USER MOD reduce.3.24.130724 H: found=0, std=0, add=883, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 877 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A -4 SER OG : rot -167:sc= -0.108 USER MOD Set 1.2: A 92 HIS : no HD1:sc= -4.32 K(o=-4.4,f=-7.5!) USER MOD Set 2.1: A 31 LYS NZ :NH3+ 147:sc=-0.00645 (180deg=-0.427) USER MOD Set 2.2: A 32 GLN : amide:sc= -0.892 X(o=-0.9,f=-1.1) USER MOD Set 3.1: A 7 SER OG : rot -86:sc= 0.638 USER MOD Set 3.2: A 11 LYS NZ :NH3+ -169:sc= -0.43 (180deg=-0.436) USER MOD Set 4.1: A -5 GLY N :NH3+ -131:sc= 0.905 (180deg=0) USER MOD Set 4.2: A 52 GLN : amide:sc= 0.659 K(o=1.6,f=-11!) USER MOD Single : A 1 SER OG : rot -49:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 CYS SG : rot -70:sc= -1.55 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -3 HIS : no HD1:sc=-0.00679 X(o=-0.0068,f=-0.052) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN :FLIP amide:sc= 0 F(o=-0.72,f=0) USER MOD Single : A 26 GLN : amide:sc= -1.53 K(o=-1.5,f=-3!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 178:sc= -0.15 (180deg=-0.16) USER MOD Single : A 36 GLN : amide:sc= -2.53 X(o=-2.5,f=-2.1) USER MOD Single : A 47 THR OG1 : rot 96:sc= 0.626 USER MOD Single : A 50 GLN : amide:sc= -1.54 X(o=-1.5,f=-1.9) USER MOD Single : A 54 HIS : no HD1:sc= -0.253 X(o=-0.25,f=-0.049) USER MOD Single : A 55 HIS : no HE2:sc= -1.9 K(o=-1.9,f=-6.2!) USER MOD Single : A 60 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.016) USER MOD Single : A 61 ASN :FLIP amide:sc= -2.69 F(o=-5.9!,f=-2.7) USER MOD Single : A 62 SER OG : rot 36:sc= 0.014 USER MOD Single : A 64 THR OG1 : rot -147:sc= -0.727 USER MOD Single : A 65 LYS NZ :NH3+ -168:sc= 0.213 (180deg=0.175) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot -136:sc= 0.229 USER MOD Single : A 76 TYR OH : rot 180:sc=-0.00817 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl -177:sc= -2.52 (180deg=-2.53) USER MOD Single : A 80 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.27) USER MOD Single : A 82 GLN : amide:sc= -1.08 K(o=-1.1,f=-3.5!) USER MOD Single : A 83 CYS SG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -5 -4.995 7.909 -3.656 1.00 0.00 N ATOM 2 CA GLY A -5 -4.795 6.636 -2.987 1.00 0.00 C ATOM 3 C GLY A -5 -3.328 6.310 -2.789 1.00 0.00 C ATOM 4 O GLY A -5 -2.529 6.423 -3.719 1.00 0.00 O ATOM 0 H1 GLY A -5 -5.692 8.473 -3.129 1.00 0.00 H new ATOM 0 H2 GLY A -5 -4.093 8.425 -3.698 1.00 0.00 H new ATOM 0 H3 GLY A -5 -5.344 7.743 -4.622 1.00 0.00 H new ATOM 0 HA2 GLY A -5 -5.294 6.656 -2.018 1.00 0.00 H new ATOM 0 HA3 GLY A -5 -5.264 5.844 -3.571 1.00 0.00 H new ATOM 8 N SER A -4 -2.972 5.905 -1.574 1.00 0.00 N ATOM 9 CA SER A -4 -1.590 5.567 -1.255 1.00 0.00 C ATOM 10 C SER A -4 -1.032 4.561 -2.258 1.00 0.00 C ATOM 11 O SER A -4 -0.230 4.910 -3.124 1.00 0.00 O ATOM 12 CB SER A -4 -1.495 4.998 0.162 1.00 0.00 C ATOM 13 OG SER A -4 -2.514 4.041 0.396 1.00 0.00 O ATOM 0 H SER A -4 -3.622 5.803 -0.794 1.00 0.00 H new ATOM 0 HA SER A -4 -0.996 6.479 -1.312 1.00 0.00 H new ATOM 0 HB2 SER A -4 -0.518 4.537 0.307 1.00 0.00 H new ATOM 0 HB3 SER A -4 -1.577 5.807 0.888 1.00 0.00 H new ATOM 0 HG SER A -4 -2.566 3.847 1.355 1.00 0.00 H new ATOM 19 N HIS A -3 -1.462 3.310 -2.132 1.00 0.00 N ATOM 20 CA HIS A -3 -1.007 2.251 -3.027 1.00 0.00 C ATOM 21 C HIS A -3 -2.000 2.038 -4.165 1.00 0.00 C ATOM 22 O HIS A -3 -2.317 0.903 -4.519 1.00 0.00 O ATOM 23 CB HIS A -3 -0.812 0.948 -2.252 1.00 0.00 C ATOM 24 CG HIS A -3 0.300 1.006 -1.250 1.00 0.00 C ATOM 25 ND1 HIS A -3 1.526 1.575 -1.520 1.00 0.00 N ATOM 26 CD2 HIS A -3 0.364 0.564 0.027 1.00 0.00 C ATOM 27 CE1 HIS A -3 2.298 1.479 -0.452 1.00 0.00 C ATOM 28 NE2 HIS A -3 1.617 0.870 0.501 1.00 0.00 N ATOM 0 H HIS A -3 -2.125 3.004 -1.419 1.00 0.00 H new ATOM 0 HA HIS A -3 -0.052 2.556 -3.455 1.00 0.00 H new ATOM 0 HB2 HIS A -3 -1.740 0.699 -1.738 1.00 0.00 H new ATOM 0 HB3 HIS A -3 -0.612 0.142 -2.958 1.00 0.00 H new ATOM 0 HD2 HIS A -3 -0.423 0.064 0.572 1.00 0.00 H new ATOM 0 HE1 HIS A -3 3.314 1.838 -0.372 1.00 0.00 H new ATOM 0 HE2 HIS A -3 1.964 0.661 1.437 1.00 0.00 H new ATOM 36 N MET A -2 -2.487 3.136 -4.733 1.00 0.00 N ATOM 37 CA MET A -2 -3.444 3.067 -5.831 1.00 0.00 C ATOM 38 C MET A -2 -3.326 4.292 -6.733 1.00 0.00 C ATOM 39 O MET A -2 -4.004 5.297 -6.522 1.00 0.00 O ATOM 40 CB MET A -2 -4.870 2.956 -5.288 1.00 0.00 C ATOM 41 CG MET A -2 -5.166 1.619 -4.628 1.00 0.00 C ATOM 42 SD MET A -2 -5.124 0.244 -5.795 1.00 0.00 S ATOM 43 CE MET A -2 -6.183 -0.937 -4.965 1.00 0.00 C ATOM 0 H MET A -2 -2.235 4.083 -4.451 1.00 0.00 H new ATOM 0 HA MET A -2 -3.217 2.179 -6.421 1.00 0.00 H new ATOM 0 HB2 MET A -2 -5.038 3.754 -4.565 1.00 0.00 H new ATOM 0 HB3 MET A -2 -5.574 3.113 -6.105 1.00 0.00 H new ATOM 0 HG2 MET A -2 -4.439 1.440 -3.836 1.00 0.00 H new ATOM 0 HG3 MET A -2 -6.148 1.660 -4.156 1.00 0.00 H new ATOM 0 HE1 MET A -2 -6.257 -1.844 -5.565 1.00 0.00 H new ATOM 0 HE2 MET A -2 -5.762 -1.180 -3.989 1.00 0.00 H new ATOM 0 HE3 MET A -2 -7.176 -0.507 -4.835 1.00 0.00 H new ATOM 53 N ALA A -1 -2.460 4.201 -7.737 1.00 0.00 N ATOM 54 CA ALA A -1 -2.255 5.301 -8.671 1.00 0.00 C ATOM 55 C ALA A -1 -3.239 5.225 -9.833 1.00 0.00 C ATOM 56 O ALA A -1 -3.030 5.844 -10.877 1.00 0.00 O ATOM 57 CB ALA A -1 -0.824 5.294 -9.187 1.00 0.00 C ATOM 0 H ALA A -1 -1.889 3.377 -7.924 1.00 0.00 H new ATOM 0 HA ALA A -1 -2.434 6.235 -8.139 1.00 0.00 H new ATOM 0 HB1 ALA A -1 -0.684 6.121 -9.884 1.00 0.00 H new ATOM 0 HB2 ALA A -1 -0.135 5.405 -8.350 1.00 0.00 H new ATOM 0 HB3 ALA A -1 -0.626 4.352 -9.698 1.00 0.00 H new ATOM 63 N SER A 1 -4.311 4.463 -9.646 1.00 0.00 N ATOM 64 CA SER A 1 -5.326 4.303 -10.681 1.00 0.00 C ATOM 65 C SER A 1 -4.849 3.342 -11.766 1.00 0.00 C ATOM 66 O SER A 1 -5.607 2.976 -12.663 1.00 0.00 O ATOM 67 CB SER A 1 -5.671 5.659 -11.300 1.00 0.00 C ATOM 68 OG SER A 1 -7.062 5.769 -11.545 1.00 0.00 O ATOM 0 H SER A 1 -4.500 3.946 -8.787 1.00 0.00 H new ATOM 0 HA SER A 1 -6.220 3.885 -10.218 1.00 0.00 H new ATOM 0 HB2 SER A 1 -5.352 6.459 -10.632 1.00 0.00 H new ATOM 0 HB3 SER A 1 -5.123 5.786 -12.234 1.00 0.00 H new ATOM 0 HG SER A 1 -7.374 4.972 -12.023 1.00 0.00 H new ATOM 74 N ALA A 2 -3.586 2.938 -11.676 1.00 0.00 N ATOM 75 CA ALA A 2 -3.006 2.019 -12.647 1.00 0.00 C ATOM 76 C ALA A 2 -3.538 0.604 -12.448 1.00 0.00 C ATOM 77 O ALA A 2 -3.715 -0.144 -13.410 1.00 0.00 O ATOM 78 CB ALA A 2 -1.488 2.034 -12.548 1.00 0.00 C ATOM 0 H ALA A 2 -2.945 3.233 -10.940 1.00 0.00 H new ATOM 0 HA ALA A 2 -3.296 2.352 -13.644 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -1.069 1.343 -13.279 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.120 3.040 -12.748 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.186 1.729 -11.546 1.00 0.00 H new ATOM 84 N ASP A 3 -3.789 0.242 -11.195 1.00 0.00 N ATOM 85 CA ASP A 3 -4.301 -1.084 -10.870 1.00 0.00 C ATOM 86 C ASP A 3 -5.805 -1.161 -11.113 1.00 0.00 C ATOM 87 O ASP A 3 -6.319 -2.184 -11.568 1.00 0.00 O ATOM 88 CB ASP A 3 -3.989 -1.432 -9.413 1.00 0.00 C ATOM 89 CG ASP A 3 -4.137 -2.913 -9.127 1.00 0.00 C ATOM 90 OD1 ASP A 3 -4.660 -3.637 -10.000 1.00 0.00 O ATOM 91 OD2 ASP A 3 -3.731 -3.348 -8.030 1.00 0.00 O ATOM 0 H ASP A 3 -3.646 0.848 -10.387 1.00 0.00 H new ATOM 0 HA ASP A 3 -3.808 -1.806 -11.522 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -2.972 -1.119 -9.178 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -4.655 -0.870 -8.758 1.00 0.00 H new ATOM 96 N LEU A 4 -6.505 -0.075 -10.807 1.00 0.00 N ATOM 97 CA LEU A 4 -7.951 -0.019 -10.991 1.00 0.00 C ATOM 98 C LEU A 4 -8.311 -0.010 -12.473 1.00 0.00 C ATOM 99 O LEU A 4 -9.254 -0.678 -12.898 1.00 0.00 O ATOM 100 CB LEU A 4 -8.525 1.223 -10.307 1.00 0.00 C ATOM 101 CG LEU A 4 -10.050 1.325 -10.271 1.00 0.00 C ATOM 102 CD1 LEU A 4 -10.573 1.009 -8.878 1.00 0.00 C ATOM 103 CD2 LEU A 4 -10.502 2.710 -10.711 1.00 0.00 C ATOM 0 H LEU A 4 -6.095 0.779 -10.430 1.00 0.00 H new ATOM 0 HA LEU A 4 -8.385 -0.909 -10.536 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -8.155 1.253 -9.282 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.134 2.105 -10.813 1.00 0.00 H new ATOM 0 HG LEU A 4 -10.461 0.593 -10.966 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -11.660 1.087 -8.871 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -10.280 -0.003 -8.600 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -10.154 1.717 -8.163 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -11.590 2.765 -10.679 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -10.081 3.460 -10.041 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -10.159 2.899 -11.728 1.00 0.00 H new ATOM 115 N VAL A 5 -7.552 0.751 -13.256 1.00 0.00 N ATOM 116 CA VAL A 5 -7.789 0.844 -14.692 1.00 0.00 C ATOM 117 C VAL A 5 -7.370 -0.437 -15.403 1.00 0.00 C ATOM 118 O VAL A 5 -8.139 -1.011 -16.175 1.00 0.00 O ATOM 119 CB VAL A 5 -7.028 2.033 -15.310 1.00 0.00 C ATOM 120 CG1 VAL A 5 -7.136 2.005 -16.827 1.00 0.00 C ATOM 121 CG2 VAL A 5 -7.554 3.348 -14.754 1.00 0.00 C ATOM 0 H VAL A 5 -6.769 1.311 -12.920 1.00 0.00 H new ATOM 0 HA VAL A 5 -8.860 0.997 -14.827 1.00 0.00 H new ATOM 0 HB VAL A 5 -5.975 1.947 -15.043 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -6.593 2.852 -17.246 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.708 1.076 -17.205 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -8.185 2.067 -17.118 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -7.006 4.177 -15.201 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -8.614 3.445 -14.990 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -7.420 3.365 -13.672 1.00 0.00 H new ATOM 131 N SER A 6 -6.146 -0.883 -15.137 1.00 0.00 N ATOM 132 CA SER A 6 -5.623 -2.096 -15.754 1.00 0.00 C ATOM 133 C SER A 6 -6.496 -3.300 -15.411 1.00 0.00 C ATOM 134 O SER A 6 -6.744 -4.161 -16.254 1.00 0.00 O ATOM 135 CB SER A 6 -4.186 -2.347 -15.295 1.00 0.00 C ATOM 136 OG SER A 6 -3.664 -3.530 -15.877 1.00 0.00 O ATOM 0 H SER A 6 -5.498 -0.422 -14.498 1.00 0.00 H new ATOM 0 HA SER A 6 -5.633 -1.958 -16.835 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.560 -1.497 -15.567 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.157 -2.429 -14.208 1.00 0.00 H new ATOM 0 HG SER A 6 -2.744 -3.668 -15.569 1.00 0.00 H new ATOM 142 N SER A 7 -6.960 -3.351 -14.166 1.00 0.00 N ATOM 143 CA SER A 7 -7.802 -4.450 -13.709 1.00 0.00 C ATOM 144 C SER A 7 -9.197 -4.356 -14.321 1.00 0.00 C ATOM 145 O SER A 7 -9.700 -5.321 -14.897 1.00 0.00 O ATOM 146 CB SER A 7 -7.901 -4.444 -12.182 1.00 0.00 C ATOM 147 OG SER A 7 -8.646 -3.330 -11.724 1.00 0.00 O ATOM 0 H SER A 7 -6.767 -2.644 -13.456 1.00 0.00 H new ATOM 0 HA SER A 7 -7.344 -5.385 -14.032 1.00 0.00 H new ATOM 0 HB2 SER A 7 -8.373 -5.366 -11.841 1.00 0.00 H new ATOM 0 HB3 SER A 7 -6.901 -4.419 -11.750 1.00 0.00 H new ATOM 0 HG SER A 7 -8.054 -2.554 -11.637 1.00 0.00 H new ATOM 153 N CYS A 8 -9.816 -3.188 -14.190 1.00 0.00 N ATOM 154 CA CYS A 8 -11.153 -2.967 -14.728 1.00 0.00 C ATOM 155 C CYS A 8 -11.178 -3.199 -16.235 1.00 0.00 C ATOM 156 O CYS A 8 -12.123 -3.780 -16.770 1.00 0.00 O ATOM 157 CB CYS A 8 -11.625 -1.547 -14.411 1.00 0.00 C ATOM 158 SG CYS A 8 -12.252 -1.337 -12.728 1.00 0.00 S ATOM 0 H CYS A 8 -9.413 -2.380 -13.716 1.00 0.00 H new ATOM 0 HA CYS A 8 -11.829 -3.681 -14.257 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -10.796 -0.857 -14.567 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -12.408 -1.270 -15.116 1.00 0.00 H new ATOM 0 HG CYS A 8 -13.386 -1.961 -12.606 1.00 0.00 H new ATOM 164 N LYS A 9 -10.133 -2.741 -16.917 1.00 0.00 N ATOM 165 CA LYS A 9 -10.033 -2.897 -18.363 1.00 0.00 C ATOM 166 C LYS A 9 -9.904 -4.369 -18.743 1.00 0.00 C ATOM 167 O LYS A 9 -10.685 -4.884 -19.543 1.00 0.00 O ATOM 168 CB LYS A 9 -8.834 -2.113 -18.900 1.00 0.00 C ATOM 169 CG LYS A 9 -8.477 -2.456 -20.336 1.00 0.00 C ATOM 170 CD LYS A 9 -7.163 -3.215 -20.418 1.00 0.00 C ATOM 171 CE LYS A 9 -6.073 -2.373 -21.062 1.00 0.00 C ATOM 172 NZ LYS A 9 -6.133 -2.432 -22.549 1.00 0.00 N ATOM 0 H LYS A 9 -9.342 -2.258 -16.490 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.946 -2.503 -18.810 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -9.048 -1.046 -18.833 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.970 -2.305 -18.264 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -9.273 -3.056 -20.776 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.407 -1.540 -20.923 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.851 -3.513 -19.417 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.305 -4.130 -20.993 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -6.173 -1.338 -20.735 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.097 -2.721 -20.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.374 -1.845 -22.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.012 -3.416 -22.