USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 996 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 76 LYS NZ :NH3+ -153:sc= -0.0458 (180deg=-0.465) USER MOD Set 1.2: A 78 GLN : amide:sc= 0 X(o=-0.046,f=-0.046) USER MOD Single : A 45 SER OG : rot -45:sc= -0.134 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 65:sc= -6.18! USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= -2.98! USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 137:sc= -0.91 (180deg=-3.42!) USER MOD Single : A 80 SER OG : rot -171:sc= 0.894 USER MOD Single : A 83 GLN : amide:sc= -0.277 X(o=-0.28,f=-0.21) USER MOD Single : A 91 LYS NZ :NH3+ -157:sc= -0.107 (180deg=-0.77) USER MOD Single : A 93 ASN : amide:sc= 0.245! C(o=0.24!,f=-14!) USER MOD Single : A 101 THR OG1 : rot -47:sc= 0.673 USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= -0.141 X(o=-0.14,f=-0.043) USER MOD Single : A 105 SER OG : rot -100:sc= -3.29! USER MOD Single : A 108 TYR OH : rot 180:sc= -0.0574 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -20.4! C(o=-20!,f=-24!) USER MOD Single : A 114 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 118 GLN : amide:sc= -0.227 K(o=-0.23,f=-1.6) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 163:sc= -0.0683 (180deg=-0.46) USER MOD Single : A 130 ASN :FLIP amide:sc= -15.8! C(o=-29!,f=-16!) USER MOD Single : A 134 ASN : amide:sc= -0.835 X(o=-0.84,f=-0.61) USER MOD Single : A 138 ASN : amide:sc= -5.07! C(o=-5.1!,f=-13!) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 THR OG1 : rot 180:sc= -0.701 USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 ASN : amide:sc= -0.541 K(o=-0.54,f=-1.4) USER MOD Single : A 157 HIS : no HD1:sc= -0.0858 X(o=-0.086,f=-0.086) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 GLN :FLIP amide:sc= -7.58! C(o=-12!,f=-7.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 45 6.877 -9.772 -9.343 1.00 0.00 N ATOM 2 CA SER A 45 7.210 -8.420 -8.830 1.00 0.00 C ATOM 3 C SER A 45 6.841 -7.391 -9.881 1.00 0.00 C ATOM 4 O SER A 45 6.164 -6.416 -9.618 1.00 0.00 O ATOM 5 CB SER A 45 8.711 -8.325 -8.573 1.00 0.00 C ATOM 6 OG SER A 45 9.404 -8.640 -9.777 1.00 0.00 O ATOM 0 HA SER A 45 6.662 -8.239 -7.905 1.00 0.00 H new ATOM 0 HB2 SER A 45 8.974 -7.322 -8.238 1.00 0.00 H new ATOM 0 HB3 SER A 45 9.002 -9.013 -7.779 1.00 0.00 H new ATOM 0 HG SER A 45 9.007 -9.438 -10.184 1.00 0.00 H new ATOM 14 N ASP A 46 7.295 -7.601 -11.074 1.00 0.00 N ATOM 15 CA ASP A 46 6.996 -6.639 -12.149 1.00 0.00 C ATOM 16 C ASP A 46 5.485 -6.530 -12.383 1.00 0.00 C ATOM 17 O ASP A 46 4.915 -5.464 -12.419 1.00 0.00 O ATOM 18 CB ASP A 46 7.624 -7.143 -13.444 1.00 0.00 C ATOM 19 CG ASP A 46 7.351 -6.117 -14.552 1.00 0.00 C ATOM 20 OD1 ASP A 46 7.709 -4.955 -14.378 1.00 0.00 O ATOM 21 OD2 ASP A 46 6.795 -6.511 -15.556 1.00 0.00 O ATOM 0 H ASP A 46 7.863 -8.402 -11.351 1.00 0.00 H new ATOM 0 HA ASP A 46 7.392 -5.666 -11.859 1.00 0.00 H new ATOM 0 HB2 ASP A 46 8.697 -7.283 -13.314 1.00 0.00 H new ATOM 0 HB3 ASP A 46 7.206 -8.113 -13.715 1.00 0.00 H new ATOM 26 N MET A 47 4.843 -7.660 -12.691 1.00 0.00 N ATOM 27 CA MET A 47 3.405 -7.651 -13.098 1.00 0.00 C ATOM 28 C MET A 47 2.603 -6.663 -12.283 1.00 0.00 C ATOM 29 O MET A 47 1.961 -5.760 -12.797 1.00 0.00 O ATOM 30 CB MET A 47 2.770 -9.057 -12.957 1.00 0.00 C ATOM 31 CG MET A 47 3.508 -10.063 -13.873 1.00 0.00 C ATOM 32 SD MET A 47 2.595 -10.277 -15.433 1.00 0.00 S ATOM 33 CE MET A 47 1.441 -11.563 -14.882 1.00 0.00 C ATOM 0 H MET A 47 5.272 -8.585 -12.672 1.00 0.00 H new ATOM 0 HA MET A 47 3.380 -7.350 -14.145 1.00 0.00 H new ATOM 0 HB2 MET A 47 2.825 -9.388 -11.920 1.00 0.00 H new ATOM 0 HB3 MET A 47 1.714 -9.017 -13.223 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.517 -9.706 -14.079 1.00 0.00 H new ATOM 0 HG3 MET A 47 3.607 -11.023 -13.366 1.00 0.00 H new ATOM 0 HE1 MET A 47 0.783 -11.838 -15.706 1.00 0.00 H new ATOM 0 HE2 MET A 47 2.001 -12.440 -14.557 1.00 0.00 H new ATOM 0 HE3 MET A 47 0.844 -11.185 -14.052 1.00 0.00 H new ATOM 43 N THR A 48 2.603 -6.888 -10.968 1.00 0.00 N ATOM 44 CA THR A 48 1.847 -6.042 -10.047 1.00 0.00 C ATOM 45 C THR A 48 2.349 -4.606 -10.231 1.00 0.00 C ATOM 46 O THR A 48 1.612 -3.652 -10.117 1.00 0.00 O ATOM 47 CB THR A 48 2.094 -6.633 -8.626 1.00 0.00 C ATOM 48 OG1 THR A 48 1.213 -6.077 -7.674 1.00 0.00 O ATOM 49 CG2 THR A 48 3.550 -6.439 -8.155 1.00 0.00 C ATOM 0 H THR A 48 3.117 -7.647 -10.519 1.00 0.00 H new ATOM 0 HA THR A 48 0.771 -6.020 -10.220 1.00 0.00 H new ATOM 0 HB THR A 48 1.902 -7.703 -8.707 1.00 0.00 H new ATOM 0 HG1 THR A 48 0.293 -6.335 -7.890 1.00 0.00 H new ATOM 0 HG21 THR A 48 3.671 -6.868 -7.160 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.226 -6.937 -8.849 1.00 0.00 H new ATOM 0 HG23 THR A 48 3.783 -5.375 -8.122 1.00 0.00 H new ATOM 57 N ARG A 49 3.598 -4.447 -10.559 1.00 0.00 N ATOM 58 CA ARG A 49 4.121 -3.066 -10.768 1.00 0.00 C ATOM 59 C ARG A 49 3.115 -2.217 -11.555 1.00 0.00 C ATOM 60 O ARG A 49 2.703 -1.154 -11.135 1.00 0.00 O ATOM 61 CB ARG A 49 5.418 -3.090 -11.594 1.00 0.00 C ATOM 62 CG ARG A 49 6.019 -1.681 -11.575 1.00 0.00 C ATOM 63 CD ARG A 49 7.430 -1.696 -12.164 1.00 0.00 C ATOM 64 NE ARG A 49 7.989 -0.311 -12.143 1.00 0.00 N ATOM 65 CZ ARG A 49 8.977 0.004 -12.939 1.00 0.00 C ATOM 66 NH1 ARG A 49 9.477 -0.897 -13.737 1.00 0.00 N ATOM 67 NH2 ARG A 49 9.471 1.215 -12.936 1.00 0.00 N ATOM 0 H ARG A 49 4.273 -5.200 -10.691 1.00 0.00 H new ATOM 0 HA ARG A 49 4.298 -2.644 -9.779 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.122 -3.810 -11.177 1.00 0.00 H new ATOM 0 HB3 ARG A 49 5.212 -3.402 -12.618 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.387 -1.001 -12.146 1.00 0.00 H new ATOM 0 HG3 ARG A 49 6.049 -1.305 -10.552 1.00 0.00 H new ATOM 0 HD2 ARG A 49 8.069 -2.367 -11.590 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.406 -2.075 -13.186 1.00 0.00 H new ATOM 0 HE ARG A 49 7.601 0.387 -11.509 1.00 0.00 H new ATOM 0 HH11 ARG A 49 9.097 -1.844 -13.739 1.00 0.00 H new ATOM 0 HH12 ARG A 49 10.248 -0.655 -14.360 1.00 0.00 H new ATOM 0 HH21 ARG A 49 9.085 1.922 -12.310 1.00 0.00 H new ATOM 0 HH22 ARG A 49 10.242 1.453 -13.560 1.00 0.00 H new ATOM 81 N ASP A 50 2.746 -2.701 -12.735 1.00 0.00 N ATOM 82 CA ASP A 50 1.822 -2.031 -13.724 1.00 0.00 C ATOM 83 C ASP A 50 0.362 -1.966 -13.283 1.00 0.00 C ATOM 84 O ASP A 50 -0.197 -0.895 -13.173 1.00 0.00 O ATOM 85 CB ASP A 50 1.858 -2.813 -15.049 1.00 0.00 C ATOM 86 CG ASP A 50 1.078 -2.064 -16.142 1.00 0.00 C ATOM 87 OD1 ASP A 50 0.896 -0.866 -16.008 1.00 0.00 O ATOM 88 OD2 ASP A 50 0.672 -2.711 -17.099 1.00 0.00 O ATOM 0 H ASP A 50 3.080 -3.605 -13.070 1.00 0.00 H new ATOM 0 HA ASP A 50 2.184 -1.007 -13.817 1.00 0.00 H new ATOM 0 HB2 ASP A 50 2.891 -2.955 -15.365 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.429 -3.805 -14.904 1.00 0.00 H new ATOM 93 N GLY A 51 -0.287 -3.088 -13.115 1.00 0.00 N ATOM 94 CA GLY A 51 -1.744 -3.045 -12.773 1.00 0.00 C ATOM 95 C GLY A 51 -1.954 -2.841 -11.280 1.00 0.00 C ATOM 96 O GLY A 51 -2.793 -2.045 -10.913 1.00 0.00 O ATOM 0 H GLY A 51 0.119 -4.020 -13.198 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.226 -2.237 -13.324 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.221 -3.974 -13.086 1.00 0.00 H new ATOM 100 N LEU A 52 -1.211 -3.458 -10.390 1.00 0.00 N ATOM 101 CA LEU A 52 -1.443 -3.145 -8.944 1.00 0.00 C ATOM 102 C LEU A 52 -1.416 -1.609 -8.824 1.00 0.00 C ATOM 103 O LEU A 52 -2.294 -1.009 -8.239 1.00 0.00 O ATOM 104 CB LEU A 52 -0.370 -3.871 -8.071 1.00 0.00 C ATOM 105 CG LEU A 52 0.538 -2.906 -7.248 1.00 0.00 C ATOM 106 CD1 LEU A 52 -0.209 -2.380 -6.005 1.00 0.00 C ATOM 107 CD2 LEU A 52 1.811 -3.648 -6.800 1.00 0.00 C ATOM 0 H LEU A 52 -0.480 -4.140 -10.591 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.403 -3.506 -8.576 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -0.875 -4.552 -7.385 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.259 -4.480 -8.720 1.00 0.00 H new ATOM 0 HG LEU A 52 0.805 -2.060 -7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.443 -1.709 -5.446 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.102 -1.840 -6.319 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.496 -3.219 -5.371 1.00 0.00 H new ATOM 0 HD21 LEU A 52 2.443 -2.971 -6.225 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.536 -4.501 -6.180 1.00 0.00 H new ATOM 0 HD23 LEU A 52 2.356 -3.997 -7.677 1.00 0.00 H new ATOM 119 N ALA A 53 -0.445 -0.961 -9.443 1.00 0.00 N ATOM 120 CA ALA A 53 -0.425 0.526 -9.398 1.00 0.00 C ATOM 121 C ALA A 53 -1.808 1.081 -9.765 1.00 0.00 C ATOM 122 O ALA A 53 -2.483 1.663 -8.933 1.00 0.00 O ATOM 123 CB ALA A 53 0.616 1.082 -10.380 1.00 0.00 C ATOM 0 H ALA A 53 0.315 -1.397 -9.965 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.162 0.833 -8.386 1.00 0.00 H new ATOM 0 HB1 ALA A 53 0.616 2.171 -10.333 1.00 0.00 H new ATOM 0 HB2 ALA A 53 1.604 0.707 -10.113 1.00 0.00 H new ATOM 0 HB3 ALA A 53 0.368 0.763 -11.392 1.00 0.00 H new ATOM 129 N ASN A 54 -2.263 0.899 -10.992 1.00 0.00 N ATOM 130 CA ASN A 54 -3.602 1.397 -11.457 1.00 0.00 C ATOM 131 C ASN A 54 -4.765 0.681 -10.774 1.00 0.00 C ATOM 132 O ASN A 54 -5.670 1.291 -10.234 1.00 0.00 O ATOM 133 CB ASN A 54 -3.734 1.059 -12.954 1.00 0.00 C ATOM 134 CG ASN A 54 -5.111 1.523 -13.457 1.00 0.00 C ATOM 135 OD1 ASN A 54 -5.456 2.680 -13.326 1.00 0.00 O ATOM 136 ND2 ASN A 54 -5.921 0.660 -14.014 1.00 0.00 N ATOM 0 H ASN A 54 -1.737 0.406 -11.714 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.648 2.463 -11.232 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -2.942 1.549 -13.521 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -3.620 -0.014 -13.108 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -6.841 0.959 -14.338 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -5.633 -0.312 -14.125 1.00 0.00 H new ATOM 143 N LYS A 55 -4.777 -0.616 -10.878 1.00 0.00 N ATOM 144 CA LYS A 55 -5.919 -1.411 -10.351 1.00 0.00 C ATOM 145 C LYS A 55 -6.036 -1.419 -8.833 1.00 0.00 C ATOM 146 O LYS A 55 -7.120 -1.212 -8.320 1.00 0.00 O ATOM 147 CB LYS A 55 -5.802 -2.867 -10.801 1.00 0.00 C ATOM 148 CG LYS A 55 -6.118 -3.000 -12.293 1.00 0.00 C ATOM 149 CD LYS A 55 -5.567 -4.337 -12.805 1.00 0.00 C ATOM 150 CE LYS A 55 -6.298 -5.497 -12.116 1.00 0.00 C ATOM 151 NZ LYS A 55 -5.958 -6.778 -12.799 1.00 0.00 N ATOM 0 H LYS A 55 -4.035 -1.166 -11.311 1.00 0.00 H new ATOM 0 HA LYS A 55 -6.806 -0.921 -10.754 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.795 -3.234 -10.604 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -6.486 -3.488 -10.223 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -7.195 -2.950 -12.455 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -5.673 -2.173 -12.847 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -5.695 -4.404 -13.885 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -4.497 -4.400 -12.607 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -6.013 -5.547 -11.065 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -7.375 -5.331 -12.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -6.454 -7.563 -12.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -6.251 -6.728 -13.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -4.932 -6.937 -12.747 1.00 0.00 H new ATOM 165 N ALA A 56 -5.012 -1.688 -8.064 1.00 0.00 N ATOM 166 CA ALA A 56 -5.211 -1.754 -6.593 1.00 0.00 C ATOM 167 C ALA A 56 -5.469 -0.372 -6.008 1.00 0.00 C ATOM 168 O ALA A 56 -6.257 -0.230 -5.105 1.00 0.00 O ATOM 169 CB ALA A 56 -4.038 -2.475 -5.950 1.00 0.00 C ATOM 0 H ALA A 56 -4.061 -1.862 -8.389 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.106 -2.335 -6.371 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.187 -2.522 -4.871 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.968 -3.486 -6.351 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.116 -1.935 -6.166 1.00 0.00 H new ATOM 175 N LEU A 57 -4.898 0.648 -6.542 1.00 0.00 N ATOM 176 CA LEU A 57 -5.214 2.009 -6.014 1.00 0.00 C ATOM 177 C LEU A 57 -6.700 2.377 -6.282 1.00 0.00 C ATOM 178 O LEU A 57 -7.342 3.016 -5.475 1.00 0.00 O ATOM 179 CB LEU A 57 -4.307 3.037 -6.718 1.00 0.00 C ATOM 180 CG LEU A 57 -4.253 4.351 -5.912 1.00 0.00 C ATOM 181 CD1 LEU A 57 -3.204 5.291 -6.515 1.00 0.00 C ATOM 182 CD2 LEU A 57 -5.626 5.052 -5.927 1.00 0.00 C ATOM 0 H LEU A 57 -4.231 0.616 -7.313 1.00 0.00 H new ATOM 0 HA LEU A 57 -5.043 2.017 -4.938 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.302 2.629 -6.828 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.682 3.235 -7.722 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.985 4.111 -4.883 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.172 6.217 -5.940 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.226 4.811 -6.485 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.467 5.515 -7.549 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -5.569 5.977 -5.353 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.907 5.280 -6.955 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -6.374 4.396 -5.483 1.00 0.00 H new ATOM 194 N ALA A 58 -7.260 2.020 -7.396 1.00 0.00 N ATOM 195 CA ALA A 58 -8.682 2.406 -7.730 1.00 0.00 C ATOM 196 C ALA A 58 -9.787 1.630 -6.966 1.00 0.00 C ATOM 197 O ALA A 58 -10.708 2.214 -6.433 1.00 0.00 O ATOM 198 CB ALA A 58 -8.825 2.146 -9.206 1.00 0.00 C ATOM 0 H ALA A 58 -6.795 1.465 -8.114 1.00 0.00 H new ATOM 0 HA ALA A 58 -8.832 3.444 -7.432 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -9.835 2.403 -9.525 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -8.106 2.754 -9.754 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -8.638 1.092 -9.410 1.00 0.00 H new ATOM 204 N VAL A 59 -9.736 0.337 -6.876 1.00 0.00 N ATOM 205 CA VAL A 59 -10.827 -0.396 -6.149 1.00 0.00 C ATOM 206 C VAL A 59 -10.635 -0.098 -4.678 1.00 0.00 C ATOM 207 O VAL A 59 -11.585 0.149 -3.917 1.00 0.00 O ATOM 208 CB VAL A 59 -10.734 -1.883 -6.510 1.00 0.00 C ATOM 209 CG1 VAL A 59 -11.618 -2.711 -5.598 1.00 0.00 C ATOM 210 CG2 VAL A 59 -11.181 -2.080 -7.963 1.00 0.00 C ATOM 0 H VAL A 59 -8.998 -0.249 -7.266 1.00 0.00 H new ATOM 0 HA VAL A 59 -11.833 -0.082 -6.427 1.00 0.00 H new ATOM 0 HB VAL A 59 -9.701 -2.209 -6.388 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -11.538 -3.763 -5.871 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -11.299 -2.579 -4.564 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -12.653 -2.387 -5.703 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -11.116 -3.136 -8.224 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -12.211 -1.741 -8.076 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -10.534 -1.503 -8.624 1.00 0.00 H new ATOM 220 N ALA A 60 -9.422 -0.003 -4.293 1.00 0.00 N ATOM 221 CA ALA A 60 -9.167 0.396 -2.909 1.00 0.00 C ATOM 222 C ALA A 60 -9.886 1.723 -2.725 1.00 0.00 C ATOM 223 O ALA A 60 -10.420 2.021 -1.687 1.00 0.00 O ATOM 224 CB ALA A 60 -7.685 0.598 -2.684 1.00 0.00 C ATOM 0 H ALA A 60 -8.598 -0.182 -4.867 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.512 -0.364 -2.208 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -7.511 0.895 -1.650 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -7.156 -0.333 -2.888 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -7.319 1.378 -3.352 1.00 0.00 H new ATOM 230 N ARG A 61 -9.944 2.482 -3.783 1.00 0.00 N ATOM 231 CA ARG A 61 -10.647 3.775 -3.702 1.00 0.00 C ATOM 232 C ARG A 61 -12.150 3.573 -3.516 1.00 0.00 C ATOM 233 O ARG A 61 -12.773 4.462 -3.014 1.00 0.00 O ATOM 234 CB ARG A 61 -10.310 4.670 -4.930 1.00 0.00 C ATOM 235 CG ARG A 61 -11.496 4.853 -5.894 1.00 0.00 C ATOM 236 CD ARG A 61 -10.992 5.424 -7.245 1.00 0.00 C ATOM 237 NE ARG A 61 -11.163 4.396 -8.302 1.00 0.00 N ATOM 238 CZ ARG A 61 -12.358 4.014 -8.638 1.00 0.00 C ATOM 239 NH1 ARG A 61 -13.396 4.503 -8.016 1.00 0.00 N ATOM 240 NH2 ARG A 61 -12.513 3.131 -9.583 1.00 0.00 N ATOM 0 H ARG A 61 -9.536 2.258 -4.691 1.00 0.00 H new ATOM 0 HA ARG A 61 -10.292 4.306 -2.819 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -9.982 5.648 -4.579 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -9.474 4.230 -5.473 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -11.995 3.898 -6.056 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -12.232 5.527 -5.456 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -11.549 6.325 -7.503 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -9.943 5.709 -7.165 1.00 0.00 H new ATOM 0 HE ARG A 61 -10.347 3.992 -8.762 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -13.268 5.184 -7.267 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -14.335 4.204 -8.278 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -11.697 2.742 -10.056 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -13.450 2.828 -9.850 1.00 0.00 H new ATOM 254 N THR A 62 -12.795 2.458 -3.861 1.00 0.00 N ATOM 255 CA THR A 62 -14.274 2.445 -3.622 1.00 0.00 C ATOM 256 C THR A 62 -14.466 2.651 -2.161 1.00 0.00 C ATOM 257 O THR A 62 -15.274 3.434 -1.707 1.00 0.00 O ATOM 258 CB THR A 62 -14.927 1.107 -4.005 1.00 0.00 C ATOM 259 OG1 THR A 62 -15.066 1.035 -5.416 1.00 0.00 O ATOM 260 CG2 THR A 62 -16.324 1.011 -3.343 1.00 0.00 C ATOM 0 H THR A 62 -12.385 1.618 -4.269 1.00 0.00 H new ATOM 0 HA THR A 62 -14.737 3.218 -4.235 1.00 0.00 H new ATOM 0 HB THR A 62 -14.302 0.283 -3.660 1.00 0.00 H new ATOM 0 HG1 THR A 62 -15.481 0.181 -5.661 1.00 0.00 H new ATOM 0 HG21 THR A 62 -16.790 0.063 -3.613 1.00 0.00 H new ATOM 0 HG22 THR A 62 -16.218 1.068 -2.260 1.00 0.00 H new ATOM 0 HG23 THR A 62 -16.949 1.834 -3.690 1.00 0.00 H new ATOM 268 N LEU A 63 -13.735 1.911 -1.424 1.00 0.00 N ATOM 269 CA LEU A 63 -13.848 2.000 0.036 1.00 0.00 C ATOM 270 C LEU A 63 -12.940 3.133 0.549 1.00 0.00 C ATOM 271 O LEU A 63 -13.316 3.861 1.450 1.00 0.00 O ATOM 272 CB LEU A 63 -13.499 0.631 0.600 1.00 0.00 C ATOM 273 CG LEU A 63 -14.732 -0.301 0.481 1.00 0.00 C ATOM 274 CD1 LEU A 63 -14.308 -1.765 0.691 1.00 0.00 C ATOM 275 CD2 LEU A 63 -15.832 0.099 1.508 1.00 0.00 C ATOM 0 H LEU A 63 -13.052 1.236 -1.768 1.00 0.00 H new ATOM 0 HA LEU A 63 -14.856 2.253 0.364 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -12.654 0.206 0.058 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -13.196 0.721 1.643 1.00 0.00 H new ATOM 0 HG LEU A 63 -15.150 -0.194 -0.520 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -15.181 -2.412 0.606 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -13.574 -2.043 -0.065 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -13.868 -1.878 1.682 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -16.687 -0.570 1.405 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -15.431 0.022 2.519 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -16.149 1.125 1.320 1.00 0.00 H new ATOM 287 N ALA A 64 -11.777 3.352 -0.027 1.00 0.00 N ATOM 288 CA ALA A 64 -10.971 4.511 0.457 1.00 0.00 C ATOM 289 C ALA A 64 -11.785 5.773 0.115 1.00 0.00 C ATOM 290 O ALA A 64 -11.647 6.818 0.701 1.00 0.00 O ATOM 291 CB ALA A 64 -9.541 4.556 -0.171 1.00 0.00 C ATOM 0 H ALA A 64 -11.368 2.800 -0.781 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.797 4.430 1.530 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.000 5.419 0.217 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.002 3.644 0.086 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -9.622 4.636 -1.255 1.00 0.00 H new ATOM 297 N ASP A 65 -12.655 5.637 -0.832 1.00 0.00 N ATOM 298 CA ASP A 65 -13.551 6.803 -1.253 1.00 0.00 C ATOM 299 C ASP A 65 -14.691 6.960 -0.258 1.00 0.00 C ATOM 300 O ASP A 65 -15.396 7.953 -0.273 1.00 0.00 O ATOM 301 CB ASP A 65 -14.132 6.629 -2.666 1.00 0.00 C ATOM 302 CG ASP A 65 -15.122 7.764 -2.952 1.00 0.00 C ATOM 303 OD1 ASP A 65 -14.909 8.851 -2.442 1.00 0.00 O ATOM 304 OD2 ASP A 65 -16.082 7.523 -3.668 1.00 0.00 O ATOM 0 H ASP A 65 -12.806 4.773 -1.353 1.00 0.00 H new ATOM 0 HA ASP A 65 -12.925 7.695 -1.265 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -13.330 6.636 -3.404 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -14.633 5.665 -2.749 1.00 0.00 H new ATOM 309 N SER A 66 -14.882 6.039 0.605 1.00 0.00 N ATOM 310 CA SER A 66 -15.978 6.198 1.584 1.00 0.00 C ATOM 311 C SER A 66 -15.575 7.298 2.595 1.00 0.00 C ATOM 312 O SER A 66 -14.765 8.143 2.267 1.00 0.00 O ATOM 313 CB SER A 66 -16.045 4.799 2.198 1.00 0.00 C ATOM 314 OG SER A 66 -17.366 4.476 2.596 1.00 0.00 O ATOM 0 H SER A 66 -14.336 5.181 0.685 1.00 0.00 H new ATOM 0 HA SER A 66 -16.944 6.512 1.188 1.00 0.00 H new ATOM 0 HB2 SER A 66 -15.691 4.064 1.475 1.00 0.00 H new ATOM 0 HB3 SER A 66 -15.379 4.745 3.060 1.00 0.00 H new ATOM 0 HG SER A 66 -17.380 3.576 2.983 1.00 0.00 H new ATOM 320 N PRO A 67 -16.059 7.277 3.816 1.00 0.00 N ATOM 321 CA PRO A 67 -15.661 8.249 4.867 1.00 0.00 C ATOM 322 C PRO A 67 -14.689 7.628 5.865 1.00 0.00 C ATOM 323 O PRO A 67 -13.942 8.300 6.548 1.00 0.00 O ATOM 324 CB PRO A 67 -17.005 8.492 5.511 1.00 0.00 C ATOM 325 CG PRO A 67 -17.584 7.122 5.610 1.00 0.00 C ATOM 326 CD PRO A 67 -17.114 6.385 4.345 1.00 0.00 C ATOM 0 HA PRO A 67 -15.147 9.137 4.499 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -16.904 8.959 6.491 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -17.629 9.151 4.907 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -17.239 6.614 6.511 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -18.672 7.159 5.661 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -16.726 5.393 4.576 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -17.926 6.251 3.630 1.00 0.00 H new ATOM 334 N GLU A 68 -14.690 6.337 5.917 1.00 0.00 N ATOM 335 CA GLU A 68 -13.761 5.658 6.843 1.00 0.00 C ATOM 336 C GLU A 68 -12.330 6.083 6.490 1.00 0.00 C ATOM 337 O GLU A 68 -11.492 6.212 7.366 1.00 0.00 O ATOM 338 CB GLU A 68 -13.988 4.131 6.791 1.00 0.00 C ATOM 339 CG GLU A 68 -13.633 3.518 5.433 1.00 0.00 C ATOM 340 CD GLU A 68 -14.425 2.210 5.249 1.00 0.00 C ATOM 341 OE1 GLU A 68 -14.716 1.568 6.248 1.00 0.00 O ATOM 342 OE2 GLU A 68 -14.730 1.879 4.119 1.00 0.00 O ATOM 0 H GLU A 68 -15.289 5.725 5.363 1.00 0.00 H new ATOM 0 HA GLU A 68 -13.943 5.950 7.877 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -13.389 3.654 7.566 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -15.032 3.917 7.018 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.870 4.217 4.631 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.562 3.321 5.378 1.00 0.00 H new ATOM 349 N ILE A 69 -12.002 6.254 5.233 1.00 0.00 N ATOM 350 CA ILE A 69 -10.605 6.635 4.885 1.00 0.00 C ATOM 351 C ILE A 69 -10.111 7.852 5.747 1.00 0.00 C ATOM 352 O ILE A 69 -9.297 7.710 6.649 1.00 0.00 O ATOM 353 CB ILE A 69 -10.577 6.922 3.332 1.00 0.00 C ATOM 354 CG1 ILE A 69 -9.371 6.238 2.688 1.00 0.00 C ATOM 355 CG2 ILE A 69 -10.558 8.413 2.914 1.00 0.00 C ATOM 356 CD1 ILE A 69 -8.082 6.770 3.282 1.00 0.00 C ATOM 0 H ILE A 69 -12.637 6.147 4.442 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.908 5.829 5.116 1.00 0.00 H new ATOM 0 HB ILE A 69 -11.526 6.518 2.978 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -9.432 5.160 2.841 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -9.380 6.408 1.611 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -10.539 8.486 1.827 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -11.450 8.909 3.296 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -9.671 8.895 3.325 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.233 6.273 2.813 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.016 7.844 3.106 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.069 6.576 4.355 1.00 0.00 H new ATOM 368 N ARG A 70 -10.534 9.035 5.364 1.00 0.00 N ATOM 369 CA ARG A 70 -10.053 10.276 6.020 1.00 0.00 C ATOM 370 C ARG A 70 -10.240 10.139 7.515 1.00 0.00 C ATOM 371 O ARG A 70 -9.459 10.655 8.290 1.00 0.00 O ATOM 372 CB ARG A 70 -10.777 11.503 5.433 1.00 0.00 C ATOM 373 CG ARG A 70 -10.534 12.716 6.323 1.00 0.00 C ATOM 374 CD ARG A 70 -11.093 13.964 5.649 1.00 0.00 C ATOM 375 NE ARG A 70 -10.968 15.133 6.568 1.00 0.00 N ATOM 376 CZ ARG A 70 -11.635 16.231 6.321 1.00 0.00 C ATOM 377 NH1 ARG A 70 -12.404 16.311 5.268 1.00 0.00 N ATOM 378 NH2 ARG A 70 -11.530 17.254 7.123 1.00 0.00 N ATOM 0 H ARG A 70 -11.204 9.186 4.610 1.00 0.00 H new ATOM 0 HA ARG A 70 -8.991 10.427 5.829 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -10.416 11.702 4.424 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -11.846 11.304 5.356 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -11.010 12.570 7.293 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -9.466 12.837 6.507 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -10.555 14.160 4.721 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -12.139 13.808 5.384 1.00 0.00 H new ATOM 0 HE ARG A 70 -10.363 15.076 7.388 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -12.486 15.516 4.635 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -12.922 17.169 5.079 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -10.927 17.199 7.944 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.051 18.109 6.929 1.00 0.00 H new ATOM 392 N GLN A 71 -11.236 9.425 7.938 1.00 0.00 N ATOM 393 CA GLN A 71 -11.397 9.249 9.399 1.00 0.00 C ATOM 394 C GLN A 71 -10.555 8.103 9.941 1.00 0.00 C ATOM 395 O GLN A 71 -10.414 8.017 11.140 1.00 0.00 O ATOM 396 CB GLN A 71 -12.825 8.972 9.824 1.00 0.00 C ATOM 397 CG GLN A 71 -12.866 8.928 11.385 1.00 0.00 C ATOM 398 CD GLN A 71 -14.259 9.358 11.874 1.00 0.00 C ATOM 399 OE1 GLN A 71 -15.250 8.765 11.500 1.00 0.00 O ATOM 400 NE2 GLN A 71 -14.384 10.365 12.699 1.00 0.00 N ATOM 0 H GLN A 71 -11.932 8.965 7.351 1.00 0.00 H new ATOM 0 HA GLN A 71 -11.069 10.204 9.809 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -13.492 9.748 9.447 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -13.170 8.026 9.407 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -12.640 7.921 11.737 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -12.104 9.589 11.798 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -13.556 10.869 13.018 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -15.309 10.647 13.023 1.00 0.00 H new ATOM 409 N GLY A 72 -9.957 7.215 9.143 1.00 0.00 N ATOM 410 CA GLY A 72 -9.100 6.151 9.770 1.00 0.00 C ATOM 411 C GLY A 72 -7.749 6.807 9.768 1.00 0.00 C ATOM 412 O GLY A 72 -7.089 6.965 10.763 1.00 0.00 O ATOM 0 H GLY A 72 -10.028 7.189 8.126 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -9.431 5.900 10.778 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -9.107 5.227 9.192 1.00 0.00 H new ATOM 416 N LEU A 73 -7.420 7.274 8.609 1.00 0.00 N ATOM 417 CA LEU A 73 -6.193 8.054 8.373 1.00 0.00 C ATOM 418 C LEU A 73 -6.060 9.063 9.527 1.00 0.00 C ATOM 419 O LEU A 73 -4.999 9.317 10.057 1.00 0.00 O ATOM 420 CB LEU A 73 -6.478 8.735 7.026 1.00 0.00 C ATOM 421 CG LEU A 73 -5.449 9.793 6.650 1.00 0.00 C ATOM 422 CD1 LEU A 73 -4.287 9.134 5.905 1.00 0.00 C ATOM 423 CD2 LEU A 73 -6.107 10.846 5.743 1.00 0.00 C ATOM 0 H LEU A 73 -7.986 7.137 7.771 1.00 0.00 H new ATOM 0 HA LEU A 73 -5.263 7.486 8.340 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -6.510 7.976 6.244 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -7.465 9.196 7.063 1.00 0.00 H new ATOM 0 HG LEU A 73 -5.074 10.273 7.554 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -3.551 9.892 5.636 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.821 8.386 6.547 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -4.660 8.654 5.001 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -5.372 11.604 5.473 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.481 10.365 4.839 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -6.935 11.316 6.273 1.00 0.00 H new ATOM 435 N GLN A 74 -7.172 9.594 9.918 1.00 0.00 N ATOM 436 CA GLN A 74 -7.161 10.560 11.054 1.00 0.00 C ATOM 437 C GLN A 74 -6.724 9.831 12.342 1.00 0.00 C ATOM 438 O GLN A 74 -6.625 10.435 13.381 1.00 0.00 O ATOM 439 CB GLN A 74 -8.539 11.249 11.185 1.00 0.00 C ATOM 440 CG GLN A 74 -8.539 12.311 12.301 1.00 0.00 C ATOM 441 CD GLN A 74 -9.941 12.905 12.427 1.00 0.00 C ATOM 442 OE1 GLN A 74 -10.201 13.998 11.963 1.00 0.00 O ATOM 443 NE2 GLN A 74 -10.868 12.217 13.039 1.00 0.00 N ATOM 0 H GLN A 74 -8.087 9.408 9.508 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.437 11.354 10.869 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -8.804 11.717 10.237 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -9.302 10.500 11.395 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.234 11.863 13.247 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -7.817 13.096 12.073 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -10.649 11.300 13.428 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -11.810 12.597 13.128 1.00 0.00 H new ATOM 452 N LYS A 75 -6.447 8.528 12.300 1.00 0.00 N ATOM 453 CA LYS A 75 -6.021 7.797 13.559 1.00 0.00 C ATOM 454 C LYS A 75 -4.820 6.849 13.350 1.00 0.00 C ATOM 455 O LYS A 75 -5.010 5.667 13.383 1.00 0.00 O ATOM 456 CB LYS A 75 -7.199 6.937 14.012 1.00 0.00 C ATOM 457 CG LYS A 75 -6.910 6.258 15.372 1.00 0.00 C ATOM 458 CD LYS A 75 -6.712 7.303 16.474 1.00 0.00 C ATOM 459 CE LYS A 75 -6.888 6.626 17.838 1.00 0.00 C ATOM 460 NZ LYS A 75 -6.242 5.280 17.806 1.00 0.00 N ATOM 0 H LYS A 75 -6.497 7.951 11.461 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.723 8.553 14.286 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.093 7.555 14.095 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.407 6.176 13.260 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.736 5.598 15.636 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -6.018 5.636 15.290 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.719 7.747 16.399 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -7.433 8.113 16.359 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -6.441 7.238 18.621 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -7.947 6.528 18.