USER MOD reduce.3.24.130724 H: found=0, std=0, add=501, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 504 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 Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -166:sc= -0.0245 (180deg=-0.245) USER MOD Single : A 102 SER OG : rot -3:sc= 0.988 USER MOD Single : A 103 TYR OH : rot 165:sc= 0 USER MOD Single : A 105 THR OG1 : rot -53:sc= 1.23 USER MOD Single : A 108 ASN : amide:sc= -2.41! C(o=-2.4!,f=-2.8!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.0268 USER MOD Single : A 135 HIS : no HD1:sc= -1.78! C(o=-1.8!,f=-4!) USER MOD Single : A 139 SER OG : rot 169:sc= -2.37! USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot -138:sc= -0.208! USER MOD Single : A 145 SER OG : rot 180:sc= 0.0636 USER MOD Single : A 146 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : A 148 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.265 USER MOD Single : A 153 LYS NZ :NH3+ -124:sc= -6.19! (180deg=-10.6!) USER MOD Single : A 155 HIS : no HD1:sc= -0.787 K(o=-0.79,f=-1.3) USER MOD Single : A 157 GLN : amide:sc= -0.221 X(o=-0.22,f=-0.083) USER MOD Single : A 159 ASN : amide:sc= -4.31! C(o=-4.3!,f=-4.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 92 29.848 2.913 -4.562 1.00 0.00 N ATOM 2 CA GLU A 92 29.956 1.441 -4.398 1.00 0.00 C ATOM 3 C GLU A 92 28.578 0.797 -4.284 1.00 0.00 C ATOM 4 O GLU A 92 28.331 -0.267 -4.852 1.00 0.00 O ATOM 5 CB GLU A 92 30.784 1.148 -3.145 1.00 0.00 C ATOM 6 CG GLU A 92 32.193 1.715 -3.202 1.00 0.00 C ATOM 7 CD GLU A 92 32.999 1.159 -4.360 1.00 0.00 C ATOM 8 OE1 GLU A 92 33.192 -0.074 -4.411 1.00 0.00 O ATOM 9 OE2 GLU A 92 33.436 1.957 -5.215 1.00 0.00 O ATOM 0 HA GLU A 92 30.444 1.018 -5.276 1.00 0.00 H new ATOM 0 HB2 GLU A 92 30.271 1.559 -2.276 1.00 0.00 H new ATOM 0 HB3 GLU A 92 30.841 0.069 -3.001 1.00 0.00 H new ATOM 0 HG2 GLU A 92 32.141 2.800 -3.289 1.00 0.00 H new ATOM 0 HG3 GLU A 92 32.708 1.494 -2.267 1.00 0.00 H new ATOM 18 N ALA A 93 27.684 1.450 -3.546 1.00 0.00 N ATOM 19 CA ALA A 93 26.330 0.942 -3.356 1.00 0.00 C ATOM 20 C ALA A 93 25.437 1.996 -2.703 1.00 0.00 C ATOM 21 O ALA A 93 25.475 3.168 -3.080 1.00 0.00 O ATOM 22 CB ALA A 93 26.362 -0.331 -2.522 1.00 0.00 C ATOM 0 H ALA A 93 27.874 2.332 -3.070 1.00 0.00 H new ATOM 0 HA ALA A 93 25.908 0.709 -4.333 1.00 0.00 H new ATOM 0 HB1 ALA A 93 25.346 -0.702 -2.386 1.00 0.00 H new ATOM 0 HB2 ALA A 93 26.959 -1.086 -3.033 1.00 0.00 H new ATOM 0 HB3 ALA A 93 26.804 -0.117 -1.549 1.00 0.00 H new ATOM 28 N GLU A 94 24.634 1.572 -1.724 1.00 0.00 N ATOM 29 CA GLU A 94 23.728 2.475 -1.015 1.00 0.00 C ATOM 30 C GLU A 94 22.642 3.007 -1.951 1.00 0.00 C ATOM 31 O GLU A 94 22.934 3.514 -3.034 1.00 0.00 O ATOM 32 CB GLU A 94 24.511 3.639 -0.401 1.00 0.00 C ATOM 33 CG GLU A 94 23.669 4.553 0.475 1.00 0.00 C ATOM 34 CD GLU A 94 23.151 3.860 1.722 1.00 0.00 C ATOM 35 OE1 GLU A 94 23.466 2.667 1.917 1.00 0.00 O ATOM 36 OE2 GLU A 94 22.433 4.513 2.507 1.00 0.00 O ATOM 0 H GLU A 94 24.594 0.604 -1.404 1.00 0.00 H new ATOM 0 HA GLU A 94 23.245 1.912 -0.216 1.00 0.00 H new ATOM 0 HB2 GLU A 94 25.333 3.238 0.193 1.00 0.00 H new ATOM 0 HB3 GLU A 94 24.955 4.229 -1.203 1.00 0.00 H new ATOM 0 HG2 GLU A 94 24.264 5.418 0.767 1.00 0.00 H new ATOM 0 HG3 GLU A 94 22.825 4.927 -0.104 1.00 0.00 H new ATOM 43 N PHE A 95 21.386 2.880 -1.523 1.00 0.00 N ATOM 44 CA PHE A 95 20.250 3.340 -2.320 1.00 0.00 C ATOM 45 C PHE A 95 20.276 2.725 -3.716 1.00 0.00 C ATOM 46 O PHE A 95 19.909 3.370 -4.699 1.00 0.00 O ATOM 47 CB PHE A 95 20.244 4.870 -2.421 1.00 0.00 C ATOM 48 CG PHE A 95 19.836 5.571 -1.152 1.00 0.00 C ATOM 49 CD1 PHE A 95 20.364 5.192 0.074 1.00 0.00 C ATOM 50 CD2 PHE A 95 18.924 6.613 -1.188 1.00 0.00 C ATOM 51 CE1 PHE A 95 19.989 5.839 1.235 1.00 0.00 C ATOM 52 CE2 PHE A 95 18.544 7.264 -0.029 1.00 0.00 C ATOM 53 CZ PHE A 95 19.078 6.877 1.184 1.00 0.00 C ATOM 0 H PHE A 95 21.130 2.462 -0.628 1.00 0.00 H new ATOM 0 HA PHE A 95 19.338 3.017 -1.817 1.00 0.00 H new ATOM 0 HB2 PHE A 95 21.241 5.208 -2.705 1.00 0.00 H new ATOM 0 HB3 PHE A 95 19.566 5.167 -3.221 1.00 0.00 H new ATOM 0 HD1 PHE A 95 21.076 4.382 0.121 1.00 0.00 H new ATOM 0 HD2 PHE A 95 18.504 6.921 -2.134 1.00 0.00 H new ATOM 0 HE1 PHE A 95 20.408 5.534 2.183 1.00 0.00 H new ATOM 0 HE2 PHE A 95 17.831 8.074 -0.072 1.00 0.00 H new ATOM 0 HZ PHE A 95 18.784 7.384 2.091 1.00 0.00 H new ATOM 63 N VAL A 96 20.713 1.471 -3.795 1.00 0.00 N ATOM 64 CA VAL A 96 20.787 0.763 -5.067 1.00 0.00 C ATOM 65 C VAL A 96 19.592 -0.165 -5.255 1.00 0.00 C ATOM 66 O VAL A 96 19.187 -0.867 -4.327 1.00 0.00 O ATOM 67 CB VAL A 96 22.086 -0.061 -5.174 1.00 0.00 C ATOM 68 CG1 VAL A 96 22.129 -0.834 -6.484 1.00 0.00 C ATOM 69 CG2 VAL A 96 23.303 0.841 -5.039 1.00 0.00 C ATOM 0 H VAL A 96 21.021 0.925 -2.991 1.00 0.00 H new ATOM 0 HA VAL A 96 20.778 1.521 -5.851 1.00 0.00 H new ATOM 0 HB VAL A 96 22.102 -0.782 -4.356 1.00 0.00 H new ATOM 0 HG11 VAL A 96 23.054 -1.408 -6.538 1.00 0.00 H new ATOM 0 HG12 VAL A 96 21.278 -1.513 -6.534 1.00 0.00 H new ATOM 0 HG13 VAL A 96 22.086 -0.136 -7.320 1.00 0.00 H new ATOM 0 HG21 VAL A 96 24.210 0.242 -5.117 1.00 0.00 H new ATOM 0 HG22 VAL A 96 23.292 1.588 -5.833 1.00 0.00 H new ATOM 0 HG23 VAL A 96 23.280 1.340 -4.070 1.00 0.00 H new ATOM 79 N ARG A 97 19.038 -0.171 -6.466 1.00 0.00 N ATOM 80 CA ARG A 97 17.896 -1.021 -6.787 1.00 0.00 C ATOM 81 C ARG A 97 16.690 -0.696 -5.909 1.00 0.00 C ATOM 82 O ARG A 97 16.155 -1.569 -5.224 1.00 0.00 O ATOM 83 CB ARG A 97 18.278 -2.496 -6.638 1.00 0.00 C ATOM 84 CG ARG A 97 19.356 -2.940 -7.614 1.00 0.00 C ATOM 85 CD ARG A 97 19.764 -4.393 -7.403 1.00 0.00 C ATOM 86 NE ARG A 97 20.493 -4.596 -6.150 1.00 0.00 N ATOM 87 CZ ARG A 97 19.913 -4.728 -4.958 1.00 0.00 C ATOM 88 NH1 ARG A 97 18.592 -4.754 -4.853 1.00 0.00 N ATOM 89 NH2 ARG A 97 20.661 -4.856 -3.870 1.00 0.00 N ATOM 0 H ARG A 97 19.363 0.405 -7.242 1.00 0.00 H new ATOM 0 HA ARG A 97 17.615 -0.826 -7.822 1.00 0.00 H new ATOM 0 HB2 ARG A 97 18.624 -2.673 -5.620 1.00 0.00 H new ATOM 0 HB3 ARG A 97 17.390 -3.111 -6.784 1.00 0.00 H new ATOM 0 HG2 ARG A 97 18.995 -2.811 -8.634 1.00 0.00 H new ATOM 0 HG3 ARG A 97 20.231 -2.299 -7.502 1.00 0.00 H new ATOM 0 HD2 ARG A 97 18.873 -5.021 -7.407 1.00 0.00 H