 0 HG LEU A 60 1.846 4.306 3.155 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.427 1.933 3.376 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.871 2.314 4.150 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.902 1.489 2.574 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.173 3.184 1.404 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.674 2.813 0.518 1.00 0.00 H new ATOM 0 HD23 LEU A 60 2.182 4.505 0.741 1.00 0.00 H new ATOM 984 N LEU A 61 -3.190 4.961 2.886 1.00 0.00 N ATOM 985 CA LEU A 61 -4.266 5.933 2.726 1.00 0.00 C ATOM 986 C LEU A 61 -4.721 6.464 4.078 1.00 0.00 C ATOM 987 O LEU A 61 -5.279 7.555 4.175 1.00 0.00 O ATOM 988 CB LEU A 61 -5.453 5.321 1.991 1.00 0.00 C ATOM 989 CG LEU A 61 -5.233 5.062 0.504 1.00 0.00 C ATOM 990 CD1 LEU A 61 -6.450 4.384 -0.089 1.00 0.00 C ATOM 991 CD2 LEU A 61 -4.927 6.357 -0.230 1.00 0.00 C ATOM 0 H LEU A 61 -3.463 3.990 2.734 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.875 6.760 2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.712 4.378 2.473 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.311 5.983 2.105 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.374 4.401 0.389 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -6.284 4.203 -1.151 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -6.621 3.435 0.419 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -7.322 5.026 0.038 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.774 6.148 -1.289 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.763 7.047 -0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.025 6.806 0.185 1.00 0.00 H new ATOM 1003 N LEU A 62 -4.488 5.682 5.117 1.00 0.00 N ATOM 1004 CA LEU A 62 -4.860 6.075 6.463 1.00 0.00 C ATOM 1005 C LEU A 62 -3.886 7.108 7.013 1.00 0.00 C ATOM 1006 O LEU A 62 -4.274 8.000 7.765 1.00 0.00 O ATOM 1007 CB LEU A 62 -4.907 4.846 7.372 1.00 0.00 C ATOM 1008 CG LEU A 62 -5.377 5.101 8.805 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -6.770 5.710 8.817 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -5.356 3.806 9.600 1.00 0.00 C ATOM 0 H LEU A 62 -4.041 4.767 5.053 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.851 6.528 6.431 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.567 4.106 6.919 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.911 4.405 7.409 1.00 0.00 H new ATOM 0 HG LEU A 62 -4.694 5.811 9.271 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.083 5.882 9.847 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.758 6.657 8.278 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -7.470 5.027 8.335 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.692 3.999 10.619 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.019 3.080 9.130 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -4.341 3.409 9.622 1.00 0.00 H new ATOM 1022 N ASP A 63 -2.626 6.991 6.625 1.00 0.00 N ATOM 1023 CA ASP A 63 -1.598 7.897 7.127 1.00 0.00 C ATOM 1024 C ASP A 63 -1.208 8.947 6.094 1.00 0.00 C ATOM 1025 O ASP A 63 -1.085 10.129 6.406 1.00 0.00 O ATOM 1026 CB ASP A 63 -0.358 7.113 7.544 1.00 0.00 C ATOM 1027 CG ASP A 63 0.678 8.000 8.197 1.00 0.00 C ATOM 1028 OD1 ASP A 63 0.418 8.488 9.315 1.00 0.00 O ATOM 1029 OD2 ASP A 63 1.758 8.202 7.611 1.00 0.00 O ATOM 0 H ASP A 63 -2.290 6.285 5.970 1.00 0.00 H new ATOM 0 HA ASP A 63 -2.019 8.411 7.991 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.645 6.321 8.235 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.077 6.630 6.669 1.00 0.00 H new ATOM 1034 N TYR A 64 -1.032 8.509 4.862 1.00 0.00 N ATOM 1035 CA TYR A 64 -0.534 9.363 3.796 1.00 0.00 C ATOM 1036 C TYR A 64 -1.677 9.902 2.948 1.00 0.00 C ATOM 1037 O TYR A 64 -1.565 9.979 1.729 1.00 0.00 O ATOM 1038 CB TYR A 64 0.421 8.576 2.898 1.00 0.00 C ATOM 1039 CG TYR A 64 1.643 8.045 3.599 1.00 0.00 C ATOM 1040 CD1 TYR A 64 2.838 8.746 3.578 1.00 0.00 C ATOM 1041 CD2 TYR A 64 1.602 6.837 4.273 1.00 0.00 C ATOM 1042 CE1 TYR A 64 3.959 8.258 4.210 1.00 0.00 C ATOM 1043 CE2 TYR A 64 2.714 6.340 4.911 1.00 0.00 C ATOM 1044 CZ TYR A 64 3.893 7.053 4.876 1.00 0.00 C ATOM 1045 OH TYR A 64 5.007 6.556 5.504 1.00 0.00 O ATOM 0 H TYR A 64 -1.230 7.552 4.570 1.00 0.00 H new ATOM 0 HA TYR A 64 -0.009 10.200 4.256 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -0.121 7.740 2.457 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.739 9.218 2.077 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.891 9.691 3.057 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.680 6.275 4.298 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.884 8.815 4.184 1.00 0.00 H new ATOM 0 HE2 TYR A 64 2.664 5.397 5.436 1.00 0.00 H new ATOM 0 HH TYR A 64 5.487 7.287 5.946 1.00 0.00 H new ATOM 1124 N PRO B 2 4.545 6.974 9.612 1.00 0.00 N ATOM 1125 CA PRO B 2 5.900 6.679 9.154 1.00 0.00 C ATOM 1126 C PRO B 2 6.495 7.824 8.348 1.00 0.00 C ATOM 1127 O PRO B 2 5.941 8.238 7.329 1.00 0.00 O ATOM 1128 CB PRO B 2 5.734 5.444 8.262 1.00 0.00 C ATOM 1129 CG PRO B 2 4.380 4.906 8.571 1.00 0.00 C ATOM 1130 CD PRO B 2 3.555 6.086 8.987 1.00 0.00 C ATOM 0 HA PRO B 2 6.578 6.523 9.993 1.00 0.00 H new ATOM 0 HB2 PRO B 2 5.820 5.707 7.208 1.00 0.00 H new ATOM 0 HB3 PRO B 2 6.507 4.704 8.470 1.00 0.00 H new ATOM 0 HG2 PRO B 2 3.947 4.414 7.700 1.00 0.00 H new ATOM 0 HG3 PRO B 2 4.427 4.162 9.366 1.00 0.00 H new ATOM 0 HD2 PRO B 2 3.069 6.560 8.134 1.00 0.00 H new ATOM 0 HD3 PRO B 2 2.768 5.803 9.686 1.00 0.00 H new ATOM 1138 N LYS B 3 7.612 8.341 8.815 1.00 0.00 N ATOM 1139 CA LYS B 3 8.332 9.366 8.085 1.00 0.00 C ATOM 1140 C LYS B 3 9.572 8.758 7.470 1.00 0.00 C ATOM 1141 O LYS B 3 10.229 9.365 6.624 1.00 0.00 O ATOM 1142 CB LYS B 3 8.722 10.521 9.004 1.00 0.00 C ATOM 1143 CG LYS B 3 7.536 11.204 9.669 1.00 0.00 C ATOM 1144 CD LYS B 3 6.648 11.929 8.665 1.00 0.00 C ATOM 1145 CE LYS B 3 7.362 13.101 8.006 1.00 0.00 C ATOM 1146 NZ LYS B 3 7.808 14.119 8.996 1.00 0.00 N ATOM 0 H LYS B 3 8.043 8.068 9.699 1.00 0.00 H new ATOM 0 HA LYS B 3 7.684 9.761 7.303 1.00 0.00 H new ATOM 0 HB2 LYS B 3 9.394 10.147 9.776 1.00 0.00 H new ATOM 0 HB3 LYS B 3 9.278 11.260 8.427 1.00 0.00 H new ATOM 0 HG2 LYS B 3 6.944 10.461 10.203 1.00 0.00 H new ATOM 0 HG3 LYS B 3 7.899 11.916 10.410 1.00 0.00 H new ATOM 0 HD2 LYS B 3 6.322 11.227 7.898 1.00 0.00 H new ATOM 0 HD3 LYS B 3 5.751 12.289 9.169 1.00 0.00 H new ATOM 0 HE2 LYS B 3 8.226 12.733 7.452 1.00 0.00 H new ATOM 0 HE3 LYS B 3 6.695 13.569 7.282 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 8.086 14.989 8.498 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 7.029 14.330 9.652 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 8.621 13.751 9.530 1.00 0.00 H new ATOM 1160 N THR B 4 9.885 7.548 7.903 1.00 0.00 N ATOM 1161 CA THR B 4 11.059 6.858 7.426 1.00 0.00 C ATOM 1162 C THR B 4 10.703 5.525 6.783 1.00 0.00 C ATOM 1163 O THR B 4 9.589 5.015 6.959 1.00 0.00 O ATOM 1164 CB THR B 4 12.076 6.627 8.558 1.00 0.00 C ATOM 1165 OG1 THR B 4 11.445 5.969 9.661 1.00 0.00 O ATOM 1166 CG2 THR B 4 12.667 7.945 9.026 1.00 0.00 C ATOM 0 H THR B 4 9.336 7.026 8.587 1.00 0.00 H new ATOM 0 HA THR B 4 11.513 7.500 6.671 1.00 0.00 H new ATOM 0 HB THR B 4 12.878 5.998 8.171 1.00 0.00 H new ATOM 0 HG1 THR B 4 10.828 6.589 10.102 1.00 0.00 H new ATOM 0 HG21 THR B 4 13.383 7.759 9.826 1.00 0.00 H new ATOM 0 HG22 THR B 4 13.173 8.433 8.193 1.00 0.00 H new ATOM 0 HG23 THR B 4 11.870 8.590 9.395 1.00 0.00 H new ATOM 1174 N LEU B 5 11.650 4.968 6.050 1.00 0.00 N ATOM 1175 CA LEU B 5 11.440 3.740 5.305 1.00 0.00 C ATOM 1176 C LEU B 5 11.030 2.602 6.237 1.00 0.00 C ATOM 1177 O LEU B 5 9.988 1.971 6.042 1.00 0.00 O ATOM 1178 CB LEU B 5 12.728 3.405 4.535 1.00 0.00 C ATOM 1179 CG LEU B 5 12.618 2.344 3.438 1.00 0.00 C ATOM 1180 CD1 LEU B 5 12.802 0.946 4.002 1.00 0.00 C ATOM 1181 CD2 LEU B 5 11.284 