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -5.713 5.128 18.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -6.973 4.546 17.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -5.590 5.227 16.997 1.00 0.00 H new ATOM 474 N LYS A 76 -3.637 7.358 13.095 1.00 0.00 N ATOM 475 CA LYS A 76 -2.377 6.509 12.869 1.00 0.00 C ATOM 476 C LYS A 76 -2.634 4.977 12.680 1.00 0.00 C ATOM 477 O LYS A 76 -3.592 4.417 13.143 1.00 0.00 O ATOM 478 CB LYS A 76 -1.395 6.715 14.060 1.00 0.00 C ATOM 479 CG LYS A 76 -2.139 6.827 15.400 1.00 0.00 C ATOM 480 CD LYS A 76 -2.846 5.497 15.735 1.00 0.00 C ATOM 481 CE LYS A 76 -3.022 5.356 17.249 1.00 0.00 C ATOM 482 NZ LYS A 76 -1.696 5.135 17.885 1.00 0.00 N ATOM 0 H LYS A 76 -3.468 8.362 13.028 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.955 6.859 11.927 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.694 5.881 14.102 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.807 7.618 13.894 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.436 7.083 16.193 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.871 7.633 15.351 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.818 5.460 15.244 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -2.263 4.660 15.350 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -3.487 6.253 17.657 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -3.688 4.522 17.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.820 4.604 18.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -1.087 4.593 17.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -1.252 6.053 18.091 1.00 0.00 H new ATOM 496 N PRO A 77 -1.740 4.293 12.000 1.00 0.00 N ATOM 497 CA PRO A 77 -1.855 2.824 11.732 1.00 0.00 C ATOM 498 C PRO A 77 -2.607 2.028 12.786 1.00 0.00 C ATOM 499 O PRO A 77 -3.539 1.311 12.475 1.00 0.00 O ATOM 500 CB PRO A 77 -0.391 2.371 11.673 1.00 0.00 C ATOM 501 CG PRO A 77 0.411 3.588 11.265 1.00 0.00 C ATOM 502 CD PRO A 77 -0.500 4.828 11.405 1.00 0.00 C ATOM 0 HA PRO A 77 -2.437 2.649 10.827 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -0.061 1.994 12.641 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -0.263 1.561 10.955 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.295 3.691 11.895 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.762 3.487 10.238 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -0.046 5.587 12.042 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -0.690 5.295 10.439 1.00 0.00 H new ATOM 510 N GLN A 78 -2.202 2.088 14.006 1.00 0.00 N ATOM 511 CA GLN A 78 -2.899 1.267 15.011 1.00 0.00 C ATOM 512 C GLN A 78 -4.418 1.542 14.948 1.00 0.00 C ATOM 513 O GLN A 78 -4.867 2.670 15.005 1.00 0.00 O ATOM 514 CB GLN A 78 -2.340 1.582 16.406 1.00 0.00 C ATOM 515 CG GLN A 78 -0.846 1.242 16.431 1.00 0.00 C ATOM 516 CD GLN A 78 -0.277 1.471 17.833 1.00 0.00 C ATOM 517 OE1 GLN A 78 -0.515 0.691 18.733 1.00 0.00 O ATOM 518 NE2 GLN A 78 0.479 2.512 18.055 1.00 0.00 N ATOM 0 H GLN A 78 -1.431 2.660 14.351 1.00 0.00 H new ATOM 0 HA GLN A 78 -2.735 0.210 14.803 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -2.491 2.635 16.643 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -2.870 1.005 17.164 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -0.697 0.204 16.135 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -0.313 1.860 15.708 1.00 0.00 H new ATOM 0 HE21 GLN A 78 0.679 3.167 17.299 1.00 0.00 H new ATOM 0 HE22 GLN A 78 0.869 2.670 18.984 1.00 0.00 H new ATOM 527 N GLU A 79 -5.185 0.490 14.919 1.00 0.00 N ATOM 528 CA GLU A 79 -6.678 0.620 14.948 1.00 0.00 C ATOM 529 C GLU A 79 -7.271 1.235 13.662 1.00 0.00 C ATOM 530 O GLU A 79 -8.449 1.540 13.621 1.00 0.00 O ATOM 531 CB GLU A 79 -7.032 1.519 16.149 1.00 0.00 C ATOM 532 CG GLU A 79 -8.433 1.161 16.679 1.00 0.00 C ATOM 533 CD GLU A 79 -8.810 2.089 17.835 1.00 0.00 C ATOM 534 OE1 GLU A 79 -8.782 3.293 17.638 1.00 0.00 O ATOM 535 OE2 GLU A 79 -9.126 1.580 18.899 1.00 0.00 O ATOM 0 H GLU A 79 -4.842 -0.470 14.876 1.00 0.00 H new ATOM 0 HA GLU A 79 -7.105 -0.380 15.030 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -6.292 1.393 16.939 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -7.004 2.567 15.850 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.167 1.249 15.878 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -8.450 0.124 17.014 1.00 0.00 H new ATOM 542 N SER A 80 -6.514 1.418 12.606 1.00 0.00 N ATOM 543 CA SER A 80 -7.124 2.023 11.379 1.00 0.00 C ATOM 544 C SER A 80 -7.917 0.971 10.618 1.00 0.00 C ATOM 545 O SER A 80 -7.393 0.330 9.742 1.00 0.00 O ATOM 546 CB SER A 80 -6.048 2.580 10.475 1.00 0.00 C ATOM 547 OG SER A 80 -5.262 3.511 11.206 1.00 0.00 O ATOM 0 H SER A 80 -5.524 1.181 12.539 1.00 0.00 H new ATOM 0 HA SER A 80 -7.788 2.830 11.689 1.00 0.00 H new ATOM 0 HB2 SER A 80 -5.420 1.773 10.097 1.00 0.00 H new ATOM 0 HB3 SER A 80 -6.498 3.066 9.610 1.00 0.00 H new ATOM 0 HG SER A 80 -4.654 3.977 10.595 1.00 0.00 H new ATOM 553 N GLY A 81 -9.146 0.770 11.024 1.00 0.00 N ATOM 554 CA GLY A 81 -9.987 -0.286 10.361 1.00 0.00 C ATOM 555 C GLY A 81 -9.800 -0.268 8.814 1.00 0.00 C ATOM 556 O GLY A 81 -10.724 -0.008 8.082 1.00 0.00 O ATOM 0 H GLY A 81 -9.604 1.283 11.777 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -9.717 -1.267 10.751 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -11.037 -0.124 10.605 1.00 0.00 H new ATOM 560 N ILE A 82 -8.633 -0.559 8.327 1.00 0.00 N ATOM 561 CA ILE A 82 -8.334 -0.601 6.858 1.00 0.00 C ATOM 562 C ILE A 82 -9.016 -1.826 6.284 1.00 0.00 C ATOM 563 O ILE A 82 -8.877 -2.161 5.121 1.00 0.00 O ATOM 564 CB ILE A 82 -6.814 -0.648 6.749 1.00 0.00 C ATOM 565 CG1 ILE A 82 -6.256 -0.340 5.344 1.00 0.00 C ATOM 566 CG2 ILE A 82 -6.321 -2.033 7.212 1.00 0.00 C ATOM 567 CD1 ILE A 82 -6.025 1.164 5.197 1.00 0.00 C ATOM 0 H ILE A 82 -7.828 -0.782 8.912 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.702 0.258 6.298 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.438 0.148 7.391 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.321 -0.878 5.188 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.954 -0.686 4.582 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.234 -2.076 7.137 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -6.621 -2.199 8.247 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.759 -2.805 6.580 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.631 1.376 4.203 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -6.969 1.692 5.334 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.310 1.498 5.949 1.00 0.00 H new ATOM 579 N GLN A 83 -9.745 -2.499 7.094 1.00 0.00 N ATOM 580 CA GLN A 83 -10.459 -3.715 6.670 1.00 0.00 C ATOM 581 C GLN A 83 -11.334 -3.448 5.444 1.00 0.00 C ATOM 582 O GLN A 83 -11.455 -4.316 4.632 1.00 0.00 O ATOM 583 CB GLN A 83 -11.317 -4.206 7.848 1.00 0.00 C ATOM 584 CG GLN A 83 -11.738 -5.662 7.607 1.00 0.00 C ATOM 585 CD GLN A 83 -10.521 -6.592 7.729 1.00 0.00 C ATOM 586 OE1 GLN A 83 -10.076 -6.895 8.820 1.00 0.00 O ATOM 587 NE2 GLN A 83 -9.970 -7.071 6.644 1.00 0.00 N ATOM 0 H GLN A 83 -9.884 -2.250 8.073 1.00 0.00 H new ATOM 0 HA GLN A 83 -9.735 -4.479 6.387 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -10.754 -4.129 8.778 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -12.199 -3.575 7.956 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -12.501 -5.952 8.329 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -12.183 -5.761 6.617 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -10.342 -6.818 5.729 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -9.168 -7.698 6.713 1.00 0.00 H new ATOM 596 N ALA A 84 -11.901 -2.261 5.256 1.00 0.00 N ATOM 597 CA ALA A 84 -12.732 -1.978 4.055 1.00 0.00 C ATOM 598 C ALA A 84 -11.713 -1.714 2.968 1.00 0.00 C ATOM 599 O ALA A 84 -11.229 -2.668 2.449 1.00 0.00 O ATOM 600 CB ALA A 84 -13.631 -0.769 4.355 1.00 0.00 C ATOM 0 H ALA A 84 -11.812 -1.477 5.902 1.00 0.00 H new ATOM 0 HA ALA A 84 -13.406 -2.782 3.759 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -14.247 -0.549 3.483 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -14.274 -0.996 5.206 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -13.011 0.096 4.589 1.00 0.00 H new ATOM 606 N ILE A 85 -11.377 -0.491 2.587 1.00 0.00 N ATOM 607 CA ILE A 85 -10.342 -0.294 1.504 1.00 0.00 C ATOM 608 C ILE A 85 -9.632 -1.622 1.144 1.00 0.00 C ATOM 609 O ILE A 85 -9.670 -2.059 0.000 1.00 0.00 O ATOM 610 CB ILE A 85 -9.294 0.712 2.020 1.00 0.00 C ATOM 611 CG1 ILE A 85 -9.976 1.887 2.795 1.00 0.00 C ATOM 612 CG2 ILE A 85 -8.546 1.255 0.813 1.00 0.00 C ATOM 613 CD1 ILE A 85 -9.899 1.624 4.305 1.00 0.00 C ATOM 0 H ILE A 85 -11.769 0.367 2.974 1.00 0.00 H new ATOM 0 HA ILE A 85 -10.839 0.074 0.606 1.00 0.00 H new ATOM 0 HB ILE A 85 -8.613 0.215 2.711 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -9.483 2.829 2.554 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -11.017 1.984 2.486 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -7.794 1.972 1.143 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -8.058 0.434 0.288 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -9.248 1.749 0.142 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -10.375 2.444 4.842 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -10.412 0.691 4.539 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -8.855 1.549 4.609 1.00 0.00 H new ATOM 625 N ALA A 86 -9.058 -2.312 2.084 1.00 0.00 N ATOM 626 CA ALA A 86 -8.450 -3.625 1.755 1.00 0.00 C ATOM 627 C ALA A 86 -9.535 -4.568 1.191 1.00 0.00 C ATOM 628 O ALA A 86 -9.419 -5.150 0.134 1.00 0.00 O ATOM 629 CB ALA A 86 -7.912 -4.205 3.055 1.00 0.00 C ATOM 0 H ALA A 86 -8.984 -2.026 3.060 1.00 0.00 H new ATOM 0 HA ALA A 86 -7.659 -3.513 1.014 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.454 -5.175 2.859 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.166 -3.530 3.474 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -8.730 -4.327 3.765 1.00 0.00 H new ATOM 635 N GLU A 87 -10.593 -4.698 1.961 1.00 0.00 N ATOM 636 CA GLU A 87 -11.755 -5.563 1.599 1.00 0.00 C ATOM 637 C GLU A 87 -12.095 -5.469 0.142 1.00 0.00 C ATOM 638 O GLU A 87 -12.190 -6.508 -0.487 1.00 0.00 O ATOM 639 CB GLU A 87 -13.025 -5.169 2.362 1.00 0.00 C ATOM 640 CG GLU A 87 -14.152 -6.166 2.092 1.00 0.00 C ATOM 641 CD GLU A 87 -15.359 -5.799 2.959 1.00 0.00 C ATOM 642 OE1 GLU A 87 -15.251 -4.859 3.728 1.00 0.00 O ATOM 643 OE2 GLU A 87 -16.376 -6.465 2.837 1.00 0.00 O ATOM 0 H GLU A 87 -10.697 -4.221 2.856 1.00 0.00 H new ATOM 0 HA GLU A 87 -11.443 -6.574 1.860 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -12.815 -5.131 3.431 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -13.339 -4.169 2.063 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.426 -6.148 1.037 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -13.820 -7.180 2.318 1.00 0.00 H new ATOM 650 N ALA A 88 -12.349 -4.328 -0.464 1.00 0.00 N ATOM 651 CA ALA A 88 -12.714 -4.467 -1.887 1.00 0.00 C ATOM 652 C ALA A 88 -11.506 -4.985 -2.635 1.00 0.00 C ATOM 653 O ALA A 88 -11.583 -6.042 -3.253 1.00 0.00 O ATOM 654 CB ALA A 88 -13.227 -3.171 -2.478 1.00 0.00 C ATOM 0 H ALA A 88 -12.321 -3.389 -0.067 1.00 0.00 H new ATOM 0 HA ALA A 88 -13.538 -5.175 -1.979 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -13.482 -3.325 -3.526 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -14.114 -2.848 -1.932 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -12.455 -2.405 -2.401 1.00 0.00 H new ATOM 660 N VAL A 89 -10.434 -4.256 -2.696 1.00 0.00 N ATOM 661 CA VAL A 89 -9.344 -4.803 -3.551 1.00 0.00 C ATOM 662 C VAL A 89 -9.146 -6.329 -3.268 1.00 0.00 C ATOM 663 O VAL A 89 -9.562 -7.152 -4.043 1.00 0.00 O ATOM 664 CB VAL A 89 -8.063 -3.983 -3.331 1.00 0.00 C ATOM 665 CG1 VAL A 89 -6.826 -4.857 -3.516 1.00 0.00 C ATOM 666 CG2 VAL A 89 -8.020 -2.843 -4.331 1.00 0.00 C ATOM 0 H VAL A 89 -10.264 -3.365 -2.228 1.00 0.00 H new ATOM 0 HA VAL A 89 -9.612 -4.716 -4.604 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.069 -3.592 -2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -5.930 -4.258 -3.356 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -6.848 -5.676 -2.797 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.815 -5.263 -4.528 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -7.113 -2.259 -4.178 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -8.025 -3.247 -5.343 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -8.891 -2.203 -4.191 1.00 0.00 H new ATOM 676 N ARG A 90 -8.578 -6.688 -2.134 1.00 0.00 N ATOM 677 CA ARG A 90 -8.395 -8.138 -1.756 1.00 0.00 C ATOM 678 C ARG A 90 -9.553 -8.989 -2.320 1.00 0.00 C ATOM 679 O ARG A 90 -9.317 -9.986 -2.969 1.00 0.00 O ATOM 680 CB ARG A 90 -8.380 -8.270 -0.217 1.00 0.00 C ATOM 681 CG ARG A 90 -7.153 -7.555 0.378 1.00 0.00 C ATOM 682 CD ARG A 90 -7.130 -7.707 1.912 1.00 0.00 C ATOM 683 NE ARG A 90 -7.155 -9.151 2.282 1.00 0.00 N ATOM 684 CZ ARG A 90 -7.538 -9.516 3.478 1.00 0.00 C ATOM 685 NH1 ARG A 90 -7.856 -8.614 4.368 1.00 0.00 N ATOM 686 NH2 ARG A 90 -7.591 -10.783 3.785 1.00 0.00 N ATOM 0 H ARG A 90 -8.227 -6.027 -1.441 1.00 0.00 H new ATOM 0 HA ARG A 90 -7.452 -8.492 -2.172 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.293 -7.843 0.199 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.364 -9.323 0.063 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -6.240 -7.971 -0.048 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.176 -6.498 0.112 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -6.236 -7.234 2.319 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -7.988 -7.196 2.349 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.873 -9.856 1.601 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -7.806 -7.623 4.131 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -8.155 -8.900 5.300 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.334 -11.487 3.093 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.889 -11.070 4.717 1.00 0.00 H new ATOM 700 N LYS A 91 -10.792 -8.565 -2.095 1.00 0.00 N ATOM 701 CA LYS A 91 -11.947 -9.368 -2.679 1.00 0.00 C ATOM 702 C LYS A 91 -11.488 -9.952 -4.026 1.00 0.00 C ATOM 703 O LYS A 91 -11.708 -11.109 -4.326 1.00 0.00 O ATOM 704 CB LYS A 91 -13.203 -8.486 -2.890 1.00 0.00 C ATOM 705 CG LYS A 91 -14.411 -9.367 -3.273 1.00 0.00 C ATOM 706 CD LYS A 91 -15.127 -9.854 -2.012 1.00 0.00 C ATOM 707 CE LYS A 91 -16.238 -10.827 -2.405 1.00 0.00 C ATOM 708 NZ LYS A 91 -17.035 -10.245 -3.522 1.00 0.00 N ATOM 0 H LYS A 91 -11.049 -7.737 -1.558 1.00 0.00 H new ATOM 0 HA LYS A 91 -12.219 -10.162 -1.983 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -13.423 -7.929 -1.979 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -13.015 -7.753 -3.674 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -15.102 -8.799 -3.897 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -14.076 -10.220 -3.863 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -14.418 -10.344 -1.344 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -15.545 -9.007 -1.468 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -15.809 -11.782 -2.709 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -16.883 -11.025 -1.