new ATOM 0 HD3 ARG A 97 20.386 -4.717 -8.238 1.00 0.00 H new ATOM 0 HE ARG A 97 21.511 -4.639 -6.192 1.00 0.00 H new ATOM 0 HH11 ARG A 97 18.012 -4.673 -5.688 1.00 0.00 H new ATOM 0 HH12 ARG A 97 18.155 -4.855 -3.937 1.00 0.00 H new ATOM 0 HH21 ARG A 97 21.678 -4.853 -3.947 1.00 0.00 H new ATOM 0 HH22 ARG A 97 20.219 -4.957 -2.956 1.00 0.00 H new ATOM 103 N ILE A 98 16.266 0.565 -5.937 1.00 0.00 N ATOM 104 CA ILE A 98 15.119 1.007 -5.151 1.00 0.00 C ATOM 105 C ILE A 98 13.900 0.127 -5.421 1.00 0.00 C ATOM 106 O ILE A 98 13.708 -0.355 -6.538 1.00 0.00 O ATOM 107 CB ILE A 98 14.748 2.479 -5.443 1.00 0.00 C ATOM 108 CG1 ILE A 98 14.211 2.644 -6.873 1.00 0.00 C ATOM 109 CG2 ILE A 98 15.947 3.388 -5.212 1.00 0.00 C ATOM 110 CD1 ILE A 98 15.222 2.333 -7.958 1.00 0.00 C ATOM 0 H ILE A 98 16.701 1.299 -6.496 1.00 0.00 H new ATOM 0 HA ILE A 98 15.411 0.922 -4.104 1.00 0.00 H new ATOM 0 HB ILE A 98 13.955 2.769 -4.753 1.00 0.00 H new ATOM 0 HG12 ILE A 98 13.346 1.993 -7.001 1.00 0.00 H new ATOM 0 HG13 ILE A 98 13.861 3.668 -7.001 1.00 0.00 H new ATOM 0 HG21 ILE A 98 15.667 4.420 -5.423 1.00 0.00 H new ATOM 0 HG22 ILE A 98 16.272 3.305 -4.175 1.00 0.00 H new ATOM 0 HG23 ILE A 98 16.761 3.091 -5.873 1.00 0.00 H new ATOM 0 HD11 ILE A 98 14.762 2.474 -8.936 1.00 0.00 H new ATOM 0 HD12 ILE A 98 16.078 3.001 -7.860 1.00 0.00 H new ATOM 0 HD13 ILE A 98 15.555 1.300 -7.860 1.00 0.00 H new ATOM 122 N CYS A 99 13.083 -0.084 -4.392 1.00 0.00 N ATOM 123 CA CYS A 99 11.886 -0.910 -4.520 1.00 0.00 C ATOM 124 C CYS A 99 11.011 -0.439 -5.676 1.00 0.00 C ATOM 125 O CYS A 99 10.787 0.760 -5.851 1.00 0.00 O ATOM 126 CB CYS A 99 11.083 -0.889 -3.218 1.00 0.00 C ATOM 127 SG CYS A 99 11.966 -1.600 -1.792 1.00 0.00 S ATOM 0 H CYS A 99 13.228 0.306 -3.461 1.00 0.00 H new ATOM 0 HA CYS A 99 12.207 -1.931 -4.727 1.00 0.00 H new ATOM 0 HB2 CYS A 99 10.811 0.141 -2.987 1.00 0.00 H new ATOM 0 HB3 CYS A 99 10.153 -1.438 -3.367 1.00 0.00 H new ATOM 132 N SER A 100 10.529 -1.395 -6.466 1.00 0.00 N ATOM 133 CA SER A 100 9.682 -1.098 -7.617 1.00 0.00 C ATOM 134 C SER A 100 8.561 -0.128 -7.252 1.00 0.00 C ATOM 135 O SER A 100 7.763 -0.393 -6.355 1.00 0.00 O ATOM 136 CB SER A 100 9.085 -2.390 -8.175 1.00 0.00 C ATOM 137 OG SER A 100 8.255 -2.130 -9.293 1.00 0.00 O ATOM 0 H SER A 100 10.713 -2.389 -6.328 1.00 0.00 H new ATOM 0 HA SER A 100 10.305 -0.625 -8.376 1.00 0.00 H new ATOM 0 HB2 SER A 100 9.887 -3.069 -8.464 1.00 0.00 H new ATOM 0 HB3 SER A 100 8.507 -2.892 -7.399 1.00 0.00 H new ATOM 0 HG SER A 100 7.888 -2.973 -9.631 1.00 0.00 H new ATOM 143 N LYS A 101 8.502 0.993 -7.966 1.00 0.00 N ATOM 144 CA LYS A 101 7.473 1.999 -7.728 1.00 0.00 C ATOM 145 C LYS A 101 6.170 1.607 -8.416 1.00 0.00 C ATOM 146 O LYS A 101 6.095 1.573 -9.644 1.00 0.00 O ATOM 147 CB LYS A 101 7.945 3.362 -8.235 1.00 0.00 C ATOM 148 CG LYS A 101 9.232 3.841 -7.583 1.00 0.00 C ATOM 149 CD LYS A 101 9.688 5.177 -8.151 1.00 0.00 C ATOM 150 CE LYS A 101 10.008 5.076 -9.634 1.00 0.00 C ATOM 151 NZ LYS A 101 11.086 4.084 -9.905 1.00 0.00 N ATOM 0 H LYS A 101 9.155 1.227 -8.714 1.00 0.00 H new ATOM 0 HA LYS A 101 7.292 2.062 -6.655 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.092 3.308 -9.314 1.00 0.00 H new ATOM 0 HB3 LYS A 101 7.161 4.098 -8.057 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.082 3.935 -6.508 1.00 0.00 H new ATOM 0 HG3 LYS A 101 10.014 3.096 -7.732 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.909 5.923 -7.997 1.00 0.00 H new ATOM 0 HD3 LYS A 101 10.570 5.521 -7.611 1.00 0.00 H new ATOM 0 HE2 LYS A 101 9.109 4.793 -10.181 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.313 6.054 -10.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 11.439 4.211 -10.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 11.866 4.226 -9.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 10.707 3.121 -9.797 1.00 0.00 H new ATOM 165 N SER A 102 5.152 1.310 -7.615 1.00 0.00 N ATOM 166 CA SER A 102 3.847 0.910 -8.128 1.00 0.00 C ATOM 167 C SER A 102 2.832 0.848 -6.992 1.00 0.00 C ATOM 168 O SER A 102 1.686 1.268 -7.142 1.00 0.00 O ATOM 169 CB SER A 102 3.942 -0.460 -8.797 1.00 0.00 C ATOM 170 OG SER A 102 4.696 -0.404 -9.995 1.00 0.00 O ATOM 0 H SER A 102 5.208 1.340 -6.597 1.00 0.00 H new ATOM 0 HA SER A 102 3.523 1.648 -8.861 1.00 0.00 H new ATOM 0 HB2 SER A 102 4.402 -1.170 -8.110 1.00 0.00 H new ATOM 0 HB3 SER A 102 2.940 -0.830 -9.014 1.00 0.00 H new ATOM 0 HG SER A 102 4.958 0.523 -10.173 1.00 0.00 H new ATOM 176 N TYR A 103 3.271 0.318 -5.858 1.00 0.00 N ATOM 177 CA TYR A 103 2.418 0.191 -4.683 1.00 0.00 C ATOM 178 C TYR A 103 1.969 1.559 -4.181 1.00 0.00 C ATOM 179 O TYR A 103 0.908 1.690 -3.572 1.00 0.00 O ATOM 180 CB TYR A 103 3.157 -0.551 -3.565 1.00 0.00 C ATOM 181 CG TYR A 103 3.501 -1.988 -3.897 1.00 0.00 C ATOM 182 CD1 TYR A 103 4.228 -2.309 -5.039 1.00 0.00 C ATOM 183 CD2 TYR A 103 3.104 -3.025 -3.062 1.00 0.00 C ATOM 184 CE1 TYR A 103 4.545 -3.620 -5.338 1.00 0.00 C ATOM 185 CE2 TYR A 103 3.419 -4.337 -3.355 1.00 0.00 C ATOM 186 CZ TYR A 103 4.138 -4.630 -4.493 1.00 0.00 C ATOM 187 OH TYR A 103 4.452 -5.937 -4.788 1.00 0.00 O ATOM 0 H TYR A 103 4.220 -0.033 -5.727 1.00 0.00 H new ATOM 0 HA TYR A 103 1.535 -0.380 -4.972 1.00 0.00 H new ATOM 0 HB2 TYR A 103 4.076 -0.013 -3.333 1.00 0.00 H new ATOM 0 HB3 TYR A 103 2.542 -0.535 -2.665 1.00 0.00 H new ATOM 0 HD1 TYR A 103 4.550 -1.520 -5.703 1.00 0.00 H new ATOM 0 HD2 TYR A 103 2.540 -2.801 -2.169 1.00 0.00 H new ATOM 0 HE1 TYR A 103 5.109 -3.852 -6.229 1.00 0.00 H new ATOM 0 HE2 TYR A 103 3.103 -5.131 -2.694 1.00 0.00 H new ATOM 0 HH TYR A 103 4.311 -6.494 -3.994 1.00 0.00 H new ATOM 197 N LEU A 104 2.798 2.569 -4.423 1.00 0.00 N ATOM 198 CA LEU A 104 2.506 3.930 -3.981 1.00 0.00 C ATOM 199 C LEU A 104 1.382 4.577 -4.794 1.00 0.00 C ATOM 200 O LEU A 104 1.339 5.800 -4.931 1.00 0.00 O ATOM 201 CB LEU A 104 3.771 4.785 -4.084 1.00 0.00 C ATOM 202 CG LEU A 104 4.997 4.223 -3.360 1.00 0.00 C ATOM 203 CD1 LEU A 104 6.183 5.165 -3.512 1.00 0.00 C ATOM 204 CD2 LEU A 104 4.691 3.981 -1.891 1.00 0.00 C ATOM 0 H LEU A 104 3.681 2.471 -4.925 1.00 0.00 H new ATOM 0 HA LEU A 104 2.170 3.873 -2.946 1.00 0.00 H new ATOM 0 HB2 LEU A 104 4.018 4.914 -5.138 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.555 