2.464 2.725 1.00 0.00 C ATOM 0 H LEU B 5 12.589 5.355 5.954 1.00 0.00 H new ATOM 0 HA LEU B 5 10.625 3.874 4.594 1.00 0.00 H new ATOM 0 HB2 LEU B 5 13.103 4.323 4.083 1.00 0.00 H new ATOM 0 HB3 LEU B 5 13.478 3.074 5.254 1.00 0.00 H new ATOM 0 HG LEU B 5 13.417 2.516 2.717 1.00 0.00 H new ATOM 0 HD11 LEU B 5 12.718 0.215 3.198 1.00 0.00 H new ATOM 0 HD12 LEU B 5 13.786 0.866 4.463 1.00 0.00 H new ATOM 0 HD13 LEU B 5 12.034 0.752 4.750 1.00 0.00 H new ATOM 0 HD21 LEU B 5 11.218 1.704 1.947 1.00 0.00 H new ATOM 0 HD22 LEU B 5 10.475 2.322 3.441 1.00 0.00 H new ATOM 0 HD23 LEU B 5 11.200 3.453 2.274 1.00 0.00 H new ATOM 1193 N HIS B 6 11.833 2.377 7.270 1.00 0.00 N ATOM 1194 CA HIS B 6 11.600 1.287 8.211 1.00 0.00 C ATOM 1195 C HIS B 6 10.202 1.356 8.815 1.00 0.00 C ATOM 1196 O HIS B 6 9.517 0.343 8.910 1.00 0.00 O ATOM 1197 CB HIS B 6 12.652 1.317 9.319 1.00 0.00 C ATOM 1198 CG HIS B 6 12.563 0.170 10.287 1.00 0.00 C ATOM 1199 ND1 HIS B 6 12.284 -1.144 10.091 1.00 0.00 N flip ATOM 1200 CD2 HIS B 6 12.805 0.304 11.635 1.00 0.00 C flip ATOM 1201 CE1 HIS B 6 12.367 -1.764 11.308 1.00 0.00 C flip ATOM 1202 NE2 HIS B 6 12.683 -0.872 12.222 1.00 0.00 N flip ATOM 0 H HIS B 6 12.658 2.940 7.479 1.00 0.00 H new ATOM 0 HA HIS B 6 11.680 0.349 7.661 1.00 0.00 H new ATOM 0 HB2 HIS B 6 13.642 1.317 8.864 1.00 0.00 H new ATOM 0 HB3 HIS B 6 12.555 2.252 9.871 1.00 0.00 H new ATOM 0 HD2 HIS B 6 13.056 1.228 12.135 1.00 0.00 H new ATOM 0 HE1 HIS B 6 12.200 -2.816 11.489 1.00 0.00 H new ATOM 0 HE2 HIS B 6 12.812 -1.058 13.217 1.00 0.00 H new ATOM 1211 N GLU B 7 9.782 2.557 9.197 1.00 0.00 N ATOM 1212 CA GLU B 7 8.478 2.748 9.822 1.00 0.00 C ATOM 1213 C GLU B 7 7.361 2.289 8.900 1.00 0.00 C ATOM 1214 O GLU B 7 6.387 1.671 9.338 1.00 0.00 O ATOM 1215 CB GLU B 7 8.254 4.213 10.168 1.00 0.00 C ATOM 1216 CG GLU B 7 9.165 4.751 11.247 1.00 0.00 C ATOM 1217 CD GLU B 7 8.880 6.207 11.540 1.00 0.00 C ATOM 1218 OE1 GLU B 7 8.265 6.501 12.586 1.00 0.00 O ATOM 1219 OE2 GLU B 7 9.253 7.063 10.713 1.00 0.00 O ATOM 0 H GLU B 7 10.325 3.413 9.085 1.00 0.00 H new ATOM 0 HA GLU B 7 8.465 2.151 10.734 1.00 0.00 H new ATOM 0 HB2 GLU B 7 8.388 4.810 9.266 1.00 0.00 H new ATOM 0 HB3 GLU B 7 7.220 4.344 10.486 1.00 0.00 H new ATOM 0 HG2 GLU B 7 9.038 4.164 12.157 1.00 0.00 H new ATOM 0 HG3 GLU B 7 10.204 4.638 10.937 1.00 0.00 H new ATOM 1226 N LEU B 8 7.507 2.601 7.623 1.00 0.00 N ATOM 1227 CA LEU B 8 6.502 2.255 6.637 1.00 0.00 C ATOM 1228 C LEU B 8 6.455 0.746 6.452 1.00 0.00 C ATOM 1229 O LEU B 8 5.378 0.148 6.408 1.00 0.00 O ATOM 1230 CB LEU B 8 6.807 2.969 5.317 1.00 0.00 C ATOM 1231 CG LEU B 8 5.679 2.974 4.282 1.00 0.00 C ATOM 1232 CD1 LEU B 8 5.673 1.687 3.476 1.00 0.00 C ATOM 1233 CD2 LEU B 8 4.337 3.180 4.963 1.00 0.00 C ATOM 0 H LEU B 8 8.316 3.095 7.246 1.00 0.00 H new ATOM 0 HA LEU B 8 5.521 2.582 6.983 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.075 4.002 5.539 1.00 0.00 H new ATOM 0 HB3 LEU B 8 7.684 2.502 4.868 1.00 0.00 H new ATOM 0 HG LEU B 8 5.853 3.802 3.595 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.862 1.717 2.748 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.624 1.580 2.955 1.00 0.00 H new ATOM 0 HD13 LEU B 8 5.528 0.839 4.146 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.545 3.181 4.214 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.162 2.373 5.674 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.339 4.134 5.490 1.00 0.00 H new ATOM 1245 N LEU B 9 7.630 0.139 6.367 1.00 0.00 N ATOM 1246 CA LEU B 9 7.740 -1.307 6.247 1.00 0.00 C ATOM 1247 C LEU B 9 7.103 -1.994 7.446 1.00 0.00 C ATOM 1248 O LEU B 9 6.418 -3.004 7.302 1.00 0.00 O ATOM 1249 CB LEU B 9 9.206 -1.727 6.117 1.00 0.00 C ATOM 1250 CG LEU B 9 9.802 -1.668 4.704 1.00 0.00 C ATOM 1251 CD1 LEU B 9 9.220 -2.763 3.835 1.00 0.00 C ATOM 1252 CD2 LEU B 9 9.563 -0.318 4.057 1.00 0.00 C ATOM 0 H LEU B 9 8.525 0.629 6.379 1.00 0.00 H new ATOM 0 HA LEU B 9 7.208 -1.614 5.346 1.00 0.00 H new ATOM 0 HB2 LEU B 9 9.804 -1.090 6.769 1.00 0.00 H new ATOM 0 HB3 LEU B 9 9.305 -2.747 6.489 1.00 0.00 H new ATOM 0 HG LEU B 9 10.878 -1.817 4.796 1.00 0.00 H new ATOM 0 HD11 LEU B 9 9.655 -2.705 2.837 1.00 0.00 H new ATOM 0 HD12 LEU B 9 9.447 -3.735 4.274 1.00 0.00 H new ATOM 0 HD13 LEU B 9 8.139 -2.638 3.768 1.00 0.00 H new ATOM 0 HD21 LEU B 9 9.998 -0.311 3.058 1.00 0.00 H new ATOM 0 HD22 LEU B 9 8.491 -0.133 3.987 1.00 0.00 H new ATOM 0 HD23 LEU B 9 10.028 0.462 4.660 1.00 0.00 H new ATOM 1264 N GLU B 10 7.317 -1.431 8.628 1.00 0.00 N ATOM 1265 CA GLU B 10 6.737 -1.973 9.850 1.00 0.00 C ATOM 1266 C GLU B 10 5.216 -1.908 9.808 1.00 0.00 C ATOM 1267 O GLU B 10 4.536 -2.822 10.271 1.00 0.00 O ATOM 1268 CB GLU B 10 7.247 -1.213 11.072 1.00 0.00 C ATOM 1269 CG GLU B 10 8.737 -1.366 11.308 1.00 0.00 C ATOM 1270 CD GLU B 10 9.208 -0.611 12.529 1.00 0.00 C ATOM 1271 OE1 GLU B 10 9.453 0.607 12.422 1.00 0.00 O ATOM 1272 OE2 GLU B 10 9.339 -1.233 13.604 1.00 0.00 O ATOM 0 H GLU B 10 7.889 -0.598 8.767 1.00 0.00 H new ATOM 0 HA GLU B 10 7.042 -3.017 9.925 1.00 0.00 H new ATOM 0 HB2 GLU B 10 7.014 -0.155 10.954 1.00 0.00 H new ATOM 0 HB3 GLU B 10 6.711 -1.561 11.955 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.977 -2.423 11.423 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.279 -1.009 10.432 1.00 0.00 H new ATOM 1279 N ARG B 11 4.693 -0.835 9.233 1.00 0.00 N ATOM 1280 CA ARG B 11 3.257 -0.617 9.192 1.00 0.00 C ATOM 1281 C ARG B 11 2.582 -1.602 8.248 1.00 0.00 C ATOM 1282 O ARG B 11 1.546 -2.182 8.577 1.00 0.00 O ATOM 1283 CB ARG B 11 2.945 0.812 8.760 1.00 0.00 C ATOM 1284 CG ARG B 11 1.468 1.139 8.832 1.00 0.00 C ATOM 1285 CD ARG B 11 1.196 2.599 8.536 1.00 0.00 C ATOM 1286 NE ARG B 11 -0.206 2.936 8.760 1.00 0.00 N ATOM 1287 CZ ARG B 11 -0.624 3.990 9.460 1.00 0.00 C ATOM 1288 NH1 ARG B 11 0.246 4.772 10.094 1.00 0.00 N ATOM 1289 NH2 ARG B 11 -1.921 4.240 9.557 1.00 0.00 N ATOM 0 H ARG B 11 5.244 -0.101 8.788 1.00 0.00 H new ATOM 0 HA ARG B 11 2.866 -0.778 10.197 1.00 0.00 H new ATOM 0 HB2 ARG B 11 3.497 1.507 9.393 1.00 0.00 H new ATOM 0 HB3 ARG B 11 3.296 0.963 7.739 1.00 0.00 H new ATOM 0 HG2 ARG B 11 0.924 0.517 8.121 1.00 0.00 H new ATOM 0 HG3 ARG B 11 1.090 0.894 9.825 1.00 0.00 H new ATOM 0 HD2 ARG B 11 1.827 3.224 9.168 1.00 0.00 H new ATOM 0 HD3 ARG B 11 1.464 2.818 7.502 1.00 0.00 H new ATOM 0 HE ARG B 11 -0.913 2.324 8.354 1.00 0.00 H new ATOM 0 HH11 ARG B 11 1.244 4.567 10.047 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -0.085 5.576 10.627 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -2.594 3.627 9.097 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -2.247 5.045 10.092 1.00 0.00 H new ATOM 1303 N ILE B 12 3.176 -1.797 7.080 1.00 0.00 N ATOM 1304 CA ILE B 12 2.597 -2.680 6.082 1.00 0.00 C ATOM 1305 C ILE B 12 2.932 -4.139 6.377 1.00 0.00 C ATOM 1306 O ILE B 12 2.337 -5.051 5.808 1.00 0.00 O ATOM 1307 CB ILE B 12 3.048 -2.302 4.659 1.00 0.00 C ATOM 1308 CG1 ILE B 12 4.560 -2.468 4.490 1.00 0.00 C ATOM 1309 CG2 ILE B 12 2.638 -0.867 4.370 1.00 0.00 C ATOM 1310 CD1 ILE B 12 5.031 -2.232 3.072 1.00 0.00 C ATOM 0 H ILE B 12 4.054 -1.358 6.802 1.00 0.00 H new ATOM 0 HA ILE B 12 1.515 -2.558 6.134 1.00 0.00 H new ATOM 0 HB ILE B 12 2.564 -2.973 3.950 1.00 0.00 H new ATOM 0 HG12 ILE B 12 5.072 -1.774 5.156 1.00 0.00 H new ATOM 0 HG13 ILE B 12 4.845 -3.474 4.798 1.00 0.00 H new ATOM 0 HG21 ILE B 12 2.955 -0.594 3.364 1.00 0.00 H new ATOM 0 HG22 ILE B 12 1.555 -0.776 4.447 1.00 0.00 H new ATOM 0 HG23 ILE B 12 3.110 -0.201 5.092 1.00 0.00 H new ATOM 0 HD11 ILE B 12 6.112 -2.365 3.021 1.00 0.00 H new ATOM 0 HD12 ILE B 12 4.545 -2.944 2.404 1.00 0.00 H new ATOM 0 HD13 ILE B 12 4.776 -1.217 2.768 1.00 0.00 H new ATOM 1322 N GLY B 13 3.886 -4.354 7.271 1.00 0.00 N ATOM 1323 CA GLY B 13 4.180 -5.697 7.730 1.00 0.00 C ATOM 