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -7.055 -2.076 -22.874 1.00 0.00 H new ATOM 186 N ASP A 10 -8.914 -5.039 -18.164 1.00 0.00 N ATOM 187 CA ASP A 10 -8.684 -6.453 -18.440 1.00 0.00 C ATOM 188 C ASP A 10 -9.966 -7.259 -18.255 1.00 0.00 C ATOM 189 O ASP A 10 -10.322 -8.082 -19.098 1.00 0.00 O ATOM 190 CB ASP A 10 -7.585 -7.000 -17.528 1.00 0.00 C ATOM 191 CG ASP A 10 -7.408 -8.499 -17.670 1.00 0.00 C ATOM 192 OD1 ASP A 10 -6.769 -8.931 -18.652 1.00 0.00 O ATOM 193 OD2 ASP A 10 -7.909 -9.241 -16.799 1.00 0.00 O ATOM 0 H ASP A 10 -8.258 -4.626 -17.501 1.00 0.00 H new ATOM 0 HA ASP A 10 -8.364 -6.548 -19.478 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -6.643 -6.502 -17.760 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -7.825 -6.762 -16.492 1.00 0.00 H new ATOM 198 N LYS A 11 -10.655 -7.016 -17.145 1.00 0.00 N ATOM 199 CA LYS A 11 -11.898 -7.718 -16.847 1.00 0.00 C ATOM 200 C LYS A 11 -13.004 -7.298 -17.810 1.00 0.00 C ATOM 201 O LYS A 11 -13.609 -8.136 -18.481 1.00 0.00 O ATOM 202 CB LYS A 11 -12.330 -7.444 -15.405 1.00 0.00 C ATOM 203 CG LYS A 11 -11.265 -7.782 -14.376 1.00 0.00 C ATOM 204 CD LYS A 11 -11.470 -7.006 -13.086 1.00 0.00 C ATOM 205 CE LYS A 11 -10.294 -7.183 -12.137 1.00 0.00 C ATOM 206 NZ LYS A 11 -10.454 -6.370 -10.900 1.00 0.00 N ATOM 0 H LYS A 11 -10.374 -6.338 -16.437 1.00 0.00 H new ATOM 0 HA LYS A 11 -11.721 -8.787 -16.969 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -12.596 -6.391 -15.308 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -13.229 -8.021 -15.188 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -11.287 -8.851 -14.166 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -10.279 -7.558 -14.784 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -11.600 -5.948 -13.313 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -12.386 -7.342 -12.599 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -10.198 -8.235 -11.870 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -9.372 -6.897 -12.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -9.561 -6.368 -10.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -10.706 -5.394 -11.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -11.207 -6.779 -10.311 1.00 0.00 H new ATOM 220 N LEU A 12 -13.264 -5.997 -17.873 1.00 0.00 N ATOM 221 CA LEU A 12 -14.297 -5.465 -18.755 1.00 0.00 C ATOM 222 C LEU A 12 -14.123 -5.990 -20.176 1.00 0.00 C ATOM 223 O LEU A 12 -15.096 -6.344 -20.842 1.00 0.00 O ATOM 224 CB LEU A 12 -14.257 -3.936 -18.755 1.00 0.00 C ATOM 225 CG LEU A 12 -15.461 -3.233 -19.384 1.00 0.00 C ATOM 226 CD1 LEU A 12 -16.272 -2.509 -18.321 1.00 0.00 C ATOM 227 CD2 LEU A 12 -15.007 -2.262 -20.464 1.00 0.00 C ATOM 0 H LEU A 12 -12.774 -5.291 -17.324 1.00 0.00 H new ATOM 0 HA LEU A 12 -15.266 -5.797 -18.381 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -14.160 -3.595 -17.724 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -13.358 -3.616 -19.282 1.00 0.00 H new ATOM 0 HG LEU A 12 -16.098 -3.988 -19.846 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -17.124 -2.015 -18.787 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -16.628 -3.228 -17.583 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -15.645 -1.765 -17.829 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -15.877 -1.771 -20.901 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -14.349 -1.512 -20.026 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -14.470 -2.807 -21.241 1.00 0.00 H new ATOM 239 N ALA A 13 -12.876 -6.039 -20.635 1.00 0.00 N ATOM 240 CA ALA A 13 -12.574 -6.525 -21.975 1.00 0.00 C ATOM 241 C ALA A 13 -12.845 -8.021 -22.091 1.00 0.00 C ATOM 242 O ALA A 13 -13.392 -8.487 -23.091 1.00 0.00 O ATOM 243 CB ALA A 13 -11.127 -6.220 -22.334 1.00 0.00 C ATOM 0 H ALA A 13 -12.059 -5.748 -20.098 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.228 -6.008 -22.677 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.916 -6.589 -23.338 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -10.963 -5.143 -22.301 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.464 -6.710 -21.621 1.00 0.00 H new ATOM 249 N TYR A 14 -12.459 -8.769 -21.064 1.00 0.00 N ATOM 250 CA TYR A 14 -12.658 -10.213 -21.052 1.00 0.00 C ATOM 251 C TYR A 14 -14.115 -10.560 -20.764 1.00 0.00 C ATOM 252 O TYR A 14 -14.535 -11.708 -20.919 1.00 0.00 O ATOM 253 CB TYR A 14 -11.750 -10.865 -20.007 1.00 0.00 C ATOM 254 CG TYR A 14 -11.819 -12.376 -20.004 1.00 0.00 C ATOM 255 CD1 TYR A 14 -11.574 -13.105 -21.161 1.00 0.00 C ATOM 256 CD2 TYR A 14 -12.129 -13.074 -18.843 1.00 0.00 C ATOM 257 CE1 TYR A 14 -11.637 -14.485 -21.162 1.00 0.00 C ATOM 258 CE2 TYR A 14 -12.192 -14.454 -18.835 1.00 0.00 C ATOM 259 CZ TYR A 14 -11.946 -15.155 -19.997 1.00 0.00 C ATOM 260 OH TYR A 14 -12.008 -16.530 -19.994 1.00 0.00 O ATOM 0 H TYR A 14 -12.006 -8.399 -20.228 1.00 0.00 H new ATOM 0 HA TYR A 14 -12.400 -10.598 -22.039 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -10.720 -10.557 -20.189 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -12.023 -10.495 -19.019 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -11.330 -12.584 -22.075 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -12.324 -12.528 -17.932 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -11.445 -15.036 -22.071 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -12.433 -14.981 -17.924 1.00 0.00 H new ATOM 0 HH TYR A 14 -12.236 -16.845 -19.095 1.00 0.00 H new ATOM 270 N PHE A 15 -14.883 -9.560 -20.345 1.00 0.00 N ATOM 271 CA PHE A 15 -16.294 -9.758 -20.035 1.00 0.00 C ATOM 272 C PHE A 15 -17.173 -9.331 -21.206 1.00 0.00 C ATOM 273 O PHE A 15 -16.955 -8.280 -21.810 1.00 0.00 O ATOM 274 CB PHE A 15 -16.678 -8.969 -18.781 1.00 0.00 C ATOM 275 CG PHE A 15 -16.328 -9.673 -17.500 1.00 0.00 C ATOM 276 CD1 PHE A 15 -16.719 -10.984 -17.286 1.00 0.00 C ATOM 277 CD2 PHE A 15 -15.608 -9.022 -16.511 1.00 0.00 C ATOM 278 CE1 PHE A 15 -16.399 -11.634 -16.109 1.00 0.00 C ATOM 279 CE2 PHE A 15 -15.285 -9.667 -15.333 1.00 0.00 C ATOM 280 CZ PHE A 15 -15.682 -10.974 -15.131 1.00 0.00 C ATOM 0 H PHE A 15 -14.552 -8.604 -20.212 1.00 0.00 H new ATOM 0 HA PHE A 15 -16.454 -10.820 -19.851 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -16.178 -8.001 -18.803 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -17.750 -8.774 -18.798 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -17.281 -11.505 -18.048 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -15.296 -7.999 -16.663 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -16.709 -12.657 -15.955 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -14.722 -9.149 -14.570 1.00 0.00 H new ATOM 0 HZ PHE A 15 -15.432 -11.479 -14.210 1.00 0.00 H new ATOM 290 N ARG A 16 -18.168 -10.153 -21.522 1.00 0.00 N ATOM 291 CA ARG A 16 -19.080 -9.863 -22.622 1.00 0.00 C ATOM 292 C ARG A 16 -19.747 -8.503 -22.431 1.00 0.00 C ATOM 293 O ARG A 16 -19.480 -7.802 -21.454 1.00 0.00 O ATOM 294 CB ARG A 16 -20.145 -10.955 -22.732 1.00 0.00 C ATOM 295 CG ARG A 16 -19.584 -12.364 -22.643 1.00 0.00 C ATOM 296 CD ARG A 16 -20.313 -13.314 -23.581 1.00 0.00 C ATOM 297 NE ARG A 16 -21.298 -14.130 -22.876 1.00 0.00 N ATOM 298 CZ ARG A 16 -22.001 -15.097 -23.456 1.00 0.00 C ATOM 299 NH1 ARG A 16 -21.829 -15.366 -24.742 1.00 0.00 N ATOM 300 NH2 ARG A 16 -22.879 -15.796 -22.747 1.00 0.00 N ATOM 0 H ARG A 16 -18.363 -11.026 -21.032 1.00 0.00 H new ATOM 0 HA ARG A 16 -18.500 -9.838 -23.545 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -20.880 -10.815 -21.939 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -20.672 -10.842 -23.679 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -18.522 -12.350 -22.890 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -19.668 -12.726 -21.618 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -20.810 -12.741 -24.363 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -19.589 -13.964 -24.073 1.00 0.00 H new ATOM 0 HE ARG A 16 -21.455 -13.948 -21.885 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -21.155 -14.830 -25.289 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -22.370 -16.109 -25.184 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -23.014 -15.591 -21.757 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -23.419 -16.538 -23.192 1.00 0.00 H new ATOM 314 N ILE A 17 -20.614 -8.138 -23.370 1.00 0.00 N ATOM 315 CA ILE A 17 -21.318 -6.864 -23.304 1.00 0.00 C ATOM 316 C ILE A 17 -22.031 -6.699 -21.966 1.00 0.00 C ATOM 317 O ILE A 17 -22.300 -5.580 -21.527 1.00 0.00 O ATOM 318 CB ILE A 17 -22.349 -6.731 -24.441 1.00 0.00 C ATOM 319 CG1 ILE A 17 -21.711 -7.101 -25.782 1.00 0.00 C ATOM 320 CG2 ILE A 17 -22.908 -5.317 -24.486 1.00 0.00 C ATOM 321 CD1 ILE A 17 -22.340 -6.398 -26.964 1.00 0.00 C ATOM 0 H ILE A 17 -20.845 -8.706 -24.185 1.00 0.00 H new ATOM 0 HA ILE A 17 -20.566 -6.082 -23.412 1.00 0.00 H new ATOM 0 HB ILE A 17 -23.172 -7.420 -24.249 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -20.649 -6.859 -25.749 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -21.788 -8.179 -25.927 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -23.635 -5.239 -25.294 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -23.394 -5.087 -23.538 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -22.096 -4.610 -24.658 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -21.838 -6.708 -27.881 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -23.397 -6.659 -27.023 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -22.239 -5.320 -26.842 1.00 0.00 H new ATOM 333 N LYS A 18 -22.332 -7.820 -21.319 1.00 0.00 N ATOM 334 CA LYS A 18 -23.011 -7.801 -20.029 1.00 0.00 C ATOM 335 C LYS A 18 -22.367 -6.785 -19.091 1.00 0.00 C ATOM 336 O LYS A 18 -23.054 -5.957 -18.494 1.00 0.00 O ATOM 337 CB LYS A 18 -22.978 -9.192 -19.392 1.00 0.00 C ATOM 338 CG LYS A 18 -24.353 -9.739 -19.053 1.00 0.00 C ATOM 339 CD LYS A 18 -24.989 -8.976 -17.903 1.00 0.00 C ATOM 340 CE LYS A 18 -26.390 -8.500 -18.256 1.00 0.00 C ATOM 341 NZ LYS A 18 -26.703 -7.186 -17.630 1.00 0.00 N ATOM 0 H LYS A 18 -22.116 -8.754 -21.668 1.00 0.00 H new ATOM 0 HA LYS A 18 -24.048 -7.509 -20.196 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -22.479 -9.882 -20.073 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -22.378 -9.152 -18.483 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -24.996 -9.678 -19.931 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -24.271 -10.794 -18.790 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -25.032 -9.615 -17.021 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -24.367 -8.119 -17.645 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -26.484 -8.418 -19.339 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -27.119 -9.241 -17.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -27.666 -6.896 -17.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -26.639 -7.270 -16.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -26.023 -6.472 -17.962 1.00 0.00 H new ATOM 355 N GLU A 19 -21.045 -6.854 -18.968 1.00 0.00 N ATOM 356 CA GLU A 19 -20.311 -5.939 -18.102 1.00 0.00 C ATOM 357 C GLU A 19 -20.595 -4.488 -18.478 1.00 0.00 C ATOM 358 O GLU A 19 -21.043 -3.695 -17.648 1.00 0.00 O ATOM 359 CB GLU A 19 -18.808 -6.215 -18.190 1.00 0.00 C ATOM 360 CG GLU A 19 -18.186 -6.625 -16.866 1.00 0.00 C ATOM 361 CD GLU A 19 -19.000 -7.680 -16.141 1.00 0.00 C ATOM 362 OE1 GLU A 19 -18.928 -8.862 -16.538 1.00 0.00 O ATOM 363 OE2 GLU A 19 -19.709 -7.323 -15.177 1.00 0.00 O ATOM 0 H GLU A 19 -20.461 -7.533 -19.456 1.00 0.00 H new ATOM 0 HA GLU A 19 -20.645 -6.102 -17.077 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -18.634 -7.003 -18.923 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -18.304 -5.321 -18.557 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.180 -7.006 -17.044 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -18.086 -5.747 -16.228 1.00 0.00 H new ATOM 370 N LEU A 20 -20.332 -4.146 -19.735 1.00 0.00 N ATOM 371 CA LEU A 20 -20.560 -2.790 -20.223 1.00 0.00 C ATOM 372 C LEU A 20 -22.017 -2.381 -20.036 1.00 0.00 C ATOM 373 O LEU A 20 -22.318 -1.214 -19.784 1.00 0.00 O ATOM 374 CB LEU A 20 -20.175 -2.687 -21.700 1.00 0.00 C ATOM 375 CG LEU A 20 -18.682 -2.539 -21.996 1.00 0.00 C ATOM 376 CD1 LEU A 20 -18.102 -1.357 -21.236 1.00 0.00 C ATOM 377 CD2 LEU A 20 -17.939 -3.819 -21.641 1.00 0.00 C ATOM 0 H LEU A 20 -19.961 -4.789 -20.434 1.00 0.00 H new ATOM 0 HA LEU A 20 -19.935 -2.112 -19.642 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -20.540 -3.577 -22.213 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -20.697 -1.833 -22.132 1.00 0.00 H new ATOM 0 HG LEU A 20 -18.559 -2.354 -23.063 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -17.039 -1.267 -21.459 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -18.614 -0.444 -21.538 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -18.236 -1.511 -20.165 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -16.878 -3.696 -21.858 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -18.070 -4.033 -20.580 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -18.336 -4.646 -22.230 1.00 0.00 H new ATOM 389 N LYS A 21 -22.918 -3.350 -20.158 1.00 0.00 N ATOM 390 CA LYS A 21 -24.345 -3.092 -19.999 1.00 0.00 C ATOM 391 C LYS A 21 -24.650 -2.567 -18.600 1.00 0.00 C ATOM 392 O LYS A 21 -25.357 -1.572 -18.441 1.00 0.00 O ATOM 393 CB LYS A 21 -25.146 -4.369 -20.262 1.00 0.00 C ATOM 394 CG LYS A 21 -26.200 -4.214 -21.345 1.00 0.00 C ATOM 395 CD LYS A 21 -27.409 -3.445 -20.841 1.00 0.00 C ATOM 396 CE LYS A 21 -28.149 -2.761 -21.980 1.00 0.00 C ATOM 397 NZ LYS A 21 -29.032 -3.708 -22.716 1.00 0.00 N ATOM 0 H LYS A 21 -22.686 -4.321 -20.366 1.00 0.00 H new ATOM 0 HA LYS A 21 -24.635 -2.332 -20.724 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -24.459 -5.166 -20.546 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -25.631 -4.681 -19.337 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -25.769 -3.695 -22.202 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.513 -5.198 -21.693 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -28.085 -4.126 -20.324 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -27.090 -2.699 -20.113 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -28.747 -1.940 -21.584 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -27.428 -2.325 -22.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -29.518 -3.203 -23.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -28.458 -4.478 -23.