5.775 -3.684 1.00 0.00 H new ATOM 0 HG LEU A 104 5.255 3.267 -3.815 1.00 0.00 H new ATOM 0 HD11 LEU A 104 7.046 4.750 -2.991 1.00 0.00 H new ATOM 0 HD12 LEU A 104 6.420 5.284 -4.569 1.00 0.00 H new ATOM 0 HD13 LEU A 104 5.933 6.136 -3.084 1.00 0.00 H new ATOM 0 HD21 LEU A 104 5.576 3.582 -1.396 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.404 4.921 -1.419 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.873 3.267 -1.803 1.00 0.00 H new ATOM 216 N THR A 105 0.468 3.765 -5.324 1.00 0.00 N ATOM 217 CA THR A 105 -0.649 4.290 -6.108 1.00 0.00 C ATOM 218 C THR A 105 -1.903 3.437 -5.943 1.00 0.00 C ATOM 219 O THR A 105 -1.872 2.222 -6.140 1.00 0.00 O ATOM 220 CB THR A 105 -0.304 4.373 -7.608 1.00 0.00 C ATOM 221 OG1 THR A 105 0.084 3.085 -8.095 1.00 0.00 O ATOM 222 CG2 THR A 105 0.814 5.375 -7.858 1.00 0.00 C ATOM 0 H THR A 105 0.478 2.750 -5.226 1.00 0.00 H new ATOM 0 HA THR A 105 -0.841 5.293 -5.727 1.00 0.00 H new ATOM 0 HB THR A 105 -1.193 4.709 -8.141 1.00 0.00 H new ATOM 0 HG1 THR A 105 0.796 2.721 -7.528 1.00 0.00 H new ATOM 0 HG21 THR A 105 1.037 5.413 -8.924 1.00 0.00 H new ATOM 0 HG22 THR A 105 0.501 6.362 -7.517 1.00 0.00 H new ATOM 0 HG23 THR A 105 1.706 5.069 -7.312 1.00 0.00 H new ATOM 230 N LEU A 106 -3.011 4.087 -5.596 1.00 0.00 N ATOM 231 CA LEU A 106 -4.285 3.398 -5.423 1.00 0.00 C ATOM 232 C LEU A 106 -5.437 4.295 -5.869 1.00 0.00 C ATOM 233 O LEU A 106 -5.601 5.406 -5.363 1.00 0.00 O ATOM 234 CB LEU A 106 -4.468 2.978 -3.961 1.00 0.00 C ATOM 235 CG LEU A 106 -5.736 2.174 -3.665 1.00 0.00 C ATOM 236 CD1 LEU A 106 -5.851 0.980 -4.601 1.00 0.00 C ATOM 237 CD2 LEU A 106 -5.743 1.716 -2.214 1.00 0.00 C ATOM 0 H LEU A 106 -3.051 5.092 -5.429 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.284 2.502 -6.043 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -3.604 2.386 -3.659 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.473 3.874 -3.341 1.00 0.00 H new ATOM 0 HG LEU A 106 -6.598 2.820 -3.832 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -6.760 0.424 -4.371 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -5.890 1.329 -5.633 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -4.986 0.330 -4.470 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -6.650 1.145 -2.017 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.872 1.088 -2.026 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.712 2.586 -1.558 1.00 0.00 H new ATOM 249 N GLU A 107 -6.222 3.817 -6.831 1.00 0.00 N ATOM 250 CA GLU A 107 -7.345 4.587 -7.357 1.00 0.00 C ATOM 251 C GLU A 107 -8.648 4.278 -6.624 1.00 0.00 C ATOM 252 O GLU A 107 -9.710 4.201 -7.241 1.00 0.00 O ATOM 253 CB GLU A 107 -7.510 4.320 -8.854 1.00 0.00 C ATOM 254 CG GLU A 107 -7.707 2.851 -9.193 1.00 0.00 C ATOM 255 CD GLU A 107 -7.818 2.607 -10.685 1.00 0.00 C ATOM 256 OE1 GLU A 107 -8.743 3.165 -11.311 1.00 0.00 O ATOM 257 OE2 GLU A 107 -6.979 1.857 -11.227 1.00 0.00 O ATOM 0 H GLU A 107 -6.101 2.900 -7.262 1.00 0.00 H new ATOM 0 HA GLU A 107 -7.121 5.642 -7.196 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -8.364 4.887 -9.224 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -6.630 4.691 -9.380 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -6.871 2.275 -8.796 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -8.608 2.486 -8.701 1.00 0.00 H new ATOM 264 N ASN A 108 -8.561 4.128 -5.306 1.00 0.00 N ATOM 265 CA ASN A 108 -9.734 3.850 -4.480 1.00 0.00 C ATOM 266 C ASN A 108 -9.435 4.122 -3.009 1.00 0.00 C ATOM 267 O ASN A 108 -9.923 3.416 -2.127 1.00 0.00 O ATOM 268 CB ASN A 108 -10.200 2.395 -4.643 1.00 0.00 C ATOM 269 CG ASN A 108 -10.762 2.100 -6.020 1.00 0.00 C ATOM 270 OD1 ASN A 108 -11.747 2.704 -6.444 1.00 0.00 O ATOM 271 ND2 ASN A 108 -10.138 1.164 -6.725 1.00 0.00 N ATOM 0 H ASN A 108 -7.687 4.194 -4.784 1.00 0.00 H new ATOM 0 HA ASN A 108 -10.531 4.513 -4.816 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -9.361 1.727 -4.449 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.960 2.177 -3.893 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -10.472 0.920 -7.658 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -9.325 0.688 -6.334 1.00 0.00 H new ATOM 278 N GLY A 109 -8.635 5.153 -2.749 1.00 0.00 N ATOM 279 CA GLY A 109 -8.294 5.493 -1.380 1.00 0.00 C ATOM 280 C GLY A 109 -7.107 6.424 -1.285 1.00 0.00 C ATOM 281 O GLY A 109 -6.897 7.277 -2.148 1.00 0.00 O ATOM 0 H GLY A 109 -8.219 5.756 -3.459 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -9.155 5.960 -0.901 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.078 4.579 -0.827 1.00 0.00 H new ATOM 285 N LYS A 110 -6.330 6.248 -0.227 1.00 0.00 N ATOM 286 CA LYS A 110 -5.145 7.062 0.011 1.00 0.00 C ATOM 287 C LYS A 110 -4.017 6.210 0.582 1.00 0.00 C ATOM 288 O LYS A 110 -4.248 5.345 1.427 1.00 0.00 O ATOM 289 CB LYS A 110 -5.468 8.210 0.971 1.00 0.00 C ATOM 290 CG LYS A 110 -6.478 9.203 0.417 1.00 0.00 C ATOM 291 CD LYS A 110 -5.954 9.890 -0.832 1.00 0.00 C ATOM 292 CE LYS A 110 -6.981 10.841 -1.421 1.00 0.00 C ATOM 293 NZ LYS A 110 -6.468 11.530 -2.638 1.00 0.00 N ATOM 0 H LYS A 110 -6.501 5.541 0.488 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.822 7.480 -0.942 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -5.853 7.796 1.903 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -4.547 8.739 1.214 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -7.409 8.686 0.186 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.709 9.951 1.176 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -5.045 10.440 -0.591 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -5.685 9.139 -1.575 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -7.886 10.288 -1.672 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -7.258 11.584 -0.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -7.199 12.170 -3.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -5.619 12.079 -2.