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -17.981 -10.678 -3.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -17.126 -9.218 -3.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.555 -10.433 -4.425 1.00 0.00 H new ATOM 722 N ARG A 92 -10.706 -9.188 -4.736 1.00 0.00 N ATOM 723 CA ARG A 92 -10.035 -9.697 -5.983 1.00 0.00 C ATOM 724 C ARG A 92 -9.220 -10.950 -5.621 1.00 0.00 C ATOM 725 O ARG A 92 -9.571 -12.009 -6.113 1.00 0.00 O ATOM 726 CB ARG A 92 -9.066 -8.699 -6.574 1.00 0.00 C ATOM 727 CG ARG A 92 -9.806 -7.463 -7.052 1.00 0.00 C ATOM 728 CD ARG A 92 -8.779 -6.532 -7.692 1.00 0.00 C ATOM 729 NE ARG A 92 -7.577 -6.424 -6.803 1.00 0.00 N ATOM 730 CZ ARG A 92 -6.441 -5.984 -7.281 1.00 0.00 C ATOM 731 NH1 ARG A 92 -6.351 -5.633 -8.533 1.00 0.00 N ATOM 732 NH2 ARG A 92 -5.391 -5.896 -6.506 1.00 0.00 N ATOM 0 H ARG A 92 -10.495 -8.216 -4.508 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.820 -9.896 -6.712 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.322 -8.419 -5.828 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.528 -9.153 -7.406 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.579 -7.733 -7.771 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -10.305 -6.968 -6.218 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -8.487 -6.913 -8.671 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.216 -5.546 -7.851 1.00 0.00 H new ATOM 0 HE ARG A 92 -7.645 -6.694 -5.822 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -7.167 -5.701 -9.142 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -5.465 -5.290 -8.904 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -5.456 -6.171 -5.526 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -4.507 -5.553 -6.882 1.00 0.00 H new ATOM 746 N ASN A 93 -8.160 -10.918 -4.813 1.00 0.00 N ATOM 747 CA ASN A 93 -7.499 -12.280 -4.606 1.00 0.00 C ATOM 748 C ASN A 93 -7.619 -12.691 -3.146 1.00 0.00 C ATOM 749 O ASN A 93 -8.439 -13.506 -2.837 1.00 0.00 O ATOM 750 CB ASN A 93 -6.069 -12.269 -5.159 1.00 0.00 C ATOM 751 CG ASN A 93 -5.472 -10.890 -4.856 1.00 0.00 C ATOM 752 OD1 ASN A 93 -5.891 -10.247 -3.920 1.00 0.00 O ATOM 753 ND2 ASN A 93 -4.526 -10.392 -5.609 1.00 0.00 N ATOM 0 H ASN A 93 -7.758 -10.111 -4.336 1.00 0.00 H new ATOM 0 HA ASN A 93 -8.017 -13.052 -5.175 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -5.473 -13.056 -4.697 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.071 -12.459 -6.232 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -4.146 -9.467 -5.406 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -4.168 -10.928 -6.399 1.00 0.00 H new ATOM 760 N ASP A 94 -6.930 -12.043 -2.263 1.00 0.00 N ATOM 761 CA ASP A 94 -7.107 -12.280 -0.779 1.00 0.00 C ATOM 762 C ASP A 94 -5.841 -11.892 -0.037 1.00 0.00 C ATOM 763 O ASP A 94 -5.799 -11.832 1.173 1.00 0.00 O ATOM 764 CB ASP A 94 -7.534 -13.729 -0.432 1.00 0.00 C ATOM 765 CG ASP A 94 -9.067 -13.854 -0.570 1.00 0.00 C ATOM 766 OD1 ASP A 94 -9.749 -12.852 -0.411 1.00 0.00 O ATOM 767 OD2 ASP A 94 -9.527 -14.939 -0.875 1.00 0.00 O ATOM 0 H ASP A 94 -6.230 -11.338 -2.495 1.00 0.00 H new ATOM 0 HA ASP A 94 -7.930 -11.644 -0.453 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -7.038 -14.436 -1.097 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -7.227 -13.978 0.584 1.00 0.00 H new ATOM 772 N LEU A 95 -4.828 -11.634 -0.806 1.00 0.00 N ATOM 773 CA LEU A 95 -3.533 -11.239 -0.188 1.00 0.00 C ATOM 774 C LEU A 95 -3.141 -9.839 -0.702 1.00 0.00 C ATOM 775 O LEU A 95 -3.499 -9.490 -1.773 1.00 0.00 O ATOM 776 CB LEU A 95 -2.503 -12.316 -0.552 1.00 0.00 C ATOM 777 CG LEU A 95 -2.699 -12.809 -2.029 1.00 0.00 C ATOM 778 CD1 LEU A 95 -1.346 -13.025 -2.719 1.00 0.00 C ATOM 779 CD2 LEU A 95 -3.456 -14.153 -2.075 1.00 0.00 C ATOM 0 H LEU A 95 -4.836 -11.678 -1.825 1.00 0.00 H new ATOM 0 HA LEU A 95 -3.594 -11.173 0.898 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.496 -11.917 -0.429 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.597 -13.160 0.132 1.00 0.00 H new ATOM 0 HG LEU A 95 -3.272 -12.035 -2.541 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.509 -13.366 -3.741 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.791 -12.087 -2.734 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.775 -13.775 -2.173 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -3.576 -14.468 -3.112 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.890 -14.908 -1.530 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.438 -14.034 -1.616 1.00 0.00 H new ATOM 791 N LEU A 96 -2.385 -9.081 0.077 1.00 0.00 N ATOM 792 CA LEU A 96 -2.006 -7.653 -0.388 1.00 0.00 C ATOM 793 C LEU A 96 -2.017 -6.703 0.821 1.00 0.00 C ATOM 794 O LEU A 96 -2.869 -6.920 1.661 1.00 0.00 O ATOM 795 CB LEU A 96 -3.124 -7.051 -1.323 1.00 0.00 C ATOM 796 CG LEU A 96 -4.576 -7.324 -0.792 1.00 0.00 C ATOM 797 CD1 LEU A 96 -5.202 -6.022 -0.257 1.00 0.00 C ATOM 798 CD2 LEU A 96 -5.517 -7.834 -1.914 1.00 0.00 C ATOM 0 H LEU A 96 -2.016 -9.359 0.986 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.039 -7.731 -0.885 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.973 -5.976 -1.416 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.022 -7.475 -2.322 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.479 -8.078 -0.011 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -6.209 -6.226 0.108 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.592 -5.633 0.558 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -5.249 -5.285 -1.058 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.511 -8.010 -1.503 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -5.579 -7.087 -2.705 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.124 -8.764 -2.324 1.00 0.00 H new ATOM 810 N PHE A 97 -1.279 -5.591 0.937 1.00 0.00 N ATOM 811 CA PHE A 97 -1.564 -4.710 2.078 1.00 0.00 C ATOM 812 C PHE A 97 -2.053 -3.418 1.426 1.00 0.00 C ATOM 813 O PHE A 97 -1.277 -2.566 1.051 1.00 0.00 O ATOM 814 CB PHE A 97 -0.304 -4.502 2.921 1.00 0.00 C ATOM 815 CG PHE A 97 0.650 -5.609 2.575 1.00 0.00 C ATOM 816 CD1 PHE A 97 0.280 -6.929 2.820 1.00 0.00 C ATOM 817 CD2 PHE A 97 1.863 -5.322 1.970 1.00 0.00 C ATOM 818 CE1 PHE A 97 1.134 -7.973 2.476 1.00 0.00 C ATOM 819 CE2 PHE A 97 2.725 -6.360 1.614 1.00 0.00 C ATOM 820 CZ PHE A 97 2.362 -7.689 1.872 1.00 0.00 C ATOM 0 H PHE A 97 -0.534 -5.294 0.307 1.00 0.00 H new ATOM 0 HA PHE A 97 -2.303 -5.115 2.769 1.00 0.00 H new ATOM 0 HB2 PHE A 97 0.143 -3.530 2.712 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -0.545 -4.520 3.984 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -0.674 -7.144 3.279 1.00 0.00 H new ATOM 0 HD2 PHE A 97 2.141 -4.297 1.774 1.00 0.00 H new ATOM 0 HE1 PHE A 97 0.850 -8.996 2.675 1.00 0.00 H new ATOM 0 HE2 PHE A 97 3.670 -6.140 1.140 1.00 0.00 H new ATOM 0 HZ PHE A 97 3.031 -8.493 1.604 1.00 0.00 H new ATOM 830 N ILE A 98 -3.350 -3.255 1.332 1.00 0.00 N ATOM 831 CA ILE A 98 -3.918 -2.008 0.738 1.00 0.00 C ATOM 832 C ILE A 98 -4.071 -1.103 1.940 1.00 0.00 C ATOM 833 O ILE A 98 -4.814 -1.349 2.862 1.00 0.00 O ATOM 834 CB ILE A 98 -5.262 -2.337 0.051 1.00 0.00 C ATOM 835 CG1 ILE A 98 -5.111 -2.431 -1.495 1.00 0.00 C ATOM 836 CG2 ILE A 98 -6.345 -1.315 0.400 1.00 0.00 C ATOM 837 CD1 ILE A 98 -4.806 -1.076 -2.168 1.00 0.00 C ATOM 0 H ILE A 98 -4.042 -3.937 1.643 1.00 0.00 H new ATOM 0 HA ILE A 98 -3.307 -1.543 -0.036 1.00 0.00 H new ATOM 0 HB ILE A 98 -5.569 -3.311 0.431 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.312 -3.133 -1.732 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -6.029 -2.839 -1.918 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -7.274 -1.583 -0.103 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.505 -1.308 1.478 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.029 -0.324 0.074 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -4.714 -1.217 -3.245 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -5.616 -0.377 -1.962 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -3.872 -0.676 -1.773 1.00 0.00 H new ATOM 849 N VAL A 99 -3.215 -0.164 1.974 1.00 0.00 N ATOM 850 CA VAL A 99 -3.078 0.710 3.141 1.00 0.00 C ATOM 851 C VAL A 99 -3.043 2.180 2.850 1.00 0.00 C ATOM 852 O VAL A 99 -2.446 2.675 1.923 1.00 0.00 O ATOM 853 CB VAL A 99 -1.758 0.296 3.774 1.00 0.00 C ATOM 854 CG1 VAL A 99 -1.872 -1.208 4.076 1.00 0.00 C ATOM 855 CG2 VAL A 99 -0.560 0.529 2.818 1.00 0.00 C ATOM 0 H VAL A 99 -2.573 0.049 1.211 1.00 0.00 H new ATOM 0 HA VAL A 99 -3.956 0.587 3.774 1.00 0.00 H new ATOM 0 HB VAL A 99 -1.577 0.891 4.669 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.947 -1.558 4.534 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.703 -1.380 4.760 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -2.047 -1.753 3.148 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.363 0.220 3.309 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.701 -0.056 1.909 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.499 1.587 2.563 1.00 0.00 H new ATOM 865 N VAL A 100 -3.649 2.880 3.768 1.00 0.00 N ATOM 866 CA VAL A 100 -3.620 4.344 3.743 1.00 0.00 C ATOM 867 C VAL A 100 -2.728 4.659 4.926 1.00 0.00 C ATOM 868 O VAL A 100 -2.825 4.019 5.958 1.00 0.00 O ATOM 869 CB VAL A 100 -5.018 4.933 3.922 1.00 0.00 C ATOM 870 CG1 VAL A 100 -4.937 6.459 3.749 1.00 0.00 C ATOM 871 CG2 VAL A 100 -5.973 4.317 2.872 1.00 0.00 C ATOM 0 H VAL A 100 -4.171 2.477 4.546 1.00 0.00 H new ATOM 0 HA VAL A 100 -3.264 4.762 2.801 1.00 0.00 H new ATOM 0 HB VAL A 100 -5.402 4.705 4.916 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.929 6.893 3.874 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -4.262 6.875 4.497 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -4.562 6.693 2.753 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.971 4.736 2.998 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -5.608 4.544 1.870 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -6.014 3.236 3.007 1.00 0.00 H new ATOM 881 N THR A 101 -1.850 5.599 4.794 1.00 0.00 N ATOM 882 CA THR A 101 -0.939 5.917 5.922 1.00 0.00 C ATOM 883 C THR A 101 -1.185 7.337 6.322 1.00 0.00 C ATOM 884 O THR A 101 -1.361 8.205 5.485 1.00 0.00 O ATOM 885 CB THR A 101 0.549 5.783 5.497 1.00 0.00 C ATOM 886 OG1 THR A 101 0.919 6.917 4.731 1.00 0.00 O ATOM 887 CG2 THR A 101 0.785 4.509 4.673 1.00 0.00 C ATOM 0 H THR A 101 -1.720 6.164 3.955 1.00 0.00 H new ATOM 0 HA THR A 101 -1.131 5.223 6.741 1.00 0.00 H new ATOM 0 HB THR A 101 1.159 5.720 6.398 1.00 0.00 H new ATOM 0 HG1 THR A 101 0.229 7.096 4.058 1.00 0.00 H new ATOM 0 HG21 THR A 101 1.836 4.447 4.392 1.00 0.00 H new ATOM 0 HG22 THR A 101 0.516 3.636 5.268 1.00 0.00 H new ATOM 0 HG23 THR A 101 0.170 4.539 3.773 1.00 0.00 H new ATOM 895 N ASP A 102 -1.016 7.632 7.564 1.00 0.00 N ATOM 896 CA ASP A 102 -1.062 9.026 7.957 1.00 0.00 C ATOM 897 C ASP A 102 0.332 9.429 7.558 1.00 0.00 C ATOM 898 O ASP A 102 1.029 8.637 6.945 1.00 0.00 O ATOM 899 CB ASP A 102 -1.251 9.158 9.475 1.00 0.00 C ATOM 900 CG ASP A 102 -1.542 10.617 9.828 1.00 0.00 C ATOM 901 OD1 ASP A 102 -2.573 11.117 9.407 1.00 0.00 O ATOM 902 OD2 ASP A 102 -0.724 11.216 10.508 1.00 0.00 O ATOM 0 H ASP A 102 -0.849 6.963 8.315 1.00 0.00 H new ATOM 0 HA ASP A 102 -1.869 9.614 7.520 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -2.072 8.522 9.807 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -0.355 8.819 9.995 1.00 0.00 H new ATOM 907 N MET A 103 0.774 10.586 7.841 1.00 0.00 N ATOM 908 CA MET A 103 2.157 10.835 7.368 1.00 0.00 C ATOM 909 C MET A 103 3.052 10.043 8.321 1.00 0.00 C ATOM 910 O MET A 103 3.706 10.591 9.183 1.00 0.00 O ATOM 911 CB MET A 103 2.406 12.357 7.468 1.00 0.00 C ATOM 912 CG MET A 103 3.155 12.835 6.236 1.00 0.00 C ATOM 913 SD MET A 103 3.582 14.589 6.402 1.00 0.00 S ATOM 914 CE MET A 103 5.254 14.371 7.066 1.00 0.00 C ATOM 0 H MET A 103 0.295 11.335 8.341 1.00 0.00 H new ATOM 0 HA MET A 103 2.347 10.530 6.339 1.00 0.00 H new ATOM 0 HB2 MET A 103 1.457 12.886 7.556 1.00 0.00 H new ATOM 0 HB3 MET A 103 2.981 12.583 8.366 1.00 0.00 H new ATOM 0 HG2 MET A 103 4.061 12.244 6.101 1.00 0.00 H new ATOM 0 HG3 MET A 103 2.541 12.685 5.348 1.00 0.00 H new ATOM 0 HE1 MET A 103 5.705 15.347 7.243 1.00 0.00 H new ATOM 0 HE2 MET A 103 5.204 13.819 8.004 1.00 0.00 H new ATOM 0 HE3 MET A 103 5.860 13.816 6.350 1.00 0.00 H new ATOM 924 N GLN A 104 3.038 8.707 8.230 1.00 0.00 N ATOM 925 CA GLN A 104 3.795 7.847 9.147 1.00 0.00 C ATOM 926 C GLN A 104 4.312 6.608 8.403 1.00 0.00 C ATOM 927 O GLN A 104 5.463 6.263 8.551 1.00 0.00 O ATOM 928 CB GLN A 104 2.814 7.424 10.238 1.00 0.00 C ATOM 929 CG GLN A 104 3.516 6.614 11.323 1.00 0.00 C ATOM 930 CD GLN A 104 4.376 7.547 12.173 1.00 0.00 C ATOM 931 OE1 GLN A 104 5.565 7.343 12.306 1.00 0.00 O ATOM 932 NE2 GLN A 104 3.819 8.572 12.761 1.00 0.00 N ATOM 0 H GLN A 104 2.507 8.196 7.525 1.00 0.00 H new ATOM 0 HA GLN A 104 4.657 8.370 9.562 1.00 0.00 H new ATOM 0 HB2 GLN A 104 2.354 8.308 10.680 1.00 0.00 H new ATOM 0 HB3 GLN A 104 2.011 6.832 9.800 1.00 0.00 H new ATOM 0 HG2 GLN A 104 2.780 6.108 11.948 1.00 0.00 H new ATOM 0 HG3 GLN A 104 4.136 5.840 10.871 1.00 0.00 H new ATOM 0 HE21 GLN A 104 2.820 8.743 12.649 1.00 0.00 H new ATOM 0 HE22 GLN A 104 4.383 9.201 13.332 1.00 0.00 H new ATOM 941 N SER A 105 3.477 5.917 7.631 1.00 0.00 N ATOM 942 CA SER A 105 3.889 4.698 