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -29.737 -4.105 -22.062 1.00 0.00 H new ATOM 411 N ASP A 22 -24.113 -3.241 -17.589 1.00 0.00 N ATOM 412 CA ASP A 22 -24.326 -2.840 -16.203 1.00 0.00 C ATOM 413 C ASP A 22 -23.742 -1.455 -15.942 1.00 0.00 C ATOM 414 O ASP A 22 -24.351 -0.634 -15.257 1.00 0.00 O ATOM 415 CB ASP A 22 -23.697 -3.860 -15.253 1.00 0.00 C ATOM 416 CG ASP A 22 -24.717 -4.826 -14.682 1.00 0.00 C ATOM 417 OD1 ASP A 22 -25.814 -4.371 -14.297 1.00 0.00 O ATOM 418 OD2 ASP A 22 -24.418 -6.037 -14.622 1.00 0.00 O ATOM 0 H ASP A 22 -23.527 -4.068 -17.703 1.00 0.00 H new ATOM 0 HA ASP A 22 -25.400 -2.801 -16.022 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -22.928 -4.421 -15.784 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -23.202 -3.334 -14.436 1.00 0.00 H new ATOM 423 N ILE A 23 -22.559 -1.204 -16.492 1.00 0.00 N ATOM 424 CA ILE A 23 -21.893 0.081 -16.318 1.00 0.00 C ATOM 425 C ILE A 23 -22.677 1.201 -16.993 1.00 0.00 C ATOM 426 O ILE A 23 -23.068 2.175 -16.349 1.00 0.00 O ATOM 427 CB ILE A 23 -20.462 0.055 -16.887 1.00 0.00 C ATOM 428 CG1 ILE A 23 -19.650 -1.065 -16.235 1.00 0.00 C ATOM 429 CG2 ILE A 23 -19.784 1.401 -16.676 1.00 0.00 C ATOM 430 CD1 ILE A 23 -19.677 -1.029 -14.723 1.00 0.00 C ATOM 0 H ILE A 23 -22.042 -1.873 -17.062 1.00 0.00 H new ATOM 0 HA ILE A 23 -21.845 0.270 -15.246 1.00 0.00 H new ATOM 0 HB ILE A 23 -20.516 -0.139 -17.958 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -20.035 -2.027 -16.574 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -18.616 -0.998 -16.574 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -18.773 1.367 -17.083 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -20.354 2.179 -17.184 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -19.738 1.622 -15.610 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -19.081 -1.852 -14.329 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -19.265 -0.082 -14.374 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -20.705 -1.127 -14.375 1.00 0.00 H new ATOM 442 N LEU A 24 -22.904 1.056 -18.294 1.00 0.00 N ATOM 443 CA LEU A 24 -23.644 2.056 -19.057 1.00 0.00 C ATOM 444 C LEU A 24 -25.055 2.228 -18.504 1.00 0.00 C ATOM 445 O LEU A 24 -25.662 3.289 -18.646 1.00 0.00 O ATOM 446 CB LEU A 24 -23.707 1.655 -20.532 1.00 0.00 C ATOM 447 CG LEU A 24 -25.108 1.501 -21.126 1.00 0.00 C ATOM 448 CD1 LEU A 24 -25.063 1.633 -22.640 1.00 0.00 C ATOM 449 CD2 LEU A 24 -25.713 0.164 -20.723 1.00 0.00 C ATOM 0 H LEU A 24 -22.587 0.257 -18.842 1.00 0.00 H new ATOM 0 HA LEU A 24 -23.120 3.008 -18.967 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -23.167 2.402 -21.114 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -23.176 0.711 -20.654 1.00 0.00 H new ATOM 0 HG LEU A 24 -25.739 2.297 -20.731 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -26.069 1.521 -23.045 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -24.671 2.614 -22.908 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -24.417 0.859 -23.054 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -26.710 0.071 -21.154 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -25.082 -0.646 -21.089 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -25.781 0.108 -19.637 1.00 0.00 H new ATOM 461 N ASN A 25 -25.570 1.179 -17.873 1.00 0.00 N ATOM 462 CA ASN A 25 -26.910 1.215 -17.297 1.00 0.00 C ATOM 463 C ASN A 25 -26.950 2.120 -16.069 1.00 0.00 C ATOM 464 O ASN A 25 -27.837 2.962 -15.936 1.00 0.00 O ATOM 465 CB ASN A 25 -27.363 -0.197 -16.919 1.00 0.00 C ATOM 466 CG ASN A 25 -28.307 -0.202 -15.732 1.00 0.00 C ATOM 467 OD1 ASN A 25 -27.774 -0.502 -14.553 1.00 0.00 O flip ATOM 468 ND2 ASN A 25 -29.502 0.060 -15.873 1.00 0.00 N flip ATOM 0 H ASN A 25 -25.080 0.293 -17.747 1.00 0.00 H new ATOM 0 HA ASN A 25 -27.590 1.619 -18.047 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -27.856 -0.659 -17.774 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -26.489 -0.806 -16.688 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -29.869 0.285 -16.798 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -30.125 0.052 -15.065 1.00 0.00 H new ATOM 475 N GLN A 26 -25.982 1.939 -15.175 1.00 0.00 N ATOM 476 CA GLN A 26 -25.907 2.739 -13.959 1.00 0.00 C ATOM 477 C GLN A 26 -25.527 4.181 -14.278 1.00 0.00 C ATOM 478 O GLN A 26 -25.881 5.104 -13.543 1.00 0.00 O ATOM 479 CB GLN A 26 -24.892 2.134 -12.987 1.00 0.00 C ATOM 480 CG GLN A 26 -25.241 0.723 -12.543 1.00 0.00 C ATOM 481 CD GLN A 26 -24.105 0.048 -11.800 1.00 0.00 C ATOM 482 OE1 GLN A 26 -24.257 -0.361 -10.649 1.00 0.00 O ATOM 483 NE2 GLN A 26 -22.957 -0.074 -12.457 1.00 0.00 N ATOM 0 H GLN A 26 -25.240 1.246 -15.271 1.00 0.00 H new ATOM 0 HA GLN A 26 -26.892 2.738 -13.492 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -23.910 2.125 -13.460 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -24.817 2.774 -12.108 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -26.121 0.755 -11.901 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -25.505 0.126 -13.416 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -22.875 0.279 -13.410 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -22.158 -0.521 -12.008 1.00 0.00 H new ATOM 492 N LEU A 27 -24.805 4.367 -15.378 1.00 0.00 N ATOM 493 CA LEU A 27 -24.377 5.698 -15.795 1.00 0.00 C ATOM 494 C LEU A 27 -25.565 6.530 -16.267 1.00 0.00 C ATOM 495 O LEU A 27 -25.449 7.738 -16.468 1.00 0.00 O ATOM 496 CB LEU A 27 -23.337 5.593 -16.912 1.00 0.00 C ATOM 497 CG LEU A 27 -23.202 6.816 -17.820 1.00 0.00 C ATOM 498 CD1 LEU A 27 -22.678 8.009 -17.036 1.00 0.00 C ATOM 499 CD2 LEU A 27 -22.290 6.507 -18.998 1.00 0.00 C ATOM 0 H LEU A 27 -24.504 3.614 -15.997 1.00 0.00 H new ATOM 0 HA LEU A 27 -23.929 6.195 -14.935 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -22.366 5.392 -16.459 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -23.584 4.731 -17.531 1.00 0.00 H new ATOM 0 HG LEU A 27 -24.189 7.068 -18.207 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -22.589 8.869 -17.699 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -23.369 8.245 -16.227 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -21.700 7.769 -16.619 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -22.205 7.388 -19.634 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -21.302 6.229 -18.630 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -22.708 5.682 -19.575 1.00 0.00 H new ATOM 511 N GLY A 28 -26.709 5.874 -16.440 1.00 0.00 N ATOM 512 CA GLY A 28 -27.902 6.570 -16.885 1.00 0.00 C ATOM 513 C GLY A 28 -28.283 6.214 -18.308 1.00 0.00 C ATOM 514 O GLY A 28 -29.139 6.865 -18.910 1.00 0.00 O ATOM 0 H GLY A 28 -26.830 4.874 -16.280 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -28.730 6.328 -16.219 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -27.740 7.645 -16.814 1.00 0.00 H new ATOM 518 N LEU A 29 -27.648 5.181 -18.849 1.00 0.00 N ATOM 519 CA LEU A 29 -27.924 4.741 -20.212 1.00 0.00 C ATOM 520 C LEU A 29 -27.760 5.892 -21.199 1.00 0.00 C ATOM 521 O LEU A 29 -28.672 6.689 -21.419 1.00 0.00 O ATOM 522 CB LEU A 29 -29.340 4.169 -20.307 1.00 0.00 C ATOM 523 CG LEU A 29 -29.872 3.480 -19.050 1.00 0.00 C ATOM 524 CD1 LEU A 29 -30.791 4.414 -18.279 1.00 0.00 C ATOM 525 CD2 LEU A 29 -30.598 2.194 -19.414 1.00 0.00 C ATOM 0 H LEU A 29 -26.938 4.632 -18.365 1.00 0.00 H new ATOM 0 HA LEU A 29 -27.206 3.962 -20.469 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -30.021 4.979 -20.568 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -29.367 3.453 -21.128 1.00 0.00 H new ATOM 0 HG LEU A 29 -29.026 3.227 -18.411 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -31.160 3.907 -17.388 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -30.239 5.307 -17.986 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -31.633 4.698 -18.910 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -30.970 1.717 -18.507 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -31.435 2.423 -20.073 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -29.910 1.519 -19.923 1.00 0.00 H new ATOM 537 N PRO A 30 -26.570 5.981 -21.812 1.00 0.00 N ATOM 538 CA PRO A 30 -26.259 7.029 -22.789 1.00 0.00 C ATOM 539 C PRO A 30 -27.028 6.852 -24.094 1.00 0.00 C ATOM 540 O PRO A 30 -27.504 5.759 -24.403 1.00 0.00 O ATOM 541 CB PRO A 30 -24.757 6.858 -23.026 1.00 0.00 C ATOM 542 CG PRO A 30 -24.482 5.431 -22.702 1.00 0.00 C ATOM 543 CD PRO A 30 -25.437 5.065 -21.599 1.00 0.00 C ATOM 0 HA PRO A 30 -26.538 8.019 -22.428 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -24.490 7.088 -24.058 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -24.177 7.527 -22.390 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -24.633 4.796 -23.575 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -23.448 5.295 -22.384 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -25.746 4.022 -21.664 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -24.988 5.203 -20.616 1.00 0.00 H new ATOM 551 N LYS A 31 -27.146 7.933 -24.857 1.00 0.00 N ATOM 552 CA LYS A 31 -27.856 7.897 -26.130 1.00 0.00 C ATOM 553 C LYS A 31 -27.420 6.695 -26.962 1.00 0.00 C ATOM 554 O LYS A 31 -28.221 6.113 -27.694 1.00 0.00 O ATOM 555 CB LYS A 31 -27.608 9.189 -26.912 1.00 0.00 C ATOM 556 CG LYS A 31 -28.187 10.424 -26.245 1.00 0.00 C ATOM 557 CD LYS A 31 -27.756 11.696 -26.957 1.00 0.00 C ATOM 558 CE LYS A 31 -26.520 12.304 -26.312 1.00 0.00 C ATOM 559 NZ LYS A 31 -25.264 11.761 -26.901 1.00 0.00 N ATOM 0 H LYS A 31 -26.759 8.845 -24.616 1.00 0.00 H new ATOM 0 HA LYS A 31 -28.922 7.805 -25.921 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -26.534 9.325 -27.041 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -28.038 9.089 -27.908 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -29.275 10.360 -26.240 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -27.865 10.461 -25.204 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -27.550 11.476 -28.005 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -28.571 12.419 -26.937 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -26.541 13.387 -26.436 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -26.534 12.105 -25.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -24.531 12.499 -26.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -24.940 10.948 -26.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -25.443 11.456 -27.879 1.00 0.00 H new ATOM 573 N GLN A 32 -26.148 6.329 -26.844 1.00 0.00 N ATOM 574 CA GLN A 32 -25.608 5.195 -27.585 1.00 0.00 C ATOM 575 C GLN A 32 -24.274 4.747 -26.998 1.00 0.00 C ATOM 576 O GLN A 32 -23.830 5.263 -25.973 1.00 0.00 O ATOM 577 CB GLN A 32 -25.433 5.560 -29.060 1.00 0.00 C ATOM 578 CG GLN A 32 -24.349 6.598 -29.306 1.00 0.00 C ATOM 579 CD GLN A 32 -24.741 7.978 -28.817 1.00 0.00 C ATOM 580 OE1 GLN A 32 -25.631 8.619 -29.377 1.00 0.00 O ATOM 581 NE2 GLN A 32 -24.078 8.445 -27.765 1.00 0.00 N ATOM 0 H GLN A 32 -25.472 6.801 -26.243 1.00 0.00 H new ATOM 0 HA GLN A 32 -26.315 4.370 -27.504 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -25.195 4.658 -29.623 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -26.380 5.937 -29.447 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -23.432 6.286 -28.805 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -24.130 6.643 -30.373 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -23.348 7.881 -27.331 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -24.299 9.368 -27.391 1.00 0.00 H new ATOM 590 N GLY A 33 -23.638 3.782 -27.655 1.00 0.00 N ATOM 591 CA GLY A 33 -22.361 3.280 -27.183 1.00 0.00 C ATOM 592 C GLY A 33 -22.216 1.784 -27.382 1.00 0.00 C ATOM 593 O GLY A 33 -22.705 0.992 -26.576 1.00 0.00 O ATOM 0 H GLY A 33 -23.984 3.339 -28.506 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -21.556 3.793 -27.709 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -22.251 3.515 -26.124 1.00 0.00 H new ATOM 597 N LYS A 34 -21.545 1.394 -28.460 1.00 0.00 N ATOM 598 CA LYS A 34 -21.337 -0.017 -28.764 1.00 0.00 C ATOM 599 C LYS A 34 -20.306 -0.630 -27.822 1.00 0.00 C ATOM 600 O LYS A 34 -19.836 0.022 -26.890 1.00 0.00 O ATOM 601 CB LYS A 34 -20.881 -0.185 -30.216 1.00 0.00 C ATOM 602 CG LYS A 34 -21.712 0.607 -31.210 1.00 0.00 C ATOM 603 CD LYS A 34 -20.927 1.774 -31.787 1.00 0.00 C ATOM 604 CE LYS A 34 -21.846 2.913 -32.200 1.00 0.00 C ATOM 605 NZ LYS A 34 -21.346 3.618 -33.413 1.00 0.00 N ATOM 0 H LYS A 34 -21.135 2.036 -29.139 1.00 0.00 H new ATOM 0 HA LYS A 34 -22.285 -0.537 -28.625 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -19.839 0.124 -30.299 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -20.922 -1.241 -30.481 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -22.038 -0.049 -32.018 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -22.611 0.979 -30.719 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -20.210 2.133 -31.048 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -20.353 1.437 -32.650 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -22.845 2.522 -32.393 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -21.936 3.623 -31.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -22.000 4.387 -33.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -20.404 4.014 -33.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -21.285 2.946 -34.204 1.00 0.00 H new ATOM 619 N LYS A 35 -19.958 -1.888 -28.072 1.00 0.00 N ATOM 620 CA LYS A 35 -18.981 -2.590 -27.248 1.00 0.00 C ATOM 621 C LYS A 35 -17.711 -1.762 -27.086 1.00 0.00 C ATOM 622 O LYS A 35 -17.169 -1.648 -25.987 1.00 0.00 O ATOM 623 CB LYS A 35 -18.643 -3.948 -27.867 1.00 0.00 C ATOM 624 CG LYS A 35 -17.655 -4.761 -27.048 1.00 0.00 C ATOM 625 CD LYS A 35 -18.363 -5.643 -26.035 1.00 0.00 C ATOM 626 CE LYS A 35 -17.694 -5.574 -24.671 1.00 0.00 C ATOM 627 NZ LYS A 35 -16.517 -6.483 -24.584 1.00 0.00 N ATOM 0 H LYS A 35 -20.338 -2.442 -28.839 1.00 0.00 H new ATOM 0 HA LYS A 35 -19.419 -2.746 -26.262 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -19.562 -4.522 -27.987 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -18.233 -3.791 -28.865 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -17.053 -5.380 -27.713 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -16.970 -4.089 -26.531 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.404 -5.333 -25.947 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -18.366 -6.674 -26.388 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -17.377 -4.550 -24.473 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -18.416 -5.839 -23.