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -6.227 10.823 -3.362 1.00 0.00 H new ATOM 307 N VAL A 111 -2.799 6.457 0.115 1.00 0.00 N ATOM 308 CA VAL A 111 -1.639 5.706 0.579 1.00 0.00 C ATOM 309 C VAL A 111 -0.778 6.551 1.511 1.00 0.00 C ATOM 310 O VAL A 111 -0.527 7.728 1.249 1.00 0.00 O ATOM 311 CB VAL A 111 -0.778 5.213 -0.602 1.00 0.00 C ATOM 312 CG1 VAL A 111 0.459 4.482 -0.098 1.00 0.00 C ATOM 313 CG2 VAL A 111 -1.596 4.315 -1.519 1.00 0.00 C ATOM 0 H VAL A 111 -2.589 7.170 -0.583 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.016 4.841 1.124 1.00 0.00 H new ATOM 0 HB VAL A 111 -0.450 6.081 -1.174 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.052 4.143 -0.947 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.056 5.157 0.515 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.155 3.622 0.499 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -0.973 3.976 -2.347 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.955 3.452 -0.958 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -2.447 4.873 -1.910 1.00 0.00 H new ATOM 323 N PHE A 112 -0.332 5.938 2.600 1.00 0.00 N ATOM 324 CA PHE A 112 0.499 6.622 3.582 1.00 0.00 C ATOM 325 C PHE A 112 1.936 6.119 3.505 1.00 0.00 C ATOM 326 O PHE A 112 2.177 4.947 3.214 1.00 0.00 O ATOM 327 CB PHE A 112 -0.058 6.413 4.995 1.00 0.00 C ATOM 328 CG PHE A 112 -1.449 6.958 5.191 1.00 0.00 C ATOM 329 CD1 PHE A 112 -2.505 6.516 4.406 1.00 0.00 C ATOM 330 CD2 PHE A 112 -1.699 7.914 6.162 1.00 0.00 C ATOM 331 CE1 PHE A 112 -3.780 7.019 4.586 1.00 0.00 C ATOM 332 CE2 PHE A 112 -2.973 8.420 6.347 1.00 0.00 C ATOM 333 CZ PHE A 112 -4.014 7.972 5.558 1.00 0.00 C ATOM 0 H PHE A 112 -0.533 4.964 2.826 1.00 0.00 H new ATOM 0 HA PHE A 112 0.489 7.689 3.357 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -0.062 5.346 5.219 1.00 0.00 H new ATOM 0 HB3 PHE A 112 0.612 6.887 5.712 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -2.328 5.770 3.645 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -0.889 8.269 6.782 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -4.592 6.667 3.967 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -3.153 9.165 7.108 1.00 0.00 H new ATOM 0 HZ PHE A 112 -5.009 8.366 5.701 1.00 0.00 H new ATOM 343 N LEU A 113 2.890 7.012 3.751 1.00 0.00 N ATOM 344 CA LEU A 113 4.301 6.648 3.690 1.00 0.00 C ATOM 345 C LEU A 113 5.132 7.538 4.611 1.00 0.00 C ATOM 346 O LEU A 113 4.915 8.747 4.687 1.00 0.00 O ATOM 347 CB LEU A 113 4.803 6.754 2.242 1.00 0.00 C ATOM 348 CG LEU A 113 6.212 6.207 1.974 1.00 0.00 C ATOM 349 CD1 LEU A 113 6.438 6.051 0.477 1.00 0.00 C ATOM 350 CD2 LEU A 113 7.277 7.117 2.566 1.00 0.00 C ATOM 0 H LEU A 113 2.713 7.987 3.993 1.00 0.00 H new ATOM 0 HA LEU A 113 4.411 5.618 4.030 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.101 6.226 1.596 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.780 7.803 1.947 1.00 0.00 H new ATOM 0 HG LEU A 113 6.291 5.232 2.454 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.441 5.662 0.299 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.702 5.358 0.068 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.333 7.021 -0.010 1.00 0.00 H new ATOM 0 HD21 LEU A 113 8.264 6.704 2.360 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.198 8.108 2.119 1.00 0.00 H new ATOM 0 HD23 LEU A 113 7.133 7.193 3.644 1.00 0.00 H new ATOM 362 N THR A 114 6.089 6.924 5.301 1.00 0.00 N ATOM 363 CA THR A 114 6.966 7.649 6.213 1.00 0.00 C ATOM 364 C THR A 114 8.303 6.932 6.358 1.00 0.00 C ATOM 365 O THR A 114 8.355 5.759 6.727 1.00 0.00 O ATOM 366 CB THR A 114 6.326 7.803 7.608 1.00 0.00 C ATOM 367 OG1 THR A 114 5.076 8.494 7.500 1.00 0.00 O ATOM 368 CG2 THR A 114 7.251 8.562 8.547 1.00 0.00 C ATOM 0 H THR A 114 6.277 5.923 5.245 1.00 0.00 H new ATOM 0 HA THR A 114 7.125 8.639 5.786 1.00 0.00 H new ATOM 0 HB THR A 114 6.156 6.807 8.017 1.00 0.00 H new ATOM 0 HG1 THR A 114 4.675 8.586 8.390 1.00 0.00 H new ATOM 0 HG21 THR A 114 6.778 8.658 9.524 1.00 0.00 H new ATOM 0 HG22 THR A 114 8.190 8.019 8.650 1.00 0.00 H new ATOM 0 HG23 THR A 114 7.448 9.554 8.140 1.00 0.00 H new ATOM 376 N GLY A 115 9.382 7.647 6.058 1.00 0.00 N ATOM 377 CA GLY A 115 10.711 7.069 6.153 1.00 0.00 C ATOM 378 C GLY A 115 11.751 7.910 5.440 1.00 0.00 C ATOM 379 O GLY A 115 12.878 8.054 5.916 1.00 0.00 O ATOM 0 H GLY A 115 9.360 8.619 5.750 1.00 0.00 H new ATOM 0 HA2 GLY A 115 10.987 6.965 7.202 1.00 0.00 H new ATOM 0 HA3 GLY A 115 10.701 6.066 5.726 1.00 0.00 H new ATOM 383 N GLY A 116 11.368 8.464 4.295 1.00 0.00 N ATOM 384 CA GLY A 116 12.278 9.289 3.522 1.00 0.00 C ATOM 385 C GLY A 116 11.565 10.046 2.417 1.00 0.00 C ATOM 386 O GLY A 116 10.547 10.694 2.659 1.00 0.00 O ATOM 0 H GLY A 116 10.439 8.356 3.887 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.775 9.998 4.184 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.055 8.661 3.087 1.00 0.00 H new ATOM 390 N ASP A 117 12.097 9.962 1.201 1.00 0.00 N ATOM 391 CA ASP A 117 11.503 10.639 0.056 1.00 0.00 C ATOM 392 C ASP A 117 12.206 10.215 -1.223 1.00 0.00 C ATOM 393 O ASP A 117 13.428 10.318 -1.329 1.00 0.00 O ATOM 394 CB ASP A 117 11.594 12.160 0.229 1.00 0.00 C ATOM 395 CG ASP A 117 10.926 12.917 -0.903 1.00 0.00 C ATOM 396 OD1 ASP A 117 11.369 12.771 -2.061 1.00 0.00 O ATOM 397 OD2 ASP A 117 9.957 13.658 -0.630 1.00 0.00 O ATOM 0 H ASP A 117 12.940 9.430 0.984 1.00 0.00 H new ATOM 0 HA ASP A 117 10.452 10.358 -0.009 1.00 0.00 H new ATOM 0 HB2 ASP A 117 11.130 12.443 1.174 1.00 0.00 H new ATOM 0 HB3 ASP A 117 12.642 12.453 0.288 1.00 0.00 H new ATOM 402 N LEU A 118 11.429 9.733 -2.189 1.00 0.00 N ATOM 403 CA LEU A 118 11.977 9.279 -3.464 1.00 0.00 C ATOM 404 C LEU A 118 13.060 10.230 -3.970 1.00 0.00 C ATOM 405 O LEU A 118 12.920 11.448 -3.872 1.00 0.00 O ATOM 406 CB LEU A 118 10.870 9.143 -4.517 1.00 0.00 C ATOM 407 CG LEU A 118 9.877 7.996 -4.291 1.00 0.00 C ATOM 408 CD1 LEU A 118 9.047 8.230 -3.036 1.00 0.00 C ATOM 409 CD2 LEU A 118 8.968 7.840 -5.499 1.00 0.00 C ATOM 0 H LEU A 118 10.416 9.647 -2.113 1.00 0.00 H new ATOM 0 HA LEU A 118 12.427 8.300 -3.297 1.00 0.00 H new ATOM 0 HB2 LEU A 118 10.313 10.079 -4.556 1.00 0.00 H new ATOM 0 HB3 LEU A 118 11.336 9.009 -5.493 1.00 0.00 H new ATOM 0 HG LEU A 118 10.447 7.077 -4.155 1.00 0.00 H new ATOM 0 HD11 LEU A 118 8.352 7.402 -2.900 1.00 0.00 H new ATOM 0 HD12 LEU A 118 9.706 8.296 -2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 118 8.488 9.160 -3.138 1.00 0.00 H new ATOM 0 HD21 LEU A 118 8.268 7.022 -5.325 1.00 0.00 H new ATOM 0 HD22 LEU A 118 8.413 8.765 -5.659 1.00 0.00 H new ATOM 0 HD23 LEU A 118 9.570 7.621 -6.381 1.00 0.00 H new ATOM 421 N PRO A 119 14.164 9.682 -4.513 1.00 0.00 N ATOM 422 CA PRO A 119 14.369 8.238 -4.648 1.00 0.00 C ATOM 423 C PRO A 119 14.989 7.591 -3.406 1.00 0.00 C ATOM 424 O PRO A 119 15.858 6.726 -3.523 1.00 0.00 O ATOM 425 CB PRO A 119 15.336 8.161 -5.825 1.00 0.00 C ATOM 426 CG PRO A 119 16.174 9.390 -5.700 1.00 0.00 C ATOM 427 CD PRO A 119 15.305 10.443 -5.052 1.00 0.00 C ATOM 0 HA PRO A 119 13.430 7.702 -4.785 1.00 0.00 H new ATOM 0 HB2 PRO A 119 15.946 7.258 -5.780 1.00 0.00 H new ATOM 0 HB3 PRO A 119 14.803 8.139 -6.776 1.00 0.00 H new ATOM 0 HG2 PRO A 119 17.060 9.194 -5.097 1.00 0.00 H new ATOM 0 HG3 PRO A 119 16.521 9.723 -6.678 1.00 0.00 H new ATOM 0 HD2 PRO A 119 15.840 10.972 -4.263 1.00 0.00 H new ATOM 0 HD3 PRO A 119 14.980 11.192 -5.774 1.00 0.00 H new ATOM 435 N ALA A 120 14.539 7.999 -2.221 1.00 0.00 N ATOM 436 CA ALA A 120 15.059 7.437 -0.976 1.00 0.00 C ATOM 437 C ALA A 120 14.213 6.258 -0.512 1.00 0.00 C ATOM 438 O ALA A 120 12.989 6.353 -0.432 1.00 0.00 O ATOM 439 CB ALA A 120 15.121 8.503 0.107 1.00 0.00 C ATOM 0 H ALA A 120 13.820 8.712 -2.097 1.00 0.00 H new ATOM 0 HA ALA A 120 16.069 7.075 -1.167 1.00 0.00 H new ATOM 0 HB1 ALA A 120 15.511 8.066 1.026 1.00 0.00 H new ATOM 0 HB2 ALA A 120 15.776 9.312 -0.216 1.00 0.00 H new ATOM 0 HB3 ALA A 120 14.121 8.896 0.288 1.00 0.00 H new ATOM 445 N LEU A 121 14.876 5.147 -0.205 1.00 0.00 N ATOM 446 CA LEU A 121 14.190 3.943 0.255 1.00 0.00 C ATOM 447 C LEU A 121 14.861 3.389 1.509 1.00 0.00 C ATOM 448 O LEU A 121 15.195 2.205 1.575 1.00 0.00 O ATOM 449 CB LEU A 121 14.172 2.870 -0.844 1.00 0.00 C ATOM 450 CG LEU A 121 13.212 3.126 -2.015 1.00 0.00 C ATOM 451 CD1 LEU A 121 11.785 3.289 -1.513 1.00 0.00 C ATOM 452 CD2 LEU A 121 13.640 4.341 -2.821 1.00 0.00 C ATOM 0 H LEU A 121 15.890 5.055 -0.267 1.00 0.00 H new ATOM 0 HA LEU A 121 13.162 4.214 0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 121 15.181 2.769 -1.242 1.00 0.00 H new ATOM 0 HB3 LEU A 121 13.912 1.915 -0.388 1.00 0.00 H new ATOM 0 HG LEU A 121 13.248 2.258 -2.674 1.00 0.00 H new ATOM 0 HD11 LEU A 121 11.120 3.470 -2.358 1.00 0.00 H new ATOM 0 HD12 LEU A 121 11.475 2.381 -0.995 1.00 0.00 H new ATOM 0 HD13 LEU A 121 11.735 4.133 -0.825 1.00 0.00 H new ATOM 0 HD21 LEU A 121 12.941 4.497 -3.643 1.00 0.00 H new ATOM 0 HD22 LEU A 121 13.646 5.221 -2.178 1.00 0.00 H new ATOM 0 HD23 LEU A 121 14.641 4.178 -3.221 1.00 0.00 H new ATOM 464 N ASP A 122 15.058 4.257 2.497 1.00 0.00 N ATOM 465 CA ASP A 122 15.691 3.868 3.755 1.00 0.00 C ATOM 466 C ASP A 122 14.720 3.079 4.634 1.00 0.00 C ATOM 467 O ASP A 122 14.407 3.486 5.754 1.00 0.00 O ATOM 468 CB ASP A 122 16.191 5.111 4.497 1.00 0.00 C ATOM 469 CG ASP A 122 17.107 4.774 5.660 1.00 0.00 C ATOM 470 OD1 ASP A 122 16.655 4.085 6.597 1.00 0.00 O ATOM 471 OD2 ASP A 122 18.281 5.201 5.632 1.00 0.00 O ATOM 0 H ASP A 122 14.787 5.239 2.451 1.00 0.00 H new ATOM 0 HA ASP A 122 16.541 3.224 3.528 1.00 0.00 H new ATOM 0 HB2 ASP A 122 16.722 5.757 3.798 1.00 0.00 H new ATOM 0 HB3 ASP A 122 15.336 5.677 4.866 1.00 0.00 H new ATOM 476 N GLY A 123 14.240 1.950 4.118 1.00 0.00 N ATOM 477 CA GLY A 123 13.309 1.126 4.867 1.00 0.00 C ATOM 478 C GLY A 123 12.023 1.857 5.201 1.00 0.00 C ATOM 479 O GLY A 123 11.511 1.748 6.315 1.00 0.00 O ATOM 0 H GLY A 123 14.480 1.592 3.194 1.00 0.00 H new ATOM 0 HA2 GLY A 123 13.075 0.232 4.289 1.00 0.00 H new ATOM 0 HA3 GLY A 123 13.784 0.794 5.790 1.00 0.00 H new ATOM 483 N ALA A 124 11.501 2.602 4.233 1.00 0.00 N ATOM 484 CA ALA A 124 10.267 3.354 4.425 1.00 0.00 C ATOM 485 C ALA A 124 9.076 2.420 4.612 1.00 0.00 C ATOM 486 O ALA A 124 8.980 1.383 3.954 1.00 0.00 O ATOM 487 CB ALA A 124 10.030 4.289 3.248 1.00 0.00 C ATOM 0 H ALA A 124 11.914 2.701 3.306 1.00 0.00 H new ATOM 0 HA ALA A 124 10.372 3.950 5.332 1.00 0.00 H new ATOM 0 HB1 ALA A 124 9.105 4.844 3.405 1.00 0.00 H new ATOM 0 HB2 ALA A 124 10.863 4.987 3.165 1.00 0.00 H new ATOM 0 HB3 ALA A 124 9.952 3.706 2.330 1.00 0.00 H new ATOM 493 N ARG A 125 8.170 2.796 5.509 1.00 0.00 N ATOM 494 CA ARG A 125 6.982 1.993 5.779 1.00 0.00 C ATOM 495 C ARG A 125 5.743 2.651 5.193 1.00 0.00 C ATOM 496 O ARG A 125 5.501 3.842 5.388 1.00 0.00 O ATOM 497 CB ARG A 125 6.808 1.782 7.285 1.00 0.00 C ATOM 498 CG ARG A 125 5.556 1.000 7.651 1.00 0.00 C ATOM 499 CD ARG A 125 5.474 0.744 9.147 1.00 0.00 C ATOM 500 NE ARG A 125 4.251 0.035 9.515 1.00 0.00 N ATOM 501 CZ ARG A 125 3.974 -0.364 10.753 1.00 0.00 C ATOM 502 NH1 ARG A 125 4.842 -0.149 11.734 1.00 0.00 N ATOM 503 NH2 ARG A 125 2.831 -0.984 11.012 1.00 0.00 N ATOM 0 H ARG A 125 8.235 3.651 6.061 1.00 0.00 H new ATOM 0 HA ARG A 125 7.114 1.021 5.304 1.00 0.00 H new ATOM 0 HB2 ARG A 125 7.681 1.256 7.673 1.00 0.00 H new ATOM 0 HB3 ARG A 125 6.776 2.754 7.778 1.00 0.00 H new ATOM 0 HG2 ARG A 125 4.674 1.552 7.327 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.551 0.049 7.118 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.340 0.162 9.463 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.517 1.694 9.680 1.00 0.00 H new ATOM 0 HE ARG A 125 3.571 -0.165 8.781 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.725 0.324 11.539 1.00 0.00 H new ATOM 0 HH12 ARG A 125 4.626 -0.456 12.682 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.162 -1.156 10.261 1.00 0.00 H new ATOM 0 HH22 ARG A 125 2.620 -1.289 11.962 1.00 0.00 H new ATOM 517 N VAL A 126 4.971 1.861 4.460 1.00 0.00 N ATOM 518 CA VAL A 126 3.765 2.341 3.818 1.00 0.00 C ATOM 519 C VAL A 126 2.517 1.682 4.402 1.00 0.00 C ATOM 520 O VAL A 126 2.471 0.464 4.583 1.00 0.00 O ATOM 521 CB VAL A 126 3.830 2.076 2.303 1.00 0.00 C ATOM 522 CG1 VAL A 126 2.445 1.890 1.725 1.00 0.00 C ATOM 523 CG2 VAL A 126 4.586 3.189 1.595 1.00 0.00 C ATOM 0 H VAL A 126 5.166 0.873 4.297 1.00 0.00 H new ATOM 0 HA VAL A 126 3.699 3.414 4.000 1.00 0.00 H new ATOM 0 HB VAL A 126 4.378 1.148 2.141 1.00 0.00 H new ATOM 0 HG11 VAL A 126 2.520 1.704 0.654 1.00 0.00 H new ATOM 0 HG12 VAL A 126 1.960 1.041 2.207 1.00 0.00 H new ATOM 0 HG13 VAL A 126 1.855 2.790 1.897 1.00 0.00 H new ATOM 0 HG21 VAL A 126 4.620 2.982 0.525 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.079 4.139 1.765 