6.912 1.00 0.00 C ATOM 943 C SER A 105 3.709 3.527 7.833 1.00 0.00 C ATOM 944 O SER A 105 4.091 3.588 8.981 1.00 0.00 O ATOM 945 CB SER A 105 5.331 4.788 6.454 1.00 0.00 C ATOM 946 OG SER A 105 5.475 3.957 5.312 1.00 0.00 O ATOM 0 H SER A 105 2.502 6.177 7.482 1.00 0.00 H new ATOM 0 HA SER A 105 3.273 4.580 6.020 1.00 0.00 H new ATOM 0 HB2 SER A 105 5.592 5.818 6.212 1.00 0.00 H new ATOM 0 HB3 SER A 105 6.005 4.467 7.248 1.00 0.00 H new ATOM 0 HG SER A 105 5.879 3.104 5.577 1.00 0.00 H new ATOM 952 N LEU A 106 3.199 2.451 7.306 1.00 0.00 N ATOM 953 CA LEU A 106 3.021 1.192 8.045 1.00 0.00 C ATOM 954 C LEU A 106 1.907 0.507 7.267 1.00 0.00 C ATOM 955 O LEU A 106 0.954 1.119 6.834 1.00 0.00 O ATOM 956 CB LEU A 106 2.661 1.348 9.566 1.00 0.00 C ATOM 957 CG LEU A 106 3.602 0.487 10.447 1.00 0.00 C ATOM 958 CD1 LEU A 106 4.910 1.235 10.718 1.00 0.00 C ATOM 959 CD2 LEU A 106 2.929 0.189 11.790 1.00 0.00 C ATOM 0 H LEU A 106 2.884 2.403 6.337 1.00 0.00 H new ATOM 0 HA LEU A 106 3.954 0.631 8.095 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.741 2.395 9.857 1.00 0.00 H new ATOM 0 HB3 LEU A 106 1.626 1.049 9.732 1.00 0.00 H new ATOM 0 HG LEU A 106 3.812 -0.442 9.916 1.00 0.00 H new ATOM 0 HD11 LEU A 106 5.560 0.618 11.338 1.00 0.00 H new ATOM 0 HD12 LEU A 106 5.408 1.451 9.773 1.00 0.00 H new ATOM 0 HD13 LEU A 106 4.694 2.169 11.237 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.595 -0.416 12.404 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.712 1.125 12.304 1.00 0.00 H new ATOM 0 HD23 LEU A 106 2.000 -0.354 11.619 1.00 0.00 H new ATOM 971 N ARG A 107 2.050 -0.762 7.078 1.00 0.00 N ATOM 972 CA ARG A 107 0.999 -1.458 6.304 1.00 0.00 C ATOM 973 C ARG A 107 -0.185 -1.570 7.231 1.00 0.00 C ATOM 974 O ARG A 107 -0.268 -2.411 8.093 1.00 0.00 O ATOM 975 CB ARG A 107 1.470 -2.835 5.799 1.00 0.00 C ATOM 976 CG ARG A 107 2.150 -2.727 4.418 1.00 0.00 C ATOM 977 CD ARG A 107 3.606 -2.270 4.557 1.00 0.00 C ATOM 978 NE ARG A 107 4.313 -2.477 3.252 1.00 0.00 N ATOM 979 CZ ARG A 107 5.019 -3.564 3.027 1.00 0.00 C ATOM 980 NH1 ARG A 107 5.148 -4.482 3.947 1.00 0.00 N ATOM 981 NH2 ARG A 107 5.599 -3.730 1.870 1.00 0.00 N ATOM 0 H ARG A 107 2.823 -1.337 7.413 1.00 0.00 H new ATOM 0 HA ARG A 107 0.742 -0.904 5.401 1.00 0.00 H new ATOM 0 HB2 ARG A 107 2.167 -3.268 6.516 1.00 0.00 H new ATOM 0 HB3 ARG A 107 0.618 -3.511 5.734 1.00 0.00 H new ATOM 0 HG2 ARG A 107 2.115 -3.693 3.915 1.00 0.00 H new ATOM 0 HG3 ARG A 107 1.602 -2.022 3.793 1.00 0.00 H new ATOM 0 HD2 ARG A 107 3.644 -1.219 4.842 1.00 0.00 H new ATOM 0 HD3 ARG A 107 4.103 -2.833 5.347 1.00 0.00 H new ATOM 0 HE ARG A 107 4.246 -1.763 2.526 1.00 0.00 H new ATOM 0 HH11 ARG A 107 4.698 -4.361 4.854 1.00 0.00 H new ATOM 0 HH12 ARG A 107 5.699 -5.320 3.758 1.00 0.00 H new ATOM 0 HH21 ARG A 107 5.504 -3.019 1.145 1.00 0.00 H new ATOM 0 HH22 ARG A 107 6.148 -4.571 1.690 1.00 0.00 H new ATOM 995 N TYR A 108 -1.082 -0.659 7.061 1.00 0.00 N ATOM 996 CA TYR A 108 -2.271 -0.636 7.934 1.00 0.00 C ATOM 997 C TYR A 108 -2.834 -2.054 7.950 1.00 0.00 C ATOM 998 O TYR A 108 -3.597 -2.439 8.811 1.00 0.00 O ATOM 999 CB TYR A 108 -3.324 0.309 7.333 1.00 0.00 C ATOM 1000 CG TYR A 108 -3.155 1.734 7.815 1.00 0.00 C ATOM 1001 CD1 TYR A 108 -1.890 2.255 8.051 1.00 0.00 C ATOM 1002 CD2 TYR A 108 -4.289 2.544 7.997 1.00 0.00 C ATOM 1003 CE1 TYR A 108 -1.752 3.575 8.471 1.00 0.00 C ATOM 1004 CE2 TYR A 108 -4.151 3.864 8.421 1.00 0.00 C ATOM 1005 CZ TYR A 108 -2.881 4.384 8.659 1.00 0.00 C ATOM 1006 OH TYR A 108 -2.740 5.692 9.078 1.00 0.00 O ATOM 0 H TYR A 108 -1.045 0.074 6.353 1.00 0.00 H new ATOM 0 HA TYR A 108 -2.015 -0.295 8.937 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -3.253 0.284 6.246 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -4.321 -0.046 7.596 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -1.015 1.638 7.909 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -5.273 2.141 7.807 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -0.767 3.979 8.653 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -5.025 4.482 8.565 1.00 0.00 H new ATOM 0 HH TYR A 108 -3.624 6.108 9.156 1.00 0.00 H new ATOM 1016 N SER A 109 -2.494 -2.793 6.916 1.00 0.00 N ATOM 1017 CA SER A 109 -3.052 -4.166 6.746 1.00 0.00 C ATOM 1018 C SER A 109 -2.023 -5.270 6.431 1.00 0.00 C ATOM 1019 O SER A 109 -0.927 -5.011 6.026 1.00 0.00 O ATOM 1020 CB SER A 109 -4.018 -4.098 5.560 1.00 0.00 C ATOM 1021 OG SER A 109 -5.128 -4.948 5.809 1.00 0.00 O ATOM 0 H SER A 109 -1.850 -2.497 6.182 1.00 0.00 H new ATOM 0 HA SER A 109 -3.504 -4.440 7.699 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.357 -3.073 5.411 1.00 0.00 H new ATOM 0 HB3 SER A 109 -3.510 -4.403 4.645 1.00 0.00 H new ATOM 0 HG SER A 109 -5.749 -4.905 5.052 1.00 0.00 H new ATOM 1027 N HIS A 110 -2.407 -6.527 6.603 1.00 0.00 N ATOM 1028 CA HIS A 110 -1.482 -7.667 6.283 1.00 0.00 C ATOM 1029 C HIS A 110 -2.070 -9.012 6.776 1.00 0.00 C ATOM 1030 O HIS A 110 -2.616 -9.075 7.859 1.00 0.00 O ATOM 1031 CB HIS A 110 -0.112 -7.453 6.990 1.00 0.00 C ATOM 1032 CG HIS A 110 1.026 -7.408 5.999 1.00 0.00 C ATOM 1033 ND1 HIS A 110 1.510 -6.215 5.485 1.00 0.00 N ATOM 1034 CD2 HIS A 110 1.800 -8.399 5.440 1.00 0.00 C ATOM 1035 CE1 HIS A 110 2.529 -6.514 4.658 1.00 0.00 C ATOM 1036 NE2 HIS A 110 2.740 -7.828 4.592 1.00 0.00 N ATOM 0 H HIS A 110 -3.324 -6.806 6.952 1.00 0.00 H new ATOM 0 HA HIS A 110 -1.356 -7.697 5.201 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -0.137 -6.523 7.558 1.00 0.00 H new ATOM 0 HB3 HIS A 110 0.059 -8.258 7.704 1.00 0.00 H new ATOM 0 HD2 HIS A 110 1.693 -9.457 5.631 1.00 0.00 H new ATOM 0 HE1 HIS A 110 3.105 -5.779 4.115 1.00 0.00 H new ATOM 0 HE2 HIS A 110 3.444 -8.313 4.035 1.00 0.00 H new ATOM 1045 N PRO A 111 -1.871 -10.110 6.050 1.00 0.00 N ATOM 1046 CA PRO A 111 -2.303 -11.446 6.546 1.00 0.00 C ATOM 1047 C PRO A 111 -1.425 -11.733 7.760 1.00 0.00 C ATOM 1048 O PRO A 111 -1.882 -12.107 8.822 1.00 0.00 O ATOM 1049 CB PRO A 111 -1.995 -12.405 5.387 1.00 0.00 C ATOM 1050 CG PRO A 111 -0.920 -11.715 4.617 1.00 0.00 C ATOM 1051 CD PRO A 111 -1.239 -10.221 4.720 1.00 0.00 C ATOM 0 HA PRO A 111 -3.351 -11.529 6.833 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -1.662 -13.377 5.752 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -2.877 -12.581 4.770 1.00 0.00 H new ATOM 0 HG2 PRO A 111 0.064 -11.936 5.032 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -0.909 -12.043 3.578 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -0.339 -9.610 4.648 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -1.910 -9.895 3.925 1.00 0.00 H new ATOM 1059 N GLU A 112 -0.144 -11.450 7.596 1.00 0.00 N ATOM 1060 CA GLU A 112 0.836 -11.575 8.713 1.00 0.00 C ATOM 1061 C GLU A 112 1.225 -10.138 9.134 1.00 0.00 C ATOM 1062 O GLU A 112 1.903 -9.405 8.442 1.00 0.00 O ATOM 1063 CB GLU A 112 2.070 -12.387 8.288 1.00 0.00 C ATOM 1064 CG GLU A 112 2.879 -12.779 9.535 1.00 0.00 C ATOM 1065 CD GLU A 112 4.030 -13.706 9.136 1.00 0.00 C ATOM 1066 OE1 GLU A 112 3.766 -14.868 8.873 1.00 0.00 O ATOM 1067 OE2 GLU A 112 5.156 -13.238 9.097 1.00 0.00 O ATOM 0 H GLU A 112 0.260 -11.133 6.715 1.00 0.00 H new ATOM 0 HA GLU A 112 0.394 -12.114 9.551 1.00 0.00 H new ATOM 0 HB2 GLU A 112 1.761 -13.281 7.746 1.00 0.00 H new ATOM 0 HB3 GLU A 112 2.689 -11.800 7.609 1.00 0.00 H new ATOM 0 HG2 GLU A 112 3.271 -11.886 10.021 1.00 0.00 H new ATOM 0 HG3 GLU A 112 2.232 -13.277 10.257 1.00 0.00 H new ATOM 1074 N ALA A 113 0.748 -9.797 10.288 1.00 0.00 N ATOM 1075 CA ALA A 113 0.981 -8.431 10.873 1.00 0.00 C ATOM 1076 C ALA A 113 2.461 -8.097 11.077 1.00 0.00 C ATOM 1077 O ALA A 113 2.827 -6.948 11.027 1.00 0.00 O ATOM 1078 CB ALA A 113 0.294 -8.354 12.237 1.00 0.00 C ATOM 0 H ALA A 113 0.190 -10.415 10.876 1.00 0.00 H new ATOM 0 HA ALA A 113 0.575 -7.714 10.160 1.00 0.00 H new ATOM 0 HB1 ALA A 113 0.456 -7.367 12.671 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -0.776 -8.526 12.116 1.00 0.00 H new ATOM 0 HB3 ALA A 113 0.711 -9.114 12.898 1.00 0.00 H new ATOM 1084 N GLN A 114 3.324 -9.018 11.299 1.00 0.00 N ATOM 1085 CA GLN A 114 4.750 -8.663 11.498 1.00 0.00 C ATOM 1086 C GLN A 114 5.366 -7.901 10.289 1.00 0.00 C ATOM 1087 O GLN A 114 6.158 -6.993 10.483 1.00 0.00 O ATOM 1088 CB GLN A 114 5.514 -9.964 11.713 1.00 0.00 C ATOM 1089 CG GLN A 114 6.941 -9.648 12.141 1.00 0.00 C ATOM 1090 CD GLN A 114 7.665 -10.949 12.473 1.00 0.00 C ATOM 1091 OE1 GLN A 114 7.363 -11.986 11.916 1.00 0.00 O ATOM 1092 NE2 GLN A 114 8.611 -10.938 13.367 1.00 0.00 N ATOM 0 H GLN A 114 3.112 -10.014 11.354 1.00 0.00 H new ATOM 0 HA GLN A 114 4.822 -7.992 12.354 1.00 0.00 H new ATOM 0 HB2 GLN A 114 5.020 -10.567 12.474 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.520 -10.551 10.795 1.00 0.00 H new ATOM 0 HG2 GLN A 114 7.464 -9.120 11.344 1.00 0.00 H new ATOM 0 HG3 GLN A 114 6.935 -8.989 13.009 1.00 0.00 H new ATOM 0 HE21 GLN A 114 8.862 -10.066 13.833 1.00 0.00 H new ATOM 0 HE22 GLN A 114 9.101 -11.801 13.602 1.00 0.00 H new ATOM 1101 N ARG A 115 5.023 -8.212 9.049 1.00 0.00 N ATOM 1102 CA ARG A 115 5.642 -7.445 7.920 1.00 0.00 C ATOM 1103 C ARG A 115 5.339 -5.962 8.155 1.00 0.00 C ATOM 1104 O ARG A 115 6.199 -5.111 8.003 1.00 0.00 O ATOM 1105 CB ARG A 115 5.090 -7.893 6.515 1.00 0.00 C ATOM 1106 CG ARG A 115 5.885 -7.196 5.362 1.00 0.00 C ATOM 1107 CD ARG A 115 6.952 -8.136 4.745 1.00 0.00 C ATOM 1108 NE ARG A 115 6.386 -8.831 3.539 1.00 0.00 N ATOM 1109 CZ ARG A 115 7.167 -9.204 2.543 1.00 0.00 C ATOM 1110 NH1 ARG A 115 8.456 -8.983 2.581 1.00 0.00 N ATOM 1111 NH2 ARG A 115 6.654 -9.801 1.499 1.00 0.00 N ATOM 0 H ARG A 115 4.362 -8.941 8.782 1.00 0.00 H new ATOM 0 HA ARG A 115 6.715 -7.637 7.904 1.00 0.00 H new ATOM 0 HB2 ARG A 115 5.169 -8.976 6.416 1.00 0.00 H new ATOM 0 HB3 ARG A 115 4.032 -7.642 6.437 1.00 0.00 H new ATOM 0 HG2 ARG A 115 5.191 -6.875 4.585 1.00 0.00 H new ATOM 0 HG3 ARG A 115 6.370 -6.299 5.746 1.00 0.00 H new ATOM 0 HD2 ARG A 115 7.835 -7.563 4.464 1.00 0.00 H new ATOM 0 HD3 ARG A 115 7.271 -8.872 5.483 1.00 0.00 H new ATOM 0 HE ARG A 115 5.384 -9.017 3.490 1.00 0.00 H new ATOM 0 HH11 ARG A 115 8.870 -8.517 3.388 1.00 0.00 H new ATOM 0 HH12 ARG A 115 9.047 -9.277 1.803 1.00 0.00 H new ATOM 0 HH21 ARG A 115 5.650 -9.978 1.455 1.00 0.00 H new ATOM 0 HH22 ARG A 115 7.257 -10.090 0.729 1.00 0.00 H new ATOM 1125 N ILE A 116 4.126 -5.666 8.572 1.00 0.00 N ATOM 1126 CA ILE A 116 3.783 -4.234 8.886 1.00 0.00 C ATOM 1127 C ILE A 116 4.953 -3.559 9.616 1.00 0.00 C ATOM 1128 O ILE A 116 5.669 -2.780 9.053 1.00 0.00 O ATOM 1129 CB ILE A 116 2.561 -4.182 9.821 1.00 0.00 C ATOM 1130 CG1 ILE A 116 1.358 -4.779 9.098 1.00 0.00 C ATOM 1131 CG2 ILE A 116 2.292 -2.724 10.262 1.00 0.00 C ATOM 1132 CD1 ILE A 116 0.148 -4.844 10.037 1.00 0.00 C ATOM 0 H ILE A 116 3.371 -6.338 8.707 1.00 0.00 H new ATOM 0 HA ILE A 116 3.572 -3.721 7.947 1.00 0.00 H new ATOM 0 HB ILE A 116 2.752 -4.767 10.721 1.00 0.00 H new ATOM 0 HG12 ILE A 116 1.115 -4.176 8.223 1.00 0.00 H new ATOM 0 HG13 ILE A 116 1.601 -5.779 8.738 1.00 0.00 H new ATOM 0 HG21 ILE A 116 1.426 -2.698 10.923 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.163 -2.337 10.790 1.00 0.00 H new ATOM 0 HG23 ILE A 116 2.097 -2.108 9.384 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -0.702 -5.272 9.506 1.00 0.00 H new ATOM 0 HD12 ILE A 116 0.389 -5.467 10.898 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -0.104 -3.839 10.375 1.00 0.00 H new ATOM 1144 N GLY A 117 5.050 -3.806 10.889 1.00 0.00 N ATOM 1145 CA GLY A 117 6.102 -3.172 11.745 1.00 0.00 C ATOM 1146 C GLY A 117 7.386 -2.795 10.965 1.00 0.00 C ATOM 1147 O GLY A 117 8.174 -2.011 11.455 1.00 0.00 O ATOM 0 H GLY A 117 4.428 -4.439 11.392 1.00 0.00 H new ATOM 0 HA2 GLY A 117 5.691 -2.275 12.208 1.00 0.00 H new ATOM 0 HA3 GLY A 117 6.364 -3.856 12.552 1.00 0.00 H new ATOM 1151 N GLN A 118 7.653 -3.341 9.789 1.00 0.00 N ATOM 1152 CA GLN A 118 8.940 -2.982 9.104 1.00 0.00 C ATOM 1153 C GLN A 118 8.929 -1.549 8.513 1.00 0.00 C ATOM 1154 O GLN A 118 9.631 -0.716 9.031 1.00 0.00 O ATOM 1155 CB GLN A 118 9.317 -4.029 8.022 1.00 0.00 C ATOM 1156 CG GLN A 118 10.441 -4.949 8.534 1.00 0.00 C ATOM 1157 CD GLN A 118 11.722 -4.137 8.743 1.00 0.00 C ATOM 1158 OE1 GLN A 118 11.893 -3.087 8.156 1.00 0.00 O ATOM 1159 NE2 GLN A 118 12.636 -4.582 9.563 1.00 0.00 N ATOM 0 H GLN A 118 7.053 -3.999 9.291 1.00 0.00 H new ATOM 0 HA GLN A 118 9.710 -2.995 9.875 1.00 0.00 H new ATOM 0 HB2 GLN A 118 8.442 -4.624 7.762 1.00 0.00 H new ATOM 0 HB3 GLN A 118 9.639 -3.522 7.113 1.00 0.00 H new ATOM 0 HG2 GLN A 118 10.141 -5.419 9.471 1.00 0.00 H new ATOM 0 HG3 GLN A 118 10.621 -5.751 7.818 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.493 -5.463 10.056 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.493 -4.048 9.710 1.00 0.00 H new ATOM 1168 N PRO A 119 8.185 -1.269 7.447 1.00 0.00 N ATOM 1169 CA PRO A 119 8.108 0.077 6.814 1.00 0.00 C ATOM 1170 C PRO A 119 8.546 1.221 7.724 1.00 0.00 C ATOM 1171 O PRO A 119 8.560 1.118 8.927 1.00 0.00 O ATOM 1172 CB PRO A 119 6.653 0.176 6.378 1.00 0.00 C ATOM 1173 CG PRO A 119 6.209 -1.260 6.162 1.00 0.00 C ATOM 1174 CD PRO A 119 7.335 -2.184 6.696 1.00 0.00 C ATOM 0 HA PRO A 119 8.806 0.178 5.983 1.00 0.00 H new ATOM 0 HB2 PRO A 119 6.046 0.667 7.138 1.00 0.00 H new ATOM 0 HB3 PRO A 119 6.554 0.762 5.464 1.00 0.00 H new ATOM 0 HG2 PRO A 119 5.273 -1.454 6.686 1.00 0.00 H new ATOM 0 HG3 PRO A 119 6.027 -1.450 5.104 1.00 0.00 H new ATOM 0 HD2 PRO A 119 6.939 -2.978 7.329 1.00 0.00 H new ATOM 0 HD3 PRO A 119 7.880 -2.666 5.884 1.00 0.00 H new ATOM 1182 N PHE A 120 8.953 2.298 7.082 1.00 0.00 N ATOM 1183 CA PHE A 120 9.492 3.495 7.785 1.00 0.00 C ATOM 1184 C PHE A 120 11.015 3.272 7.928 1.00 0.00 C ATOM 1185 O PHE A 120 11.492 2.164 8.073 1.00 0.00 O ATOM 1186 CB PHE A 120 8.804 3.697 9.156 1.00 0.00 C ATOM 1187 CG PHE A 120 9.089 5.073 9.738 1.00 0.00 C ATOM 1188 CD1 PHE A 120 8.664 6.240 9.079 1.00 0.00 C ATOM 1189 CD2 PHE A 120 9.758 5.174 10.967 1.00 0.00 C ATOM 1190 CE1 PHE A 120 8.918 7.497 9.654 1.00 0.00 C ATOM 1191 CE2 PHE A 120 10.011 6.424 11.533 1.00 0.00 C ATOM 1192 CZ PHE A 120 9.591 7.586 10.880 1.00 0.00 C ATOM 0 H PHE A 120 8.929 2.390 6.066 1.00 0.00 H new ATOM 0 HA PHE A 120 9.293 4.406 7.221 1.00 0.00 H new ATOM 0 HB2 PHE A 120 7.728 3.566 9.044 1.00 0.00 H new ATOM 0 HB3 PHE A 120 9.148 2.931 9.851 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.144 6.171 8.135 1.00 0.00 H new ATOM 0 HD2 PHE A 120 10.079 4.279 11.478 1.00 0.00 H new ATOM 0 HE1 PHE A 120 8.594 8.396 9.150 1.00 0.00 H new ATOM 0 HE2 PHE A 120 10.532 6.494 12.477 1.00 0.00 H new ATOM 0 HZ PHE A 120 9.785 8.553 11.320 1.00 0.00 H new ATOM 1202 N LYS A 121 11.752 4.332 7.846 1.00 0.00 N ATOM 1203 CA LYS A 121 13.250 4.146 7.936 1.00 0.00 C ATOM 1204 C LYS A 121 13.783 3.233 6.777 1.00 0.00 C ATOM 1205 O LYS A 121 14.202 2.108 6.987 1.00 0.00 O ATOM 1206 CB LYS A 121 13.609 3.516 9.317 1.00 0.00 C ATOM 1207 CG LYS A 121 14.515 4.439 10.156 1.00 0.00 C ATOM 1208 CD LYS A 121 15.870 4.716 9.465 1.00 0.00 C ATOM 1209 CE LYS A 121 16.449 3.454 8.814 1.00 0.00 C ATOM 1210 NZ LYS A 121 17.885 3.699 8.492 1.00 0.00 N ATOM 0 H LYS A 121 11.419 5.289 7.726 1.00 0.00 H new ATOM 0 HA LYS A 121 13.726 5.122 7.838 1.00 0.00 H new ATOM 0 HB2 LYS A 121 12.693 3.308 9.870 1.00 0.00 H new ATOM 0 HB3 LYS A 121 14.111 2.561 9.160 1.00 0.00 H new ATOM 0 HG2 LYS A 121 14.001 5.383 10.335 1.00 0.00 H new ATOM 0 HG3 LYS A 121 14.693 3.983 11.130 1.00 0.00 H new ATOM 0 HD2 LYS A 121 15.740 5.488 8.707 1.00 0.00 H new ATOM 0 HD3 LYS A 121 16.578 5.104 10.197 1.00 0.00 H new ATOM 0 HE2 LYS A 121 16.353 2.603 9.488 1.00 0.00 H new ATOM 0 HE3 LYS A 121 15.895 3.208 7.