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -16.069 -6.382 -23.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -16.828 -7.467 -24.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -15.832 -6.236 -25.326 1.00 0.00 H new ATOM 641 N GLN A 36 -17.242 -1.185 -28.188 1.00 0.00 N ATOM 642 CA GLN A 36 -16.035 -0.367 -28.167 1.00 0.00 C ATOM 643 C GLN A 36 -16.289 0.959 -27.458 1.00 0.00 C ATOM 644 O GLN A 36 -15.554 1.336 -26.545 1.00 0.00 O ATOM 645 CB GLN A 36 -15.543 -0.111 -29.593 1.00 0.00 C ATOM 646 CG GLN A 36 -14.562 1.046 -29.699 1.00 0.00 C ATOM 647 CD GLN A 36 -13.526 1.036 -28.591 1.00 0.00 C ATOM 648 OE1 GLN A 36 -13.138 2.087 -28.079 1.00 0.00 O ATOM 649 NE2 GLN A 36 -13.073 -0.154 -28.215 1.00 0.00 N ATOM 0 H GLN A 36 -17.679 -1.269 -29.106 1.00 0.00 H new ATOM 0 HA GLN A 36 -15.267 -0.911 -27.617 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -15.068 -1.016 -29.972 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -16.401 0.091 -30.234 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -14.057 1.002 -30.664 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -15.111 1.987 -29.669 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -13.423 -0.999 -28.667 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -12.375 -0.223 -27.474 1.00 0.00 H new ATOM 658 N ASP A 37 -17.332 1.662 -27.884 1.00 0.00 N ATOM 659 CA ASP A 37 -17.683 2.946 -27.289 1.00 0.00 C ATOM 660 C ASP A 37 -17.784 2.832 -25.771 1.00 0.00 C ATOM 661 O ASP A 37 -17.229 3.652 -25.038 1.00 0.00 O ATOM 662 CB ASP A 37 -19.007 3.454 -27.863 1.00 0.00 C ATOM 663 CG ASP A 37 -18.835 4.715 -28.687 1.00 0.00 C ATOM 664 OD1 ASP A 37 -18.019 5.574 -28.293 1.00 0.00 O ATOM 665 OD2 ASP A 37 -19.517 4.843 -29.726 1.00 0.00 O ATOM 0 H ASP A 37 -17.949 1.364 -28.639 1.00 0.00 H new ATOM 0 HA ASP A 37 -16.894 3.658 -27.531 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -19.453 2.676 -28.483 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -19.703 3.649 -27.047 1.00 0.00 H new ATOM 670 N LEU A 38 -18.495 1.812 -25.305 1.00 0.00 N ATOM 671 CA LEU A 38 -18.669 1.591 -23.874 1.00 0.00 C ATOM 672 C LEU A 38 -17.328 1.332 -23.195 1.00 0.00 C ATOM 673 O LEU A 38 -16.988 1.978 -22.203 1.00 0.00 O ATOM 674 CB LEU A 38 -19.612 0.411 -23.631 1.00 0.00 C ATOM 675 CG LEU A 38 -20.988 0.504 -24.292 1.00 0.00 C ATOM 676 CD1 LEU A 38 -21.486 -0.878 -24.685 1.00 0.00 C ATOM 677 CD2 LEU A 38 -21.981 1.186 -23.362 1.00 0.00 C ATOM 0 H LEU A 38 -18.961 1.124 -25.897 1.00 0.00 H new ATOM 0 HA LEU A 38 -19.105 2.492 -23.443 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -19.123 -0.497 -23.983 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -19.754 0.301 -22.556 1.00 0.00 H new ATOM 0 HG LEU A 38 -20.895 1.105 -25.197 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -22.466 -0.792 -25.154 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -20.786 -1.331 -25.388 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -21.563 -1.504 -23.796 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -22.955 1.244 -23.849 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -22.070 0.612 -22.440 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -21.631 2.192 -23.131 1.00 0.00 H new ATOM 689 N ILE A 39 -16.569 0.386 -23.737 1.00 0.00 N ATOM 690 CA ILE A 39 -15.264 0.045 -23.186 1.00 0.00 C ATOM 691 C ILE A 39 -14.408 1.292 -22.989 1.00 0.00 C ATOM 692 O ILE A 39 -13.867 1.522 -21.908 1.00 0.00 O ATOM 693 CB ILE A 39 -14.509 -0.944 -24.095 1.00 0.00 C ATOM 694 CG1 ILE A 39 -14.908 -2.383 -23.761 1.00 0.00 C ATOM 695 CG2 ILE A 39 -13.007 -0.757 -23.948 1.00 0.00 C ATOM 696 CD1 ILE A 39 -14.755 -3.337 -24.924 1.00 0.00 C ATOM 0 H ILE A 39 -16.836 -0.158 -24.558 1.00 0.00 H new ATOM 0 HA ILE A 39 -15.443 -0.427 -22.220 1.00 0.00 H new ATOM 0 HB ILE A 39 -14.780 -0.743 -25.131 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -14.299 -2.737 -22.929 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -15.945 -2.395 -23.425 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -12.487 -1.463 -24.596 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -12.738 0.261 -24.230 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -12.718 -0.935 -22.912 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -15.056 -4.338 -24.615 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -15.385 -3.008 -25.750 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -13.714 -3.354 -25.246 1.00 0.00 H new ATOM 708 N ASP A 40 -14.291 2.094 -24.042 1.00 0.00 N ATOM 709 CA ASP A 40 -13.503 3.320 -23.984 1.00 0.00 C ATOM 710 C ASP A 40 -14.079 4.289 -22.957 1.00 0.00 C ATOM 711 O ASP A 40 -13.341 5.019 -22.295 1.00 0.00 O ATOM 712 CB ASP A 40 -13.454 3.985 -25.361 1.00 0.00 C ATOM 713 CG ASP A 40 -12.051 4.404 -25.752 1.00 0.00 C ATOM 714 OD1 ASP A 40 -11.518 5.345 -25.129 1.00 0.00 O ATOM 715 OD2 ASP A 40 -11.487 3.792 -26.683 1.00 0.00 O ATOM 0 H ASP A 40 -14.731 1.917 -24.945 1.00 0.00 H new ATOM 0 HA ASP A 40 -12.490 3.058 -23.679 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -13.846 3.295 -26.109 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -14.105 4.859 -25.362 1.00 0.00 H new ATOM 720 N ARG A 41 -15.402 4.291 -22.831 1.00 0.00 N ATOM 721 CA ARG A 41 -16.078 5.173 -21.886 1.00 0.00 C ATOM 722 C ARG A 41 -15.730 4.798 -20.448 1.00 0.00 C ATOM 723 O ARG A 41 -15.451 5.664 -19.620 1.00 0.00 O ATOM 724 CB ARG A 41 -17.593 5.108 -22.089 1.00 0.00 C ATOM 725 CG ARG A 41 -18.117 6.120 -23.095 1.00 0.00 C ATOM 726 CD ARG A 41 -17.895 7.546 -22.617 1.00 0.00 C ATOM 727 NE ARG A 41 -18.881 8.469 -23.173 1.00 0.00 N ATOM 728 CZ ARG A 41 -18.733 9.789 -23.175 1.00 0.00 C ATOM 729 NH1 ARG A 41 -17.644 10.338 -22.654 1.00 0.00 N ATOM 730 NH2 ARG A 41 -19.674 10.563 -23.699 1.00 0.00 N ATOM 0 H ARG A 41 -16.027 3.692 -23.371 1.00 0.00 H new ATOM 0 HA ARG A 41 -15.737 6.192 -22.070 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -17.864 4.105 -22.420 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -18.087 5.272 -21.131 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -17.618 5.974 -24.053 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -19.181 5.952 -23.261 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -17.944 7.575 -21.529 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -16.894 7.871 -22.900 1.00 0.00 H new ATOM 0 HE ARG A 41 -19.730 8.079 -23.582 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -16.918 9.746 -22.251 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -17.533 11.352 -22.657 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -20.513 10.145 -24.101 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -19.559 11.576 -23.700 1.00 0.00 H new ATOM 744 N VAL A 42 -15.750 3.500 -20.159 1.00 0.00 N ATOM 745 CA VAL A 42 -15.437 3.010 -18.823 1.00 0.00 C ATOM 746 C VAL A 42 -14.014 3.383 -18.420 1.00 0.00 C ATOM 747 O VAL A 42 -13.798 4.051 -17.408 1.00 0.00 O ATOM 748 CB VAL A 42 -15.600 1.481 -18.733 1.00 0.00 C ATOM 749 CG1 VAL A 42 -14.984 0.953 -17.446 1.00 0.00 C ATOM 750 CG2 VAL A 42 -17.069 1.096 -18.827 1.00 0.00 C ATOM 0 H VAL A 42 -15.980 2.770 -20.833 1.00 0.00 H new ATOM 0 HA VAL A 42 -16.141 3.484 -18.139 1.00 0.00 H new ATOM 0 HB VAL A 42 -15.074 1.027 -19.573 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.109 -0.129 -17.400 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -13.922 1.197 -17.424 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -15.479 1.412 -16.590 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -17.166 0.012 -18.762 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -17.620 1.560 -18.009 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -17.475 1.440 -19.778 1.00 0.00 H new ATOM 760 N LEU A 43 -13.046 2.947 -19.219 1.00 0.00 N ATOM 761 CA LEU A 43 -11.642 3.234 -18.947 1.00 0.00 C ATOM 762 C LEU A 43 -11.419 4.732 -18.761 1.00 0.00 C ATOM 763 O LEU A 43 -10.660 5.153 -17.888 1.00 0.00 O ATOM 764 CB LEU A 43 -10.764 2.715 -20.087 1.00 0.00 C ATOM 765 CG LEU A 43 -11.009 1.268 -20.517 1.00 0.00 C ATOM 766 CD1 LEU A 43 -9.873 0.774 -21.399 1.00 0.00 C ATOM 767 CD2 LEU A 43 -11.170 0.370 -19.299 1.00 0.00 C ATOM 0 H LEU A 43 -13.208 2.393 -20.060 1.00 0.00 H new ATOM 0 HA LEU A 43 -11.365 2.726 -18.023 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -10.909 3.360 -20.953 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.720 2.813 -19.788 1.00 0.00 H new ATOM 0 HG LEU A 43 -11.932 1.232 -21.095 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -10.064 -0.257 -21.695 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -9.804 1.400 -22.288 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.935 0.824 -20.846 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -11.344 -0.656 -19.624 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.264 0.411 -18.695 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -12.018 0.711 -18.705 1.00 0.00 H new ATOM 779 N ALA A 44 -12.088 5.532 -19.585 1.00 0.00 N ATOM 780 CA ALA A 44 -11.967 6.982 -19.508 1.00 0.00 C ATOM 781 C ALA A 44 -12.607 7.520 -18.233 1.00 0.00 C ATOM 782 O ALA A 44 -12.206 8.564 -17.717 1.00 0.00 O ATOM 783 CB ALA A 44 -12.598 7.630 -20.731 1.00 0.00 C ATOM 0 H ALA A 44 -12.720 5.200 -20.314 1.00 0.00 H new ATOM 0 HA ALA A 44 -10.906 7.232 -19.484 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.500 8.713 -20.660 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -12.093 7.278 -21.631 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -13.654 7.363 -20.780 1.00 0.00 H new ATOM 789 N LEU A 45 -13.604 6.801 -17.728 1.00 0.00 N ATOM 790 CA LEU A 45 -14.300 7.207 -16.512 1.00 0.00 C ATOM 791 C LEU A 45 -13.474 6.873 -15.274 1.00 0.00 C ATOM 792 O LEU A 45 -13.360 7.683 -14.354 1.00 0.00 O ATOM 793 CB LEU A 45 -15.665 6.520 -16.429 1.00 0.00 C ATOM 794 CG LEU A 45 -15.947 5.741 -15.144 1.00 0.00 C ATOM 795 CD1 LEU A 45 -16.243 6.693 -13.997 1.00 0.00 C ATOM 796 CD2 LEU A 45 -17.104 4.774 -15.350 1.00 0.00 C ATOM 0 H LEU A 45 -13.948 5.935 -18.142 1.00 0.00 H new ATOM 0 HA LEU A 45 -14.445 8.287 -16.549 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -16.439 7.278 -16.548 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -15.757 5.836 -17.273 1.00 0.00 H new ATOM 0 HG LEU A 45 -15.058 5.164 -14.889 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -16.441 6.120 -13.091 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -15.384 7.344 -13.834 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -17.116 7.298 -14.242 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -17.291 4.228 -14.425 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -17.998 5.331 -15.630 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -16.853 4.070 -16.143 1.00 0.00 H new ATOM 808 N LEU A 46 -12.898 5.676 -15.259 1.00 0.00 N ATOM 809 CA LEU A 46 -12.079 5.235 -14.135 1.00 0.00 C ATOM 810 C LEU A 46 -10.687 5.855 -14.199 1.00 0.00 C ATOM 811 O LEU A 46 -9.935 5.823 -13.224 1.00 0.00 O ATOM 812 CB LEU A 46 -11.971 3.709 -14.125 1.00 0.00 C ATOM 813 CG LEU A 46 -13.261 2.943 -14.419 1.00 0.00 C ATOM 814 CD1 LEU A 46 -12.986 1.450 -14.510 1.00 0.00 C ATOM 815 CD2 LEU A 46 -14.307 3.230 -13.351 1.00 0.00 C ATOM 0 H LEU A 46 -12.983 4.993 -16.012 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.561 5.565 -13.215 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -11.221 3.413 -14.859 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -11.602 3.397 -13.148 1.00 0.00 H new ATOM 0 HG LEU A 46 -13.650 3.280 -15.380 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -13.916 0.921 -14.720 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -12.272 1.260 -15.311 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -12.573 1.098 -13.565 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -15.219 2.676 -13.576 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -13.927 2.922 -12.377 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -14.526 4.298 -13.334 1.00 0.00 H new ATOM 827 N THR A 47 -10.349 6.421 -15.354 1.00 0.00 N ATOM 828 CA THR A 47 -9.049 7.049 -15.546 1.00 0.00 C ATOM 829 C THR A 47 -9.161 8.569 -15.509 1.00 0.00 C ATOM 830 O THR A 47 -8.656 9.216 -14.592 1.00 0.00 O ATOM 831 CB THR A 47 -8.411 6.625 -16.882 1.00 0.00 C ATOM 832 OG1 THR A 47 -8.260 5.202 -16.923 1.00 0.00 O ATOM 833 CG2 THR A 47 -7.056 7.290 -17.071 1.00 0.00 C ATOM 0 H THR A 47 -10.959 6.457 -16.171 1.00 0.00 H new ATOM 0 HA THR A 47 -8.413 6.714 -14.726 1.00 0.00 H new ATOM 0 HB THR A 47 -9.069 6.943 -17.690 1.00 0.00 H new ATOM 0 HG1 THR A 47 -9.023 4.806 -17.394 1.00 0.00 H new ATOM 0 HG21 THR A 47 -6.625 6.975 -18.022 1.00 0.00 H new ATOM 0 HG22 THR A 47 -7.179 8.373 -17.070 1.00 0.00 H new ATOM 0 HG23 THR A 47 -6.391 6.999 -16.258 1.00 0.00 H new ATOM 841 N ASP A 48 -9.827 9.132 -16.510 1.00 0.00 N ATOM 842 CA ASP A 48 -10.008 10.577 -16.591 1.00 0.00 C ATOM 843 C ASP A 48 -10.986 11.063 -15.527 1.00 0.00 C ATOM 844 O ASP A 48 -11.095 12.262 -15.271 1.00 0.00 O ATOM 845 CB ASP A 48 -10.509 10.973 -17.981 1.00 0.00 C ATOM 846 CG ASP A 48 -9.467 11.734 -18.778 1.00 0.00 C ATOM 847 OD1 ASP A 48 -9.432 12.978 -18.673 1.00 0.00 O ATOM 848 OD2 ASP A 48 -8.687 11.085 -19.504 1.00 0.00 O ATOM 0 H ASP A 48 -10.251 8.610 -17.277 1.00 0.00 H new ATOM 0 HA ASP A 48 -9.042 11.049 -16.413 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.797 10.076 -18.529 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -11.404 11.587 -17.880 1.00 0.00 H new ATOM 