1.00 0.00 H new ATOM 0 HG23 VAL A 126 5.602 3.245 1.986 1.00 0.00 H new ATOM 533 N GLU A 127 1.504 2.497 4.680 1.00 0.00 N ATOM 534 CA GLU A 127 0.246 2.001 5.227 1.00 0.00 C ATOM 535 C GLU A 127 -0.901 2.297 4.268 1.00 0.00 C ATOM 536 O GLU A 127 -1.123 3.445 3.886 1.00 0.00 O ATOM 537 CB GLU A 127 -0.029 2.634 6.591 1.00 0.00 C ATOM 538 CG GLU A 127 0.992 2.262 7.653 1.00 0.00 C ATOM 539 CD GLU A 127 0.978 0.782 7.991 1.00 0.00 C ATOM 540 OE1 GLU A 127 1.246 -0.039 7.088 1.00 0.00 O ATOM 541 OE2 GLU A 127 0.698 0.445 9.160 1.00 0.00 O ATOM 0 H GLU A 127 1.530 3.506 4.535 1.00 0.00 H new ATOM 0 HA GLU A 127 0.326 0.921 5.354 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -0.048 3.718 6.481 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -1.020 2.331 6.930 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.987 2.541 7.307 1.00 0.00 H new ATOM 0 HG3 GLU A 127 0.795 2.838 8.557 1.00 0.00 H new ATOM 548 N PHE A 128 -1.618 1.252 3.874 1.00 0.00 N ATOM 549 CA PHE A 128 -2.734 1.396 2.947 1.00 0.00 C ATOM 550 C PHE A 128 -4.014 1.819 3.658 1.00 0.00 C ATOM 551 O PHE A 128 -4.226 1.506 4.830 1.00 0.00 O ATOM 552 CB PHE A 128 -2.970 0.094 2.179 1.00 0.00 C ATOM 553 CG PHE A 128 -1.820 -0.295 1.294 1.00 0.00 C ATOM 554 CD1 PHE A 128 -0.618 -0.715 1.840 1.00 0.00 C ATOM 555 CD2 PHE A 128 -1.947 -0.247 -0.084 1.00 0.00 C ATOM 556 CE1 PHE A 128 0.439 -1.077 1.025 1.00 0.00 C ATOM 557 CE2 PHE A 128 -0.894 -0.607 -0.903 1.00 0.00 C ATOM 558 CZ PHE A 128 0.300 -1.022 -0.348 1.00 0.00 C ATOM 0 H PHE A 128 -1.447 0.295 4.182 1.00 0.00 H new ATOM 0 HA PHE A 128 -2.466 2.184 2.243 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -3.159 -0.710 2.891 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -3.868 0.198 1.570 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -0.505 -0.760 2.913 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -2.879 0.075 -0.523 1.00 0.00 H new ATOM 0 HE1 PHE A 128 1.372 -1.402 1.462 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -1.005 -0.564 -1.976 1.00 0.00 H new ATOM 0 HZ PHE A 128 1.124 -1.303 -0.987 1.00 0.00 H new ATOM 568 N ARG A 129 -4.865 2.529 2.926 1.00 0.00 N ATOM 569 CA ARG A 129 -6.138 3.005 3.451 1.00 0.00 C ATOM 570 C ARG A 129 -7.132 3.178 2.307 1.00 0.00 C ATOM 571 O ARG A 129 -6.867 3.910 1.354 1.00 0.00 O ATOM 572 CB ARG A 129 -5.939 4.333 4.186 1.00 0.00 C ATOM 573 CG ARG A 129 -7.207 4.885 4.818 1.00 0.00 C ATOM 574 CD ARG A 129 -7.740 3.962 5.901 1.00 0.00 C ATOM 575 NE ARG A 129 -6.754 3.720 6.952 1.00 0.00 N ATOM 576 CZ ARG A 129 -6.272 4.671 7.749 1.00 0.00 C ATOM 577 NH1 ARG A 129 -6.694 5.923 7.628 1.00 0.00 N ATOM 578 NH2 ARG A 129 -5.369 4.368 8.672 1.00 0.00 N ATOM 0 H ARG A 129 -4.692 2.790 1.955 1.00 0.00 H new ATOM 0 HA ARG A 129 -6.532 2.273 4.156 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -5.187 4.197 4.963 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -5.544 5.069 3.485 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -7.004 5.867 5.244 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -7.967 5.022 4.049 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -8.637 4.399 6.340 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -8.034 3.012 5.455 1.00 0.00 H new ATOM 0 HE ARG A 129 -6.415 2.767 7.083 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -7.391 6.160 6.922 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -6.322 6.648 8.241 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -5.044 3.406 8.771 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -5.000 5.097 9.283 1.00 0.00 H new ATOM 592 N CYS A 130 -8.263 2.486 2.391 1.00 0.00 N ATOM 593 CA CYS A 130 -9.274 2.557 1.340 1.00 0.00 C ATOM 594 C CYS A 130 -10.442 3.453 1.739 1.00 0.00 C ATOM 595 O CYS A 130 -10.838 3.499 2.905 1.00 0.00 O ATOM 596 CB CYS A 130 -9.780 1.154 0.997 1.00 0.00 C ATOM 597 SG CYS A 130 -10.668 1.063 -0.591 1.00 0.00 S ATOM 0 H CYS A 130 -8.503 1.873 3.170 1.00 0.00 H new ATOM 0 HA CYS A 130 -8.804 2.996 0.460 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -8.933 0.469 0.969 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -10.441 0.811 1.793 1.00 0.00 H new ATOM 602 N ASP A 131 -10.991 4.163 0.755 1.00 0.00 N ATOM 603 CA ASP A 131 -12.119 5.064 0.979 1.00 0.00 C ATOM 604 C ASP A 131 -13.301 4.329 1.611 1.00 0.00 C ATOM 605 O ASP A 131 -13.412 3.108 1.500 1.00 0.00 O ATOM 606 CB ASP A 131 -12.559 5.701 -0.341 1.00 0.00 C ATOM 607 CG ASP A 131 -11.488 6.586 -0.947 1.00 0.00 C ATOM 608 OD1 ASP A 131 -11.040 7.530 -0.261 1.00 0.00 O ATOM 609 OD2 ASP A 131 -11.101 6.340 -2.108 1.00 0.00 O ATOM 0 H ASP A 131 -10.669 4.131 -0.212 1.00 0.00 H new ATOM 0 HA ASP A 131 -11.789 5.842 1.667 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -12.820 4.915 -1.050 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -13.460 6.291 -0.173 1.00 0.00 H new ATOM 614 N PRO A 132 -14.204 5.070 2.283 1.00 0.00 N ATOM 615 CA PRO A 132 -15.386 4.488 2.929 1.00 0.00 C ATOM 616 C PRO A 132 -16.149 3.548 2.000 1.00 0.00 C ATOM 617 O PRO A 132 -15.947 3.569 0.786 1.00 0.00 O ATOM 618 CB PRO A 132 -16.239 5.710 3.273 1.00 0.00 C ATOM 619 CG PRO A 132 -15.258 6.817 3.437 1.00 0.00 C ATOM 620 CD PRO A 132 -14.148 6.537 2.459 1.00 0.00 C ATOM 0 HA PRO A 132 -15.121 3.880 3.794 1.00 0.00 H new ATOM 0 HB2 PRO A 132 -16.956 5.929 2.481 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -16.812 5.549 4.186 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -15.722 7.782 3.235 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -14.878 6.854 4.458 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -14.303 7.061 1.516 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -13.181 6.858 2.847 1.00 0.00 H new ATOM 628 N ASP A 133 -17.013 2.718 2.587 1.00 0.00 N ATOM 629 CA ASP A 133 -17.807 1.750 1.828 1.00 0.00 C ATOM 630 C ASP A 133 -16.954 0.553 1.414 1.00 0.00 C ATOM 631 O ASP A 133 -17.448 -0.571 1.327 1.00 0.00 O ATOM 632 CB ASP A 133 -18.442 2.401 0.594 1.00 0.00 C ATOM 633 CG ASP A 133 -19.358 3.553 0.955 1.00 0.00 C ATOM 634 OD1 ASP A 133 -20.342 3.322 1.690 1.00 0.00 O ATOM 635 OD2 ASP A 133 -19.093 4.687 0.503 1.00 0.00 O ATOM 0 H ASP A 133 -17.181 2.697 3.593 1.00 0.00 H new ATOM 0 HA ASP A 133 -18.608 1.398 