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 18.291 2.850 8.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 17.961 4.502 7.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 18.405 3.916 9.366 1.00 0.00 H new ATOM 1224 N GLY A 122 13.823 3.741 5.563 1.00 0.00 N ATOM 1225 CA GLY A 122 14.400 2.961 4.410 1.00 0.00 C ATOM 1226 C GLY A 122 14.941 3.959 3.378 1.00 0.00 C ATOM 1227 O GLY A 122 16.115 3.949 3.091 1.00 0.00 O ATOM 0 H GLY A 122 13.478 4.669 5.318 1.00 0.00 H new ATOM 0 HA2 GLY A 122 15.197 2.304 4.757 1.00 0.00 H new ATOM 0 HA3 GLY A 122 13.636 2.326 3.961 1.00 0.00 H new ATOM 1231 N ASP A 123 14.089 4.844 2.870 1.00 0.00 N ATOM 1232 CA ASP A 123 14.503 5.929 1.874 1.00 0.00 C ATOM 1233 C ASP A 123 13.540 5.962 0.683 1.00 0.00 C ATOM 1234 O ASP A 123 13.718 6.749 -0.227 1.00 0.00 O ATOM 1235 CB ASP A 123 15.933 5.754 1.299 1.00 0.00 C ATOM 1236 CG ASP A 123 16.977 6.205 2.325 1.00 0.00 C ATOM 1237 OD1 ASP A 123 17.049 7.396 2.582 1.00 0.00 O ATOM 1238 OD2 ASP A 123 17.691 5.354 2.830 1.00 0.00 O ATOM 0 H ASP A 123 13.097 4.863 3.108 1.00 0.00 H new ATOM 0 HA ASP A 123 14.477 6.855 2.449 1.00 0.00 H new ATOM 0 HB2 ASP A 123 16.101 4.710 1.034 1.00 0.00 H new ATOM 0 HB3 ASP A 123 16.038 6.336 0.383 1.00 0.00 H new ATOM 1243 N ASP A 124 12.522 5.148 0.666 1.00 0.00 N ATOM 1244 CA ASP A 124 11.573 5.198 -0.488 1.00 0.00 C ATOM 1245 C ASP A 124 10.391 6.099 -0.113 1.00 0.00 C ATOM 1246 O ASP A 124 9.740 6.656 -0.976 1.00 0.00 O ATOM 1247 CB ASP A 124 11.122 3.774 -0.828 1.00 0.00 C ATOM 1248 CG ASP A 124 12.371 2.909 -1.008 1.00 0.00 C ATOM 1249 OD1 ASP A 124 13.027 3.056 -2.027 1.00 0.00 O ATOM 1250 OD2 ASP A 124 12.664 2.129 -0.116 1.00 0.00 O ATOM 0 H ASP A 124 12.305 4.460 1.387 1.00 0.00 H new ATOM 0 HA ASP A 124 12.053 5.616 -1.373 1.00 0.00 H new ATOM 0 HB2 ASP A 124 10.494 3.374 -0.032 1.00 0.00 H new ATOM 0 HB3 ASP A 124 10.523 3.772 -1.739 1.00 0.00 H new ATOM 1255 N ILE A 125 10.066 6.234 1.152 1.00 0.00 N ATOM 1256 CA ILE A 125 8.895 7.092 1.537 1.00 0.00 C ATOM 1257 C ILE A 125 9.333 8.561 1.638 1.00 0.00 C ATOM 1258 O ILE A 125 8.523 9.470 1.587 1.00 0.00 O ATOM 1259 CB ILE A 125 8.331 6.590 2.874 1.00 0.00 C ATOM 1260 CG1 ILE A 125 8.638 5.076 2.997 1.00 0.00 C ATOM 1261 CG2 ILE A 125 6.812 6.852 2.930 1.00 0.00 C ATOM 1262 CD1 ILE A 125 7.668 4.393 3.962 1.00 0.00 C ATOM 0 H ILE A 125 10.556 5.792 1.930 1.00 0.00 H new ATOM 0 HA ILE A 125 8.116 7.027 0.777 1.00 0.00 H new ATOM 0 HB ILE A 125 8.794 7.120 3.707 1.00 0.00 H new ATOM 0 HG12 ILE A 125 8.569 4.607 2.015 1.00 0.00 H new ATOM 0 HG13 ILE A 125 9.661 4.937 3.346 1.00 0.00 H new ATOM 0 HG21 ILE A 125 6.416 6.494 3.880 1.00 0.00 H new ATOM 0 HG22 ILE A 125 6.624 7.922 2.838 1.00 0.00 H new ATOM 0 HG23 ILE A 125 6.322 6.325 2.111 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.908 3.332 4.028 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.756 4.847 4.949 1.00 0.00 H new ATOM 0 HD13 ILE A 125 6.648 4.513 3.598 1.00 0.00 H new ATOM 1274 N LEU A 126 10.618 8.798 1.752 1.00 0.00 N ATOM 1275 CA LEU A 126 11.152 10.193 1.819 1.00 0.00 C ATOM 1276 C LEU A 126 10.547 10.954 0.658 1.00 0.00 C ATOM 1277 O LEU A 126 10.208 12.116 0.760 1.00 0.00 O ATOM 1278 CB LEU A 126 12.685 10.156 1.659 1.00 0.00 C ATOM 1279 CG LEU A 126 13.416 9.916 3.003 1.00 0.00 C ATOM 1280 CD1 LEU A 126 13.496 11.205 3.832 1.00 0.00 C ATOM 1281 CD2 LEU A 126 12.713 8.835 3.828 1.00 0.00 C ATOM 0 H LEU A 126 11.330 8.070 1.802 1.00 0.00 H new ATOM 0 HA LEU A 126 10.905 10.665 2.770 1.00 0.00 H new ATOM 0 HB2 LEU A 126 12.955 9.367 0.957 1.00 0.00 H new ATOM 0 HB3 LEU A 126 13.025 11.097 1.227 1.00 0.00 H new ATOM 0 HG LEU A 126 14.426 9.584 2.760 1.00 0.00 H new ATOM 0 HD11 LEU A 126 14.015 11.003 4.769 1.00 0.00 H new ATOM 0 HD12 LEU A 126 14.041 11.965 3.272 1.00 0.00 H new ATOM 0 HD13 LEU A 126 12.489 11.564 4.045 1.00 0.00 H new ATOM 0 HD21 LEU A 126 13.248 8.688 4.766 1.00 0.00 H new ATOM 0 HD22 LEU A 126 11.690 9.146 4.039 1.00 0.00 H new ATOM 0 HD23 LEU A 126 12.700 7.900 3.267 1.00 0.00 H new ATOM 1293 N LYS A 127 10.378 10.301 -0.436 1.00 0.00 N ATOM 1294 CA LYS A 127 9.768 10.975 -1.591 1.00 0.00 C ATOM 1295 C LYS A 127 8.266 11.004 -1.416 1.00 0.00 C ATOM 1296 O LYS A 127 7.641 11.888 -1.903 1.00 0.00 O ATOM 1297 CB LYS A 127 10.140 10.235 -2.879 1.00 0.00 C ATOM 1298 CG LYS A 127 11.610 10.549 -3.229 1.00 0.00 C ATOM 1299 CD LYS A 127 11.949 10.012 -4.621 1.00 0.00 C ATOM 1300 CE LYS A 127 13.375 10.429 -4.996 1.00 0.00 C ATOM 1301 NZ LYS A 127 14.342 9.868 -4.009 1.00 0.00 N ATOM 0 H LYS A 127 10.636 9.325 -0.583 1.00 0.00 H new ATOM 0 HA LYS A 127 10.139 11.998 -1.658 1.00 0.00 H new ATOM 0 HB2 LYS A 127 10.004 9.161 -2.749 1.00 0.00 H new ATOM 0 HB3 LYS A 127 9.484 10.543 -3.694 1.00 0.00 H new ATOM 0 HG2 LYS A 127 11.777 11.626 -3.196 1.00 0.00 H new ATOM 0 HG3 LYS A 127 12.272 10.101 -2.488 1.00 0.00 H new ATOM 0 HD2 LYS A 127 11.861 8.926 -4.635 1.00 0.00 H new ATOM 0 HD3 LYS A 127 11.241 10.399 -5.354 1.00 0.00 H new ATOM 0 HE2 LYS A 127 13.616 10.073 -5.998 1.00 0.00 H new ATOM 0 HE3 LYS A 127 13.452 11.516 -5.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 15.302 9.900 -4.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 14.311 10.430 -3.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 14.088 8.882 -3.796 1.00 0.00 H new ATOM 1315 N ALA A 128 7.641 10.016 -0.816 1.00 0.00 N ATOM 1316 CA ALA A 128 6.141 10.053 -0.736 1.00 0.00 C ATOM 1317 C ALA A 128 5.693 10.842 0.500 1.00 0.00 C ATOM 1318 O ALA A 128 4.622 11.418 0.536 1.00 0.00 O ATOM 1319 CB ALA A 128 5.611 8.617 -0.666 1.00 0.00 C ATOM 0 H ALA A 128 8.089 9.205 -0.388 1.00 0.00 H new ATOM 0 HA ALA A 128 5.742 10.549 -1.621 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.523 8.633 -0.608 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.918 8.072 -1.558 1.00 0.00 H new ATOM 0 HB3 ALA A 128 6.014 8.123 0.218 1.00 0.00 H new ATOM 1325 N LEU A 129 6.516 10.834 1.521 1.00 0.00 N ATOM 1326 CA LEU A 129 6.221 11.526 2.811 1.00 0.00 C ATOM 1327 C LEU A 129 5.793 12.966 2.521 1.00 0.00 C ATOM 1328 O LEU A 129 5.053 13.575 3.270 1.00 0.00 O ATOM 1329 CB LEU A 129 7.497 11.511 3.685 1.00 0.00 C ATOM 1330 CG LEU A 129 7.622 10.209 4.511 1.00 0.00 C ATOM 1331 CD1 LEU A 129 8.900 10.275 5.356 1.00 0.00 C ATOM 1332 CD2 LEU A 129 6.412 10.015 5.452 1.00 0.00 C ATOM 0 H LEU A 129 7.417 10.355 1.509 1.00 0.00 H new ATOM 0 HA LEU A 129 5.415 11.018 3.341 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.374 11.621 3.047 1.00 0.00 H new ATOM 0 HB3 LEU A 129 7.484 12.367 4.359 1.00 0.00 H new ATOM 0 HG LEU A 129 7.656 9.369 3.818 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.996 9.361 5.942 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.765 10.379 4.700 1.00 0.00 H new ATOM 0 HD13 LEU A 129 8.849 11.132 6.027 1.00 0.00 H new ATOM 0 HD21 LEU A 129 6.534 9.090 6.016 1.00 0.00 H new ATOM 0 HD22 LEU A 129 6.350 10.856 6.143 1.00 0.00 H new ATOM 0 HD23 LEU A 129 5.497 9.962 4.862 1.00 0.00 H new ATOM 1344 N ASN A 130 6.221 13.497 1.424 1.00 0.00 N ATOM 1345 CA ASN A 130 5.844 14.846 1.049 1.00 0.00 C ATOM 1346 C ASN A 130 4.417 14.787 0.483 1.00 0.00 C ATOM 1347 O ASN A 130 3.445 14.728 1.211 1.00 0.00 O ATOM 1348 CB ASN A 130 6.810 15.181 -0.059 1.00 0.00 C ATOM 1349 CG ASN A 130 6.769 14.038 -1.066 1.00 0.00 C ATOM 1350 OD1 ASN A 130 5.834 13.084 -0.914 1.00 0.00 O flip ATOM 1351 ND2 ASN A 130 7.539 14.025 -2.006 1.00 0.00 N flip ATOM 0 H ASN A 130 6.835 13.026 0.760 1.00 0.00 H new ATOM 0 HA ASN A 130 5.871 15.568 1.865 1.00 0.00 H new ATOM 0 HB2 ASN A 130 6.535 16.122 -0.536 1.00 0.00 H new ATOM 0 HB3 ASN A 130 7.818 15.307 0.337 1.00 0.00 H new ATOM 0 HD21 ASN A 130 8.240 14.759 -2.101 1.00 0.00 H new ATOM 0 HD22 ASN A 130 7.484 13.280 -2.700 1.00 0.00 H new ATOM 1358 N GLY A 131 4.297 14.730 -0.828 1.00 0.00 N ATOM 1359 CA GLY A 131 3.015 14.591 -1.532 1.00 0.00 C ATOM 1360 C GLY A 131 3.272 14.103 -2.980 1.00 0.00 C ATOM 1361 O GLY A 131 2.762 14.680 -3.918 1.00 0.00 O ATOM 0 H GLY A 131 5.098 14.779 -1.457 1.00 0.00 H new ATOM 0 HA2 GLY A 131 2.374 13.883 -1.006 1.00 0.00 H new ATOM 0 HA3 GLY A 131 2.490 15.546 -1.546 1.00 0.00 H new ATOM 1365 N GLU A 132 4.070 13.054 -3.191 1.00 0.00 N ATOM 1366 CA GLU A 132 4.344 12.577 -4.586 1.00 0.00 C ATOM 1367 C GLU A 132 4.411 11.037 -4.603 1.00 0.00 C ATOM 1368 O GLU A 132 4.517 10.384 -3.586 1.00 0.00 O ATOM 1369 CB GLU A 132 5.669 13.138 -5.133 1.00 0.00 C ATOM 1370 CG GLU A 132 5.644 14.673 -5.182 1.00 0.00 C ATOM 1371 CD GLU A 132 6.975 15.189 -5.756 1.00 0.00 C ATOM 1372 OE1 GLU A 132 7.946 14.451 -5.709 1.00 0.00 O ATOM 1373 OE2 GLU A 132 6.998 16.314 -6.230 1.00 0.00 O ATOM 0 H GLU A 132 4.533 12.521 -2.455 1.00 0.00 H new ATOM 0 HA GLU A 132 3.532 12.933 -5.220 1.00 0.00 H new ATOM 0 HB2 GLU A 132 6.495 12.805 -4.505 1.00 0.00 H new ATOM 0 HB3 GLU A 132 5.849 12.742 -6.133 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.813 15.014 -5.799 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.486 15.077 -4.182 1.00 0.00 H new ATOM 1380 N GLU A 133 4.309 10.479 -5.767 1.00 0.00 N ATOM 1381 CA GLU A 133 4.329 8.995 -5.905 1.00 0.00 C ATOM 1382 C GLU A 133 5.736 8.407 -5.649 1.00 0.00 C ATOM 1383 O GLU A 133 6.729 9.106 -5.684 1.00 0.00 O ATOM 1384 CB GLU A 133 3.925 8.640 -7.339 1.00 0.00 C ATOM 1385 CG GLU A 133 2.541 9.222 -7.659 1.00 0.00 C ATOM 1386 CD GLU A 133 1.439 8.330 -7.077 1.00 0.00 C ATOM 1387 OE1 GLU A 133 1.715 7.177 -6.794 1.00 0.00 O ATOM 1388 OE2 GLU A 133 0.331 8.820 -6.932 1.00 0.00 O ATOM 0 H GLU A 133 4.211 10.990 -6.645 1.00 0.00 H new ATOM 0 HA GLU A 133 3.642 8.578 -5.169 1.00 0.00 H new ATOM 0 HB2 GLU A 133 4.663 9.031 -8.040 1.00 0.00 H new ATOM 0 HB3 GLU A 133 3.910 7.557 -7.463 1.00 0.00 H new ATOM 0 HG2 GLU A 133 2.459 10.228 -7.248 1.00 0.00 H new ATOM 0 HG3 GLU A 133 2.416 9.308 -8.738 1.00 0.00 H new ATOM 1395 N ASN A 134 5.818 7.103 -5.449 1.00 0.00 N ATOM 1396 CA ASN A 134 7.134 6.423 -5.261 1.00 0.00 C ATOM 1397 C ASN A 134 6.903 4.903 -5.340 1.00 0.00 C ATOM 1398 O ASN A 134 5.863 4.405 -4.971 1.00 0.00 O ATOM 1399 CB ASN A 134 7.772 6.764 -3.906 1.00 0.00 C ATOM 1400 CG ASN A 134 9.237 6.312 -3.920 1.00 0.00 C ATOM 1401 OD1 ASN A 134 10.115 7.073 -4.274 1.00 0.00 O ATOM 1402 ND2 ASN A 134 9.541 5.092 -3.553 1.00 0.00 N ATOM 0 H ASN A 134 5.011 6.480 -5.409 1.00 0.00 H new ATOM 0 HA ASN A 134 7.815 6.766 -6.040 1.00 0.00 H new ATOM 0 HB2 ASN A 134 7.710 7.836 -3.719 1.00 0.00 H new ATOM 0 HB3 ASN A 134 7.232 6.268 -3.099 1.00 0.00 H new ATOM 0 HD21 ASN A 134 10.513 4.783 -3.565 1.00 0.00 H new ATOM 0 HD22 ASN A 134 8.806 4.451 -3.255 1.00 0.00 H new ATOM 1409 N VAL A 135 7.828 4.163 -5.889 1.00 0.00 N ATOM 1410 CA VAL A 135 7.643 2.677 -6.030 1.00 0.00 C ATOM 1411 C VAL A 135 8.914 1.941 -5.544 1.00 0.00 C ATOM 1412 O VAL A 135 10.024 2.292 -5.907 1.00 0.00 O ATOM 1413 CB VAL A 135 7.356 2.403 -7.524 1.00 0.00 C ATOM 1414 CG1 VAL A 135 8.052 1.117 -8.012 1.00 0.00 C ATOM 1415 CG2 VAL A 135 5.855 2.244 -7.754 1.00 0.00 C ATOM 0 H VAL A 135 8.712 4.520 -6.250 1.00 0.00 H new ATOM 0 HA VAL A 135 6.816 2.312 -5.421 1.00 0.00 H new ATOM 0 HB VAL A 135 7.743 3.255 -8.083 1.00 0.00 H new ATOM 0 HG11 VAL A 135 7.826 0.959 -9.067 1.00 0.00 H new ATOM 0 HG12 VAL A 135 9.130 1.215 -7.882 1.00 0.00 H new ATOM 0 HG13 VAL A 135 7.693 0.267 -7.432 1.00 0.00 H new ATOM 0 HG21 VAL A 135 5.667 2.052 -8.810 1.00 0.00 H new ATOM 0 HG22 VAL A 135 5.483 1.409 -7.161 1.00 0.00 H new ATOM 0 HG23 VAL A 135 5.342 3.158 -7.455 1.00 0.00 H new ATOM 1425 N ALA A 136 8.752 0.933 -4.696 1.00 0.00 N ATOM 1426 CA ALA A 136 9.928 0.178 -4.159 1.00 0.00 C ATOM 1427 C ALA A 136 9.529 -1.287 -3.879 1.00 0.00 C ATOM 1428 O ALA A 136 8.373 -1.654 -3.930 1.00 0.00 O ATOM 1429 CB ALA A 136 10.424 0.820 -2.867 1.00 0.00 C ATOM 0 H ALA A 136 7.846 0.608 -4.358 1.00 0.00 H new ATOM 0 HA ALA A 136 10.725 0.204 -4.902 1.00 0.00 H new ATOM 0 HB1 ALA A 136 11.279 0.261 -2.488 1.00 0.00 H new ATOM 0 HB2 ALA A 136 10.722 1.850 -3.064 1.00 0.00 H new ATOM 0 HB3 ALA A 136 9.625 0.809 -2.125 1.00 0.00 H new ATOM 1435 N ILE A 137 10.499 -2.122 -3.635 1.00 0.00 N ATOM 1436 CA ILE A 137 10.257 -3.576 -3.374 1.00 0.00 C ATOM 1437 C ILE A 137 10.362 -3.909 -1.873 1.00 0.00 C ATOM 1438 O ILE A 137 11.189 -3.381 -1.155 1.00 0.00 O ATOM 1439 CB ILE A 137 11.316 -4.387 -4.134 1.00 0.00 C ATOM 1440 CG1 ILE A 137 11.472 -3.833 -5.585 1.00 0.00 C ATOM 1441 CG2 ILE A 137 10.863 -5.854 -4.184 1.00 0.00 C ATOM 1442 CD1 ILE A 137 12.732 -2.964 -5.702 1.00 0.00 C ATOM 0 H ILE A 137 11.482 -1.852 -3.604 1.00 0.00 H new ATOM 0 HA ILE A 137 9.250 -3.825 -3.708 1.00 0.00 H new ATOM 0 HB ILE A 137 12.277 -4.309 -3.626 1.00 0.00 H new ATOM 0 HG12 ILE A 137 11.529 -4.661 -6.292 1.00 0.00 H new ATOM 0 HG13 ILE A 137 10.593 -3.246 -5.852 1.00 0.00 H new ATOM 0 HG21 ILE A 137 11.604 -6.446 -4.721 1.00 0.00 H new ATOM 0 HG22 ILE A 137 10.759 -6.237 -3.169 1.00 0.00 H new ATOM 0 HG23 ILE A 137 9.904 -5.921 -4.698 1.00 0.00 H new ATOM 0 HD11 ILE A 137 12.821 -2.588 -6.721 1.00 0.00 H new ATOM 0 HD12 ILE A 137 12.660 -2.124 -5.011 1.00 0.00 H new ATOM 0 HD13 ILE A 137 13.610 -3.562 -5.457 1.00 0.00 H new ATOM 1454 N ASN A 138 9.478 -4.761 -1.398 1.00 0.00 N ATOM 1455 CA ASN A 138 9.431 -5.123 0.056 1.00 0.00 C ATOM 1456 C ASN A 138 10.069 -6.484 0.327 1.00 0.00 C ATOM 1457 O ASN A 138 9.790 -7.471 -0.323 1.00 0.00 O ATOM 1458 CB ASN A 138 7.968 -5.212 0.487 1.00 0.00 