1324 C GLY B 13 5.309 -6.350 6.968 1.00 0.00 C ATOM 1325 O GLY B 13 5.382 -7.577 6.882 1.00 0.00 O ATOM 0 H GLY B 13 4.462 -3.623 7.687 1.00 0.00 H new ATOM 0 HA2 GLY B 13 4.435 -5.665 8.789 1.00 0.00 H new ATOM 0 HA3 GLY B 13 3.284 -6.311 7.637 1.00 0.00 H new ATOM 1329 N LEU B 14 6.195 -5.539 6.416 1.00 0.00 N ATOM 1330 CA LEU B 14 7.338 -6.049 5.681 1.00 0.00 C ATOM 1331 C LEU B 14 8.633 -5.556 6.292 1.00 0.00 C ATOM 1332 O LEU B 14 9.638 -5.405 5.598 1.00 0.00 O ATOM 1333 CB LEU B 14 7.280 -5.657 4.204 1.00 0.00 C ATOM 1334 CG LEU B 14 6.297 -6.455 3.348 1.00 0.00 C ATOM 1335 CD1 LEU B 14 6.371 -7.927 3.688 1.00 0.00 C ATOM 1336 CD2 LEU B 14 4.880 -5.948 3.508 1.00 0.00 C ATOM 0 H LEU B 14 6.144 -4.521 6.464 1.00 0.00 H new ATOM 0 HA LEU B 14 7.303 -7.136 5.746 1.00 0.00 H new ATOM 0 HB2 LEU B 14 7.019 -4.601 4.137 1.00 0.00 H new ATOM 0 HB3 LEU B 14 8.277 -5.766 3.778 1.00 0.00 H new ATOM 0 HG LEU B 14 6.583 -6.319 2.305 1.00 0.00 H new ATOM 0 HD11 LEU B 14 5.664 -8.479 3.069 1.00 0.00 H new ATOM 0 HD12 LEU B 14 7.381 -8.293 3.501 1.00 0.00 H new ATOM 0 HD13 LEU B 14 6.122 -8.071 4.739 1.00 0.00 H new ATOM 0 HD21 LEU B 14 4.209 -6.539 2.885 1.00 0.00 H new ATOM 0 HD22 LEU B 14 4.578 -6.036 4.551 1.00 0.00 H new ATOM 0 HD23 LEU B 14 4.831 -4.903 3.203 1.00 0.00 H new ATOM 1348 N GLU B 15 8.612 -5.323 7.598 1.00 0.00 N ATOM 1349 CA GLU B 15 9.804 -4.892 8.312 1.00 0.00 C ATOM 1350 C GLU B 15 10.916 -5.929 8.183 1.00 0.00 C ATOM 1351 O GLU B 15 12.095 -5.609 8.340 1.00 0.00 O ATOM 1352 CB GLU B 15 9.492 -4.626 9.784 1.00 0.00 C ATOM 1353 CG GLU B 15 8.876 -5.809 10.511 1.00 0.00 C ATOM 1354 CD GLU B 15 8.688 -5.543 11.989 1.00 0.00 C ATOM 1355 OE1 GLU B 15 7.593 -5.099 12.385 1.00 0.00 O ATOM 1356 OE2 GLU B 15 9.639 -5.770 12.763 1.00 0.00 O ATOM 0 H GLU B 15 7.783 -5.425 8.183 1.00 0.00 H new ATOM 0 HA GLU B 15 10.147 -3.961 7.861 1.00 0.00 H new ATOM 0 HB2 GLU B 15 10.412 -4.339 10.293 1.00 0.00 H new ATOM 0 HB3 GLU B 15 8.812 -3.777 9.853 1.00 0.00 H new ATOM 0 HG2 GLU B 15 7.912 -6.046 10.062 1.00 0.00 H new ATOM 0 HG3 GLU B 15 9.513 -6.684 10.380 1.00 0.00 H new ATOM 1363 N GLU B 16 10.527 -7.160 7.872 1.00 0.00 N ATOM 1364 CA GLU B 16 11.472 -8.243 7.637 1.00 0.00 C ATOM 1365 C GLU B 16 12.341 -7.960 6.415 1.00 0.00 C ATOM 1366 O GLU B 16 13.441 -8.490 6.287 1.00 0.00 O ATOM 1367 CB GLU B 16 10.716 -9.558 7.439 1.00 0.00 C ATOM 1368 CG GLU B 16 9.772 -9.543 6.245 1.00 0.00 C ATOM 1369 CD GLU B 16 8.892 -10.772 6.178 1.00 0.00 C ATOM 1370 OE1 GLU B 16 9.079 -11.598 5.261 1.00 0.00 O ATOM 1371 OE2 GLU B 16 8.004 -10.911 7.045 1.00 0.00 O ATOM 0 H GLU B 16 9.549 -7.434 7.776 1.00 0.00 H new ATOM 0 HA GLU B 16 12.122 -8.322 8.508 1.00 0.00 H new ATOM 0 HB2 GLU B 16 11.436 -10.366 7.312 1.00 0.00 H new ATOM 0 HB3 GLU B 16 10.145 -9.779 8.341 1.00 0.00 H new ATOM 0 HG2 GLU B 16 9.143 -8.654 6.296 1.00 0.00 H new ATOM 0 HG3 GLU B 16 10.355 -9.469 5.327 1.00 0.00 H new ATOM 1378 N HIS B 17 11.846 -7.113 5.521 1.00 0.00 N ATOM 1379 CA HIS B 17 12.557 -6.810 4.289 1.00 0.00 C ATOM 1380 C HIS B 17 13.116 -5.397 4.298 1.00 0.00 C ATOM 1381 O HIS B 17 13.685 -4.960 3.302 1.00 0.00 O ATOM 1382 CB HIS B 17 11.649 -6.992 3.072 1.00 0.00 C ATOM 1383 CG HIS B 17 11.428 -8.422 2.686 1.00 0.00 C ATOM 1384 ND1 HIS B 17 12.449 -9.270 2.315 1.00 0.00 N ATOM 1385 CD2 HIS B 17 10.289 -9.154 2.607 1.00 0.00 C ATOM 1386 CE1 HIS B 17 11.950 -10.455 2.018 1.00 0.00 C ATOM 1387 NE2 HIS B 17 10.645 -10.413 2.189 1.00 0.00 N ATOM 0 H HIS B 17 10.956 -6.625 5.627 1.00 0.00 H new ATOM 0 HA HIS B 17 13.389 -7.511 4.222 1.00 0.00 H new ATOM 0 HB2 HIS B 17 10.684 -6.529 3.279 1.00 0.00 H new ATOM 0 HB3 HIS B 17 12.083 -6.460 2.225 1.00 0.00 H new ATOM 0 HD2 HIS B 17 9.290 -8.811 2.831 1.00 0.00 H new ATOM 0 HE1 HIS B 17 12.516 -11.314 1.690 1.00 0.00 H new ATOM 0 HE2 HIS B 17 10.002 -11.190 2.036 1.00 0.00 H new ATOM 1396 N THR B 18 12.959 -4.689 5.413 1.00 0.00 N ATOM 1397 CA THR B 18 13.460 -3.322 5.519 1.00 0.00 C ATOM 1398 C THR B 18 14.933 -3.250 5.148 1.00 0.00 C ATOM 1399 O THR B 18 15.344 -2.396 4.366 1.00 0.00 O ATOM 1400 CB THR B 18 13.304 -2.757 6.937 1.00 0.00 C ATOM 1401 OG1 THR B 18 11.962 -2.932 7.399 1.00 0.00 O ATOM 1402 CG2 THR B 18 13.669 -1.283 6.954 1.00 0.00 C ATOM 0 H THR B 18 12.492 -5.036 6.251 1.00 0.00 H new ATOM 0 HA THR B 18 12.863 -2.728 4.827 1.00 0.00 H new ATOM 0 HB THR B 18 13.977 -3.298 7.602 1.00 0.00 H new ATOM 0 HG1 THR B 18 11.846 -2.463 8.252 1.00 0.00 H new ATOM 0 HG21 THR B 18 13.555 -0.892 7.965 1.00 0.00 H new ATOM 0 HG22 THR B 18 14.703 -1.161 6.632 1.00 0.00 H new ATOM 0 HG23 THR B 18 13.011 -0.737 6.277 1.00 0.00 H new ATOM 1410 N SER B 19 15.715 -4.161 5.710 1.00 0.00 N ATOM 1411 CA SER B 19 17.142 -4.203 5.459 1.00 0.00 C ATOM 1412 C SER B 19 17.418 -4.423 3.978 1.00 0.00 C ATOM 1413 O SER B 19 18.314 -3.810 3.414 1.00 0.00 O ATOM 1414 CB SER B 19 17.775 -5.311 6.288 1.00 0.00 C ATOM 1415 OG SER B 19 17.350 -5.232 7.642 1.00 0.00 O ATOM 0 H SER B 19 15.379 -4.884 6.346 1.00 0.00 H new ATOM 0 HA SER B 19 17.580 -3.248 5.748 1.00 0.00 H new ATOM 0 HB2 SER B 19 17.505 -6.282 5.873 1.00 0.00 H new ATOM 0 HB3 SER B 19 18.861 -5.234 6.238 1.00 0.00 H new ATOM 0 HG SER B 19 17.766 -5.954 8.158 1.00 0.00 H new ATOM 1421 N THR B 20 16.624 -5.284 3.353 1.00 0.00 N ATOM 1422 CA THR B 20 16.746 -5.545 1.928 1.00 0.00 C ATOM 1423 C THR B 20 16.622 -4.250 1.133 1.00 0.00 C ATOM 1424 O THR B 20 17.458 -3.948 0.279 1.00 0.00 O ATOM 1425 CB THR B 20 15.663 -6.532 1.460 1.00 0.00 C ATOM 1426 OG1 THR B 20 15.702 -7.717 2.263 1.00 0.00 O ATOM 1427 CG2 THR B 20 15.858 -6.896 0.000 1.00 0.00 C ATOM 0 H THR B 20 15.886 -5.815 3.815 1.00 0.00 H new ATOM 0 HA THR B 20 17.729 -5.983 1.753 1.00 0.00 H new ATOM 0 HB THR B 20 14.691 -6.051 1.570 1.00 0.00 H new ATOM 0 HG1 THR B 20 15.403 -8.483 1.730 1.00 0.00 H new ATOM 0 HG21 THR B 20 15.080 -7.595 -0.308 1.00 0.00 H new ATOM 0 HG22 THR B 20 15.799 -5.995 -0.611 1.00 0.00 H new ATOM 0 HG23 THR B 20 16.835 -7.360 -0.132 1.00 0.00 H new ATOM 1435 N LEU B 21 15.583 -3.483 1.434 1.00 0.00 N ATOM 1436 CA LEU B 21 15.388 -2.186 0.813 1.00 0.00 C ATOM 1437 C LEU B 21 16.554 -1.266 1.151 1.00 0.00 C ATOM 1438 O LEU B 21 17.215 -0.733 0.262 1.00 0.00 O ATOM 1439 CB LEU B 21 14.068 -1.550 1.279 1.00 0.00 C ATOM 1440 CG LEU B 21 12.788 -2.045 0.588 1.00 0.00 C ATOM 1441 CD1 LEU B 21 12.994 -2.168 -0.910 1.00 0.00 C ATOM 1442 CD2 LEU B 21 12.315 -3.363 1.173 1.00 0.00 C ATOM 0 H LEU B 21 14.861 -3.740 2.107 1.00 0.00 H new ATOM 0 HA LEU B 21 15.341 -2.326 -0.267 1.00 0.00 H new ATOM 0 HB2 LEU B 21 13.966 -1.722 2.350 1.00 0.00 H new ATOM 0 HB3 LEU B 21 14.139 -0.472 1.135 1.00 0.00 H new ATOM 0 HG LEU B 21 12.010 -1.303 0.768 1.00 0.00 H new ATOM 0 HD11 LEU B 21 12.074 -2.520 -1.376 1.00 0.00 H new ATOM 0 HD12 LEU B 21 13.260 -1.194 -1.322 1.00 0.00 H new ATOM 0 HD13 LEU B 21 13.797 -2.878 -1.110 1.00 0.00 H new ATOM 0 HD21 LEU B 21 11.408 -3.684 0.661 1.00 0.00 H new ATOM 0 HD22 LEU B 21 13.091 -4.118 1.044 1.00 0.00 H new ATOM 0 HD23 LEU B 21 12.106 -3.236 2.235 1.00 0.00 H new ATOM 1454 N LEU B 22 16.811 -1.132 2.445 1.00 0.00 N ATOM 1455 CA LEU B 22 17.846 -0.247 2.969 1.00 0.00 C ATOM 1456 C LEU B 22 19.191 -0.480 2.282 1.00 0.00 C ATOM 1457 O LEU B 22 19.842 0.462 1.826 1.00 0.00 O ATOM 1458 CB LEU B 22 17.989 -0.490 4.471 1.00 0.00 C ATOM 1459 CG LEU B 22 18.831 0.530 5.228 1.00 0.00 C ATOM 1460 CD1 LEU B 22 18.104 1.861 5.307 1.00 0.00 C ATOM 1461 CD2 LEU B 22 19.163 0.013 6.616 1.00 0.00 C ATOM 0 H LEU B 22 16.302 -1.639 3.169 1.00 0.00 H new ATOM 0 HA LEU B 22 17.549 0.783 2.774 1.00 0.00 H new ATOM 0 HB2 LEU B 22 16.993 -0.512 4.913 1.00 0.00 H new ATOM 0 HB3 LEU B 22 18.426 -1.477 4.621 1.00 0.00 H new ATOM 0 HG LEU B 22 19.765 0.683 4.688 1.00 0.00 H new ATOM 0 HD11 