853 N GLU A 49 -11.697 10.124 -14.911 1.00 0.00 N ATOM 854 CA GLU A 49 -12.668 10.458 -13.875 1.00 0.00 C ATOM 855 C GLU A 49 -12.479 9.573 -12.646 1.00 0.00 C ATOM 856 O GLU A 49 -13.419 9.336 -11.889 1.00 0.00 O ATOM 857 CB GLU A 49 -14.093 10.305 -14.412 1.00 0.00 C ATOM 858 CG GLU A 49 -14.814 11.627 -14.611 1.00 0.00 C ATOM 859 CD GLU A 49 -15.831 11.574 -15.734 1.00 0.00 C ATOM 860 OE1 GLU A 49 -15.432 11.741 -16.905 1.00 0.00 O ATOM 861 OE2 GLU A 49 -17.027 11.366 -15.441 1.00 0.00 O ATOM 0 H GLU A 49 -11.619 9.127 -15.111 1.00 0.00 H new ATOM 0 HA GLU A 49 -12.506 11.496 -13.583 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -14.059 9.773 -15.363 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -14.668 9.688 -13.722 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -15.316 11.906 -13.684 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -14.083 12.407 -14.825 1.00 0.00 H new ATOM 868 N GLN A 50 -11.256 9.089 -12.456 1.00 0.00 N ATOM 869 CA GLN A 50 -10.943 8.230 -11.320 1.00 0.00 C ATOM 870 C GLN A 50 -11.421 8.857 -10.015 1.00 0.00 C ATOM 871 O GLN A 50 -11.666 8.159 -9.032 1.00 0.00 O ATOM 872 CB GLN A 50 -9.438 7.967 -11.252 1.00 0.00 C ATOM 873 CG GLN A 50 -8.629 9.174 -10.804 1.00 0.00 C ATOM 874 CD GLN A 50 -8.181 10.039 -11.966 1.00 0.00 C ATOM 875 OE1 GLN A 50 -7.138 9.795 -12.572 1.00 0.00 O ATOM 876 NE2 GLN A 50 -8.971 11.059 -12.283 1.00 0.00 N ATOM 0 H GLN A 50 -10.466 9.277 -13.073 1.00 0.00 H new ATOM 0 HA GLN A 50 -11.464 7.283 -11.459 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -9.253 7.141 -10.566 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -9.088 7.650 -12.234 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -9.228 9.774 -10.119 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -7.754 8.835 -10.250 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -9.827 11.225 -11.754 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -8.722 11.676 -13.056 1.00 0.00 H new ATOM 885 N GLY A 51 -11.552 10.181 -10.013 1.00 0.00 N ATOM 886 CA GLY A 51 -12.000 10.880 -8.823 1.00 0.00 C ATOM 887 C GLY A 51 -10.987 10.817 -7.697 1.00 0.00 C ATOM 888 O GLY A 51 -11.342 10.550 -6.550 1.00 0.00 O ATOM 0 H GLY A 51 -11.356 10.781 -10.814 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -12.198 11.923 -9.071 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -12.942 10.448 -8.485 1.00 0.00 H new ATOM 892 N GLN A 52 -9.722 11.060 -8.027 1.00 0.00 N ATOM 893 CA GLN A 52 -8.655 11.027 -7.034 1.00 0.00 C ATOM 894 C GLN A 52 -8.959 11.971 -5.875 1.00 0.00 C ATOM 895 O GLN A 52 -8.467 11.783 -4.763 1.00 0.00 O ATOM 896 CB GLN A 52 -7.319 11.404 -7.677 1.00 0.00 C ATOM 897 CG GLN A 52 -6.387 10.221 -7.881 1.00 0.00 C ATOM 898 CD GLN A 52 -5.743 9.756 -6.590 1.00 0.00 C ATOM 899 OE1 GLN A 52 -5.861 8.591 -6.208 1.00 0.00 O ATOM 900 NE2 GLN A 52 -5.057 10.666 -5.909 1.00 0.00 N ATOM 0 H GLN A 52 -9.412 11.282 -8.973 1.00 0.00 H new ATOM 0 HA GLN A 52 -8.589 10.012 -6.643 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.510 11.876 -8.641 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -6.821 12.145 -7.052 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -6.945 9.395 -8.322 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -5.608 10.495 -8.593 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.985 11.620 -6.262 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.602 10.411 -5.032 1.00 0.00 H new ATOM 909 N ARG A 53 -9.773 12.987 -6.144 1.00 0.00 N ATOM 910 CA ARG A 53 -10.141 13.961 -5.124 1.00 0.00 C ATOM 911 C ARG A 53 -11.221 14.907 -5.641 1.00 0.00 C ATOM 912 O ARG A 53 -10.971 16.094 -5.854 1.00 0.00 O ATOM 913 CB ARG A 53 -8.914 14.762 -4.686 1.00 0.00 C ATOM 914 CG ARG A 53 -8.043 15.223 -5.844 1.00 0.00 C ATOM 915 CD ARG A 53 -7.694 16.699 -5.725 1.00 0.00 C ATOM 916 NE ARG A 53 -8.692 17.550 -6.367 1.00 0.00 N ATOM 917 CZ ARG A 53 -8.699 18.875 -6.270 1.00 0.00 C ATOM 918 NH1 ARG A 53 -7.766 19.496 -5.562 1.00 0.00 N ATOM 919 NH2 ARG A 53 -9.641 19.581 -6.883 1.00 0.00 N ATOM 0 H ARG A 53 -10.190 13.157 -7.059 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.537 13.418 -4.266 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.243 15.634 -4.120 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -8.314 14.152 -4.011 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -7.127 14.632 -5.870 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -8.563 15.046 -6.785 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -7.611 16.968 -4.672 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -6.719 16.879 -6.178 1.00 0.00 H new ATOM 0 HE ARG A 53 -9.423 17.103 -6.920 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -7.040 18.956 -5.090 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.774 20.513 -5.489 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.360 19.106 -7.429 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -9.646 20.598 -6.808 1.00 0.00 H new ATOM 933 N HIS A 54 -12.422 14.374 -5.841 1.00 0.00 N ATOM 934 CA HIS A 54 -13.540 15.170 -6.333 1.00 0.00 C ATOM 935 C HIS A 54 -14.800 14.319 -6.459 1.00 0.00 C ATOM 936 O HIS A 54 -15.893 14.750 -6.090 1.00 0.00 O ATOM 937 CB HIS A 54 -13.194 15.793 -7.686 1.00 0.00 C ATOM 938 CG HIS A 54 -13.531 17.249 -7.779 1.00 0.00 C ATOM 939 ND1 HIS A 54 -14.078 17.825 -8.906 1.00 0.00 N ATOM 940 CD2 HIS A 54 -13.396 18.248 -6.875 1.00 0.00 C ATOM 941 CE1 HIS A 54 -14.264 19.116 -8.693 1.00 0.00 C ATOM 942 NE2 HIS A 54 -13.859 19.398 -7.468 1.00 0.00 N ATOM 0 H HIS A 54 -12.646 13.394 -5.670 1.00 0.00 H new ATOM 0 HA HIS A 54 -13.731 15.966 -5.613 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -12.128 15.662 -7.875 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -13.725 15.255 -8.471 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -12.999 18.158 -5.875 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -14.677 19.820 -9.400 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -13.886 20.320 -7.033 1.00 0.00 H new ATOM 950 N HIS A 55 -14.640 13.108 -6.983 1.00 0.00 N ATOM 951 CA HIS A 55 -15.765 12.196 -7.158 1.00 0.00 C ATOM 952 C HIS A 55 -15.325 10.748 -6.965 1.00 0.00 C ATOM 953 O HIS A 55 -15.228 9.985 -7.925 1.00 0.00 O ATOM 954 CB HIS A 55 -16.382 12.373 -8.546 1.00 0.00 C ATOM 955 CG HIS A 55 -15.370 12.418 -9.650 1.00 0.00 C ATOM 956 ND1 HIS A 55 -14.792 13.589 -10.093 1.00 0.00 N ATOM 957 CD2 HIS A 55 -14.832 11.428 -10.399 1.00 0.00 C ATOM 958 CE1 HIS A 55 -13.944 13.317 -11.068 1.00 0.00 C ATOM 959 NE2 HIS A 55 -13.949 12.012 -11.273 1.00 0.00 N ATOM 0 H HIS A 55 -13.743 12.735 -7.294 1.00 0.00 H new ATOM 0 HA HIS A 55 -16.514 12.434 -6.403 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -17.076 11.553 -8.733 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -16.965 13.294 -8.561 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -14.989 14.520 -9.725 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -15.056 10.374 -10.323 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -13.348 14.039 -11.606 1.00 0.00 H new ATOM 967 N GLY A 56 -15.060 10.376 -5.716 1.00 0.00 N ATOM 968 CA GLY A 56 -14.634 9.021 -5.419 1.00 0.00 C ATOM 969 C GLY A 56 -15.534 8.338 -4.409 1.00 0.00 C ATOM 970 O GLY A 56 -15.102 8.015 -3.302 1.00 0.00 O ATOM 0 H GLY A 56 -15.133 10.989 -4.904 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -14.619 8.438 -6.340 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -13.613 9.040 -5.037 1.00 0.00 H new ATOM 974 N TRP A 57 -16.787 8.117 -4.790 1.00 0.00 N ATOM 975 CA TRP A 57 -17.750 7.469 -3.908 1.00 0.00 C ATOM 976 C TRP A 57 -18.252 6.163 -4.515 1.00 0.00 C ATOM 977 O TRP A 57 -17.929 5.079 -4.032 1.00 0.00 O ATOM 978 CB TRP A 57 -18.930 8.403 -3.632 1.00 0.00 C ATOM 979 CG TRP A 57 -18.739 9.781 -4.191 1.00 0.00 C ATOM 980 CD1 TRP A 57 -18.085 10.823 -3.599 1.00 0.00 C ATOM 981 CD2 TRP A 57 -19.210 10.266 -5.454 1.00 0.00 C ATOM 982 NE1 TRP A 57 -18.120 11.927 -4.417 1.00 0.00 N ATOM 983 CE2 TRP A 57 -18.804 11.610 -5.561 1.00 0.00 C ATOM 984 CE3 TRP A 57 -19.933 9.695 -6.504 1.00 0.00 C ATOM 985 CZ2 TRP A 57 -19.099 12.390 -6.676 1.00 0.00 C ATOM 986 CZ3 TRP A 57 -20.225 10.470 -7.610 1.00 0.00 C ATOM 987 CH2 TRP A 57 -19.808 11.805 -7.690 1.00 0.00 C ATOM 0 H TRP A 57 -17.159 8.377 -5.703 1.00 0.00 H new ATOM 0 HA TRP A 57 -17.247 7.242 -2.968 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -19.835 7.969 -4.056 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -19.085 8.473 -2.555 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -17.610 10.785 -2.630 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -17.704 12.834 -4.207 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -20.258 8.666 -6.452 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -18.780 13.420 -6.738 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -20.784 10.039 -8.427 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -20.051 12.384 -8.569 1.00 0.00 H new ATOM 998 N GLY A 58 -19.042 6.275 -5.579 1.00 0.00 N ATOM 999 CA GLY A 58 -19.575 5.095 -6.234 1.00 0.00 C ATOM 1000 C GLY A 58 -20.934 4.696 -5.695 1.00 0.00 C ATOM 1001 O GLY A 58 -21.793 4.229 -6.443 1.00 0.00 O ATOM 0 H GLY A 58 -19.322 7.162 -5.999 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -19.653 5.282 -7.305 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -18.879 4.266 -6.105 1.00 0.00 H new ATOM 1005 N ARG A 59 -21.129 4.877 -4.393 1.00 0.00 N ATOM 1006 CA ARG A 59 -22.392 4.530 -3.753 1.00 0.00 C ATOM 1007 C ARG A 59 -23.385 5.685 -3.847 1.00 0.00 C ATOM 1008 O ARG A 59 -24.429 5.675 -3.195 1.00 0.00 O ATOM 1009 CB ARG A 59 -22.161 4.159 -2.287 1.00 0.00 C ATOM 1010 CG ARG A 59 -21.383 5.208 -1.509 1.00 0.00 C ATOM 1011 CD ARG A 59 -21.411 4.927 -0.015 1.00 0.00 C ATOM 1012 NE ARG A 59 -20.584 3.777 0.342 1.00 0.00 N ATOM 1013 CZ ARG A 59 -20.139 3.545 1.572 1.00 0.00 C ATOM 1014 NH1 ARG A 59 -20.441 4.379 2.558 1.00 0.00 N ATOM 1015 NH2 ARG A 59 -19.392 2.477 1.817 1.00 0.00 N ATOM 0 H ARG A 59 -20.428 5.262 -3.760 1.00 0.00 H new ATOM 0 HA ARG A 59 -22.811 3.670 -4.276 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -23.126 4.002 -1.804 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -21.624 3.212 -2.241 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -20.350 5.229 -1.857 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -21.805 6.194 -1.703 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -21.061 5.807 0.526 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -22.439 4.746 0.301 1.00 0.00 H new ATOM 0 HE ARG A 59 -20.335 3.116 -0.394 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -21.016 5.201 2.373 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -20.098 4.199 3.502 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -19.159 1.833 1.061 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -19.051 2.299 2.762 1.00 0.00 H new ATOM 1029 N LYS A 60 -23.051 6.680 -4.661 1.00 0.00 N ATOM 1030 CA LYS A 60 -23.912 7.843 -4.842 1.00 0.00 C ATOM 1031 C LYS A 60 -24.854 7.644 -6.025 1.00 0.00 C ATOM 1032 O LYS A 60 -26.007 8.072 -5.991 1.00 0.00 O ATOM 1033 CB LYS A 60 -23.066 9.101 -5.056 1.00 0.00 C ATOM 1034 CG LYS A 60 -22.230 9.484 -3.848 1.00 0.00 C ATOM 1035 CD LYS A 60 -23.082 10.108 -2.755 1.00 0.00 C ATOM 1036 CE LYS A 60 -23.325 9.132 -1.613 1.00 0.00 C ATOM 1037 NZ LYS A 60 -24.771 9.026 -1.273 1.00 0.00 N ATOM 0 H LYS A 60 -22.189 6.705 -5.206 1.00 0.00 H new ATOM 0 HA LYS A 60 -24.511 7.964 -3.940 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -22.406 8.944 -5.909 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -23.724 9.932 -5.310 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -21.727 8.600 -3.458 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -21.453 10.186 -4.150 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -22.588 11.002 -2.373 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -24.037 10.426 -3.173 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -22.943 8.149 -1.888 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -22.768 9.456 -0.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -24.874 8.641 -0.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -25.208 9.969 -1.