2.478 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -17.655 2.760 -0.069 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -19.007 1.651 0.041 1.00 0.00 H new ATOM 640 N PHE A 134 -15.673 0.800 1.163 1.00 0.00 N ATOM 641 CA PHE A 134 -14.754 -0.261 0.765 1.00 0.00 C ATOM 642 C PHE A 134 -13.782 -0.575 1.898 1.00 0.00 C ATOM 643 O PHE A 134 -13.211 0.333 2.505 1.00 0.00 O ATOM 644 CB PHE A 134 -13.962 0.149 -0.481 1.00 0.00 C ATOM 645 CG PHE A 134 -14.803 0.406 -1.699 1.00 0.00 C ATOM 646 CD1 PHE A 134 -15.812 1.357 -1.684 1.00 0.00 C ATOM 647 CD2 PHE A 134 -14.579 -0.306 -2.867 1.00 0.00 C ATOM 648 CE1 PHE A 134 -16.580 1.592 -2.809 1.00 0.00 C ATOM 649 CE2 PHE A 134 -15.343 -0.076 -3.994 1.00 0.00 C ATOM 650 CZ PHE A 134 -16.344 0.874 -3.965 1.00 0.00 C ATOM 0 H PHE A 134 -15.247 1.725 1.228 1.00 0.00 H new ATOM 0 HA PHE A 134 -15.344 -1.149 0.537 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -13.391 1.049 -0.253 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -13.241 -0.635 -0.712 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -16.000 1.921 -0.782 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -13.797 -1.050 -2.896 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -17.363 2.335 -2.784 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -15.158 -0.639 -4.897 1.00 0.00 H new ATOM 0 HZ PHE A 134 -16.942 1.056 -4.846 1.00 0.00 H new ATOM 660 N HIS A 135 -13.591 -1.860 2.179 1.00 0.00 N ATOM 661 CA HIS A 135 -12.680 -2.276 3.239 1.00 0.00 C ATOM 662 C HIS A 135 -11.466 -3.008 2.671 1.00 0.00 C ATOM 663 O HIS A 135 -11.591 -3.839 1.769 1.00 0.00 O ATOM 664 CB HIS A 135 -13.402 -3.157 4.261 1.00 0.00 C ATOM 665 CG HIS A 135 -14.080 -4.353 3.667 1.00 0.00 C ATOM 666 ND1 HIS A 135 -15.111 -4.258 2.757 1.00 0.00 N ATOM 667 CD2 HIS A 135 -13.875 -5.677 3.866 1.00 0.00 C ATOM 668 CE1 HIS A 135 -15.513 -5.473 2.423 1.00 0.00 C ATOM 669 NE2 HIS A 135 -14.778 -6.349 3.081 1.00 0.00 N ATOM 0 H HIS A 135 -14.052 -2.627 1.690 1.00 0.00 H new ATOM 0 HA HIS A 135 -12.327 -1.376 3.743 1.00 0.00 H new ATOM 0 HB2 HIS A 135 -12.682 -3.494 5.007 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -14.145 -2.554 4.784 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -13.139 -6.121 4.520 1.00 0.00 H new ATOM 0 HE1 HIS A 135 -16.307 -5.708 1.730 1.00 0.00 H new ATOM 0 HE2 HIS A 135 -14.867 -7.363 3.017 1.00 0.00 H new ATOM 678 N LEU A 136 -10.293 -2.682 3.210 1.00 0.00 N ATOM 679 CA LEU A 136 -9.039 -3.291 2.777 1.00 0.00 C ATOM 680 C LEU A 136 -8.999 -4.765 3.178 1.00 0.00 C ATOM 681 O LEU A 136 -9.387 -5.118 4.292 1.00 0.00 O ATOM 682 CB LEU A 136 -7.862 -2.540 3.400 1.00 0.00 C ATOM 683 CG LEU A 136 -6.500 -2.812 2.764 1.00 0.00 C ATOM 684 CD1 LEU A 136 -6.507 -2.401 1.300 1.00 0.00 C ATOM 685 CD2 LEU A 136 -5.411 -2.067 3.518 1.00 0.00 C ATOM 0 H LEU A 136 -10.186 -1.993 3.954 1.00 0.00 H new ATOM 0 HA LEU A 136 -8.968 -3.228 1.691 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -8.064 -1.470 3.342 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -7.808 -2.797 4.458 1.00 0.00 H new ATOM 0 HG LEU A 136 -6.295 -3.881 2.821 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -5.529 -2.601 0.861 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -7.268 -2.970 0.766 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -6.729 -1.337 1.222 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -4.445 -2.269 3.055 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.613 -0.996 3.485 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -5.393 -2.401 4.555 1.00 0.00 H new ATOM 697 N VAL A 137 -8.559 -5.628 2.264 1.00 0.00 N ATOM 698 CA VAL A 137 -8.514 -7.060 2.544 1.00 0.00 C ATOM 699 C VAL A 137 -7.217 -7.724 2.060 1.00 0.00 C ATOM 700 O VAL A 137 -7.252 -8.643 1.239 1.00 0.00 O ATOM 701 CB VAL A 137 -9.728 -7.769 1.905 1.00 0.00 C ATOM 702 CG1 VAL A 137 -9.689 -7.660 0.388 1.00 0.00 C ATOM 703 CG2 VAL A 137 -9.804 -9.225 2.345 1.00 0.00 C ATOM 0 H VAL A 137 -8.232 -5.364 1.334 1.00 0.00 H new ATOM 0 HA VAL A 137 -8.547 -7.165 3.628 1.00 0.00 H new ATOM 0 HB VAL A 137 -10.630 -7.266 2.253 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -10.555 -8.168 -0.036 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -9.707 -6.609 0.098 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -8.777 -8.125 0.013 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -10.668 -9.701 1.881 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -8.896 -9.745 2.040 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -9.903 -9.273 3.429 1.00 0.00 H new ATOM 713 N GLY A 138 -6.067 -7.282 2.567 1.00 0.00 N ATOM 714 CA GLY A 138 -4.822 -7.897 2.140 1.00 0.00 C ATOM 715 C GLY A 138 -3.588 -7.181 2.640 1.00 0.00 C ATOM 716 O GLY A 138 -3.406 -7.017 3.844 1.00 0.00 O ATOM 0 H GLY A 138 -5.975 -6.529 3.248 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -4.799 -8.929 2.489 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -4.797 -7.928 1.051 1.00 0.00 H new ATOM 720 N SER A 139 -2.732 -6.777 1.701 1.00 0.00 N ATOM 721 CA SER A 139 -1.486 -6.083 2.019 1.00 0.00 C ATOM 722 C SER A 139 -1.749 -4.722 2.651 1.00 0.00 C ATOM 723 O SER A 139 -1.432 -3.684 2.070 1.00 0.00 O ATOM 724 CB SER A 139 -0.642 -5.907 0.758 1.00 0.00 C ATOM 725 OG SER A 139 0.534 -5.166 1.030 1.00 0.00 O ATOM 0 H SER A 139 -2.883 -6.921 0.703 1.00 0.00 H new ATOM 0 HA SER A 139 -0.944 -6.695 2.740 1.00 0.00 H new ATOM 0 HB2 SER A 139 -0.375 -6.884 0.356 1.00 0.00 H new ATOM 0 HB3 SER A 139 -1.228 -5.397 -0.007 1.00 0.00 H new ATOM 0 HG SER A 139 1.135 -5.212 0.258 1.00 0.00 H new ATOM 731 N SER A 140 -2.321 -4.734 3.843 1.00 0.00 N ATOM 732 CA SER A 140 -2.620 -3.515 4.558 1.00 0.00 C ATOM 733 C SER A 140 -1.330 -2.805 4.954 1.00 0.00 C ATOM 734 O SER A 140 -1.340 -1.630 5.321 1.00 0.00 O ATOM 735 CB SER A 140 -3.466 -3.847 5.784 1.00 0.00 C ATOM 736 OG SER A 140 -2.745 -4.650 6.702 1.00 0.00 O ATOM 0 H SER A 140 -2.588 -5.586 4.336 1.00 0.00 H new ATOM 0 HA SER A 140 -3.185 -2.840 3.915 1.00 0.00 H new ATOM 0 HB2 SER A 140 -3.781 -2.925 6.273 1.00 0.00 H new ATOM 0 HB3 SER A 140 -4.372 -4.368 5.474 1.00 0.00 H new ATOM 0 HG SER A 140 -3.310 -4.846 7.479 1.00 0.00 H new ATOM 742 N ARG A 141 -0.217 -3.533 4.869 