LEU B 22 18.718 2.579 5.851 1.00 0.00 H new ATOM 0 HD12 LEU B 22 17.916 2.233 4.300 1.00 0.00 H new ATOM 0 HD13 LEU B 22 17.156 1.727 5.827 1.00 0.00 H new ATOM 0 HD21 LEU B 22 19.765 0.752 7.145 1.00 0.00 H new ATOM 0 HD22 LEU B 22 18.240 -0.166 7.168 1.00 0.00 H new ATOM 0 HD23 LEU B 22 19.723 -0.919 6.533 1.00 0.00 H new ATOM 1473 N LEU B 23 19.593 -1.743 2.207 1.00 0.00 N ATOM 1474 CA LEU B 23 20.879 -2.118 1.635 1.00 0.00 C ATOM 1475 C LEU B 23 20.940 -1.797 0.151 1.00 0.00 C ATOM 1476 O LEU B 23 21.982 -1.399 -0.369 1.00 0.00 O ATOM 1477 CB LEU B 23 21.129 -3.612 1.842 1.00 0.00 C ATOM 1478 CG LEU B 23 21.210 -4.067 3.299 1.00 0.00 C ATOM 1479 CD1 LEU B 23 21.401 -5.573 3.373 1.00 0.00 C ATOM 1480 CD2 LEU B 23 22.334 -3.347 4.025 1.00 0.00 C ATOM 0 H LEU B 23 19.039 -2.532 2.539 1.00 0.00 H new ATOM 0 HA LEU B 23 21.650 -1.540 2.144 1.00 0.00 H new ATOM 0 HB2 LEU B 23 20.332 -4.168 1.349 1.00 0.00 H new ATOM 0 HB3 LEU B 23 22.060 -3.880 1.343 1.00 0.00 H new ATOM 0 HG LEU B 23 20.271 -3.814 3.792 1.00 0.00 H new ATOM 0 HD11 LEU B 23 21.457 -5.882 4.417 1.00 0.00 H new ATOM 0 HD12 LEU B 23 20.559 -6.071 2.892 1.00 0.00 H new ATOM 0 HD13 LEU B 23 22.324 -5.848 2.863 1.00 0.00 H new ATOM 0 HD21 LEU B 23 22.374 -3.686 5.060 1.00 0.00 H new ATOM 0 HD22 LEU B 23 23.283 -3.566 3.535 1.00 0.00 H new ATOM 0 HD23 LEU B 23 22.153 -2.272 4.001 1.00 0.00 H new ATOM 1492 N ASN B 24 19.812 -1.949 -0.526 1.00 0.00 N ATOM 1493 CA ASN B 24 19.768 -1.775 -1.968 1.00 0.00 C ATOM 1494 C ASN B 24 19.436 -0.340 -2.350 1.00 0.00 C ATOM 1495 O ASN B 24 19.089 -0.053 -3.495 1.00 0.00 O ATOM 1496 CB ASN B 24 18.777 -2.752 -2.591 1.00 0.00 C ATOM 1497 CG ASN B 24 19.349 -4.155 -2.679 1.00 0.00 C ATOM 1498 OD1 ASN B 24 20.012 -4.507 -3.657 1.00 0.00 O ATOM 1499 ND2 ASN B 24 19.086 -4.967 -1.668 1.00 0.00 N ATOM 0 H ASN B 24 18.917 -2.192 -0.100 1.00 0.00 H new ATOM 0 HA ASN B 24 20.761 -1.991 -2.362 1.00 0.00 H new ATOM 0 HB2 ASN B 24 17.862 -2.769 -1.999 1.00 0.00 H new ATOM 0 HB3 ASN B 24 18.505 -2.407 -3.589 1.00 0.00 H new ATOM 0 HD21 ASN B 24 19.436 -5.925 -1.679 1.00 0.00 H new ATOM 0 HD22 ASN B 24 18.533 -4.635 -0.878 1.00 0.00 H new ATOM 1506 N GLY B 25 19.537 0.554 -1.382 1.00 0.00 N ATOM 1507 CA GLY B 25 19.447 1.969 -1.673 1.00 0.00 C ATOM 1508 C GLY B 25 18.118 2.567 -1.287 1.00 0.00 C ATOM 1509 O GLY B 25 17.944 3.782 -1.330 1.00 0.00 O ATOM 0 H GLY B 25 19.680 0.326 -0.398 1.00 0.00 H new ATOM 0 HA2 GLY B 25 20.243 2.494 -1.145 1.00 0.00 H new ATOM 0 HA3 GLY B 25 19.614 2.126 -2.739 1.00 0.00 H new ATOM 1513 N TYR B 26 17.182 1.722 -0.900 1.00 0.00 N ATOM 1514 CA TYR B 26 15.869 2.181 -0.494 1.00 0.00 C ATOM 1515 C TYR B 26 15.882 2.516 0.981 1.00 0.00 C ATOM 1516 O TYR B 26 15.377 1.769 1.815 1.00 0.00 O ATOM 1517 CB TYR B 26 14.825 1.119 -0.802 1.00 0.00 C ATOM 1518 CG TYR B 26 14.719 0.813 -2.270 1.00 0.00 C ATOM 1519 CD1 TYR B 26 15.290 -0.333 -2.800 1.00 0.00 C ATOM 1520 CD2 TYR B 26 14.063 1.681 -3.126 1.00 0.00 C ATOM 1521 CE1 TYR B 26 15.209 -0.607 -4.149 1.00 0.00 C ATOM 1522 CE2 TYR B 26 13.973 1.415 -4.474 1.00 0.00 C ATOM 1523 CZ TYR B 26 14.547 0.271 -4.980 1.00 0.00 C ATOM 1524 OH TYR B 26 14.467 0.010 -6.325 1.00 0.00 O ATOM 0 H TYR B 26 17.308 0.711 -0.858 1.00 0.00 H new ATOM 0 HA TYR B 26 15.610 3.081 -1.052 1.00 0.00 H new ATOM 0 HB2 TYR B 26 15.073 0.205 -0.262 1.00 0.00 H new ATOM 0 HB3 TYR B 26 13.855 1.453 -0.434 1.00 0.00 H new ATOM 0 HD1 TYR B 26 15.806 -1.021 -2.147 1.00 0.00 H new ATOM 0 HD2 TYR B 26 13.615 2.581 -2.730 1.00 0.00 H new ATOM 0 HE1 TYR B 26 15.660 -1.502 -4.551 1.00 0.00 H new ATOM 0 HE2 TYR B 26 13.455 2.099 -5.130 1.00 0.00 H new ATOM 0 HH TYR B 26 14.504 -0.958 -6.473 1.00 0.00 H new ATOM 1534 N GLN B 27 16.474 3.650 1.289 1.00 0.00 N ATOM 1535 CA GLN B 27 16.695 4.046 2.660 1.00 0.00 C ATOM 1536 C GLN B 27 15.615 5.002 3.117 1.00 0.00 C ATOM 1537 O GLN B 27 15.404 5.192 4.313 1.00 0.00 O ATOM 1538 CB GLN B 27 18.068 4.693 2.788 1.00 0.00 C ATOM 1539 CG GLN B 27 19.179 3.829 2.219 1.00 0.00 C ATOM 1540 CD GLN B 27 20.550 4.460 2.340 1.00 0.00 C ATOM 1541 OE1 GLN B 27 20.996 5.177 1.446 1.00 0.00 O ATOM 1542 NE2 GLN B 27 21.233 4.187 3.437 1.00 0.00 N ATOM 0 H GLN B 27 16.814 4.319 0.598 1.00 0.00 H new ATOM 0 HA GLN B 27 16.656 3.162 3.296 1.00 0.00 H new ATOM 0 HB2 GLN B 27 18.061 5.654 2.274 1.00 0.00 H new ATOM 0 HB3 GLN B 27 18.273 4.895 3.839 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.182 2.868 2.734 1.00 0.00 H new ATOM 0 HG3 GLN B 27 18.971 3.627 1.168 1.00 0.00 H new ATOM 0 HE21 GLN B 27 20.826 3.587 4.155 1.00 0.00 H new ATOM 0 HE22 GLN B 27 22.167 4.576 3.566 1.00 0.00 H new ATOM 1551 N THR B 28 14.931 5.600 2.159 1.00 0.00 N ATOM 1552 CA THR B 28 13.869 6.534 2.458 1.00 0.00 C ATOM 1553 C THR B 28 12.607 6.170 1.699 1.00 0.00 C ATOM 1554 O THR B 28 12.628 5.326 0.798 1.00 0.00 O ATOM 1555 CB THR B 28 14.271 7.975 2.092 1.00 0.00 C ATOM 1556 OG1 THR B 28 14.453 8.086 0.676 1.00 0.00 O ATOM 1557 CG2 THR B 28 15.553 8.375 2.802 1.00 0.00 C ATOM 0 H THR B 28 15.096 5.452 1.163 1.00 0.00 H new ATOM 0 HA THR B 28 13.683 6.478 3.531 1.00 0.00 H new ATOM 0 HB THR B 28 13.472 8.644 2.411 1.00 0.00 H new ATOM 0 HG1 THR B 28 15.269 7.611 0.413 1.00 0.00 H new ATOM 0 HG21 THR B 28 15.817 9.396 2.528 1.00 0.00 H new ATOM 0 HG22 THR B 28 15.406 8.315 3.880 1.00 0.00 H new ATOM 0 HG23 THR B 28 16.357 7.701 2.508 1.00 0.00 H new ATOM 1565 N LEU B 29 11.513 6.814 2.059 1.00 0.00 N ATOM 1566 CA LEU B 29 10.263 6.662 1.341 1.00 0.00 C ATOM 1567 C LEU B 29 10.398 7.260 -0.052 1.00 0.00 C ATOM 1568 O LEU B 29 9.704 6.868 -0.987 1.00 0.00 O ATOM 1569 CB LEU B 29 9.140 7.347 2.113 1.00 0.00 C ATOM 1570 CG LEU B 29 8.950 6.840 3.543 1.00 0.00 C ATOM 1571 CD1 LEU B 29 7.870 7.637 4.256 1.00 0.00 C ATOM 1572 CD2 LEU B 29 8.611 5.361 3.539 1.00 0.00 C ATOM 0 H LEU B 29 11.466 7.453 2.852 1.00 0.00 H new ATOM 0 HA LEU B 29 10.023 5.603 1.245 1.00 0.00 H new ATOM 0 HB2 LEU B 29 9.339 8.418 2.145 1.00 0.00 H new ATOM 0 HB3 LEU B 29 8.206 7.212 1.567 1.00 0.00 H new ATOM 0 HG LEU B 29 9.886 6.977 4.085 1.00 0.00 H new ATOM 0 HD11 LEU B 29 7.751 7.260 5.272 1.00 0.00 H new ATOM 0 HD12 LEU B 29 8.156 8.688 4.290 1.00 0.00 H new ATOM 0 HD13 LEU B 29 6.928 7.535 3.718 1.00 0.00 H new ATOM 0 HD21 LEU B 29 8.479 5.015 4.564 1.00 0.00 H new ATOM 0 HD22 LEU B 29 7.689 5.201 2.980 1.00 0.00 H new ATOM 0 HD23 LEU B 29 9.421 4.803 3.070 1.00 0.00 H new ATOM 1584 N GLU B 30 11.323 8.207 -0.175 1.00 0.00 N ATOM 1585 CA GLU B 30 11.616 8.847 -1.445 1.00 0.00 C ATOM 1586 C GLU B 30 12.339 7.881 -2.376 1.00 0.00 C ATOM 1587 O GLU B 30 12.290 8.022 -3.595 1.00 0.00 O ATOM 1588 CB GLU B 30 12.448 10.106 -1.219 1.00 0.00 C ATOM 1589 CG GLU B 30 11.718 11.162 -0.403 1.00 0.00 C ATOM 1590 CD GLU B 30 12.528 12.425 -0.214 1.00 0.00 C ATOM 1591 OE1 GLU B 30 13.152 12.581 0.858 1.00 0.00 O ATOM 1592 OE2 GLU B 30 12.532 13.277 -1.129 1.00 0.00 O ATOM 0 H GLU B 30 11.887 8.549 0.603 1.00 0.00 H new ATOM 0 HA GLU B 30 10.677 9.134 -1.918 1.00 0.00 H new ATOM 0 HB2 GLU B 30 13.373 9.837 -0.710 1.00 0.00 H new ATOM 0 HB3 GLU B 30 12.727 10.529 -2.184 1.00 0.00 H new ATOM 0 HG2 GLU B 30 10.778 11.410 -0.897 1.00 0.00 H new ATOM 0 HG3 GLU B 30 11.466 10.749 0.574 1.00 0.00 H new ATOM 1599 N ASP B 31 13.016 6.904 -1.794 1.00 0.00 N ATOM 1600 CA ASP B 31 13.634 5.844 -2.576 1.00 0.00 C ATOM 1601 C ASP B 31 12.603 4.772 -2.885 1.00 0.00 C ATOM 1602 O ASP B 31 12.469 4.323 -4.022 1.00 0.00 O ATOM 1603 CB ASP B 31 14.803 5.206 -1.819 1.00 0.00 C ATOM 1604 CG ASP B 31 15.899 6.185 -1.455 1.00 0.00 C ATOM 1605 OD1 ASP B 31 16.520 6.764 -2.369 1.00 0.00 O ATOM 1606 OD2 ASP B 31 16.159 6.358 -0.247 1.00 0.00 O ATOM 0 H ASP B 31 13.152 6.822 -0.786 1.00 0.00 H new ATOM 0 HA ASP B 31 14.013 6.283 -3.499 1.00 0.00 H new ATOM 0 