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -25.242 8.394 -1.952 1.00 0.00 H new ATOM 1051 N ASN A 61 -24.356 6.989 -7.069 1.00 0.00 N ATOM 1052 CA ASN A 61 -25.155 6.732 -8.262 1.00 0.00 C ATOM 1053 C ASN A 61 -24.569 5.579 -9.071 1.00 0.00 C ATOM 1054 O ASN A 61 -24.846 5.440 -10.262 1.00 0.00 O ATOM 1055 CB ASN A 61 -25.234 7.990 -9.128 1.00 0.00 C ATOM 1056 CG ASN A 61 -24.434 9.141 -8.551 1.00 0.00 C ATOM 1057 OD1 ASN A 61 -23.149 8.907 -8.311 1.00 0.00 O flip ATOM 1058 ND2 ASN A 61 -24.965 10.229 -8.323 1.00 0.00 N flip ATOM 0 H ASN A 61 -23.404 6.627 -7.113 1.00 0.00 H new ATOM 0 HA ASN A 61 -26.160 6.455 -7.944 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -24.867 7.762 -10.129 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -26.276 8.292 -9.231 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -25.956 10.365 -8.523 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -24.414 10.994 -7.934 1.00 0.00 H new ATOM 1065 N SER A 62 -23.757 4.756 -8.415 1.00 0.00 N ATOM 1066 CA SER A 62 -23.129 3.617 -9.074 1.00 0.00 C ATOM 1067 C SER A 62 -22.562 4.019 -10.432 1.00 0.00 C ATOM 1068 O SER A 62 -22.720 3.303 -11.421 1.00 0.00 O ATOM 1069 CB SER A 62 -24.138 2.480 -9.247 1.00 0.00 C ATOM 1070 OG SER A 62 -25.402 2.977 -9.653 1.00 0.00 O ATOM 0 H SER A 62 -23.519 4.857 -7.428 1.00 0.00 H new ATOM 0 HA SER A 62 -22.308 3.273 -8.444 1.00 0.00 H new ATOM 0 HB2 SER A 62 -23.768 1.771 -9.987 1.00 0.00 H new ATOM 0 HB3 SER A 62 -24.242 1.936 -8.308 1.00 0.00 H new ATOM 0 HG SER A 62 -25.275 3.734 -10.263 1.00 0.00 H new ATOM 1076 N LEU A 63 -21.901 5.171 -10.472 1.00 0.00 N ATOM 1077 CA LEU A 63 -21.309 5.671 -11.708 1.00 0.00 C ATOM 1078 C LEU A 63 -19.832 5.996 -11.512 1.00 0.00 C ATOM 1079 O LEU A 63 -19.185 6.556 -12.398 1.00 0.00 O ATOM 1080 CB LEU A 63 -22.058 6.916 -12.188 1.00 0.00 C ATOM 1081 CG LEU A 63 -22.389 7.954 -11.115 1.00 0.00 C ATOM 1082 CD1 LEU A 63 -21.115 8.555 -10.542 1.00 0.00 C ATOM 1083 CD2 LEU A 63 -23.285 9.044 -11.687 1.00 0.00 C ATOM 0 H LEU A 63 -21.762 5.776 -9.663 1.00 0.00 H new ATOM 0 HA LEU A 63 -21.393 4.890 -12.464 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -21.461 7.399 -12.961 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -22.989 6.597 -12.657 1.00 0.00 H new ATOM 0 HG LEU A 63 -22.926 7.456 -10.308 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -21.371 9.291 -9.780 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -20.509 7.766 -10.096 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -20.550 9.039 -11.339 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -23.511 9.774 -10.910 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -22.774 9.539 -12.513 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -24.213 8.600 -12.048 1.00 0.00 H new ATOM 1095 N THR A 64 -19.302 5.639 -10.346 1.00 0.00 N ATOM 1096 CA THR A 64 -17.901 5.891 -10.034 1.00 0.00 C ATOM 1097 C THR A 64 -17.088 4.603 -10.075 1.00 0.00 C ATOM 1098 O THR A 64 -17.624 3.526 -10.339 1.00 0.00 O ATOM 1099 CB THR A 64 -17.743 6.541 -8.646 1.00 0.00 C ATOM 1100 OG1 THR A 64 -18.964 7.186 -8.265 1.00 0.00 O ATOM 1101 CG2 THR A 64 -16.608 7.554 -8.649 1.00 0.00 C ATOM 0 H THR A 64 -19.823 5.174 -9.602 1.00 0.00 H new ATOM 0 HA THR A 64 -17.527 6.577 -10.793 1.00 0.00 H new ATOM 0 HB THR A 64 -17.507 5.757 -7.927 1.00 0.00 H new ATOM 0 HG1 THR A 64 -18.761 7.980 -7.728 1.00 0.00 H new ATOM 0 HG21 THR A 64 -16.516 8.000 -7.659 1.00 0.00 H new ATOM 0 HG22 THR A 64 -15.675 7.054 -8.911 1.00 0.00 H new ATOM 0 HG23 THR A 64 -16.819 8.335 -9.380 1.00 0.00 H new ATOM 1109 N LYS A 65 -15.791 4.718 -9.811 1.00 0.00 N ATOM 1110 CA LYS A 65 -14.903 3.562 -9.815 1.00 0.00 C ATOM 1111 C LYS A 65 -15.460 2.445 -8.939 1.00 0.00 C ATOM 1112 O LYS A 65 -15.483 1.282 -9.341 1.00 0.00 O ATOM 1113 CB LYS A 65 -13.509 3.962 -9.326 1.00 0.00 C ATOM 1114 CG LYS A 65 -13.520 4.705 -8.001 1.00 0.00 C ATOM 1115 CD LYS A 65 -12.172 5.341 -7.708 1.00 0.00 C ATOM 1116 CE LYS A 65 -12.276 6.388 -6.609 1.00 0.00 C ATOM 1117 NZ LYS A 65 -10.972 7.060 -6.356 1.00 0.00 N ATOM 0 H LYS A 65 -15.331 5.602 -9.591 1.00 0.00 H new ATOM 0 HA LYS A 65 -14.830 3.195 -10.839 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -12.897 3.066 -9.225 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -13.034 4.589 -10.081 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -14.290 5.476 -8.021 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -13.780 4.015 -7.198 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -11.462 4.570 -7.411 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -11.781 5.802 -8.615 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -13.020 7.134 -6.888 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -12.625 5.916 -5.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -11.031 7.612 -5.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -10.224 6.343 -6.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -10.749 7.695 -7.149 1.00 0.00 H new ATOM 1131 N GLU A 66 -15.908 2.806 -7.741 1.00 0.00 N ATOM 1132 CA GLU A 66 -16.466 1.833 -6.809 1.00 0.00 C ATOM 1133 C GLU A 66 -17.554 0.999 -7.479 1.00 0.00 C ATOM 1134 O GLU A 66 -17.635 -0.212 -7.278 1.00 0.00 O ATOM 1135 CB GLU A 66 -17.036 2.541 -5.578 1.00 0.00 C ATOM 1136 CG GLU A 66 -16.453 2.043 -4.266 1.00 0.00 C ATOM 1137 CD GLU A 66 -17.337 2.366 -3.076 1.00 0.00 C ATOM 1138 OE1 GLU A 66 -18.553 2.094 -3.150 1.00 0.00 O ATOM 1139 OE2 GLU A 66 -16.812 2.890 -2.071 1.00 0.00 O ATOM 0 H GLU A 66 -15.896 3.765 -7.393 1.00 0.00 H new ATOM 0 HA GLU A 66 -15.662 1.166 -6.496 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -16.850 3.611 -5.666 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -18.117 2.406 -5.560 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.307 0.964 -4.324 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.470 2.490 -4.116 1.00 0.00 H new ATOM 1146 N ALA A 67 -18.389 1.658 -8.276 1.00 0.00 N ATOM 1147 CA ALA A 67 -19.472 0.979 -8.977 1.00 0.00 C ATOM 1148 C ALA A 67 -18.927 0.030 -10.039 1.00 0.00 C ATOM 1149 O ALA A 67 -19.259 -1.156 -10.056 1.00 0.00 O ATOM 1150 CB ALA A 67 -20.413 1.995 -9.607 1.00 0.00 C ATOM 0 H ALA A 67 -18.336 2.661 -8.452 1.00 0.00 H new ATOM 0 HA ALA A 67 -20.029 0.388 -8.249 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -21.217 1.473 -10.127 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -20.837 2.630 -8.829 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -19.861 2.611 -10.317 1.00 0.00 H new ATOM 1156 N VAL A 68 -18.091 0.559 -10.926 1.00 0.00 N ATOM 1157 CA VAL A 68 -17.500 -0.241 -11.992 1.00 0.00 C ATOM 1158 C VAL A 68 -16.806 -1.478 -11.431 1.00 0.00 C ATOM 1159 O VAL A 68 -16.995 -2.587 -11.929 1.00 0.00 O ATOM 1160 CB VAL A 68 -16.484 0.577 -12.811 1.00 0.00 C ATOM 1161 CG1 VAL A 68 -15.822 -0.296 -13.866 1.00 0.00 C ATOM 1162 CG2 VAL A 68 -17.160 1.780 -13.450 1.00 0.00 C ATOM 0 H VAL A 68 -17.807 1.539 -10.928 1.00 0.00 H new ATOM 0 HA VAL A 68 -18.316 -0.550 -12.645 1.00 0.00 H new ATOM 0 HB VAL A 68 -15.709 0.941 -12.137 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -15.107 0.299 -14.435 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -15.302 -1.122 -13.381 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -16.582 -0.692 -14.540 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -16.427 2.346 -14.025 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -17.957 1.441 -14.112 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -17.581 2.416 -12.672 1.00 0.00 H new ATOM 1172 N ALA A 69 -16.003 -1.278 -10.391 1.00 0.00 N ATOM 1173 CA ALA A 69 -15.283 -2.377 -9.760 1.00 0.00 C ATOM 1174 C ALA A 69 -16.238 -3.303 -9.014 1.00 0.00 C ATOM 1175 O ALA A 69 -15.978 -4.498 -8.874 1.00 0.00 O ATOM 1176 CB ALA A 69 -14.220 -1.838 -8.814 1.00 0.00 C ATOM 0 H ALA A 69 -15.835 -0.365 -9.968 1.00 0.00 H new ATOM 0 HA ALA A 69 -14.795 -2.956 -10.544 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -13.690 -2.670 -8.350 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -13.513 -1.224 -9.373 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -14.694 -1.233 -8.041 1.00 0.00 H new ATOM 1182 N LYS A 70 -17.344 -2.743 -8.537 1.00 0.00 N ATOM 1183 CA LYS A 70 -18.339 -3.518 -7.805 1.00 0.00 C ATOM 1184 C LYS A 70 -18.969 -4.580 -8.701 1.00 0.00 C ATOM 1185 O LYS A 70 -19.019 -5.757 -8.343 1.00 0.00 O ATOM 1186 CB LYS A 70 -19.426 -2.595 -7.249 1.00 0.00 C ATOM 1187 CG LYS A 70 -20.589 -3.338 -6.614 1.00 0.00 C ATOM 1188 CD LYS A 70 -21.544 -2.386 -5.914 1.00 0.00 C ATOM 1189 CE LYS A 70 -21.788 -2.802 -4.472 1.00 0.00 C ATOM 1190 NZ LYS A 70 -22.851 -1.980 -3.829 1.00 0.00 N ATOM 0 H LYS A 70 -17.574 -1.755 -8.644 1.00 0.00 H new ATOM 0 HA LYS A 70 -17.836 -4.018 -6.977 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -18.982 -1.930 -6.508 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -19.804 -1.966 -8.055 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -21.127 -3.896 -7.380 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -20.209 -4.066 -5.897 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -21.135 -1.376 -5.938 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -22.492 -2.359 -6.451 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -22.074 -3.853 -4.441 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -20.862 -2.706 -3.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -22.987 -2.295 -2.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -22.568 -0.979 -3.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -23.741 -2.091 -4.355 1.00 0.00 H new ATOM 1204 N ILE A 71 -19.446 -4.157 -9.866 1.00 0.00 N ATOM 1205 CA ILE A 71 -20.069 -5.072 -10.814 1.00 0.00 C ATOM 1206 C ILE A 71 -19.051 -6.059 -11.376 1.00 0.00 C ATOM 1207 O ILE A 71 -19.253 -7.272 -11.326 1.00 0.00 O ATOM 1208 CB ILE A 71 -20.729 -4.313 -11.980 1.00 0.00 C ATOM 1209 CG1 ILE A 71 -21.522 -3.115 -11.453 1.00 0.00 C ATOM 1210 CG2 ILE A 71 -21.632 -5.244 -12.775 1.00 0.00 C ATOM 1211 CD1 ILE A 71 -22.568 -3.487 -10.425 1.00 0.00 C ATOM 0 H ILE A 71 -19.413 -3.186 -10.176 1.00 0.00 H new ATOM 0 HA ILE A 71 -20.837 -5.618 -10.266 1.00 0.00 H new ATOM 0 HB ILE A 71 -19.947 -3.944 -12.643 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -20.830 -2.397 -11.012 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -22.009 -2.615 -12.290 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -22.091 -4.693 -13.596 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -21.042 -6.068 -13.177 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -22.411 -5.640 -12.123 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -23.091 -2.589 -10.096 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -23.283 -4.181 -10.868 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -22.085 -3.960 -9.570 1.00 0.00 H new ATOM 1223 N VAL A 72 -17.955 -5.530 -11.910 1.00 0.00 N ATOM 1224 CA VAL A 72 -16.903 -6.364 -12.479 1.00 0.00 C ATOM 1225 C VAL A 72 -16.426 -7.408 -11.476 1.00 0.00 C ATOM 1226 O VAL A 72 -16.163 -8.555 -11.836 1.00 0.00 O ATOM 1227 CB VAL A 72 -15.699 -5.516 -12.933 1.00 0.00 C ATOM 1228 CG1 VAL A 72 -14.608 -6.405 -13.509 1.00 0.00 C ATOM 1229 CG2 VAL A 72 -16.137 -4.470 -13.946 1.00 0.00 C ATOM 0 H VAL A 72 -17.772 -4.528 -11.961 1.00 0.00 H new ATOM 0 HA VAL A 72 -17.332 -6.867 -13.346 1.00 0.00 H new ATOM 0 HB VAL A 72 -15.292 -4.999 -12.064 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.766 -5.789 -13.824 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.276 -7.112 -12.749 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -14.999 -6.952 -14.367 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.274 -3.880 -14.256 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -16.570 -4.965 -14.816 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -16.881 -3.815 -13.494 1.00 0.00 H new ATOM 1239 N ASP A 73 -16.318 -7.003 -10.215 1.00 0.00 N ATOM 1240 CA ASP A 73 -15.874 -7.904 -9.158 1.00 0.00 C ATOM 1241 C ASP A 73 -16.866 -9.048 -8.967 1.00 0.00 C ATOM 1242 O ASP A 73 -16.481 -10.216 -8.923 1.00 0.00 O ATOM 1243 CB ASP A 73 -15.700 -7.139 -7.846 1.00 0.00 C ATOM 1244 CG ASP A 73 -15.193 -8.022 -6.723 1.00 0.00 C ATOM 1245 OD1 ASP A 73 -15.875 -9.016 -6.396 1.00 0.00 O ATOM 1246 OD2 ASP A 73 -14.114 -7.720 -6.171 1.00 0.00 O ATOM 0 H ASP A 73 -16.532 -6.057 -9.900 1.00 0.00 H new ATOM 0 HA ASP A 73 -14.913 -8.325 -9.453 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -15.003 -6.315 -7.999 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -16.654 -6.700 -7.556 1.00 0.00 H new ATOM 1251 N ASP A 74 -18.144 -8.702 -8.853 1.00 0.00 N ATOM 1252 CA ASP A 74 -19.192 -9.699 -8.667 1.00 0.00 C ATOM 1253 C ASP A 74 -19.187 -10.713 -9.807 1.00 0.00 C ATOM 1254 O ASP A 74 -19.321 -11.916 -9.584 1.00 0.00 O ATOM 1255 CB ASP A 74 -20.560 -9.022 -8.576 1.00 0.00 C ATOM 1256 CG ASP A 74 -20.788 -8.356 -7.233 1.00 0.00 C ATOM 1257 OD1 ASP A 74 -19.931 -8.516 -6.339 1.00 0.00 O ATOM 1258 OD2 ASP A 74 -21.823 -7.675 -7.076 1.00 0.00 O ATOM 0 H ASP A 74 -18.479 -7.739 -8.886 1.00 0.00 H new ATOM 0 HA ASP A 74 -18.994 -10.227 -7.734 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -20.647 -8.277 -9.367 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -21.341 -9.763 -8.748 1.00 0.00 H new ATOM 1263 N THR A 75 -19.032 -10.218 -11.031 1.00 0.00 N ATOM 1264 CA THR A 75 -19.012 -11.079 -12.207 1.00 0.00 C ATOM 1265 C THR A 75 -17.864 -12.079 -12.136 1.00 0.00 C ATOM 1266 O THR A 75 -18.066 -13.284 -12.292 1.00 0.00 O ATOM 1267 CB THR A 75 -18.883 -10.257 -13.503 1.00 0.00 C ATOM 1268 OG1 THR A 75 -19.016 -8.861 -13.213 1.00 0.00 O ATOM 1269 CG2 THR A 75 -19.939 -10.673 -14.515 1.00 0.00 C ATOM 0 H THR A 75 -18.918 -9.225 -11.234 1.00 0.00 H new ATOM 0 HA THR A 75 -19.959 -11.618 -12.221 1.00 0.00 H new ATOM 0 HB THR A 75 -17.899 -10.446 -13.931 1.00 0.00 H new ATOM 0 HG1 THR A 75 -19.596 -8.442 -13.883 1.00 0.00 H new ATOM 0 HG21 THR A 75 -19.828 -10.079 -15.422 1.00 0.00 H new ATOM 0 HG22 THR A 75 -19.816 -11.729 -14.756 1.00 0.00 H new ATOM 0 HG23 THR A 75 -20.931 -10.510 -14.094 1.00 0.00 H new ATOM 1277 N TYR A 76 -16.658 -11.573 -11.900 1.00 0.00 N ATOM 1278 CA TYR A 76 -15.477 -12.423 -11.811 1.00 0.00 C ATOM 1279 C TYR A 76 -15.590 -13.392 -10.638 1.00 0.00 C ATOM 1280 O TYR A 76 -15.322 -14.586 -10.777 1.00 0.00 O ATOM 1281 CB TYR A 76 -14.218 -11.567 -11.660 1.00 0.00 C ATOM 1282 CG TYR A 76 -13.088 -11.986 -12.572 1.00 0.00 C ATOM 1283 CD1 TYR A 76 -12.853 -13.327 -12.850 1.00 0.00 C ATOM 1284 CD2 TYR A 76 -12.255 -11.041 -13.159 1.00 0.00 C ATOM 1285 CE1 TYR A 76 -11.821 -13.715 -13.682 1.00 0.00 C ATOM 1286 CE2 TYR A 76 -11.222 -11.419 -13.994 1.00 0.00 C ATOM 1287 CZ TYR A 76 -11.009 -12.757 -14.252 1.00 0.00 C ATOM 1288 OH TYR A 76 -9.980 -13.139 -15.084 1.00 0.00 O ATOM 0 H TYR A 76 -16.473 -10.579 -11.767 1.00 0.00 H new ATOM 0 HA TYR A 76 -15.407 -13.002 -12.732 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -14.470 -10.526 -11.863 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -13.877 -11.617 -10.626 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -13.489 -14.080 -12.407 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -12.418 -9.992 -12.959 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -11.651 -14.762 -13.885 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -10.585 -10.671 -14.442 1.00 0.00 H new ATOM 0 HH TYR A 76 -9.505 -12.344 -15.403 1.00 0.00 H new ATOM 1298 N ARG A 77 -15.991 -12.870 -9.484 1.00 0.00 N ATOM 1299 CA ARG A 77 -16.140 -13.687 -8.286 1.00 0.00 C ATOM 1300 C ARG A 77 -17.044 -14.887 -8.556 1.00 0.00 C ATOM 1301 O ARG A 77 -16.759 -16.003 -8.120 1.00 0.00 O ATOM 1302 CB ARG A 77 -16.713 -12.851 -7.140 1.00 0.00 C ATOM 1303 CG ARG A 77 -16.086 -13.157 -5.790 1.00 0.00 C ATOM 1304 CD ARG A 77 -15.396 -11.934 -5.207 1.00 0.00 C ATOM 1305 NE ARG A 77 -14.444 -11.344 -6.144 1.00 0.00 N ATOM 1306 CZ ARG A 77 -13.471 -10.515 -5.779 1.00 0.00 C ATOM 1307 NH1 ARG A 77 -13.323 -10.182 -4.505 1.00 0.00 N ATOM 1308 NH2 ARG A 77 -12.644 -10.020 -6.691 1.00 0.00 N ATOM 0 H ARG A 77 -16.219 -11.884 -9.353 1.00 0.00 H new ATOM 0 HA ARG A 77 -15.154 -14.053 -8.001 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -16.571 -11.794 -7.366 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -17.788 -13.022 -7.079 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -16.855 -13.505 -5.101 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -15.364 -13.967 -5.898 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -16.145 -11.190 -4.935 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -14.877 -12.213 -4.290 1.00 0.00 H new ATOM 0 HE ARG A 77 -14.530 -11.581 -7.132 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -13.956 -10.562 -3.802 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -12.576 -9.546 -4.228 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -12.755 -10.276 -7.672 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -11.897 -9.384 -6.411 1.00 0.00 H new ATOM 1322 N LYS A 78 -18.135 -14.649 -9.276 1.00 0.00 N ATOM 1323 CA LYS A 78 -19.080 -15.709 -9.605 1.00 0.00 C ATOM 1324 C LYS A 78 -18.567 -16.556 -10.765 1.00 0.00 C ATOM 1325 O LYS A 78 -18.922 -17.727 -10.897 1.00 0.00 O ATOM 1326 CB LYS A 78 -20.444 -15.112 -9.961 1.00 0.00 C ATOM 1327 CG LYS A 78 -21.547 -16.148 -10.091 1.00 0.00 C ATOM 1328 CD LYS A 78 -22.261 -16.037 -11.428 1.00 0.00 C ATOM 1329 CE LYS A 78 -21.521 -16.795 -12.520 1.00 0.00 C ATOM 1330 NZ LYS A 78 -22.416 -17.145 -13.657 1.00 0.00 N ATOM 0 H LYS A 78 -18.387 -13.731 -9.643 1.00 0.00 H new ATOM 0 HA LYS A 78 -19.187 -16.350 -8.730 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -20.725 -14.388 -9.196 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -20.358 -14.566 -10.900 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -21.124 -17.147 -9.985 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -22.266 -16.019 -9.282 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -23.274 -16.429 -11.334 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -22.350 -14.987 -11.708 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -20.691 -16.189 -12.884 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -21.091 -17.706 -12.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -21.874 -17.660 -14.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -23.194 -17.744 -13.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -22.806 -16.275 -14.072 1.00 0.00 H new ATOM 1344 N MET A 79 -17.727 -15.956 -11.603 1.00 0.00 N ATOM 1345 CA MET A 79 -17.162 -16.657 -12.751 1.00 0.00 C ATOM 1346 C MET A 79 -16.275 -17.813 -12.299 1.00 0.00 C ATOM 1347 O MET A 79 -16.500 -18.963 -12.675 1.00 0.00 O ATOM 1348 CB MET A 79 -16.357 -15.690 -13.621 1.00 0.00 C ATOM 1349 CG MET A 79 -16.035 -16.239 -15.001 1.00 0.00 C ATOM 1350 SD MET A 79 -14.347 -15.873 -15.517 1.00 0.00 S ATOM 1351 CE MET A 79 -14.549 -14.228 -16.195 1.00 0.00 C ATOM 0 H MET A 79 -17.423 -14.987 -11.509 1.00 0.00 H new ATOM 0 HA MET A 79 -17.985 -17.063 -13.339 1.00 0.00 H new ATOM 0 HB2 MET A 79 -16.916 -14.761 -13.730 1.00 0.00 H new ATOM 0 HB3 MET A 79 -15.426 -15.444 -13.110 1.00 0.00 H new ATOM 0 HG2 MET A 79 -16.185 -17.319 -15.002 1.00 0.00 H new ATOM 0 HG3 MET A 79 -16.732 -15.819 -15.727 1.00 0.00 H new ATOM 0 HE1 MET A 79 -13.599 -13.885 -16.605 1.00 0.00 H new ATOM 0 HE2 MET A 79 -15.299 -14.250 -16.985 1.00 0.00 H new ATOM 0 HE3 MET A 79 -14.871 -13.547 -15.407 1.00 0.00 H new ATOM 1361 N GLN A 80 -15.267 -17.499 -11.491 1.00 0.00 N ATOM 1362 CA GLN A 80 -14.346 -18.512 -10.990 1.00 0.00 C ATOM 1363 C GLN A 80 -13.373 -17.911 -9.981 1.00 0.00 C ATOM 1364 O GLN A 80 -12.265 -18.416 -9.797 1.00 0.00 O ATOM 1365 CB GLN A 80 -13.573 -19.146 -12.147 1.00 0.00 C ATOM 1366 CG GLN A 80 -13.691 -20.660 -12.201 1.00 0.00 C ATOM 1367 CD GLN A 80 -14.612 -21.135 -13.308 1.00 0.00 C ATOM 1368 OE1 GLN A 80 -15.602 -21.823 -13.055 1.00 0.00 O ATOM 1369 NE2 GLN A 80 -14.291 -20.770 -14.543 1.00 0.00 N ATOM 0 H GLN A 80 -15.068 -16.552 -11.170 1.00 0.00 H new ATOM 0 HA GLN A 80 -14.931 -19.283 -10.488 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -13.935 -18.728 -13.087 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -12.521 -18.875 -12.062 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -12.701 -21.093 -12.346 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -14.061 -21.026 -11.243 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -13.462 -20.199 -14.707 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -14.874 -21.060 -15.328 1.00 0.00 H new ATOM 1378 N ILE A 81 -13.794 -16.832 -9.331 1.00 0.00 N ATOM 1379 CA ILE A 81 -12.959 -16.163 -8.340 1.00 0.00 C ATOM 1380 C ILE A 81 -11.553 -15.923 -8.878 1.00 0.00 C ATOM 1381 O ILE A 81 -10.586 -15.882 -8.118 1.00 0.00 O ATOM 1382 CB ILE A 81 -12.866 -16.981 -7.038 1.00 0.00 C ATOM 1383 CG1 ILE A 81 -14.225 -17.596 -6.698 1.00 0.00 C ATOM 1384 CG2 ILE A 81 -12.374 -16.105 -5.896 1.00 0.00 C ATOM 1385 CD1 ILE A 81 -14.224 -18.391 -5.411 1.00 0.00 C ATOM 0 H ILE A 81 -14.708 -16.402 -9.472 1.00 0.00 H new ATOM 0 HA ILE A 81 -13.431 -15.205 -8.124 1.00 0.00 H new ATOM 0 HB ILE A 81 -12.149 -17.789 -7.185 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -14.966 -16.800 -6.623 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -14.536 -18.245 -7.516 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -12.314 -16.697 -4.983 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -11.387 -15.711 -6.139 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -13.068 -15.278 -5.747 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -15.220 -18.797 -5.234 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -13.507 -19.208 -5.489 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -13.944 -17.741 -4.582 1.00 0.00 H new ATOM 1397 N GLN A 82 -11.448 -15.763 -10.194 1.00 0.00 N ATOM 1398 CA GLN A 82 -10.160 -15.526 -10.833 1.00 0.00 C ATOM 1399 C GLN A 82 -9.843 -14.034 -10.884 1.00 0.00 C ATOM 1400 O GLN A 82 -10.748 -13.198 -10.896 1.00 0.00 O ATOM 1401 CB GLN A 82 -10.153 -16.108 -12.248 1.00 0.00 C ATOM 1402 CG GLN A 82 -9.193 -17.274 -12.421 1.00 0.00 C ATOM 1403 CD GLN A 82 -9.330 -18.311 -11.323 1.00 0.00 C ATOM 1404 OE1 GLN A 82 -10.243 -19.136 -11.343 1.00 0.00 O ATOM 1405 NE2 GLN A 82 -8.420 -18.273 -10.357 1.00 0.00 N ATOM 0 H GLN A 82 -12.239 -15.793 -10.837 1.00 0.00 H new ATOM 0 HA GLN A 82 -9.393 -16.023 -10.239 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -11.161 -16.437 -12.502 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -9.887 -15.321 -12.954 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -9.372 -17.747 -13.387 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -8.170 -16.898 -12.435 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.680 -17.571 -10.381 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -8.461 -18.946 -9.591 1.00 0.00 H new ATOM 1414 N CYS A 83 -8.556 -13.708 -10.912 1.00 0.00 N ATOM 1415 CA CYS A 83 -8.121 -12.317 -10.960 1.00 0.00 C ATOM 1416 C CYS A 83 -8.796 -11.498 -9.864 1.00 0.00 C ATOM 1417 O CYS A 83 -9.244 -10.377 -10.100 1.00 0.00 O ATOM 1418 CB CYS A 83 -8.429 -11.711 -12.329 1.00 0.00 C ATOM 1419 SG CYS A 83 -7.118 -10.648 -12.979 1.00 0.00 S ATOM 0 H CYS A 83 -7.796 -14.388 -10.902 1.00 0.00 H new ATOM 0 HA CYS A 83 -7.044 -12.293 -10.795 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -8.613 -12.518 -13.038 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -9.350 -11.132 -12.259 1.00 0.00 H new ATOM 0 HG CYS A 83 -7.471 -10.185 -14.141 1.00 0.00 H new ATOM 1425 N ALA A 84 -8.866 -12.068 -8.665 1.00 0.00 N ATOM 1426 CA ALA A 84 -9.486 -11.390 -7.533 1.00 0.00 C ATOM 1427 C ALA A 84 -8.447 -11.014 -6.482 1.00 0.00 C ATOM 1428 O ALA A 84 -8.356 -11.626 -5.418 1.00 0.00 O ATOM 1429 CB ALA A 84 -10.566 -12.269 -6.919 1.00 0.00 C ATOM 0 H ALA A 84 -8.501 -12.997 -8.453 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.944 -10.471 -7.898 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.021 -11.751 -6.075 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.329 -12.484 -7.667 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.123 -13.203 -6.575 1.00 0.00 H new ATOM 1435 N PRO A 85 -7.643 -9.985 -6.786 1.00 0.00 N ATOM 1436 CA PRO A 85 -6.596 -9.504 -5.880 1.00 0.00 C ATOM 1437 C PRO A 85 -7.168 -8.820 -4.643 1.00 0.00 C ATOM 1438 O PRO A 85 -6.431 -8.456 -3.726 1.00 0.00 O ATOM 1439 CB PRO A 85 -5.820 -8.500 -6.736 1.00 0.00 C ATOM 1440 CG PRO A 85 -6.800 -8.034 -7.756 1.00 0.00 C ATOM 1441 CD PRO A 85 -7.695 -9.209 -8.037 1.00 0.00 C ATOM 0 HA PRO A 85 -5.984 -10.320 -5.495 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -5.450 -7.670 -6.134 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -4.953 -8.966 -7.204 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.375 -7.185 -7.386 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -6.293 -7.704 -8.663 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -8.711 -8.893 -8.272 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.338 -9.792 -8.886 1.00 0.00 H new ATOM 1449 N ASP A 86 -8.485 -8.648 -4.624 1.00 0.00 N ATOM 1450 CA ASP A 86 -9.156 -8.009 -3.498 1.00 0.00 C ATOM 1451 C ASP A 86 -8.782 -6.533 -3.409 1.00 0.00 C ATOM 1452 O ASP A 86 -7.899 -6.151 -2.639 1.00 0.00 O ATOM 1453 CB ASP A 86 -8.797 -8.719 -2.192 1.00 0.00 C ATOM 1454 CG ASP A 86 -9.772 -8.404 -1.075 1.00 0.00 C ATOM 1455 OD1 ASP A 86 -10.279 -7.264 -1.033 1.00 0.00 O ATOM 1456 OD2 ASP A 86 -10.028 -9.298 -0.242 1.00 0.00 O ATOM 0 H ASP A 86 -9.109 -8.942 -5.375 1.00 0.00 H new ATOM 0 HA ASP A 86 -10.232 -8.084 -3.658 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.778 -9.796 -2.361 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.792 -8.426 -1.887 1.00 0.00 H new ATOM 1461 N LEU A 87 -9.457 -5.708 -4.201 1.00 0.00 N ATOM 1462 CA LEU A 87 -9.194 -4.273 -4.213 1.00 0.00 C ATOM 1463 C LEU A 87 -9.234 -3.700 -2.799 1.00 0.00 C ATOM 1464 O LEU A 87 -8.619 -2.672 -2.518 1.00 0.00 O ATOM 1465 CB LEU A 87 -10.216 -3.554 -5.095 1.00 0.00 C ATOM 1466 CG LEU A 87 -10.385 -4.105 -6.512 1.00 0.00 C ATOM 1467 CD1 LEU A 87 -11.797 -4.632 -6.715 1.00 0.00 C ATOM 1468 CD2 LEU A 87 -10.059 -3.034 -7.542 1.00 0.00 C ATOM 0 H LEU A 87 -10.191 -6.008 -4.843 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.196 -4.115 -4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -11.184 -3.587 -4.596 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.930 -2.505 -5.166 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.689 -4.933 -6.646 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.898 -5.020 -7.729 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.994 -5.430 -6.000 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -12.512 -3.824 -6.562 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.184 -3.443 -8.544 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.730 -2.186 -7.410 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -9.028 -2.705 -7.411 1.00 0.00 H new ATOM 1480 N ALA A 88 -9.960 -4.375 -1.914 1.00 0.00 N ATOM 1481 CA ALA A 88 -10.076 -3.936 -0.529 1.00 0.00 C ATOM 1482 C ALA A 88 -10.828 -2.613 -0.433 1.00 0.00 C ATOM 1483 O ALA A 88 -10.563 -1.798 0.451 1.00 0.00 O ATOM 1484 CB ALA A 88 -8.697 -3.808 0.102 1.00 0.00 C ATOM 0 H ALA A 88 -10.476 -5.227 -2.131 1.00 0.00 H new ATOM 0 HA ALA A 88 -10.645 -4.688 0.017 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -8.799 -3.479 1.136 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.194 -4.775 0.076 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.109 -3.078 -0.454 1.00 0.00 H new ATOM 1490 N THR A 89 -11.768 -2.404 -1.351 1.00 0.00 N ATOM 1491 CA THR A 89 -12.557 -1.179 -1.371 1.00 0.00 C ATOM 1492 C THR A 89 -11.659 0.053 -1.376 1.00 0.00 C ATOM 1493 O THR A 89 -12.047 1.118 -0.895 1.00 0.00 O ATOM 1494 CB THR A 89 -13.507 -1.102 -0.162 1.00 0.00 C ATOM 1495 OG1 THR A 89 -14.057 -2.396 0.112 1.00 0.00 O ATOM 1496 CG2 THR A 89 -14.633 -0.112 -0.419 1.00 0.00 C ATOM 0 H THR A 89 -12.001 -3.068 -2.090 1.00 0.00 H new ATOM 0 HA THR A 89 -13.148 -1.199 -2.287 1.00 0.00 H new ATOM 0 HB THR A 89 -12.934 -0.760 0.700 1.00 0.00 H new ATOM 0 HG1 THR A 89 -14.659 -2.339 0.883 1.00 0.00 H new ATOM 0 HG21 THR A 89 -15.291 -0.075 0.449 1.00 0.00 H new ATOM 0 HG22 THR A 89 -14.213 0.878 -0.598 1.00 0.00 H new ATOM 0 HG23 THR A 89 -15.203 -0.428 -1.293 1.00 0.00 H new ATOM 1504 N ARG A 90 -10.458 -0.098 -1.924 1.00 0.00 N ATOM 1505 CA ARG A 90 -9.505 1.004 -1.991 1.00 0.00 C ATOM 1506 C ARG A 90 -9.184 1.530 -0.595 1.00 0.00 C ATOM 1507 O ARG A 90 -8.755 2.673 -0.436 1.00 0.00 O ATOM 1508 CB ARG A 90 -10.060 2.134 -2.859 1.00 0.00 C ATOM 1509 CG ARG A 90 -9.331 2.300 -4.183 1.00 0.00 C ATOM 1510 CD ARG A 90 -10.280 2.154 -5.363 1.00 0.00 C ATOM 1511 NE ARG A 90 -11.049 0.914 -5.297 1.00 0.00 N ATOM 1512 CZ ARG A 90 -12.195 0.724 -5.941 1.00 0.00 C ATOM 1513 NH1 ARG A 90 -12.702 1.689 -6.696 1.00 0.00 N ATOM 1514 NH2 ARG A 90 -12.836 -0.432 -5.832 1.00 0.00 N ATOM 0 H ARG A 90 -10.122 -0.972 -2.328 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.585 0.630 -2.440 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -11.115 1.944 -3.056 