C ATOM 1459 CG ASN A 138 7.887 -5.671 1.948 1.00 0.00 C ATOM 1460 OD1 ASN A 138 7.083 -6.516 2.291 1.00 0.00 O ATOM 1461 ND2 ASN A 138 8.701 -5.153 2.827 1.00 0.00 N ATOM 0 H ASN A 138 8.775 -5.228 -1.970 1.00 0.00 H new ATOM 0 HA ASN A 138 9.980 -4.359 0.607 1.00 0.00 H new ATOM 0 HB2 ASN A 138 7.486 -4.241 0.373 1.00 0.00 H new ATOM 0 HB3 ASN A 138 7.432 -5.911 -0.154 1.00 0.00 H new ATOM 0 HD21 ASN A 138 8.662 -5.457 3.800 1.00 0.00 H new ATOM 0 HD22 ASN A 138 9.376 -4.444 2.541 1.00 0.00 H new ATOM 1468 N ARG A 139 10.947 -6.501 1.294 1.00 0.00 N ATOM 1469 CA ARG A 139 11.645 -7.784 1.621 1.00 0.00 C ATOM 1470 C ARG A 139 11.501 -8.048 3.114 1.00 0.00 C ATOM 1471 O ARG A 139 11.905 -7.250 3.936 1.00 0.00 O ATOM 1472 CB ARG A 139 13.118 -7.637 1.242 1.00 0.00 C ATOM 1473 CG ARG A 139 13.240 -7.566 -0.286 1.00 0.00 C ATOM 1474 CD ARG A 139 14.714 -7.614 -0.699 1.00 0.00 C ATOM 1475 NE ARG A 139 15.448 -6.462 -0.098 1.00 0.00 N ATOM 1476 CZ ARG A 139 15.368 -5.276 -0.641 1.00 0.00 C ATOM 1477 NH1 ARG A 139 14.647 -5.095 -1.714 1.00 0.00 N ATOM 1478 NH2 ARG A 139 16.016 -4.272 -0.114 1.00 0.00 N ATOM 0 H ARG A 139 11.210 -5.698 1.865 1.00 0.00 H new ATOM 0 HA ARG A 139 11.213 -8.620 1.070 1.00 0.00 H new ATOM 0 HB2 ARG A 139 13.534 -6.737 1.694 1.00 0.00 H new ATOM 0 HB3 ARG A 139 13.691 -8.481 1.626 1.00 0.00 H new ATOM 0 HG2 ARG A 139 12.700 -8.396 -0.741 1.00 0.00 H new ATOM 0 HG3 ARG A 139 12.781 -6.648 -0.653 1.00 0.00 H new ATOM 0 HD2 ARG A 139 15.162 -8.552 -0.372 1.00 0.00 H new ATOM 0 HD3 ARG A 139 14.797 -7.583 -1.785 1.00 0.00 H new ATOM 0 HE ARG A 139 16.014 -6.601 0.739 1.00 0.00 H new ATOM 0 HH11 ARG A 139 14.145 -5.880 -2.130 1.00 0.00 H new ATOM 0 HH12 ARG A 139 14.585 -4.169 -2.137 1.00 0.00 H new ATOM 0 HH21 ARG A 139 16.584 -4.414 0.721 1.00 0.00 H new ATOM 0 HH22 ARG A 139 15.954 -3.346 -0.538 1.00 0.00 H new ATOM 1492 N GLY A 140 10.893 -9.143 3.477 1.00 0.00 N ATOM 1493 CA GLY A 140 10.686 -9.463 4.911 1.00 0.00 C ATOM 1494 C GLY A 140 10.525 -10.973 5.062 1.00 0.00 C ATOM 1495 O GLY A 140 10.367 -11.684 4.088 1.00 0.00 O ATOM 0 H GLY A 140 10.526 -9.839 2.828 1.00 0.00 H new ATOM 0 HA2 GLY A 140 11.533 -9.113 5.501 1.00 0.00 H new ATOM 0 HA3 GLY A 140 9.801 -8.950 5.288 1.00 0.00 H new ATOM 1499 N PHE A 141 10.581 -11.463 6.275 1.00 0.00 N ATOM 1500 CA PHE A 141 10.447 -12.932 6.529 1.00 0.00 C ATOM 1501 C PHE A 141 9.473 -13.573 5.537 1.00 0.00 C ATOM 1502 O PHE A 141 9.669 -14.692 5.104 1.00 0.00 O ATOM 1503 CB PHE A 141 9.925 -13.146 7.952 1.00 0.00 C ATOM 1504 CG PHE A 141 11.030 -12.850 8.936 1.00 0.00 C ATOM 1505 CD1 PHE A 141 11.943 -13.852 9.281 1.00 0.00 C ATOM 1506 CD2 PHE A 141 11.143 -11.574 9.501 1.00 0.00 C ATOM 1507 CE1 PHE A 141 12.969 -13.581 10.193 1.00 0.00 C ATOM 1508 CE2 PHE A 141 12.170 -11.302 10.413 1.00 0.00 C ATOM 1509 CZ PHE A 141 13.083 -12.306 10.759 1.00 0.00 C ATOM 0 H PHE A 141 10.716 -10.899 7.114 1.00 0.00 H new ATOM 0 HA PHE A 141 11.425 -13.398 6.406 1.00 0.00 H new ATOM 0 HB2 PHE A 141 9.071 -12.496 8.140 1.00 0.00 H new ATOM 0 HB3 PHE A 141 9.578 -14.172 8.074 1.00 0.00 H new ATOM 0 HD1 PHE A 141 11.856 -14.835 8.843 1.00 0.00 H new ATOM 0 HD2 PHE A 141 10.439 -10.800 9.234 1.00 0.00 H new ATOM 0 HE1 PHE A 141 13.673 -14.355 10.460 1.00 0.00 H new ATOM 0 HE2 PHE A 141 12.258 -10.318 10.850 1.00 0.00 H new ATOM 0 HZ PHE A 141 13.875 -12.096 11.463 1.00 0.00 H new ATOM 1519 N LEU A 142 8.430 -12.885 5.166 1.00 0.00 N ATOM 1520 CA LEU A 142 7.475 -13.492 4.203 1.00 0.00 C ATOM 1521 C LEU A 142 8.182 -13.803 2.892 1.00 0.00 C ATOM 1522 O LEU A 142 8.321 -14.952 2.527 1.00 0.00 O ATOM 1523 CB LEU A 142 6.314 -12.539 3.892 1.00 0.00 C ATOM 1524 CG LEU A 142 5.623 -12.088 5.178 1.00 0.00 C ATOM 1525 CD1 LEU A 142 4.389 -11.244 4.830 1.00 0.00 C ATOM 1526 CD2 LEU A 142 5.183 -13.311 5.993 1.00 0.00 C ATOM 0 H LEU A 142 8.201 -11.943 5.483 1.00 0.00 H new ATOM 0 HA LEU A 142 7.089 -14.402 4.662 1.00 0.00 H new ATOM 0 HB2 LEU A 142 6.686 -11.670 3.350 1.00 0.00 H new ATOM 0 HB3 LEU A 142 5.594 -13.036 3.242 1.00 0.00 H new ATOM 0 HG LEU A 142 6.322 -11.494 5.766 1.00 0.00 H new ATOM 0 HD11 LEU A 142 3.897 -10.923 5.748 1.00 0.00 H new ATOM 0 HD12 LEU A 142 4.696 -10.369 4.258 1.00 0.00 H new ATOM 0 HD13 LEU A 142 3.696 -11.840 4.236 1.00 0.00 H new ATOM 0 HD21 LEU A 142 4.691 -12.981 6.908 1.00 0.00 H new ATOM 0 HD22 LEU A 142 4.489 -13.910 5.404 1.00 0.00 H new ATOM 0 HD23 LEU A 142 6.056 -13.912 6.247 1.00 0.00 H new ATOM 1538 N ALA A 143 8.588 -12.782 2.160 1.00 0.00 N ATOM 1539 CA ALA A 143 9.239 -13.013 0.824 1.00 0.00 C ATOM 1540 C ALA A 143 9.136 -11.756 -0.056 1.00 0.00 C ATOM 1541 O ALA A 143 8.277 -10.925 0.118 1.00 0.00 O ATOM 1542 CB ALA A 143 8.481 -14.126 0.098 1.00 0.00 C ATOM 0 H ALA A 143 8.496 -11.803 2.431 1.00 0.00 H new ATOM 0 HA ALA A 143 10.285 -13.269 0.991 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.941 -14.306 -0.874 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.519 -15.039 0.692 1.00 0.00 H new ATOM 0 HB3 ALA A 143 7.442 -13.827 -0.042 1.00 0.00 H new ATOM 1548 N GLN A 144 10.000 -11.651 -1.029 1.00 0.00 N ATOM 1549 CA GLN A 144 9.978 -10.490 -1.969 1.00 0.00 C ATOM 1550 C GLN A 144 8.542 -10.172 -2.435 1.00 0.00 C ATOM 1551 O GLN A 144 7.751 -11.047 -2.735 1.00 0.00 O ATOM 1552 CB GLN A 144 10.876 -10.814 -3.170 1.00 0.00 C ATOM 1553 CG GLN A 144 11.187 -9.519 -3.917 1.00 0.00 C ATOM 1554 CD GLN A 144 12.157 -9.799 -5.064 1.00 0.00 C ATOM 1555 OE1 GLN A 144 13.309 -10.115 -4.838 1.00 0.00 O ATOM 1556 NE2 GLN A 144 11.739 -9.689 -6.293 1.00 0.00 N ATOM 0 H GLN A 144 10.735 -12.333 -1.217 1.00 0.00 H new ATOM 0 HA GLN A 144 10.352 -9.605 -1.454 1.00 0.00 H new ATOM 0 HB2 GLN A 144 11.799 -11.287 -2.834 1.00 0.00 H new ATOM 0 HB3 GLN A 144 10.378 -11.522 -3.833 1.00 0.00 H new ATOM 0 HG2 GLN A 144 10.267 -9.084 -4.306 1.00 0.00 H new ATOM 0 HG3 GLN A 144 11.620 -8.790 -3.233 1.00 0.00 H new ATOM 0 HE21 GLN A 144 10.772 -9.424 -6.481 1.00 0.00 H new ATOM 0 HE22 GLN A 144 12.379 -9.868 -7.067 1.00 0.00 H new ATOM 1565 N ALA A 145 8.230 -8.894 -2.468 1.00 0.00 N ATOM 1566 CA ALA A 145 6.871 -8.388 -2.862 1.00 0.00 C ATOM 1567 C ALA A 145 7.048 -6.992 -3.468 1.00 0.00 C ATOM 1568 O ALA A 145 7.950 -6.291 -3.050 1.00 0.00 O ATOM 1569 CB ALA A 145 6.064 -8.253 -1.563 1.00 0.00 C ATOM 0 H ALA A 145 8.889 -8.153 -2.228 1.00 0.00 H new ATOM 0 HA ALA A 145 6.377 -9.050 -3.574 1.00 0.00 H new ATOM 0 HB1 ALA A 145 5.063 -7.887 -1.793 1.00 0.00 H new ATOM 0 HB2 ALA A 145 5.992 -9.226 -1.077 1.00 0.00 H new ATOM 0 HB3 ALA A 145 6.563 -7.550 -0.896 1.00 0.00 H new ATOM 1575 N LEU A 146 6.213 -6.510 -4.396 1.00 0.00 N ATOM 1576 CA LEU A 146 6.436 -5.101 -4.888 1.00 0.00 C ATOM 1577 C LEU A 146 5.385 -4.190 -4.268 1.00 0.00 C ATOM 1578 O LEU A 146 4.321 -4.635 -3.884 1.00 0.00 O ATOM 1579 CB LEU A 146 6.255 -5.025 -6.404 1.00 0.00 C ATOM 1580 CG LEU A 146 7.022 -3.803 -6.969 1.00 0.00 C ATOM 1581 CD1 LEU A 146 8.443 -4.219 -7.358 1.00 0.00 C ATOM 1582 CD2 LEU A 146 6.289 -3.256 -8.197 1.00 0.00 C ATOM 0 H LEU A 146 5.427 -7.011 -4.810 1.00 0.00 H new ATOM 0 HA LEU A 146 7.447 -4.799 -4.615 1.00 0.00 H new ATOM 0 HB2 LEU A 146 6.621 -5.941 -6.868 1.00 0.00 H new ATOM 0 HB3 LEU A 146 5.196 -4.945 -6.648 1.00 0.00 H new ATOM 0 HG LEU A 146 7.072 -3.027 -6.206 1.00 0.00 H new ATOM 0 HD11 LEU A 146 8.979 -3.357 -7.755 1.00 0.00 H new ATOM 0 HD12 LEU A 146 8.965 -4.597 -6.479 1.00 0.00 H new ATOM 0 HD13 LEU A 146 8.399 -5.000 -8.118 1.00 0.00 H new ATOM 0 HD21 LEU A 146 6.831 -2.397 -8.592 1.00 0.00 H new ATOM 0 HD22 LEU A 146 6.231 -4.031 -8.961 1.00 0.00 H new ATOM 0 HD23 LEU A 146 5.282 -2.950 -7.913 1.00 0.00 H new ATOM 1594 N ARG A 147 5.651 -2.912 -4.184 1.00 0.00 N ATOM 1595 CA ARG A 147 4.636 -1.994 -3.615 1.00 0.00 C ATOM 1596 C ARG A 147 4.698 -0.621 -4.309 1.00 0.00 C ATOM 1597 O ARG A 147 5.717 -0.190 -4.810 1.00 0.00 O ATOM 1598 CB ARG A 147 4.856 -1.870 -2.091 1.00 0.00 C ATOM 1599 CG ARG A 147 6.012 -0.893 -1.769 1.00 0.00 C ATOM 1600 CD ARG A 147 6.735 -1.330 -0.478 1.00 0.00 C ATOM 1601 NE ARG A 147 7.565 -0.199 0.043 1.00 0.00 N ATOM 1602 CZ ARG A 147 8.175 -0.304 1.202 1.00 0.00 C ATOM 1603 NH1 ARG A 147 8.015 -1.372 1.933 1.00 0.00 N ATOM 1604 NH2 ARG A 147 8.939 0.664 1.636 1.00 0.00 N ATOM 0 H ARG A 147 6.521 -2.473 -4.484 1.00 0.00 H new ATOM 0 HA ARG A 147 3.639 -2.399 -3.790 1.00 0.00 H new ATOM 0 HB2 ARG A 147 3.939 -1.521 -1.616 1.00 0.00 H new ATOM 0 HB3 ARG A 147 5.079 -2.851 -1.672 1.00 0.00 H new ATOM 0 HG2 ARG A 147 6.718 -0.867 -2.599 1.00 0.00 H new ATOM 0 HG3 ARG A 147 5.621 0.118 -1.651 1.00 0.00 H new ATOM 0 HD2 ARG A 147 6.006 -1.635 0.273 1.00 0.00 H new ATOM 0 HD3 ARG A 147 7.367 -2.195 -0.679 1.00 0.00 H new ATOM 0 HE ARG A 147 7.658 0.657 -0.504 1.00 0.00 H new ATOM 0 HH11 ARG A 147 7.415 -2.129 1.605 1.00 0.00 H new ATOM 0 HH12 ARG A 147 8.490 -1.450 2.832 1.00 0.00 H new ATOM 0 HH21 ARG A 147 9.064 1.506 1.074 1.00 0.00 H new ATOM 0 HH22 ARG A 147 9.410 0.577 2.536 1.00 0.00 H new ATOM 1618 N VAL A 148 3.579 0.066 -4.302 1.00 0.00 N ATOM 1619 CA VAL A 148 3.481 1.449 -4.916 1.00 0.00 C ATOM 1620 C VAL A 148 3.122 2.446 -3.820 1.00 0.00 C ATOM 1621 O VAL A 148 2.503 2.111 -2.835 1.00 0.00 O ATOM 1622 CB VAL A 148 2.396 1.543 -6.033 1.00 0.00 C ATOM 1623 CG1 VAL A 148 2.880 0.825 -7.317 1.00 0.00 C ATOM 1624 CG2 VAL A 148 1.064 0.914 -5.552 1.00 0.00 C ATOM 0 H VAL A 148 2.709 -0.272 -3.891 1.00 0.00 H new ATOM 0 HA VAL A 148 4.447 1.670 -5.371 1.00 0.00 H new ATOM 0 HB VAL A 148 2.228 2.596 -6.257 1.00 0.00 H new ATOM 0 HG11 VAL A 148 2.112 0.899 -8.087 1.00 0.00 H new ATOM 0 HG12 VAL A 148 3.797 1.295 -7.673 1.00 0.00 H new ATOM 0 HG13 VAL A 148 3.072 -0.225 -7.096 1.00 0.00 H new ATOM 0 HG21 VAL A 148 0.319 0.989 -6.344 1.00 0.00 H new ATOM 0 HG22 VAL A 148 1.226 -0.135 -5.304 1.00 0.00 H new ATOM 0 HG23 VAL A 148 0.709 1.445 -4.669 1.00 0.00 H new ATOM 1634 N PHE A 149 3.508 3.674 -4.011 1.00 0.00 N ATOM 1635 CA PHE A 149 3.200 4.747 -3.022 1.00 0.00 C ATOM 1636 C PHE A 149 2.406 5.840 -3.724 1.00 0.00 C ATOM 1637 O PHE A 149 2.621 6.132 -4.883 1.00 0.00 O ATOM 1638 CB PHE A 149 4.491 5.378 -2.498 1.00 0.00 C ATOM 1639 CG PHE A 149 5.205 4.438 -1.548 1.00 0.00 C ATOM 1640 CD1 PHE A 149 4.772 4.341 -0.221 1.00 0.00 C ATOM 1641 CD2 PHE A 149 6.309 3.683 -1.976 1.00 0.00 C ATOM 1642 CE1 PHE A 149 5.431 3.486 0.671 1.00 0.00 C ATOM 1643 CE2 PHE A 149 6.966 2.832 -1.083 1.00 0.00 C ATOM 1644 CZ PHE A 149 6.531 2.737 0.240 1.00 0.00 C ATOM 0 H PHE A 149 4.035 3.988 -4.826 1.00 0.00 H new ATOM 0 HA PHE A 149 2.640 4.312 -2.194 1.00 0.00 H new ATOM 0 HB2 PHE A 149 5.146 5.623 -3.334 1.00 0.00 H new ATOM 0 HB3 PHE A 149 4.262 6.313 -1.987 1.00 0.00 H new ATOM 0 HD1 PHE A 149 3.929 4.926 0.116 1.00 0.00 H new ATOM 0 HD2 PHE A 149 6.651 3.760 -2.997 1.00 0.00 H new ATOM 0 HE1 PHE A 149 5.090 3.405 1.692 1.00 0.00 H new ATOM 0 HE2 PHE A 149 7.811 2.248 -1.417 1.00 0.00 H new ATOM 0 HZ PHE A 149 7.044 2.085 0.931 1.00 0.00 H new ATOM 1654 N THR A 150 1.483 6.436 -3.024 1.00 0.00 N ATOM 1655 CA THR A 150 0.656 7.509 -3.608 1.00 0.00 C ATOM 1656 C THR A 150 0.406 8.551 -2.489 1.00 0.00 C ATOM 1657 O THR A 150 0.159 8.183 -1.359 1.00 0.00 O ATOM 1658 CB THR A 150 -0.697 6.947 -4.114 1.00 0.00 C ATOM 1659 OG1 THR A 150 -1.754 7.454 -3.313 1.00 0.00 O ATOM 1660 CG2 THR A 150 -0.711 5.412 -4.058 1.00 0.00 C ATOM 0 H THR A 150 1.268 6.215 -2.052 1.00 0.00 H new ATOM 0 HA THR A 150 1.166 7.958 -4.460 1.00 0.00 H new ATOM 0 HB THR A 150 -0.830 7.259 -5.150 1.00 0.00 H new ATOM 0 HG1 THR A 150 -2.608 7.099 -3.636 1.00 0.00 H new ATOM 0 HG21 THR A 150 -1.671 5.044 -4.418 1.00 0.00 H new ATOM 0 HG22 THR A 150 0.088 5.018 -4.686 1.00 0.00 H new ATOM 0 HG23 THR A 150 -0.559 5.084 -3.030 1.00 0.00 H new ATOM 1668 N PRO A 151 0.460 9.825 -2.793 1.00 0.00 N ATOM 1669 CA PRO A 151 0.223 10.941 -1.800 1.00 0.00 C ATOM 1670 C PRO A 151 -1.254 11.372 -1.646 1.00 0.00 C ATOM 1671 O PRO A 151 -2.057 11.223 -2.548 1.00 0.00 O ATOM 1672 CB PRO A 151 0.967 12.077 -2.476 1.00 0.00 C ATOM 1673 CG PRO A 151 0.628 11.856 -3.903 1.00 0.00 C ATOM 1674 CD PRO A 151 0.806 10.367 -4.108 1.00 0.00 C ATOM 0 HA PRO A 151 0.532 10.651 -0.796 1.00 0.00 H new ATOM 0 HB2 PRO A 151 0.632 13.052 -2.123 1.00 0.00 H new ATOM 0 HB3 PRO A 151 2.041 12.025 -2.298 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -0.393 12.167 -4.121 1.00 0.00 H new ATOM 0 HG3 PRO A 151 1.283 12.428 -4.560 1.00 0.00 H new ATOM 0 HD2 PRO A 151 0.151 9.984 -4.891 1.00 0.00 H new ATOM 0 HD3 PRO A 151 1.827 10.116 -4.395 1.00 0.00 H new ATOM 1682 N ILE A 152 -1.595 11.898 -0.486 1.00 0.00 N ATOM 1683 CA ILE A 152 -3.002 12.338 -0.226 1.00 0.00 C ATOM 1684 C ILE A 152 -3.011 13.850 0.048 1.00 0.00 C ATOM 1685 O ILE A 152 -2.174 14.344 0.773 1.00 0.00 O ATOM 1686 CB ILE A 152 -3.521 11.595 1.013 1.00 0.00 C ATOM 1687 CG1 ILE A 152 -3.333 10.082 0.839 1.00 0.00 C ATOM 1688 CG2 ILE A 152 -5.006 11.896 1.236 1.00 0.00 C ATOM 1689 CD1 ILE A 152 -3.818 9.356 2.104 1.00 0.00 C ATOM 0 H ILE A 152 -0.952 12.040 0.293 1.00 0.00 H new ATOM 0 HA ILE A 152 -3.634 12.120 -1.087 1.00 0.00 H new ATOM 0 HB ILE A 152 -2.953 11.936 1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 152 -3.891 9.733 -0.030 1.00 0.00 H new ATOM 0 HG13 ILE A 152 -2.283 9.854 0.656 1.00 0.00 H new ATOM 0 HG21 ILE A 152 -5.357 11.361 2.118 1.00 0.00 H new ATOM 0 HG22 ILE A 152 -5.142 12.967 1.383 1.00 0.00 H new ATOM 0 HG23 ILE A 152 -5.577 11.574 0.365 1.00 0.00 H new ATOM 0 HD11 ILE A 152 -3.685 8.281 1.980 1.00 0.00 H new ATOM 0 HD12 ILE A 152 -3.240 9.697 2.963 1.00 0.00 H new ATOM 0 HD13 ILE A 152 -4.873 9.574 2.267 1.00 0.00 H new ATOM 1701 N TYR A 153 -3.899 14.602 -0.574 1.00 0.00 N ATOM 1702 CA TYR A 153 -3.913 16.081 -0.388 1.00 0.00 C ATOM 1703 C TYR A 153 -5.023 16.568 0.539 1.00 0.00 C ATOM 1704 O TYR A 153 -6.108 16.023 0.576 1.00 0.00 O ATOM 1705 CB TYR A 153 -4.237 16.705 -1.727 1.00 0.00 C ATOM 1706 CG TYR A 153 -3.208 16.300 -2.721 1.00 0.00 C ATOM 1707 CD1 TYR A 153 -3.213 15.014 -3.282 1.00 0.00 C ATOM 1708 CD2 TYR A 153 -2.265 17.219 -3.103 1.00 0.00 C ATOM 1709 CE1 TYR A 153 -2.245 14.668 -4.225 1.00 0.00 C ATOM 1710 CE2 TYR A 153 -1.321 16.890 -4.027 1.00 0.00 C ATOM 1711 CZ TYR A 153 -1.293 15.615 -4.605 1.00 0.00 C ATOM 1712 OH TYR A 153 -0.333 15.298 -5.545 1.00 0.00 O ATOM 0 H TYR A 153 -4.616 14.244 -1.205 1.00 0.00 H new ATOM 0 HA TYR A 153 -2.944 16.352 0.031 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -5.225 16.387 -2.060 1.00 0.00 H new ATOM 0 HB3 TYR A 153 -4.265 17.791 -1.638 