HB2 ASP B 31 14.425 4.743 -0.908 1.00 0.00 H new ATOM 0 HB3 ASP B 31 15.228 4.409 -2.429 1.00 0.00 H new ATOM 1611 N PHE B 32 11.859 4.391 -1.855 1.00 0.00 N ATOM 1612 CA PHE B 32 10.911 3.287 -1.936 1.00 0.00 C ATOM 1613 C PHE B 32 9.778 3.574 -2.920 1.00 0.00 C ATOM 1614 O PHE B 32 9.182 2.656 -3.465 1.00 0.00 O ATOM 1615 CB PHE B 32 10.341 2.998 -0.548 1.00 0.00 C ATOM 1616 CG PHE B 32 9.572 1.707 -0.455 1.00 0.00 C ATOM 1617 CD1 PHE B 32 10.196 0.540 -0.045 1.00 0.00 C ATOM 1618 CD2 PHE B 32 8.229 1.664 -0.771 1.00 0.00 C ATOM 1619 CE1 PHE B 32 9.488 -0.643 0.048 1.00 0.00 C ATOM 1620 CE2 PHE B 32 7.518 0.487 -0.682 1.00 0.00 C ATOM 1621 CZ PHE B 32 8.146 -0.668 -0.271 1.00 0.00 C ATOM 0 H PHE B 32 11.896 4.839 -0.939 1.00 0.00 H new ATOM 0 HA PHE B 32 11.447 2.413 -2.306 1.00 0.00 H new ATOM 0 HB2 PHE B 32 11.160 2.973 0.171 1.00 0.00 H new ATOM 0 HB3 PHE B 32 9.687 3.820 -0.258 1.00 0.00 H new ATOM 0 HD1 PHE B 32 11.247 0.555 0.205 1.00 0.00 H new ATOM 0 HD2 PHE B 32 7.729 2.565 -1.092 1.00 0.00 H new ATOM 0 HE1 PHE B 32 9.984 -1.547 0.370 1.00 0.00 H new ATOM 0 HE2 PHE B 32 6.468 0.470 -0.935 1.00 0.00 H new ATOM 0 HZ PHE B 32 7.589 -1.591 -0.199 1.00 0.00 H new ATOM 1631 N LYS B 33 9.483 4.842 -3.157 1.00 0.00 N ATOM 1632 CA LYS B 33 8.418 5.204 -4.088 1.00 0.00 C ATOM 1633 C LYS B 33 8.773 4.823 -5.530 1.00 0.00 C ATOM 1634 O LYS B 33 7.932 4.892 -6.426 1.00 0.00 O ATOM 1635 CB LYS B 33 8.108 6.696 -3.998 1.00 0.00 C ATOM 1636 CG LYS B 33 9.322 7.584 -4.191 1.00 0.00 C ATOM 1637 CD LYS B 33 8.941 9.052 -4.314 1.00 0.00 C ATOM 1638 CE LYS B 33 8.217 9.576 -3.081 1.00 0.00 C ATOM 1639 NZ LYS B 33 7.881 11.020 -3.217 1.00 0.00 N ATOM 0 H LYS B 33 9.959 5.634 -2.724 1.00 0.00 H new ATOM 0 HA LYS B 33 7.530 4.640 -3.802 1.00 0.00 H new ATOM 0 HB2 LYS B 33 7.361 6.949 -4.750 1.00 0.00 H new ATOM 0 HB3 LYS B 33 7.665 6.908 -3.025 1.00 0.00 H new ATOM 0 HG2 LYS B 33 10.003 7.455 -3.349 1.00 0.00 H new ATOM 0 HG3 LYS B 33 9.860 7.273 -5.086 1.00 0.00 H new ATOM 0 HD2 LYS B 33 9.841 9.644 -4.481 1.00 0.00 H new ATOM 0 HD3 LYS B 33 8.304 9.186 -5.189 1.00 0.00 H new ATOM 0 HE2 LYS B 33 7.304 9.002 -2.923 1.00 0.00 H new ATOM 0 HE3 LYS B 33 8.842 9.428 -2.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 7.389 11.344 -2.360 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 8.755 11.569 -3.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 7.264 11.157 -4.043 1.00 0.00 H new ATOM 1653 N GLU B 34 10.021 4.427 -5.747 1.00 0.00 N ATOM 1654 CA GLU B 34 10.456 3.964 -7.057 1.00 0.00 C ATOM 1655 C GLU B 34 10.694 2.460 -7.033 1.00 0.00 C ATOM 1656 O GLU B 34 11.204 1.874 -7.990 1.00 0.00 O ATOM 1657 CB GLU B 34 11.722 4.695 -7.489 1.00 0.00 C ATOM 1658 CG GLU B 34 11.536 6.194 -7.612 1.00 0.00 C ATOM 1659 CD GLU B 34 12.734 6.885 -8.227 1.00 0.00 C ATOM 1660 OE1 GLU B 34 12.884 6.837 -9.466 1.00 0.00 O ATOM 1661 OE2 GLU B 34 13.528 7.487 -7.477 1.00 0.00 O ATOM 0 H GLU B 34 10.749 4.417 -5.032 1.00 0.00 H new ATOM 0 HA GLU B 34 9.669 4.181 -7.780 1.00 0.00 H new ATOM 0 HB2 GLU B 34 12.514 4.492 -6.768 1.00 0.00 H new ATOM 0 HB3 GLU B 34 12.054 4.297 -8.448 1.00 0.00 H new ATOM 0 HG2 GLU B 34 10.654 6.397 -8.219 1.00 0.00 H new ATOM 0 HG3 GLU B 34 11.347 6.614 -6.624 1.00 0.00 H new ATOM 1668 N LEU B 35 10.311 1.845 -5.930 1.00 0.00 N ATOM 1669 CA LEU B 35 10.447 0.414 -5.748 1.00 0.00 C ATOM 1670 C LEU B 35 9.443 -0.313 -6.637 1.00 0.00 C ATOM 1671 O LEU B 35 8.248 -0.032 -6.604 1.00 0.00 O ATOM 1672 CB LEU B 35 10.246 0.088 -4.259 1.00 0.00 C ATOM 1673 CG LEU B 35 10.412 -1.366 -3.824 1.00 0.00 C ATOM 1674 CD1 LEU B 35 9.153 -2.164 -4.121 1.00 0.00 C ATOM 1675 CD2 LEU B 35 11.627 -1.986 -4.494 1.00 0.00 C ATOM 0 H LEU B 35 9.895 2.327 -5.133 1.00 0.00 H new ATOM 0 HA LEU B 35 11.441 0.077 -6.041 1.00 0.00 H new ATOM 0 HB2 LEU B 35 10.949 0.692 -3.685 1.00 0.00 H new ATOM 0 HB3 LEU B 35 9.244 0.410 -3.977 1.00 0.00 H new ATOM 0 HG LEU B 35 10.573 -1.389 -2.746 1.00 0.00 H new ATOM 0 HD11 LEU B 35 9.294 -3.197 -3.803 1.00 0.00 H new ATOM 0 HD12 LEU B 35 8.311 -1.730 -3.582 1.00 0.00 H new ATOM 0 HD13 LEU B 35 8.950 -2.138 -5.192 1.00 0.00 H new ATOM 0 HD21 LEU B 35 11.730 -3.022 -4.173 1.00 0.00 H new ATOM 0 HD22 LEU B 35 11.502 -1.952 -5.576 1.00 0.00 H new ATOM 0 HD23 LEU B 35 12.521 -1.429 -4.214 1.00 0.00 H new ATOM 1687 N ARG B 36 9.941 -1.234 -7.447 1.00 0.00 N ATOM 1688 CA ARG B 36 9.094 -1.960 -8.382 1.00 0.00 C ATOM 1689 C ARG B 36 9.227 -3.460 -8.185 1.00 0.00 C ATOM 1690 O ARG B 36 10.158 -3.916 -7.520 1.00 0.00 O ATOM 1691 CB ARG B 36 9.447 -1.588 -9.822 1.00 0.00 C ATOM 1692 CG ARG B 36 9.260 -0.113 -10.137 1.00 0.00 C ATOM 1693 CD ARG B 36 7.833 0.332 -9.868 1.00 0.00 C ATOM 1694 NE ARG B 36 7.614 1.735 -10.212 1.00 0.00 N ATOM 1695 CZ ARG B 36 6.434 2.343 -10.116 1.00 0.00 C ATOM 1696 NH1 ARG B 36 5.372 1.663 -9.698 1.00 0.00 N ATOM 1697 NH2 ARG B 36 6.316 3.624 -10.433 1.00 0.00 N ATOM 0 H ARG B 36 10.926 -1.497 -7.476 1.00 0.00 H new ATOM 0 HA ARG B 36 8.059 -1.678 -8.187 1.00 0.00 H new ATOM 0 HB2 ARG B 36 10.484 -1.863 -10.015 1.00 0.00 H new ATOM 0 HB3 ARG B 36 8.830 -2.176 -10.501 1.00 0.00 H new ATOM 0 HG2 ARG B 36 9.948 0.480 -9.534 1.00 0.00 H new ATOM 0 HG3 ARG B 36 9.510 0.073 -11.181 1.00 0.00 H new ATOM 0 HD2 ARG B 36 7.147 -0.291 -10.441 1.00 0.00 H new ATOM 0 HD3 ARG B 36 7.600 0.178 -8.814 1.00 0.00 H new ATOM 0 HE ARG B 36 8.410 2.279 -10.544 1.00 0.00 H new ATOM 0 HH11 ARG B 36 5.462 0.677 -9.452 1.00 0.00 H new ATOM 0 HH12 ARG B 36 4.466 2.127 -9.624 1.00 0.00 H new ATOM 0 HH21 ARG B 36 7.131 4.148 -10.752 1.00 0.00 H new ATOM 0 HH22 ARG B 36 5.410 4.087 -10.358 1.00 0.00 H new ATOM 1711 N GLU B 37 8.308 -4.224 -8.760 1.00 0.00 N ATOM 1712 CA GLU B 37 8.317 -5.670 -8.594 1.00 0.00 C ATOM 1713 C GLU B 37 9.562 -6.261 -9.236 1.00 0.00 C ATOM 1714 O GLU B 37 10.166 -7.196 -8.707 1.00 0.00 O ATOM 1715 CB GLU B 37 7.063 -6.295 -9.198 1.00 0.00 C ATOM 1716 CG GLU B 37 6.960 -7.786 -8.938 1.00 0.00 C ATOM 1717 CD GLU B 37 5.722 -8.409 -9.545 1.00 0.00 C ATOM 1718 OE1 GLU B 37 4.760 -8.684 -8.797 1.00 0.00 O ATOM 1719 OE2 GLU B 37 5.711 -8.649 -10.769 1.00 0.00 O ATOM 0 H GLU B 37 7.550 -3.868 -9.343 1.00 0.00 H new ATOM 0 HA GLU B 37 8.328 -5.893 -7.527 1.00 0.00 H new ATOM 0 HB2 GLU B 37 6.183 -5.799 -8.789 1.00 0.00 H new ATOM 0 HB3 GLU B 37 7.057 -6.118 -10.274 1.00 0.00 H new ATOM 0 HG2 GLU B 37 7.844 -8.281 -9.341 1.00 0.00 H new ATOM 0 HG3 GLU B 37 6.958 -7.962 -7.862 1.00 0.00 H new ATOM 1726 N THR B 38 9.953 -5.688 -10.366 1.00 0.00 N ATOM 1727 CA THR B 38 11.173 -6.089 -11.044 1.00 0.00 C ATOM 1728 C THR B 38 12.367 -5.921 -10.111 1.00 0.00 C ATOM 1729 O THR B 38 13.332 -6.679 -10.163 1.00 0.00 O ATOM 1730 CB THR B 38 11.399 -5.242 -12.306 1.00 0.00 C ATOM 1731 OG1 THR B 38 10.193 -5.183 -13.079 1.00 0.00 O ATOM 1732 CG2 THR B 38 12.520 -5.817 -13.153 1.00 0.00 C ATOM 0 H THR B 38 9.439 -4.941 -10.832 1.00 0.00 H new ATOM 0 HA THR B 38 11.072 -7.136 -11.332 1.00 0.00 H new ATOM 0 HB THR B 38 11.682 -4.237 -11.994 1.00 0.00 H new ATOM 0 HG1 THR B 38 10.345 -4.640 -13.881 1.00 0.00 H new ATOM 0 HG21 THR B 38 12.660 -5.199 -14.040 1.00 0.00 H new ATOM 0 HG22 THR B 38 13.443 -5.833 -12.573 1.00 0.00 H new ATOM 0 HG23 THR B 38 12.264 -6.832 -13.455 1.00 0.00 H new ATOM 1740 N HIS B 39 12.266 -4.936 -9.232 1.00 0.00 N ATOM 1741 CA HIS B 39 13.330 -4.643 -8.289 1.00 0.00 C ATOM 1742 C HIS B 39 13.312 -5.680 -7.181 1.00 0.00 C ATOM 1743 O HIS B 39 14.351 -6.095 -6.694 1.00 0.00 O ATOM 1744 CB HIS B 39 13.173 -3.236 -7.706 1.00 0.00 C ATOM 1745 CG HIS B 39 13.156 -2.143 -8.737 1.00 0.00 C ATOM 1746 ND1 HIS B 39 13.075 -0.807 -8.415 1.00 0.00 N ATOM 1747 CD2 HIS B 39 13.163 -2.197 -10.090 1.00 0.00 C ATOM 1748 CE1 HIS B 39 13.023 -0.091 -9.521 1.00 0.00 C ATOM 1749 NE2 HIS B 39 13.078 -0.909 -10.552 1.00 0.00 N ATOM 0 H HIS B 39 11.453 -4.324 -9.153 1.00 0.00 H new ATOM 0 HA HIS B 39 14.287 -4.681 -8.810 1.00 0.00 H new ATOM 0 HB2 HIS B 39 12.247 -3.194 -7.132 1.00 0.00 H new ATOM 0 HB3 HIS B 39 13.990 -3.050 -7.008 1.00 0.00 H new ATOM 0 HD1 HIS B 39 13.058 -0.429 -7.468 1.00 0.00 H new ATOM 0 HD2 HIS B 39 13.224 -3.090 -10.694 1.00 0.00 H new ATOM 0 HE1 HIS B 39 12.948 0.985 -9.573 1.00 0.00 H new ATOM 1758 N LEU B 40 12.111 -6.110 -6.808 1.00 0.00 N ATOM 1759 CA LEU B 40 11.939 -7.166 -5.814 1.00 0.00 C ATOM 1760 C LEU B 40 12.520 -8.474 -6.313 1.00 0.00 C ATOM 1761 O LEU B 40 13.028 -9.271 -5.528 1.00 0.00 O ATOM 1762 CB LEU B 40 10.462 -7.343 -5.467 1.00 0.00 C ATOM 1763 CG LEU B 40 9.995 -6.582 -4.230 1.00 0.00 C ATOM 1764 CD1 LEU B 40 10.531 -5.172 -4.237 1.00 0.00 C ATOM 1765 CD2 LEU B 40 8.483 -6.563 -4.160 1.00 0.00 C ATOM 0 H LEU B 40 11.236 -5.741 -7.181 1.00 0.00 H new ATOM 0 HA LEU B 40 12.476 -6.871 -4.912 1.00 0.00 H new ATOM 0 HB2 LEU B 40 9.863 -7.023 -6.320 1.00 0.00 H new ATOM 0 HB3 LEU B 40 10.264 -8.404 -5.319 1.00 0.00 H new ATOM 0 HG LEU B 40 10.381 -7.095 -3.349 1.00 0.00 H new ATOM 0 HD11 LEU B 40 10.186 -4.647 -3.346 1.00 0.00 H new ATOM 0 HD12 LEU B 40 11.621 -5.197 -4.244 1.00 0.00 H new ATOM 0 HD13 LEU B 40 10.174 -4.652 -5.126 1.00 0.00 H new ATOM 0 HD21 LEU B 40 8.167 -6.016 -3.272 1.00 0.00 H new ATOM 0 HD22 LEU B 40 8.084 -6.074 -5.048 1.00 0.00 H new ATOM 0 HD23 LEU B 40 8.108 -7.585 -4.109 1.00 0.00 H new ATOM 1777 N ASN B 41 12.445 -8.688 -7.619 1.00 0.00 N ATOM 1778 CA ASN B 41 13.102 -9.832 -8.236 1.00 0.00 C ATOM 1779 C ASN B 41 14.594 -9.779 -7.935 1.00 0.00 C ATOM 1780 O ASN B 41 15.216 -10.788 -7.605 1.00 0.00 O ATOM 1781 CB ASN B 41 12.887 -9.845 -9.753 1.00 0.00 C ATOM 1782 CG ASN B 41 11.437 -10.025 -10.157 1.00 0.00 C ATOM 1783 OD1 ASN B 41 10.633 -10.596 -9.420 1.00 0.00 O ATOM 1784 ND2 ASN B 41 11.101 -9.570 -11.352 1.00 0.00 N ATOM 0 H ASN B 41 11.938 -8.088 -8.270 1.00 0.00 H new ATOM 0 HA ASN B 41 12.667 -10.742 -7.823 1.00 0.00 H new ATOM 0 HB2 ASN B 41 13.259 -8.911 -10.173 1.00 0.00 H new ATOM 0 HB3 ASN B 41 13.480 -10.649 -10.189 1.00 0.00 H new ATOM 0 HD21 ASN B 41 10.147 -9.687 -11.692 1.00 0.00 H new ATOM 0 HD22 ASN B 41 11.796 -9.102 -11.933 1.00 0.00 H new ATOM 1791 N GLU B 42 15.143 -8.579 -8.024 1.00 0.00 N ATOM 1792 CA GLU B 42 16.550 -8.341 -7.752 1.00 0.00 C ATOM 1793 C GLU B 42 16.840 -8.450 -6.260 1.00 0.00 C ATOM 1794 O GLU B 42 17.902 -8.914 -5.850 1.00 0.00 O ATOM 1795 CB GLU B 42 16.930 -6.954 -8.257 1.00 0.00 C ATOM 1796 CG GLU B 42 16.698 -6.768 -9.744 1.00 0.00 C ATOM 1797 CD GLU B 42 17.569 -7.674 -10.590 1.00 0.00 C ATOM 1798 OE1 GLU B 42 17.166 -8.827 -10.855 1.00 0.00 O ATOM 1799 OE2 GLU B 42 18.666 -7.235 -10.996 1.00 0.00 O ATOM 0 H GLU B 42 14.624 -7.741 -8.287 1.00 0.00 H new ATOM 0 HA GLU B 42 17.142 -9.097 -8.268 1.00 0.00 H new ATOM 0 HB2 GLU B 42 16.354 -6.207 -7.711 1.00 0.00 H new ATOM 0 HB3 GLU B 42 17.981 -6.771 -8.035 1.00 0.00 H new ATOM 0 HG2 GLU B 42 15.650 -6.963 -9.971 1.00 0.00 H new ATOM 0 HG3 GLU B 42 16.894 -5.730 -10.011 1.00 0.00 H new ATOM 1806 N LEU B 43 15.880 -8.019 -5.455 1.00 0.00 N ATOM 1807 CA LEU B 43 16.012 -8.035 -4.004 1.00 0.00 C ATOM 1808 C LEU B 43 15.733 -9.428 -3.446 1.00 0.00 C ATOM 1809 O LEU B 43 15.803 -9.648 -2.234 1.00 0.00 O ATOM 1810 CB LEU B 43 15.039 -7.034 -3.385 1.00 0.00 C ATOM 1811 CG LEU B 43 15.099 -5.623 -3.963 1.00 0.00 C ATOM 1812 CD1 LEU B 43 14.126 -4.712 -3.246 1.00 0.00 C ATOM 1813 CD2 LEU B 43 16.502 -5.066 -3.878 1.00 0.00 C ATOM 0 H LEU B 43 14.989 -7.649 -5.787 1.00 0.00 H new ATOM 0 HA LEU B 43 17.036 -7.758 -3.751 1.00 0.00 H new ATOM 0 HB2 LEU B 43 14.025 -7.416 -3.506 1.00 0.00 H new ATOM 0 HB3 LEU B 43 15.233 -6.979 -2.314 1.00 0.00 H new ATOM 0 HG LEU B 43 14.815 -5.676 -5.014 1.00 0.00 H new ATOM 0 HD11 LEU B 43 14.184 -3.710 -3.672 1.00 0.00 H new ATOM 0 HD12 LEU B 43 13.113 -5.098 -3.362 1.00 0.00 H new ATOM 0 HD13 LEU B 43 14.380 -4.670 -2.187 1.00 0.00 H new ATOM 0 HD21 LEU B 43 16.520 -4.059 -4.296 1.00 0.00 H new ATOM 0 HD22 LEU B 43 16.817 -5.031 -2.835 1.00 0.00 H new ATOM 0 HD23 LEU B 43 17.182 -5.705 -4.442 1.00 0.00 H new ATOM 1825 N ASN B 44 15.390 -10.348 -4.344 1.00 0.00 N ATOM 1826 CA ASN B 44 15.109 -11.742 -3.996 1.00 0.00 C ATOM 1827 C ASN B 44 13.827 -11.840 -3.171 1.00 0.00 C ATOM 1828 O ASN B 44 13.588 -12.817 -2.468 1.00 0.00 O ATOM 1829 CB ASN B 44 16.291 -12.362 -3.240 1.00 0.00 C ATOM 1830 CG ASN B 44 16.326 -13.880 -3.324 1.00 0.00 C ATOM 1831 OD1 ASN B 44 16.936 -14.447 -4.230 1.00 0.00 O ATOM 1832 ND2 ASN B 44 15.683 -14.549 -2.383 1.00 0.00 N ATOM 0 H ASN B 44 15.298 -10.148 -5.340 1.00 0.00 H new ATOM 0 HA ASN B 44 14.966 -12.304 -4.919 1.00 0.00 H new ATOM 0 HB2 ASN B 44 17.221 -11.961 -3.642 1.00 0.00 H new ATOM 0 HB3 ASN B 44 16.241 -12.064 -2.193 1.00 0.00 H new ATOM 0 HD21 ASN B 44 15.682 -15.569 -2.393 1.00 0.00 H new ATOM 0 HD22 ASN B 44 15.188 -14.045 -1.647 1.00 0.00 H new ATOM 1839 N ILE B 45 12.995 -10.821 -3.273 1.00 0.00 N ATOM 1840 CA ILE B 45 11.720 -10.812 -2.585 1.00 0.00 C ATOM 1841 C ILE B 45 10.675 -11.474 -3.466 1.00 0.00 C ATOM 1842 O ILE B 45 9.869 -10.811 -4.113 1.00 0.00 O ATOM 1843 CB ILE B 45 11.273 -9.386 -2.209 1.00 0.00 C ATOM 1844 CG1 ILE B 45 12.370 -8.697 -1.394 1.00 0.00 C ATOM 1845 CG2 ILE B 45 9.965 -9.427 -1.421 1.00 0.00 C ATOM 1846 CD1 ILE B 45 12.076 -7.249 -1.071 1.00 0.00 C ATOM 0 H ILE B 45 13.181 -9.986 -3.828 1.00 0.00 H new ATOM 0 HA ILE B 45 11.833 -11.367 -1.654 1.00 0.00 H new ATOM 0 HB ILE B 45 11.102 -8.816 -3.122 1.00 0.00 H new ATOM 0 HG12 ILE B 45 12.515 -9.244 -0.463 1.00 0.00 H new ATOM 0 HG13 ILE B 45 13.308 -8.753 -1.946 1.00 0.00 H new ATOM 0 HG21 ILE B 45 9.663 -8.412 -1.163 1.00 0.00 H new ATOM 0 HG22 ILE B 45 9.189 -9.893 -2.028 1.00 0.00 H new ATOM 0 HG23 ILE B 45 10.108 -10.006 -0.508 1.00 0.00 H new ATOM 0 HD11 ILE B 45 12.899 -6.831 -0.492 1.00 0.00 H new ATOM 0 HD12 ILE B 45 11.961 -6.686 -1.997 1.00 0.00 H new ATOM 0 HD13 ILE B 45 11.155 -7.185 -0.491 1.00 0.00 H new ATOM 1858 N MET B 46 10.737 -12.789 -3.520 1.00 0.00 N ATOM 1859 CA MET B 46 9.830 -13.567 -4.347 1.00 0.00 C ATOM 1860 C MET B 46 8.512 -13.770 -3.618 1.00 0.00 C ATOM 1861 O MET B 46 7.537 -14.245 -4.195 1.00 0.00 O ATOM 1862 CB MET B 46 10.465 -14.915 -4.688 1.00 0.00 C ATOM 1863 CG MET B 46 11.873 -14.811 -5.264 1.00 0.00 C ATOM 1864 SD MET B 46 11.924 -14.540 -7.051 1.00 0.00 S ATOM 1865 CE MET B 46 11.305 -12.867 -7.200 1.00 0.00 C ATOM 0 H MET B 46 11.411 -13.348 -2.997 1.00 0.00 H new ATOM 0 HA MET B 46 9.636 -13.028 -5.274 1.00 0.00 H new ATOM 0 HB2 MET B 46 10.497 -15.528 -3.787 1.00 0.00 H new ATOM 0 HB3 MET B 46 9.828 -15.434 -5.404 1.00 0.00 H new ATOM 0 HG2 MET B 46 12.397 -13.993 -4.769 1.00 0.00 H new ATOM 0 HG3 MET B 46 12.417 -15.726 -5.031 1.00 0.00 H new ATOM 0 HE1 MET B 46 11.695 -12.414 -8.112 1.00 0.00 H new ATOM 0 HE2 MET B 46 10.216 -12.884 -7.241 1.00 0.00 H new ATOM 0 HE3 MET B 46 11.626 -12.282 -6.338 1.00 0.00 H new ATOM 1875 N ASP B 47 8.518 -13.390 -2.344 1.00 0.00 N ATOM 1876 CA ASP B 47 7.339 -13.419 -1.480 1.00 0.00 C ATOM 1877 C ASP B 47 6.161 -12.729 -2.162 1.00 0.00 C ATOM 1878 O ASP B 47 6.107 -11.507 -2.215 1.00 0.00 O ATOM 1879 CB ASP B 47 7.641 -12.659 -0.190 1.00 0.00 C ATOM 1880 CG ASP B 47 8.805 -13.190 0.620 1.00 0.00 C ATOM 1881 OD1 ASP B 47 9.384 -14.233 0.260 1.00 0.00 O ATOM 1882 OD2 ASP B 47 9.153 -12.536 1.629 1.00 0.00 O ATOM 0 H ASP B 47 9.356 -13.047 -1.874 1.00 0.00 H new ATOM 0 HA ASP B 47 7.090 -14.460 -1.273 1.00 0.00 H new ATOM 0 HB2 ASP B 47 7.840 -11.617 -0.440 1.00 0.00 H new ATOM 0 HB3 ASP B 47 6.749 -12.671 0.436 1.00 0.00 H new ATOM 1887 N PRO B 48 5.182 -13.507 -2.648 1.00 0.00 N ATOM 1888 CA PRO B 48 4.089 -13.000 -3.490 1.00 0.00 C ATOM 1889 C PRO B 48 3.221 -11.944 -2.811 1.00 0.00 C ATOM 1890 O PRO B 48 2.975 -10.881 -3.381 1.00 0.00 O ATOM 1891 CB PRO B 48 3.256 -14.242 -3.800 1.00 0.00 C ATOM 1892 CG PRO B 48 4.155 -15.392 -3.527 1.00 0.00 C ATOM 1893 CD PRO B 48 5.061 -14.955 -2.419 1.00 0.00 C ATOM 0 HA PRO B 48 4.489 -12.496 -4.370 1.00 0.00 H new ATOM 0 HB2 PRO B 48 2.363 -14.283 -3.176 1.00 0.00 H new ATOM 0 HB3 PRO B 48 2.920 -14.242 -4.837 1.00 0.00 H new ATOM 0 HG2 PRO B 48 3.583 -16.274 -3.238 1.00 0.00 H new ATOM 0 HG3 PRO B 48 4.727 -15.660 -4.416 1.00 0.00 H new ATOM 0 HD2 PRO B 48 4.637 -15.175 -1.439 1.00 0.00 H new ATOM 0 HD3 PRO B 48 6.029 -15.454 -2.467 1.00 0.00 H new ATOM 1901 N GLN B 49 2.743 -12.235 -1.609 1.00 0.00 N ATOM 1902 CA GLN B 49 1.902 -11.289 -0.885 1.00 0.00 C ATOM 1903 C GLN B 49 2.734 -10.117 -0.404 1.00 0.00 C ATOM 1904 O GLN B 49 2.283 -8.976 -0.403 1.00 0.00 O ATOM 1905 CB GLN B 49 1.209 -11.960 0.300 1.00 0.00 C ATOM 1906 CG GLN B 49 0.051 -12.856 -0.101 1.00 0.00 C ATOM 1907 CD GLN B 49 -0.595 -13.539 1.086 1.00 0.00 C ATOM 1908 OE1 GLN B 49 -0.194 -14.631 1.483 1.00 0.00 O ATOM 1909 NE2 GLN B 49 -1.605 -12.904 1.656 1.00 0.00 N ATOM 0 H GLN B 49 2.921 -13.111 -1.117 1.00 0.00 H new ATOM 0 HA GLN B 49 1.132 -10.929 -1.568 1.00 0.00 H new ATOM 0 HB2 GLN B 49 1.941 -12.551 0.851 1.00 0.00 H new ATOM 0 HB3 GLN B 49 0.844 -11.190 0.980 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -0.698 -12.263 -0.626 1.00 0.00 H new ATOM 0 HG3 GLN B 49 0.407 -13.612 -0.801 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -1.907 -11.999 1.296 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -2.082 -13.319 2.456 1.00 0.00 H new ATOM 1918 N HIS B 50 3.965 -10.404 -0.025 1.00 0.00 N ATOM 1919 CA HIS B 50 4.870 -9.373 0.452 1.00 0.00 C ATOM 1920 C HIS B 50 5.202 -8.417 -0.683 1.00 0.00 C ATOM 1921 O HIS B 50 5.241 -7.205 -0.491 1.00 0.00 O ATOM 1922 CB HIS B 50 6.138 -9.999 1.023 1.00 0.00 C ATOM 1923 CG HIS B 50 5.887 -10.882 2.216 1.00 0.00 C ATOM 1924 ND1 HIS B 50 6.857 -11.677 2.793 1.00 0.00 N ATOM 1925 CD2 HIS B 50 4.764 -11.077 2.948 1.00 0.00 C ATOM 1926 CE1 HIS B 50 6.341 -12.314 3.826 1.00 0.00 C ATOM 1927 NE2 HIS B 50 5.077 -11.968 3.940 1.00 0.00 N ATOM 0 H HIS B 50 4.362 -11.343 -0.038 1.00 0.00 H new ATOM 0 HA HIS B 50 4.384 -8.813 1.250 1.00 0.00 H new ATOM 0 HB2 HIS B 50 6.627 -10.584 0.244 1.00 0.00 H new ATOM 0 HB3 HIS B 50 6.829 -9.206 1.307 1.00 0.00 H new ATOM 0 HD1 HIS B 50 7.821 -11.759 2.471 1.00 0.00 H new ATOM 0 HD2 HIS B 50 3.802 -10.616 2.781 1.00 0.00 H new ATOM 0 HE1 HIS B 50 6.867 -13.003 4.470 1.00 0.00 H new ATOM 1936 N ARG B 51 5.432 -8.982 -1.865 1.00 0.00 N ATOM 1937 CA ARG B 51 5.568 -8.203 -3.089 1.00 0.00 C ATOM 1938 C ARG B 51 4.366 -7.298 -3.255 1.00 0.00 C ATOM 1939 O ARG B 51 4.495 -6.082 -3.380 1.00 0.00 O ATOM 1940 CB ARG B 51 5.657 -9.129 -4.306 1.00 0.00 C ATOM 1941 CG ARG B 51 6.999 -9.816 -4.478 1.00 0.00 C ATOM 1942 CD ARG B 51 6.881 -11.053 -5.354 1.00 0.00 C ATOM 1943 NE ARG B 51 6.214 -10.778 -6.626 1.00 0.00 N ATOM 1944 CZ ARG B 51 6.007 -11.697 -7.571 1.00 0.00 C ATOM 1945 NH1 ARG B 51 6.439 -12.943 -7.403 1.00 0.00 N ATOM 1946 NH2 ARG B 51 5.367 -11.369 -8.683 1.00 0.00 N ATOM 0 H ARG B 51 5.529 -9.988 -2.000 1.00 0.00 H new ATOM 0 HA ARG B 51 6.479 -7.609 -3.018 1.00 0.00 H new ATOM 0 HB2 ARG B 51 4.881 -9.890 -4.225 1.00 0.00 H new ATOM 0 HB3 ARG B 51 5.442 -8.550 -5.204 1.00 0.00 H new ATOM 0 HG2 ARG B 51 7.711 -9.120 -4.922 1.00 0.00 H new ATOM 0 HG3 ARG B 51 7.394 -10.096 -3.501 1.00 0.00 H new ATOM 0 HD2 ARG B 51 7.876 -11.453 -5.549 1.00 0.00 H new ATOM 0 HD3 ARG B 51 6.328 -11.823 -4.817 1.00 0.00 H new ATOM 0 HE ARG B 51 5.888 -9.828 -6.801 1.00 0.00 H new ATOM 0 HH11 ARG B 51 6.932 -13.201 -6.548 1.00 0.00 H new ATOM 0 HH12 ARG B 51 6.278 -13.641 -8.129 1.00 0.00 H new ATOM 0 HH21 ARG B 51 5.033 -10.415 -8.817 1.00 0.00 H new ATOM 0 HH22 ARG B 51 5.208 -12.071 -9.406 1.00 0.00 H new ATOM 1960 N ALA B 52 3.197 -7.918 -3.225 1.00 0.00 N ATOM 1961 CA ALA B 52 1.940 -7.228 -3.414 1.00 0.00 C ATOM 1962 C ALA B 52 1.826 -6.011 -2.498 1.00 0.00 C ATOM 1963 O ALA B 52 1.408 -4.936 -2.929 1.00 0.00 O ATOM 1964 CB ALA B 52 0.804 -8.205 -3.176 1.00 0.00 C ATOM 0 H ALA B 52 3.098 -8.921 -3.067 1.00 0.00 H new ATOM 0 HA ALA B 52 1.887 -6.854 -4.437 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -0.149 -7.695 -3.316 1.00 0.00 H new ATOM 0 HB2 ALA B 52 0.881 -9.031 -3.883 1.00 0.00 H new ATOM 0 HB3 ALA B 52 0.863 -8.591 -2.158 1.00 0.00 H new ATOM 1970 N LYS B 53 2.219 -6.178 -1.243 1.00 0.00 N ATOM 1971 CA LYS B 53 2.194 -5.078 -0.286 1.00 0.00 C ATOM 1972 C LYS B 53 3.233 -4.023 -0.643 1.00 0.00 C ATOM 1973 O LYS B 53 2.916 -2.839 -0.741 1.00 0.00 O ATOM 1974 CB LYS B 53 2.440 -5.587 1.136 1.00 0.00 C ATOM 1975 CG LYS B 53 1.543 -6.750 1.516 1.00 0.00 C ATOM 1976 CD LYS B 53 1.416 -6.932 3.020 1.00 0.00 C ATOM 1977 CE LYS B 53 0.349 -6.019 3.600 1.00 0.00 C ATOM 1978 NZ LYS B 53 0.094 -6.307 5.035 1.00 0.00 N ATOM 0 H LYS B 53 2.558 -7.062 -0.863 1.00 0.00 H new ATOM 0 HA LYS B 53 1.204 -4.624 -0.330 1.00 0.00 H new ATOM 0 HB2 LYS B 53 3.482 -5.894 1.230 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.283 -4.770 1.840 1.00 0.00 H new ATOM 0 HG2 LYS B 53 0.552 -6.593 1.089 1.00 0.00 H new ATOM 0 HG3 LYS B 53 1.938 -7.666 1.076 1.00 0.00 H new ATOM 0 HD2 LYS B 53 1.169 -7.970 3.243 1.00 0.00 H new ATOM 0 HD3 LYS B 53 2.374 -6.723 3.496 1.00 0.00 H new ATOM 0 HE2 LYS B 53 0.660 -4.980 3.488 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -0.576 -6.138 3.036 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -0.821 -5.898 5.314 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 0.073 -7.336 5.184 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 0.851 -5.889 5.613 1.00 0.00 H new ATOM 1992 N LEU B 54 4.466 -4.468 -0.858 1.00 0.00 N ATOM 1993 CA LEU B 54 5.578 -3.572 -1.157 1.00 0.00 C ATOM 1994 C LEU B 54 5.279 -2.672 -2.353 1.00 0.00 C ATOM 1995 O LEU B 54 5.507 -1.464 -2.299 1.00 0.00 O ATOM 1996 CB LEU B 54 6.846 -4.384 -1.417 1.00 0.00 C ATOM 1997 CG LEU B 54 7.401 -5.123 -0.199 1.00 0.00 C ATOM 1998 CD1 LEU B 54 8.495 -6.086 -0.615 1.00 0.00 C ATOM 1999 CD2 LEU B 54 7.928 -4.138 0.827 1.00 0.00 C ATOM 0 H LEU B 54 4.723 -5.455 -0.830 1.00 0.00 H new ATOM 0 HA LEU B 54 5.726 -2.928 -0.290 1.00 0.00 H new ATOM 0 HB2 LEU B 54 6.639 -5.112 -2.201 1.00 0.00 H new ATOM 0 HB3 LEU B 54 7.616 -3.714 -1.799 1.00 0.00 H new ATOM 0 HG LEU B 54 6.590 -5.694 0.254 1.00 0.00 H new ATOM 0 HD11 LEU B 54 8.878 -6.603 0.265 1.00 0.00 H new ATOM 0 HD12 LEU B 54 8.090 -6.815 -1.317 1.00 0.00 H new ATOM 0 HD13 LEU B 54 9.304 -5.533 -1.092 1.00 0.00 H new ATOM 0 HD21 LEU B 54 8.319 -4.682 1.687 1.00 0.00 H new ATOM 0 HD22 LEU B 54 8.724 -3.541 0.383 1.00 0.00 H new ATOM 0 HD23 LEU B 54 7.120 -3.482 1.150 1.00 0.00 H new ATOM 2011 N LEU B 55 4.754 -3.255 -3.425 1.00 0.00 N ATOM 2012 CA LEU B 55 4.451 -2.484 -4.625 1.00 0.00 C ATOM 2013 C LEU B 55 3.324 -1.495 -4.380 1.00 0.00 C ATOM 2014 O LEU B 55 3.334 -0.389 -4.915 1.00 0.00 O ATOM 2015 CB LEU B 55 4.103 -3.391 -5.811 1.00 0.00 C ATOM 2016 CG LEU B 55 5.299 -4.028 -6.525 1.00 0.00 C ATOM 2017 CD1 LEU B 55 6.535 -3.170 -6.353 1.00 0.00 C ATOM 2018 CD2 LEU B 55 5.552 -5.441 -6.035 1.00 0.00 C ATOM 0 H LEU B 55 4.531 -4.248 -3.488 1.00 0.00 H new ATOM 0 HA LEU B 55 5.354 -1.927 -4.875 1.00 0.00 H new ATOM 0 HB2 LEU B 55 3.447 -4.186 -5.458 1.00 0.00 H new ATOM 0 HB3 LEU B 55 3.536 -2.809 -6.537 1.00 0.00 H new ATOM 0 HG LEU B 55 5.061 -4.088 -7.587 1.00 0.00 H new ATOM 0 HD11 LEU B 55 7.376 -3.636 -6.866 1.00 0.00 H new ATOM 0 HD12 LEU B 55 6.354 -2.182 -6.777 1.00 0.00 H new ATOM 0 HD13 LEU B 55 6.766 -3.073 -5.292 1.00 0.00 H new ATOM 0 HD21 LEU B 55 6.408 -5.862 -6.563 1.00 0.00 