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -10.003 3.070 -2.303 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -8.854 3.280 -4.217 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -8.537 1.557 -4.259 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -10.963 3.003 -5.386 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -9.710 2.178 -6.292 1.00 0.00 H new ATOM 0 HE ARG A 90 -10.686 0.152 -4.725 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -12.212 2.579 -6.783 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -13.582 1.541 -7.190 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -12.449 -1.177 -5.253 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -13.716 -0.576 -6.327 1.00 0.00 H new ATOM 1528 N SER A 91 -9.395 0.689 0.412 1.00 0.00 N ATOM 1529 CA SER A 91 -9.132 1.071 1.794 1.00 0.00 C ATOM 1530 C SER A 91 -7.734 0.634 2.223 1.00 0.00 C ATOM 1531 O SER A 91 -7.543 -0.478 2.717 1.00 0.00 O ATOM 1532 CB SER A 91 -10.179 0.454 2.724 1.00 0.00 C ATOM 1533 OG SER A 91 -11.482 0.900 2.391 1.00 0.00 O ATOM 0 H SER A 91 -9.747 -0.261 0.297 1.00 0.00 H new ATOM 0 HA SER A 91 -9.191 2.157 1.862 1.00 0.00 H new ATOM 0 HB2 SER A 91 -10.135 -0.633 2.656 1.00 0.00 H new ATOM 0 HB3 SER A 91 -9.953 0.718 3.757 1.00 0.00 H new ATOM 0 HG SER A 91 -12.133 0.491 2.998 1.00 0.00 H new ATOM 1539 N HIS A 92 -6.759 1.517 2.029 1.00 0.00 N ATOM 1540 CA HIS A 92 -5.378 1.223 2.395 1.00 0.00 C ATOM 1541 C HIS A 92 -4.721 2.434 3.050 1.00 0.00 C ATOM 1542 O HIS A 92 -3.534 2.693 2.850 1.00 0.00 O ATOM 1543 CB HIS A 92 -4.580 0.800 1.162 1.00 0.00 C ATOM 1544 CG HIS A 92 -4.633 1.795 0.044 1.00 0.00 C ATOM 1545 ND1 HIS A 92 -5.147 3.066 0.191 1.00 0.00 N ATOM 1546 CD2 HIS A 92 -4.229 1.702 -1.245 1.00 0.00 C ATOM 1547 CE1 HIS A 92 -5.060 3.710 -0.959 1.00 0.00 C ATOM 1548 NE2 HIS A 92 -4.506 2.905 -1.847 1.00 0.00 N ATOM 0 H HIS A 92 -6.900 2.441 1.621 1.00 0.00 H new ATOM 0 HA HIS A 92 -5.385 0.402 3.112 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -3.540 0.643 1.449 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -4.960 -0.157 0.804 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -3.774 0.842 -1.713 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -5.387 4.723 -1.142 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -4.315 3.139 -2.821 1.00 0.00 H new ATOM 1556 N SER A 93 -5.500 3.173 3.833 1.00 0.00 N ATOM 1557 CA SER A 93 -4.995 4.360 4.514 1.00 0.00 C ATOM 1558 C SER A 93 -4.551 5.416 3.507 1.00 0.00 C ATOM 1559 O SER A 93 -3.362 5.559 3.224 1.00 0.00 O ATOM 1560 CB SER A 93 -3.827 3.989 5.430 1.00 0.00 C ATOM 1561 OG SER A 93 -4.247 3.900 6.781 1.00 0.00 O ATOM 0 H SER A 93 -6.484 2.971 4.012 1.00 0.00 H new ATOM 0 HA SER A 93 -5.803 4.775 5.117 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.402 3.036 5.115 1.00 0.00 H new ATOM 0 HB3 SER A 93 -3.038 4.736 5.339 1.00 0.00 H new ATOM 0 HG SER A 93 -3.483 3.660 7.346 1.00 0.00 H new ATOM 1567 N GLY A 94 -5.517 6.154 2.968 1.00 0.00 N ATOM 1568 CA GLY A 94 -5.206 7.188 1.998 1.00 0.00 C ATOM 1569 C GLY A 94 -5.435 8.584 2.545 1.00 0.00 C ATOM 1570 O GLY A 94 -4.588 9.125 3.257 1.00 0.00 O ATOM 0 H GLY A 94 -6.509 6.054 3.186 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -4.166 7.089 1.687 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -5.820 7.044 1.109 1.00 0.00 H new ATOM 1574 N SER A 95 -6.581 9.168 2.212 1.00 0.00 N ATOM 1575 CA SER A 95 -6.916 10.511 2.670 1.00 0.00 C ATOM 1576 C SER A 95 -8.288 10.935 2.155 1.00 0.00 C ATOM 1577 O SER A 95 -8.549 12.121 1.954 1.00 0.00 O ATOM 1578 CB SER A 95 -5.854 11.511 2.206 1.00 0.00 C ATOM 1579 OG SER A 95 -5.500 11.287 0.852 1.00 0.00 O ATOM 0 H SER A 95 -7.294 8.732 1.627 1.00 0.00 H new ATOM 0 HA SER A 95 -6.944 10.500 3.760 1.00 0.00 H new ATOM 0 HB2 SER A 95 -6.231 12.527 2.323 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.969 11.425 2.836 1.00 0.00 H new ATOM 0 HG SER A 95 -4.821 11.939 0.579 1.00 0.00 H new ATOM 1585 N ASP A 96 -9.161 9.956 1.944 1.00 0.00 N ATOM 1586 CA ASP A 96 -10.508 10.225 1.453 1.00 0.00 C ATOM 1587 C ASP A 96 -11.555 9.610 2.376 1.00 0.00 C ATOM 1588 O ASP A 96 -12.756 9.806 2.187 1.00 0.00 O ATOM 1589 CB ASP A 96 -10.676 9.679 0.035 1.00 0.00 C ATOM 1590 CG ASP A 96 -10.091 10.604 -1.015 1.00 0.00 C ATOM 1591 OD1 ASP A 96 -9.748 11.753 -0.668 1.00 0.00 O ATOM 1592 OD2 ASP A 96 -9.978 10.179 -2.184 1.00 0.00 O ATOM 0 H ASP A 96 -8.960 8.969 2.105 1.00 0.00 H new ATOM 0 HA ASP A 96 -10.653 11.305 1.437 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -10.194 8.704 -0.035 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -11.736 9.526 -0.169 1.00 0.00 H new ATOM 1597 N PHE A 97 -11.093 8.865 3.374 1.00 0.00 N ATOM 1598 CA PHE A 97 -11.989 8.219 4.325 1.00 0.00 C ATOM 1599 C PHE A 97 -11.994 8.961 5.658 1.00 0.00 C ATOM 1600 O PHE A 97 -12.498 8.455 6.661 1.00 0.00 O ATOM 1601 CB PHE A 97 -11.575 6.762 4.541 1.00 0.00 C ATOM 1602 CG PHE A 97 -12.617 5.771 4.108 1.00 0.00 C ATOM 1603 CD1 PHE A 97 -13.785 5.612 4.835 1.00 0.00 C ATOM 1604 CD2 PHE A 97 -12.428 4.999 2.973 1.00 0.00 C ATOM 1605 CE1 PHE A 97 -14.747 4.701 4.439 1.00 0.00 C ATOM 1606 CE2 PHE A 97 -13.386 4.087 2.571 1.00 0.00 C ATOM 1607 CZ PHE A 97 -14.546 3.937 3.306 1.00 0.00 C ATOM 0 H PHE A 97 -10.102 8.694 3.545 1.00 0.00 H new ATOM 0 HA PHE A 97 -12.997 8.245 3.911 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -10.653 6.570 3.993 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -11.356 6.608 5.598 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -13.946 6.207 5.722 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -11.522 5.111 2.396 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -15.654 4.587 5.015 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -13.228 3.492 1.683 1.00 0.00 H new ATOM 0 HZ PHE A 97 -15.295 3.223 2.995 1.00 0.00 H new ATOM 1617 N SER A 98 -11.430 10.164 5.661 1.00 0.00 N ATOM 1618 CA SER A 98 -11.365 10.976 6.871 1.00 0.00 C ATOM 1619 C SER A 98 -12.465 12.032 6.877 1.00 0.00 C ATOM 1620 O SER A 98 -12.226 13.196 6.555 1.00 0.00 O ATOM 1621 CB SER A 98 -9.996 11.649 6.986 1.00 0.00 C ATOM 1622 OG SER A 98 -9.050 10.781 7.588 1.00 0.00 O ATOM 0 H SER A 98 -11.011 10.599 4.839 1.00 0.00 H new ATOM 0 HA SER A 98 -11.512 10.319 7.728 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.647 11.942 5.996 1.00 0.00 H new ATOM 0 HB3 SER A 98 -10.084 12.561 7.576 1.00 0.00 H new ATOM 0 HG SER A 98 -8.183 11.234 7.649 1.00 0.00 H new ATOM 1628 N PHE A 99 -13.673 11.617 7.244 1.00 0.00 N ATOM 1629 CA PHE A 99 -14.812 12.526 7.291 1.00 0.00 C ATOM 1630 C PHE A 99 -14.963 13.279 5.972 1.00 0.00 C ATOM 1631 O PHE A 99 -15.100 14.502 5.955 1.00 0.00 O ATOM 1632 CB PHE A 99 -14.651 13.521 8.443 1.00 0.00 C ATOM 1633 CG PHE A 99 -15.956 14.048 8.967 1.00 0.00 C ATOM 1634 CD1 PHE A 99 -16.790 13.241 9.725 1.00 0.00 C ATOM 1635 CD2 PHE A 99 -16.349 15.350 8.703 1.00 0.00 C ATOM 1636 CE1 PHE A 99 -17.992 13.723 10.208 1.00 0.00 C ATOM 1637 CE2 PHE A 99 -17.550 15.838 9.183 1.00 0.00 C ATOM 1638 CZ PHE A 99 -18.371 15.023 9.938 1.00 0.00 C ATOM 0 H PHE A 99 -13.888 10.657 7.513 1.00 0.00 H new ATOM 0 HA PHE A 99 -15.711 11.932 7.455 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -14.110 13.038 9.257 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -14.039 14.358 8.107 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -16.497 12.224 9.941 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -15.709 15.991 8.115 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -18.634 13.084 10.796 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -17.846 16.854 8.968 1.00 0.00 H new ATOM 0 HZ PHE A 99 -19.309 15.402 10.317 1.00 0.00 H new ATOM 1648 N ARG A 100 -14.935 12.538 4.869 1.00 0.00 N ATOM 1649 CA ARG A 100 -15.066 13.134 3.545 1.00 0.00 C ATOM 1650 C ARG A 100 -16.260 14.083 3.492 1.00 0.00 C ATOM 1651 O ARG A 100 -17.418 13.665 3.499 1.00 0.00 O ATOM 1652 CB ARG A 100 -15.221 12.043 2.484 1.00 0.00 C ATOM 1653 CG ARG A 100 -16.320 11.040 2.798 1.00 0.00 C ATOM 1654 CD ARG A 100 -15.752 9.652 3.048 1.00 0.00 C ATOM 1655 NE ARG A 100 -16.705 8.786 3.737 1.00 0.00 N ATOM 1656 CZ ARG A 100 -17.760 8.237 3.146 1.00 0.00 C ATOM 1657 NH1 ARG A 100 -17.995 8.461 1.860 1.00 0.00 N ATOM 1658 NH2 ARG A 100 -18.582 7.460 3.840 1.00 0.00 N ATOM 0 H ARG A 100 -14.823 11.524 4.866 1.00 0.00 H new ATOM 0 HA ARG A 100 -14.160 13.705 3.340 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -15.431 12.511 1.522 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -14.275 11.512 2.380 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -16.876 11.370 3.675 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -17.027 11.001 1.969 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -15.472 9.198 2.097 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -14.842 9.734 3.642 1.00 0.00 H new ATOM 0 HE ARG A 100 -16.552 8.592 4.727 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -17.365 9.056 1.322 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -18.806 8.038 1.409 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -18.404 7.284 4.829 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -19.392 7.039 3.385 1.00 0.00 H new ATOM 1672 N PRO A 101 -15.973 15.392 3.438 1.00 0.00 N ATOM 1673 CA PRO A 101 -17.009 16.428 3.383 1.00 0.00 C ATOM 1674 C PRO A 101 -17.751 16.435 2.051 1.00 0.00 C ATOM 1675 O PRO A 101 -17.301 17.050 1.083 1.00 0.00 O ATOM 1676 CB PRO A 101 -16.221 17.728 3.564 1.00 0.00 C ATOM 1677 CG PRO A 101 -14.848 17.408 3.084 1.00 0.00 C ATOM 1678 CD PRO A 101 -14.615 15.962 3.426 1.00 0.00 C ATOM 0 HA PRO A 101 -17.781 16.273 4.137 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -16.662 18.542 2.988 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -16.212 18.044 4.607 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -14.762 17.574 2.010 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -14.108 18.047 3.565 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -13.980 15.472 2.688 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -14.124 15.852 4.393 1.00 0.00 H new ATOM 1686 N ILE A 102 -18.888 15.750 2.008 1.00 0.00 N ATOM 1687 CA ILE A 102 -19.692 15.680 0.794 1.00 0.00 C ATOM 1688 C ILE A 102 -21.182 15.716 1.119 1.00 0.00 C ATOM 1689 O ILE A 102 -21.994 15.110 0.420 1.00 0.00 O ATOM 1690 CB ILE A 102 -19.385 14.404 -0.012 1.00 0.00 C ATOM 1691 CG1 ILE A 102 -17.893 14.073 0.064 1.00 0.00 C ATOM 1692 CG2 ILE A 102 -19.823 14.573 -1.459 1.00 0.00 C ATOM 1693 CD1 ILE A 102 -17.402 13.229 -1.091 1.00 0.00 C ATOM 0 H ILE A 102 -19.274 15.235 2.800 1.00 0.00 H new ATOM 0 HA ILE A 102 -19.432 16.551 0.193 1.00 0.00 H new ATOM 0 HB ILE A 102 -19.944 13.575 0.422 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -17.324 15.002 0.092 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -17.693 13.548 0.998 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -19.599 13.663 -2.016 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -20.895 14.766 -1.494 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -19.289 15.412 -1.905 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -16.336 13.033 -0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -17.945 12.284 -1.108 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -17.570 13.761 -2.028 1.00 0.00 H new ATOM 1705 N GLU A 103 -21.533 16.433 2.182 1.00 0.00 N ATOM 1706 CA GLU A 103 -22.926 16.549 2.597 1.00 0.00 C ATOM 1707 C GLU A 103 -23.573 15.173 2.723 1.00 0.00 C ATOM 1708 O GLU A 103 -24.734 14.987 2.361 1.00 0.00 O ATOM 1709 CB GLU A 103 -23.709 17.405 1.600 1.00 0.00 C ATOM 1710 CG GLU A 103 -23.194 18.829 1.483 1.00 0.00 C ATOM 1711 CD GLU A 103 -23.398 19.412 0.098 1.00 0.00 C ATOM 1712 OE1 GLU A 103 -24.263 18.895 -0.641 1.00 0.00 O ATOM 1713 OE2 GLU A 103 -22.693 20.383 -0.248 1.00 0.00 O ATOM 0 H GLU A 103 -20.873 16.941 2.771 1.00 0.00 H new ATOM 0 HA GLU A 103 -22.948 17.032 3.574 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.670 16.932 0.619 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -24.757 17.430 1.900 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -23.702 19.456 2.215 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.132 18.849 1.728 1.00 0.00 H new ATOM 1720 N GLU A 104 -22.812 14.212 3.237 1.00 0.00 N ATOM 1721 CA GLU A 104 -23.311 12.853 3.408 1.00 0.00 C ATOM 1722 C GLU A 104 -24.372 12.797 4.503 1.00 0.00 C ATOM 1723 O GLU A 104 -24.074 12.492 5.657 1.00 0.00 O ATOM 1724 CB GLU A 104 -22.160 11.903 3.749 1.00 0.00 C ATOM 1725 CG GLU A 104 -21.677 11.083 2.565 1.00 0.00 C ATOM 1726 CD GLU A 104 -22.525 9.850 2.323 1.00 0.00 C ATOM 1727 OE1 GLU A 104 -23.712 10.006 1.966 1.00 0.00 O ATOM 1728 OE2 GLU A 104 -22.002 8.728 2.491 1.00 0.00 O ATOM 0 H GLU A 104 -21.848 14.349 3.542 1.00 0.00 H new ATOM 0 HA GLU A 104 -23.766 12.539 2.469 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -21.326 12.483 4.143 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -22.481 11.227 4.542 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -21.684 11.705 1.670 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -20.644 10.781 2.735 1.00 0.00 H new ATOM 1735 N ALA A 105 -25.613 13.094 4.131 1.00 0.00 N ATOM 1736 CA ALA A 105 -26.720 13.077 5.080 1.00 0.00 C ATOM 1737 C ALA A 105 -27.402 11.713 5.103 1.00 0.00 C ATOM 1738 O ALA A 105 -28.630 11.622 5.131 1.00 0.00 O ATOM 1739 CB ALA A 105 -27.726 14.166 4.737 1.00 0.00 C ATOM 0 H ALA A 105 -25.877 13.349 3.179 1.00 0.00 H new ATOM 0 HA ALA A 105 -26.317 13.270 6.074 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -28.547 14.142 5.454 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -27.237 15.139 4.778 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -28.116 13.998 3.733 1.00 0.00 H new TER 1745 ALA A 105