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -3.963 14.295 -2.985 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -2.271 18.208 -2.669 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -2.232 13.678 -4.656 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -0.583 17.623 -4.318 1.00 0.00 H new ATOM 0 HH TYR A 153 0.249 16.073 -5.693 1.00 0.00 H new ATOM 1722 N ASP A 154 -4.772 17.641 1.238 1.00 0.00 N ATOM 1723 CA ASP A 154 -5.830 18.223 2.108 1.00 0.00 C ATOM 1724 C ASP A 154 -6.885 18.885 1.206 1.00 0.00 C ATOM 1725 O ASP A 154 -7.258 20.026 1.401 1.00 0.00 O ATOM 1726 CB ASP A 154 -5.213 19.292 2.995 1.00 0.00 C ATOM 1727 CG ASP A 154 -6.242 19.803 4.012 1.00 0.00 C ATOM 1728 OD1 ASP A 154 -7.263 19.153 4.175 1.00 0.00 O ATOM 1729 OD2 ASP A 154 -5.988 20.834 4.613 1.00 0.00 O ATOM 0 H ASP A 154 -3.881 18.138 1.244 1.00 0.00 H new ATOM 0 HA ASP A 154 -6.281 17.445 2.724 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -4.347 18.885 3.517 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -4.856 20.120 2.383 1.00 0.00 H new ATOM 1734 N GLU A 155 -7.375 18.170 0.229 1.00 0.00 N ATOM 1735 CA GLU A 155 -8.419 18.687 -0.726 1.00 0.00 C ATOM 1736 C GLU A 155 -8.099 20.132 -1.168 1.00 0.00 C ATOM 1737 O GLU A 155 -8.941 20.821 -1.706 1.00 0.00 O ATOM 1738 CB GLU A 155 -9.788 18.660 -0.031 1.00 0.00 C ATOM 1739 CG GLU A 155 -10.909 18.651 -1.090 1.00 0.00 C ATOM 1740 CD GLU A 155 -12.278 18.611 -0.416 1.00 0.00 C ATOM 1741 OE1 GLU A 155 -12.381 19.065 0.711 1.00 0.00 O ATOM 1742 OE2 GLU A 155 -13.206 18.129 -1.045 1.00 0.00 O ATOM 0 H GLU A 155 -7.087 17.210 0.041 1.00 0.00 H new ATOM 0 HA GLU A 155 -8.429 18.051 -1.611 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -9.867 17.777 0.604 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -9.894 19.529 0.618 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -10.832 19.539 -1.718 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -10.793 17.787 -1.744 1.00 0.00 H new ATOM 1749 N ASN A 156 -6.885 20.579 -0.982 1.00 0.00 N ATOM 1750 CA ASN A 156 -6.495 21.968 -1.414 1.00 0.00 C ATOM 1751 C ASN A 156 -5.174 21.902 -2.168 1.00 0.00 C ATOM 1752 O ASN A 156 -4.382 22.820 -2.132 1.00 0.00 O ATOM 1753 CB ASN A 156 -6.312 22.858 -0.193 1.00 0.00 C ATOM 1754 CG ASN A 156 -7.632 22.970 0.573 1.00 0.00 C ATOM 1755 OD1 ASN A 156 -7.730 22.533 1.704 1.00 0.00 O ATOM 1756 ND2 ASN A 156 -8.656 23.543 0.003 1.00 0.00 N ATOM 0 H ASN A 156 -6.136 20.042 -0.546 1.00 0.00 H new ATOM 0 HA ASN A 156 -7.278 22.377 -2.052 1.00 0.00 H new ATOM 0 HB2 ASN A 156 -5.539 22.446 0.456 1.00 0.00 H new ATOM 0 HB3 ASN A 156 -5.975 23.848 -0.501 1.00 0.00 H new ATOM 0 HD21 ASN A 156 -9.540 23.625 0.506 1.00 0.00 H new ATOM 0 HD22 ASN A 156 -8.573 23.909 -0.945 1.00 0.00 H new ATOM 1763 N HIS A 157 -4.936 20.817 -2.833 1.00 0.00 N ATOM 1764 CA HIS A 157 -3.670 20.662 -3.583 1.00 0.00 C ATOM 1765 C HIS A 157 -2.524 20.724 -2.575 1.00 0.00 C ATOM 1766 O HIS A 157 -1.361 20.656 -2.925 1.00 0.00 O ATOM 1767 CB HIS A 157 -3.514 21.779 -4.630 1.00 0.00 C ATOM 1768 CG HIS A 157 -4.801 21.960 -5.395 1.00 0.00 C ATOM 1769 ND1 HIS A 157 -5.270 21.006 -6.287 1.00 0.00 N ATOM 1770 CD2 HIS A 157 -5.722 22.983 -5.423 1.00 0.00 C ATOM 1771 CE1 HIS A 157 -6.425 21.467 -6.807 1.00 0.00 C ATOM 1772 NE2 HIS A 157 -6.742 22.664 -6.313 1.00 0.00 N ATOM 0 H HIS A 157 -5.572 20.021 -2.890 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.666 19.710 -4.114 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -3.240 22.713 -4.138 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -2.705 21.532 -5.318 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -5.662 23.892 -4.844 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -7.020 20.933 -7.533 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -7.561 23.228 -6.540 1.00 0.00 H new ATOM 1781 N LYS A 158 -2.862 20.818 -1.309 1.00 0.00 N ATOM 1782 CA LYS A 158 -1.823 20.844 -0.233 1.00 0.00 C ATOM 1783 C LYS A 158 -1.520 19.380 0.095 1.00 0.00 C ATOM 1784 O LYS A 158 -2.427 18.589 0.163 1.00 0.00 O ATOM 1785 CB LYS A 158 -2.397 21.542 1.013 1.00 0.00 C ATOM 1786 CG LYS A 158 -1.952 23.004 1.077 1.00 0.00 C ATOM 1787 CD LYS A 158 -2.545 23.779 -0.096 1.00 0.00 C ATOM 1788 CE LYS A 158 -2.193 25.259 0.056 1.00 0.00 C ATOM 1789 NZ LYS A 158 -2.738 26.021 -1.101 1.00 0.00 N ATOM 0 H LYS A 158 -3.824 20.878 -0.974 1.00 0.00 H new ATOM 0 HA LYS A 158 -0.927 21.380 -0.547 1.00 0.00 H new ATOM 0 HB2 LYS A 158 -3.486 21.490 0.994 1.00 0.00 H new ATOM 0 HB3 LYS A 158 -2.069 21.019 1.911 1.00 0.00 H new ATOM 0 HG2 LYS A 158 -2.273 23.450 2.018 1.00 0.00 H new ATOM 0 HG3 LYS A 158 -0.864 23.064 1.051 1.00 0.00 H new ATOM 0 HD2 LYS A 158 -2.154 23.394 -1.038 1.00 0.00 H new ATOM 0 HD3 LYS A 158 -3.627 23.650 -0.124 1.00 0.00 H new ATOM 0 HE2 LYS A 158 -2.605 25.648 0.987 1.00 0.00 H new ATOM 0 HE3 LYS A 158 -1.111 25.383 0.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 -2.498 27.028 -0.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 -2.325 25.656 -1.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 -3.772 25.913 -1.132 1.00 0.00 H new ATOM 1803 N GLN A 159 -0.294 18.981 0.204 1.00 0.00 N ATOM 1804 CA GLN A 159 0.019 17.527 0.431 1.00 0.00 C ATOM 1805 C GLN A 159 0.000 17.058 1.916 1.00 0.00 C ATOM 1806 O GLN A 159 0.587 17.667 2.775 1.00 0.00 O ATOM 1807 CB GLN A 159 1.419 17.333 -0.122 1.00 0.00 C ATOM 1808 CG GLN A 159 2.326 18.546 0.213 1.00 0.00 C ATOM 1809 CD GLN A 159 2.109 19.019 1.654 1.00 0.00 C ATOM 1810 OE1 GLN A 159 1.207 19.937 1.903 1.00 0.00 O flip ATOM 1811 NE2 GLN A 159 2.758 18.544 2.567 1.00 0.00 N flip ATOM 0 H GLN A 159 0.520 19.593 0.147 1.00 0.00 H new ATOM 0 HA GLN A 159 -0.757 16.933 -0.053 1.00 0.00 H new ATOM 0 HB2 GLN A 159 1.854 16.424 0.293 1.00 0.00 H new ATOM 0 HB3 GLN A 159 1.371 17.199 -1.203 1.00 0.00 H new ATOM 0 HG2 GLN A 159 3.371 18.272 0.071 1.00 0.00 H new ATOM 0 HG3 GLN A 159 2.114 19.363 -0.477 1.00 0.00 H new ATOM 0 HE21 GLN A 159 3.460 17.830 2.376 1.00 0.00 H new ATOM 0 HE22 GLN A 159 2.600 18.860 3.524 1.00 0.00 H new ATOM 1820 N ILE A 160 -0.706 15.986 2.259 1.00 0.00 N ATOM 1821 CA ILE A 160 -0.729 15.574 3.717 1.00 0.00 C ATOM 1822 C ILE A 160 -0.589 14.063 4.031 1.00 0.00 C ATOM 1823 O ILE A 160 -0.816 13.686 5.167 1.00 0.00 O ATOM 1824 CB ILE A 160 -2.058 16.058 4.323 1.00 0.00 C ATOM 1825 CG1 ILE A 160 -3.272 15.668 3.431 1.00 0.00 C ATOM 1826 CG2 ILE A 160 -2.022 17.586 4.480 1.00 0.00 C ATOM 1827 CD1 ILE A 160 -3.751 14.243 3.755 1.00 0.00 C ATOM 0 H ILE A 160 -1.246 15.401 1.621 1.00 0.00 H new ATOM 0 HA ILE A 160 0.162 16.031 4.147 1.00 0.00 H new ATOM 0 HB ILE A 160 -2.178 15.576 5.293 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -4.087 16.375 3.588 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -2.992 15.732 2.379 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -2.963 17.930 4.909 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -1.199 17.865 5.139 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -1.878 18.049 3.504 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -4.600 13.991 3.120 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -2.941 13.537 3.574 1.00 0.00 H new ATOM 0 HD13 ILE A 160 -4.052 14.189 4.801 1.00 0.00 H new ATOM 1839 N GLY A 161 -0.299 13.182 3.119 1.00 0.00 N ATOM 1840 CA GLY A 161 -0.279 11.738 3.576 1.00 0.00 C ATOM 1841 C GLY A 161 0.223 10.808 2.497 1.00 0.00 C ATOM 1842 O GLY A 161 0.554 11.243 1.416 1.00 0.00 O ATOM 0 H GLY A 161 -0.086 13.363 2.138 1.00 0.00 H new ATOM 0 HA2 GLY A 161 0.355 11.646 4.458 1.00 0.00 H new ATOM 0 HA3 GLY A 161 -1.284 11.438 3.874 1.00 0.00 H new ATOM 1846 N VAL A 162 0.292 9.508 2.759 1.00 0.00 N ATOM 1847 CA VAL A 162 0.782 8.551 1.715 1.00 0.00 C ATOM 1848 C VAL A 162 0.002 7.240 1.742 1.00 0.00 C ATOM 1849 O VAL A 162 -0.282 6.673 2.776 1.00 0.00 O ATOM 1850 CB VAL A 162 2.245 8.234 1.955 1.00 0.00 C ATOM 1851 CG1 VAL A 162 2.714 7.136 0.988 1.00 0.00 C ATOM 1852 CG2 VAL A 162 3.050 9.501 1.735 1.00 0.00 C ATOM 0 H VAL A 162 0.030 9.081 3.647 1.00 0.00 H new ATOM 0 HA VAL A 162 0.641 9.029 0.745 1.00 0.00 H new ATOM 0 HB VAL A 162 2.386 7.874 2.974 1.00 0.00 H new ATOM 0 HG11 VAL A 162 3.766 6.916 1.169 1.00 0.00 H new ATOM 0 HG12 VAL A 162 2.123 6.234 1.147 1.00 0.00 H new ATOM 0 HG13 VAL A 162 2.586 7.477 -0.039 1.00 0.00 H new ATOM 0 HG21 VAL A 162 4.107 9.294 1.903 1.00 0.00 H new ATOM 0 HG22 VAL A 162 2.907 9.850 0.712 1.00 0.00 H new ATOM 0 HG23 VAL A 162 2.716 10.270 2.431 1.00 0.00 H new ATOM 1862 N VAL A 163 -0.301 6.744 0.573 1.00 0.00 N ATOM 1863 CA VAL A 163 -1.013 5.448 0.447 1.00 0.00 C ATOM 1864 C VAL A 163 -0.005 4.421 -0.073 1.00 0.00 C ATOM 1865 O VAL A 163 0.629 4.637 -1.077 1.00 0.00 O ATOM 1866 CB VAL A 163 -2.151 5.636 -0.561 1.00 0.00 C ATOM 1867 CG1 VAL A 163 -2.736 4.287 -0.972 1.00 0.00 C ATOM 1868 CG2 VAL A 163 -3.247 6.504 0.068 1.00 0.00 C ATOM 0 H VAL A 163 -0.079 7.194 -0.315 1.00 0.00 H new ATOM 0 HA VAL A 163 -1.425 5.110 1.398 1.00 0.00 H new ATOM 0 HB VAL A 163 -1.756 6.126 -1.451 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -3.543 4.443 -1.688 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -1.957 3.677 -1.430 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -3.126 3.776 -0.092 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -4.059 6.640 -0.647 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -3.630 6.014 0.963 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -2.833 7.476 0.335 1.00 0.00 H new ATOM 1878 N ALA A 164 0.147 3.312 0.587 1.00 0.00 N ATOM 1879 CA ALA A 164 1.115 2.261 0.118 1.00 0.00 C ATOM 1880 C ALA A 164 0.299 1.029 -0.284 1.00 0.00 C ATOM 1881 O ALA A 164 -0.831 0.868 0.120 1.00 0.00 O ATOM 1882 CB ALA A 164 2.127 1.915 1.242 1.00 0.00 C ATOM 0 H ALA A 164 -0.358 3.077 1.441 1.00 0.00 H new ATOM 0 HA ALA A 164 1.692 2.623 -0.733 1.00 0.00 H new ATOM 0 HB1 ALA A 164 2.820 1.153 0.886 1.00 0.00 H new ATOM 0 HB2 ALA A 164 2.683 2.810 1.519 1.00 0.00 H new ATOM 0 HB3 ALA A 164 1.590 1.538 2.112 1.00 0.00 H new ATOM 1888 N ILE A 165 0.841 0.156 -1.100 1.00 0.00 N ATOM 1889 CA ILE A 165 0.077 -1.028 -1.508 1.00 0.00 C ATOM 1890 C ILE A 165 1.104 -2.099 -1.789 1.00 0.00 C ATOM 1891 O ILE A 165 1.727 -2.074 -2.821 1.00 0.00 O ATOM 1892 CB ILE A 165 -0.681 -0.761 -2.810 1.00 0.00 C ATOM 1893 CG1 ILE A 165 -1.513 0.550 -2.724 1.00 0.00 C ATOM 1894 CG2 ILE A 165 -1.551 -1.989 -3.100 1.00 0.00 C ATOM 1895 CD1 ILE A 165 -2.271 0.798 -4.053 1.00 0.00 C ATOM 0 H ILE A 165 1.780 0.227 -1.492 1.00 0.00 H new ATOM 0 HA ILE A 165 -0.641 -1.305 -0.736 1.00 0.00 H new ATOM 0 HB ILE A 165 0.017 -0.609 -3.634 1.00 0.00 H new ATOM 0 HG12 ILE A 165 -2.223 0.484 -1.900 1.00 0.00 H new ATOM 0 HG13 ILE A 165 -0.855 1.392 -2.511 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -2.107 -1.831 -4.024 1.00 0.00 H new ATOM 0 HG22 ILE A 165 -0.916 -2.869 -3.204 1.00 0.00 H new ATOM 0 HG23 ILE A 165 -2.250 -2.142 -2.278 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -2.848 1.719 -3.976 1.00 0.00 H new ATOM 0 HD12 ILE A 165 -1.554 0.886 -4.870 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -2.944 -0.037 -4.249 1.00 0.00 H new ATOM 1907 N GLY A 166 1.316 -3.015 -0.891 1.00 0.00 N ATOM 1908 CA GLY A 166 2.367 -4.042 -1.127 1.00 0.00 C ATOM 1909 C GLY A 166 1.756 -5.384 -1.471 1.00 0.00 C ATOM 1910 O GLY A 166 0.880 -5.896 -0.806 1.00 0.00 O ATOM 0 H GLY A 166 0.812 -3.099 -0.008 1.00 0.00 H new ATOM 0 HA2 GLY A 166 3.019 -3.718 -1.938 1.00 0.00 H new ATOM 0 HA3 GLY A 166 2.989 -4.140 -0.237 1.00 0.00 H new ATOM 1914 N LEU A 167 2.253 -5.956 -2.511 1.00 0.00 N ATOM 1915 CA LEU A 167 1.750 -7.301 -2.949 1.00 0.00 C ATOM 1916 C LEU A 167 2.629 -8.379 -2.326 1.00 0.00 C ATOM 1917 O LEU A 167 3.771 -8.548 -2.738 1.00 0.00 O ATOM 1918 CB LEU A 167 1.866 -7.396 -4.480 1.00 0.00 C ATOM 1919 CG LEU A 167 1.392 -8.792 -5.009 1.00 0.00 C ATOM 1920 CD1 LEU A 167 0.152 -8.617 -5.897 1.00 0.00 C ATOM 1921 CD2 LEU A 167 2.505 -9.436 -5.857 1.00 0.00 C ATOM 0 H LEU A 167 2.992 -5.561 -3.092 1.00 0.00 H new ATOM 0 HA LEU A 167 0.713 -7.434 -2.640 1.00 0.00 H new ATOM 0 HB2 LEU A 167 1.268 -6.610 -4.940 1.00 0.00 H new ATOM 0 HB3 LEU A 167 2.900 -7.225 -4.778 1.00 0.00 H new ATOM 0 HG LEU A 167 1.157 -9.426 -4.154 1.00 0.00 H new ATOM 0 HD11 LEU A 167 -0.174 -9.591 -6.263 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -0.650 -8.160 -5.317 1.00 0.00 H new ATOM 0 HD13 LEU A 167 0.398 -7.976 -6.743 1.00 0.00 H new ATOM 0 HD21 LEU A 167 2.169 -10.407 -6.222 1.00 0.00 H new ATOM 0 HD22 LEU A 167 2.737 -8.790 -6.704 1.00 0.00 H new ATOM 0 HD23 LEU A 167 3.398 -9.567 -5.246 1.00 0.00 H new ATOM 1933 N GLU A 168 2.068 -9.132 -1.376 1.00 0.00 N ATOM 1934 CA GLU A 168 2.837 -10.241 -0.716 1.00 0.00 C ATOM 1935 C GLU A 168 3.286 -11.189 -1.842 1.00 0.00 C ATOM 1936 O GLU A 168 2.771 -11.122 -2.945 1.00 0.00 O ATOM 1937 CB GLU A 168 1.939 -11.001 0.280 1.00 0.00 C ATOM 1938 CG GLU A 168 2.805 -11.838 1.248 1.00 0.00 C ATOM 1939 CD GLU A 168 3.173 -13.174 0.597 1.00 0.00 C ATOM 1940 OE1 GLU A 168 2.355 -13.697 -0.141 1.00 0.00 O ATOM 1941 OE2 GLU A 168 4.264 -13.654 0.854 1.00 0.00 O ATOM 0 H GLU A 168 1.112 -9.016 -1.040 1.00 0.00 H new ATOM 0 HA GLU A 168 3.688 -9.848 -0.160 1.00 0.00 H new ATOM 0 HB2 GLU A 168 1.330 -10.295 0.844 1.00 0.00 H new ATOM 0 HB3 GLU A 168 1.253 -11.652 -0.261 1.00 0.00 H new ATOM 0 HG2 GLU A 168 3.710 -11.289 1.507 1.00 0.00 H new ATOM 0 HG3 GLU A 168 2.262 -12.014 2.176 1.00 0.00 H new ATOM 1948 N LEU A 169 4.229 -12.055 -1.604 1.00 0.00 N ATOM 1949 CA LEU A 169 4.706 -12.979 -2.683 1.00 0.00 C ATOM 1950 C LEU A 169 3.514 -13.564 -3.463 1.00 0.00 C ATOM 1951 O LEU A 169 2.487 -13.849 -2.891 1.00 0.00 O ATOM 1952 CB LEU A 169 5.489 -14.119 -2.027 1.00 0.00 C ATOM 1953 CG LEU A 169 5.921 -15.181 -3.090 1.00 0.00 C ATOM 1954 CD1 LEU A 169 7.436 -15.396 -3.064 1.00 0.00 C ATOM 1955 CD2 LEU A 169 5.237 -16.523 -2.804 1.00 0.00 C ATOM 0 H LEU A 169 4.696 -12.167 -0.704 1.00 0.00 H new ATOM 0 HA LEU A 169 5.337 -12.427 -3.380 1.00 0.00 H new ATOM 0 HB2 LEU A 169 6.371 -13.719 -1.527 1.00 0.00 H new ATOM 0 HB3 LEU A 169 4.876 -14.594 -1.261 1.00 0.00 H new ATOM 0 HG LEU A 169 5.624 -14.808 -4.070 1.00 0.00 H new ATOM 0 HD11 LEU A 169 7.711 -16.139 -3.812 1.00 0.00 H new ATOM 0 HD12 LEU A 169 7.941 -14.455 -3.284 1.00 0.00 H new ATOM 0 HD13 LEU A 169 7.737 -15.747 -2.077 1.00 0.00 H new ATOM 0 HD21 LEU A 169 5.545 -17.255 -3.551 1.00 0.00 H new ATOM 0 HD22 LEU A 169 5.524 -16.873 -1.812 1.00 0.00 H new ATOM 0 HD23 LEU A 169 4.155 -16.396 -2.845 1.00 0.00 H new