H new ATOM 0 HD22 LEU B 55 5.759 -5.423 -4.965 1.00 0.00 H new ATOM 0 HD23 LEU B 55 4.671 -6.055 -6.224 1.00 0.00 H new ATOM 2030 N THR B 56 2.360 -1.884 -3.565 1.00 0.00 N ATOM 2031 CA THR B 56 1.258 -1.002 -3.228 1.00 0.00 C ATOM 2032 C THR B 56 1.758 0.163 -2.389 1.00 0.00 C ATOM 2033 O THR B 56 1.355 1.312 -2.587 1.00 0.00 O ATOM 2034 CB THR B 56 0.169 -1.756 -2.460 1.00 0.00 C ATOM 2035 OG1 THR B 56 -0.221 -2.904 -3.209 1.00 0.00 O ATOM 2036 CG2 THR B 56 -1.039 -0.871 -2.219 1.00 0.00 C ATOM 0 H THR B 56 2.318 -2.803 -3.125 1.00 0.00 H new ATOM 0 HA THR B 56 0.831 -0.624 -4.157 1.00 0.00 H new ATOM 0 HB THR B 56 0.569 -2.057 -1.492 1.00 0.00 H new ATOM 0 HG1 THR B 56 0.418 -3.630 -3.051 1.00 0.00 H new ATOM 0 HG21 THR B 56 -1.797 -1.431 -1.672 1.00 0.00 H new ATOM 0 HG22 THR B 56 -0.741 0.001 -1.636 1.00 0.00 H new ATOM 0 HG23 THR B 56 -1.448 -0.546 -3.175 1.00 0.00 H new ATOM 2044 N ALA B 57 2.651 -0.144 -1.458 1.00 0.00 N ATOM 2045 CA ALA B 57 3.273 0.873 -0.640 1.00 0.00 C ATOM 2046 C ALA B 57 4.048 1.843 -1.516 1.00 0.00 C ATOM 2047 O ALA B 57 3.924 3.053 -1.368 1.00 0.00 O ATOM 2048 CB ALA B 57 4.178 0.239 0.402 1.00 0.00 C ATOM 0 H ALA B 57 2.958 -1.095 -1.254 1.00 0.00 H new ATOM 0 HA ALA B 57 2.496 1.428 -0.115 1.00 0.00 H new ATOM 0 HB1 ALA B 57 4.637 1.020 1.008 1.00 0.00 H new ATOM 0 HB2 ALA B 57 3.590 -0.419 1.042 1.00 0.00 H new ATOM 0 HB3 ALA B 57 4.956 -0.339 -0.096 1.00 0.00 H new ATOM 2054 N ALA B 58 4.819 1.305 -2.451 1.00 0.00 N ATOM 2055 CA ALA B 58 5.581 2.126 -3.382 1.00 0.00 C ATOM 2056 C ALA B 58 4.659 3.023 -4.196 1.00 0.00 C ATOM 2057 O ALA B 58 4.944 4.203 -4.395 1.00 0.00 O ATOM 2058 CB ALA B 58 6.412 1.249 -4.300 1.00 0.00 C ATOM 0 H ALA B 58 4.933 0.300 -2.585 1.00 0.00 H new ATOM 0 HA ALA B 58 6.251 2.763 -2.805 1.00 0.00 H new ATOM 0 HB1 ALA B 58 6.976 1.876 -4.990 1.00 0.00 H new ATOM 0 HB2 ALA B 58 7.103 0.652 -3.705 1.00 0.00 H new ATOM 0 HB3 ALA B 58 5.755 0.588 -4.865 1.00 0.00 H new ATOM 2064 N GLU B 59 3.545 2.456 -4.649 1.00 0.00 N ATOM 2065 CA GLU B 59 2.551 3.204 -5.407 1.00 0.00 C ATOM 2066 C GLU B 59 2.044 4.401 -4.622 1.00 0.00 C ATOM 2067 O GLU B 59 2.103 5.543 -5.090 1.00 0.00 O ATOM 2068 CB GLU B 59 1.368 2.309 -5.775 1.00 0.00 C ATOM 2069 CG GLU B 59 1.657 1.357 -6.915 1.00 0.00 C ATOM 2070 CD GLU B 59 2.107 2.078 -8.170 1.00 0.00 C ATOM 2071 OE1 GLU B 59 2.737 1.439 -9.037 1.00 0.00 O ATOM 2072 OE2 GLU B 59 1.839 3.291 -8.296 1.00 0.00 O ATOM 0 H GLU B 59 3.308 1.475 -4.502 1.00 0.00 H new ATOM 0 HA GLU B 59 3.037 3.559 -6.316 1.00 0.00 H new ATOM 0 HB2 GLU B 59 1.073 1.733 -4.898 1.00 0.00 H new ATOM 0 HB3 GLU B 59 0.519 2.937 -6.044 1.00 0.00 H new ATOM 0 HG2 GLU B 59 2.429 0.651 -6.608 1.00 0.00 H new ATOM 0 HG3 GLU B 59 0.762 0.775 -7.135 1.00 0.00 H new ATOM 2079 N LEU B 60 1.554 4.143 -3.424 1.00 0.00 N ATOM 2080 CA LEU B 60 0.963 5.190 -2.619 1.00 0.00 C ATOM 2081 C LEU B 60 2.017 6.139 -2.063 1.00 0.00 C ATOM 2082 O LEU B 60 1.732 7.295 -1.818 1.00 0.00 O ATOM 2083 CB LEU B 60 0.107 4.604 -1.497 1.00 0.00 C ATOM 2084 CG LEU B 60 -1.328 4.241 -1.892 1.00 0.00 C ATOM 2085 CD1 LEU B 60 -1.354 3.161 -2.960 1.00 0.00 C ATOM 2086 CD2 LEU B 60 -2.107 3.803 -0.672 1.00 0.00 C ATOM 0 H LEU B 60 1.554 3.220 -2.990 1.00 0.00 H new ATOM 0 HA LEU B 60 0.313 5.772 -3.272 1.00 0.00 H new ATOM 0 HB2 LEU B 60 0.599 3.709 -1.116 1.00 0.00 H new ATOM 0 HB3 LEU B 60 0.071 5.321 -0.677 1.00 0.00 H new ATOM 0 HG LEU B 60 -1.799 5.130 -2.313 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -2.387 2.928 -3.217 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -0.831 3.515 -3.848 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -0.863 2.264 -2.583 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -3.126 3.547 -0.963 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -1.627 2.931 -0.227 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -2.131 4.615 0.055 1.00 0.00 H new ATOM 2098 N LEU B 61 3.239 5.668 -1.877 1.00 0.00 N ATOM 2099 CA LEU B 61 4.318 6.549 -1.443 1.00 0.00 C ATOM 2100 C LEU B 61 4.770 7.452 -2.580 1.00 0.00 C ATOM 2101 O LEU B 61 5.332 8.521 -2.355 1.00 0.00 O ATOM 2102 CB LEU B 61 5.505 5.744 -0.922 1.00 0.00 C ATOM 2103 CG LEU B 61 5.288 5.062 0.425 1.00 0.00 C ATOM 2104 CD1 LEU B 61 6.505 4.239 0.792 1.00 0.00 C ATOM 2105 CD2 LEU B 61 4.987 6.087 1.505 1.00 0.00 C ATOM 0 H LEU B 61 3.510 4.695 -2.017 1.00 0.00 H new ATOM 0 HA LEU B 61 3.932 7.168 -0.633 1.00 0.00 H new ATOM 0 HB2 LEU B 61 5.759 4.983 -1.660 1.00 0.00 H new ATOM 0 HB3 LEU B 61 6.366 6.408 -0.840 1.00 0.00 H new ATOM 0 HG LEU B 61 4.428 4.397 0.344 1.00 0.00 H new ATOM 0 HD11 LEU B 61 6.341 3.756 1.755 1.00 0.00 H new ATOM 0 HD12 LEU B 61 6.674 3.479 0.029 1.00 0.00 H new ATOM 0 HD13 LEU B 61 7.378 4.889 0.856 1.00 0.00 H new ATOM 0 HD21 LEU B 61 4.836 5.579 2.457 1.00 0.00 H new ATOM 0 HD22 LEU B 61 5.824 6.780 1.593 1.00 0.00 H new ATOM 0 HD23 LEU B 61 4.085 6.639 1.241 1.00 0.00 H new ATOM 2117 N LEU B 62 4.532 7.009 -3.803 1.00 0.00 N ATOM 2118 CA LEU B 62 4.903 7.778 -4.978 1.00 0.00 C ATOM 2119 C LEU B 62 3.931 8.926 -5.198 1.00 0.00 C ATOM 2120 O LEU B 62 4.313 9.996 -5.668 1.00 0.00 O ATOM 2121 CB LEU B 62 4.946 6.869 -6.206 1.00 0.00 C ATOM 2122 CG LEU B 62 5.410 7.532 -7.504 1.00 0.00 C ATOM 2123 CD1 LEU B 62 6.802 8.117 -7.343 1.00 0.00 C ATOM 2124 CD2 LEU B 62 5.384 6.527 -8.643 1.00 0.00 C ATOM 0 H LEU B 62 4.082 6.117 -4.008 1.00 0.00 H new ATOM 0 HA LEU B 62 5.895 8.200 -4.819 1.00 0.00 H new ATOM 0 HB2 LEU B 62 5.607 6.030 -5.991 1.00 0.00 H new ATOM 0 HB3 LEU B 62 3.950 6.457 -6.366 1.00 0.00 H new ATOM 0 HG LEU B 62 4.725 8.347 -7.739 1.00 0.00 H new ATOM 0 HD11 LEU B 62 7.111 8.583 -8.279 1.00 0.00 H new ATOM 0 HD12 LEU B 62 6.793 8.865 -6.550 1.00 0.00 H new ATOM 0 HD13 LEU B 62 7.503 7.323 -7.084 1.00 0.00 H new ATOM 0 HD21 LEU B 62 5.716 7.010 -9.562 1.00 0.00 H new ATOM 0 HD22 LEU B 62 6.049 5.695 -8.410 1.00 0.00 H new ATOM 0 HD23 LEU B 62 4.369 6.154 -8.776 1.00 0.00 H new ATOM 2136 N ASP B 63 2.675 8.704 -4.851 1.00 0.00 N ATOM 2137 CA ASP B 63 1.650 9.717 -5.064 1.00 0.00 C ATOM 2138 C ASP B 63 1.263 10.422 -3.768 1.00 0.00 C ATOM 2139 O ASP B 63 1.140 11.647 -3.719 1.00 0.00 O ATOM 2140 CB ASP B 63 0.409 9.088 -5.688 1.00 0.00 C ATOM 2141 CG ASP B 63 -0.618 10.128 -6.063 1.00 0.00 C ATOM 2142 OD1 ASP B 63 -0.349 10.914 -6.997 1.00 0.00 O ATOM 2143 OD2 ASP B 63 -1.692 10.168 -5.438 1.00 0.00 O ATOM 0 H ASP B 63 2.340 7.840 -4.424 1.00 0.00 H new ATOM 0 HA ASP B 63 2.070 10.462 -5.740 1.00 0.00 H new ATOM 0 HB2 ASP B 63 0.695 8.523 -6.575 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -0.031 8.379 -4.987 1.00 0.00 H new ATOM 2148 N TYR B 64 1.087 9.643 -2.720 1.00 0.00 N ATOM 2149 CA TYR B 64 0.593 10.150 -1.449 1.00 0.00 C ATOM 2150 C TYR B 64 1.740 10.416 -0.485 1.00 0.00 C ATOM 2151 O TYR B 64 1.634 10.129 0.703 1.00 0.00 O ATOM 2152 CB TYR B 64 -0.361 9.137 -0.817 1.00 0.00 C ATOM 2153 CG TYR B 64 -1.587 8.836 -1.639 1.00 0.00 C ATOM 2154 CD1 TYR B 64 -2.780 9.503 -1.412 1.00 0.00 C ATOM 2155 CD2 TYR B 64 -1.550 7.878 -2.637 1.00 0.00 C ATOM 2156 CE1 TYR B 64 -3.904 9.223 -2.158 1.00 0.00 C ATOM 2157 CE2 TYR B 64 -2.664 7.591 -3.389 1.00 0.00 C ATOM 2158 CZ TYR B 64 -3.841 8.265 -3.147 1.00 0.00 C ATOM 2159 OH TYR B 64 -4.957 7.977 -3.892 1.00 0.00 O ATOM 0 H TYR B 64 1.281 8.642 -2.722 1.00 0.00 H new ATOM 0 HA TYR B 64 0.068 11.086 -1.643 1.00 0.00 H new ATOM 0 HB2 TYR B 64 0.180 8.207 -0.642 1.00 0.00 H new ATOM 0 HB3 TYR B 64 -0.675 9.512 0.157 1.00 0.00 H new ATOM 0 HD1 TYR B 64 -2.830 10.254 -0.638 1.00 0.00 H new ATOM 0 HD2 TYR B 64 -0.629 7.347 -2.828 1.00 0.00 H new ATOM 0 HE1 TYR B 64 -4.827 9.750 -1.969 1.00 0.00 H new ATOM 0 HE2 TYR B 64 -2.617 6.841 -4.165 1.00 0.00 H new ATOM 0 HH TYR B 64 -5.417 8.810 -4.128 1.00 0.00 H new