1.00 0.00 N ATOM 743 CA ARG A 141 1.091 -2.983 5.208 1.00 0.00 C ATOM 744 C ARG A 141 2.161 -3.477 4.235 1.00 0.00 C ATOM 745 O ARG A 141 2.187 -4.649 3.861 1.00 0.00 O ATOM 746 CB ARG A 141 1.479 -3.350 6.646 1.00 0.00 C ATOM 747 CG ARG A 141 1.690 -4.841 6.878 1.00 0.00 C ATOM 748 CD ARG A 141 0.392 -5.626 6.754 1.00 0.00 C ATOM 749 NE ARG A 141 0.586 -7.051 7.015 1.00 0.00 N ATOM 750 CZ ARG A 141 0.969 -7.541 8.191 1.00 0.00 C ATOM 751 NH1 ARG A 141 1.180 -6.728 9.218 1.00 0.00 N ATOM 752 NH2 ARG A 141 1.137 -8.847 8.342 1.00 0.00 N ATOM 0 H ARG A 141 -0.197 -4.507 4.567 1.00 0.00 H new ATOM 0 HA ARG A 141 1.026 -1.898 5.129 1.00 0.00 H new ATOM 0 HB2 ARG A 141 2.395 -2.820 6.909 1.00 0.00 H new ATOM 0 HB3 ARG A 141 0.700 -2.996 7.322 1.00 0.00 H new ATOM 0 HG2 ARG A 141 2.414 -5.221 6.157 1.00 0.00 H new ATOM 0 HG3 ARG A 141 2.115 -4.997 7.870 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -0.342 -5.226 7.454 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -0.017 -5.493 5.753 1.00 0.00 H new ATOM 0 HE ARG A 141 0.418 -7.707 6.252 1.00 0.00 H new ATOM 0 HH11 ARG A 141 1.049 -5.723 9.108 1.00 0.00 H new ATOM 0 HH12 ARG A 141 1.474 -7.108 10.118 1.00 0.00 H new ATOM 0 HH21 ARG A 141 0.973 -9.477 7.556 1.00 0.00 H new ATOM 0 HH22 ARG A 141 1.431 -9.223 9.244 1.00 0.00 H new ATOM 766 N SER A 142 3.044 -2.567 3.831 1.00 0.00 N ATOM 767 CA SER A 142 4.128 -2.886 2.904 1.00 0.00 C ATOM 768 C SER A 142 5.394 -2.138 3.313 1.00 0.00 C ATOM 769 O SER A 142 5.326 -0.982 3.731 1.00 0.00 O ATOM 770 CB SER A 142 3.734 -2.498 1.477 1.00 0.00 C ATOM 771 OG SER A 142 3.490 -1.106 1.375 1.00 0.00 O ATOM 0 H SER A 142 3.029 -1.593 4.134 1.00 0.00 H new ATOM 0 HA SER A 142 4.317 -3.959 2.938 1.00 0.00 H new ATOM 0 HB2 SER A 142 4.529 -2.782 0.787 1.00 0.00 H new ATOM 0 HB3 SER A 142 2.842 -3.049 1.180 1.00 0.00 H new ATOM 0 HG SER A 142 2.697 -0.953 0.820 1.00 0.00 H new ATOM 777 N VAL A 143 6.545 -2.794 3.207 1.00 0.00 N ATOM 778 CA VAL A 143 7.807 -2.165 3.586 1.00 0.00 C ATOM 779 C VAL A 143 8.899 -2.406 2.549 1.00 0.00 C ATOM 780 O VAL A 143 9.107 -3.532 2.095 1.00 0.00 O ATOM 781 CB VAL A 143 8.294 -2.673 4.959 1.00 0.00 C ATOM 782 CG1 VAL A 143 8.455 -4.185 4.948 1.00 0.00 C ATOM 783 CG2 VAL A 143 9.599 -1.994 5.350 1.00 0.00 C ATOM 0 H VAL A 143 6.631 -3.751 2.866 1.00 0.00 H new ATOM 0 HA VAL A 143 7.612 -1.094 3.644 1.00 0.00 H new ATOM 0 HB VAL A 143 7.540 -2.418 5.704 1.00 0.00 H new ATOM 0 HG11 VAL A 143 8.799 -4.521 5.926 1.00 0.00 H new ATOM 0 HG12 VAL A 143 7.496 -4.651 4.720 1.00 0.00 H new ATOM 0 HG13 VAL A 143 9.185 -4.468 4.190 1.00 0.00 H new ATOM 0 HG21 VAL A 143 9.926 -2.366 6.321 1.00 0.00 H new ATOM 0 HG22 VAL A 143 10.361 -2.213 4.602 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.446 -0.916 5.407 1.00 0.00 H new ATOM 793 N CYS A 144 9.598 -1.334 2.186 1.00 0.00 N ATOM 794 CA CYS A 144 10.681 -1.410 1.211 1.00 0.00 C ATOM 795 C CYS A 144 11.956 -1.943 1.857 1.00 0.00 C ATOM 796 O CYS A 144 12.190 -1.739 3.049 1.00 0.00 O ATOM 797 CB CYS A 144 10.941 -0.034 0.597 1.00 0.00 C ATOM 798 SG CYS A 144 12.320 0.000 -0.594 1.00 0.00 S ATOM 0 H CYS A 144 9.432 -0.398 2.555 1.00 0.00 H new ATOM 0 HA CYS A 144 10.380 -2.099 0.422 1.00 0.00 H new ATOM 0 HB2 CYS A 144 10.034 0.306 0.097 1.00 0.00 H new ATOM 0 HB3 CYS A 144 11.149 0.676 1.398 1.00 0.00 H new ATOM 803 N SER A 145 12.778 -2.626 1.067 1.00 0.00 N ATOM 804 CA SER A 145 14.028 -3.187 1.567 1.00 0.00 C ATOM 805 C SER A 145 15.096 -3.193 0.470 1.00 0.00 C ATOM 806 O SER A 145 15.325 -2.174 -0.183 1.00 0.00 O ATOM 807 CB SER A 145 13.793 -4.605 2.098 1.00 0.00 C ATOM 808 OG SER A 145 14.970 -5.133 2.688 1.00 0.00 O ATOM 0 H SER A 145 12.601 -2.804 0.078 1.00 0.00 H new ATOM 0 HA SER A 145 14.387 -2.562 2.385 1.00 0.00 H new ATOM 0 HB2 SER A 145 12.989 -4.592 2.833 1.00 0.00 H new ATOM 0 HB3 SER A 145 13.470 -5.252 1.283 1.00 0.00 H new ATOM 0 HG SER A 145 14.792 -6.038 3.020 1.00 0.00 H new ATOM 814 N GLN A 146 15.753 -4.334 0.273 1.00 0.00 N ATOM 815 CA GLN A 146 16.797 -4.450 -0.741 1.00 0.00 C ATOM 816 C GLN A 146 16.257 -4.118 -2.130 1.00 0.00 C ATOM 817 O GLN A 146 16.910 -3.422 -2.907 1.00 0.00 O ATOM 818 CB GLN A 146 17.394 -5.860 -0.733 1.00 0.00 C ATOM 819 CG GLN A 146 16.369 -6.961 -0.955 1.00 0.00 C ATOM 820 CD GLN A 146 16.978 -8.354 -0.930 1.00 0.00 C ATOM 821 OE1 GLN A 146 18.292 -8.432 -0.741 1.00 0.00 O flip ATOM 822 NE2 GLN A 146 16.273 -9.350 -1.083 1.00 0.00 N flip ATOM 0 H GLN A 146 15.581 -5.189 0.801 1.00 0.00 H new ATOM 0 HA GLN A 146 17.579 -3.731 -0.499 1.00 0.00 H new ATOM 0 HB2 GLN A 146 18.158 -5.926 -1.508 1.00 0.00 H new ATOM 0 HB3 GLN A 146 17.893 -6.028 0.221 1.00 0.00 H new ATOM 0 HG2 GLN A 146 15.599 -6.893 -0.186 1.00 0.00 H new ATOM 0 HG3 GLN A 146 15.876 -6.803 -1.914 1.00 0.00 H new ATOM 0 HE21 GLN A 146 15.268 -9.247 -1.225 1.00 0.00 H new ATOM 0 HE22 GLN A 146 16.693 -10.279 -1.068 1.00 0.00 H new ATOM 831 N GLY A 147 15.063 -4.618 -2.435 1.00 0.00 N ATOM 832 CA GLY A 147 14.464 -4.357 -3.731 1.00 0.00 C ATOM 833 C GLY A 147 13.149 -5.086 -3.924 1.00 0.00 C ATOM 834 O GLY A 147 12.927 -5.714 -4.960 1.00 0.00 O ATOM 0 H GLY A 147 14.502 -5.197 -1.810 1.00 0.00 H new ATOM 0 HA2 GLY A 147 14.300 -3.285 -3.842 1.00 0.00 H new ATOM 0 HA3 GLY A 147 15.159 -4.656 -4.515 1.00 0.00 H new ATOM 838 N GLN A 148 12.275 -5.001 -2.926 1.00 0.00 N ATOM 839 CA GLN A 148 10.973 -5.656 -2.988 1.00 0.00 C ATOM 840 C GLN A 148 10.117 -5.269 -1.786 1.00 0.00 C ATOM 841 O GLN A 148 10.623 -5.127 -0.673 1.00 0.00 O ATOM 842 CB GLN A 148 11.144 -7.177 -3.044 1.00 0.00 C ATOM 843 CG GLN A 148 9.833 -7.934 -3.189 1.00 0.00 C ATOM 844 CD GLN A 148 10.032 -9.435 -3.253 1.00 0.00 C ATOM 845 OE1 GLN A 148 10.574 -10.041 -2.329 1.00 0.00 O ATOM 846 NE2 GLN A 148 9.592 -10.044 -4.349 1.00 0.00 N ATOM 0 H GLN A 148 12.445 -4.484 -2.063 1.00 0.00 H new ATOM 0 HA GLN A 148 10.467 -5.324 -3.895 1.00 0.00 H new ATOM 0 HB2 GLN A 148 11.794 -7.430 -3.881 1.00 0.00 H new ATOM 0 HB3 GLN A 148 11.648 -7.511 -2.137 1.00 0.00 H new ATOM 0 HG2 GLN A 148 9.183 -7.693 -2.348 1.00 0.00 H new ATOM 0 HG3 GLN A 148 9.322 -7.600 -4.092 1.00 0.00 H new ATOM 0 HE21 GLN A 148 9.148 -9.502 -5.090 1.00 0.00 H new ATOM 0 HE22 GLN A 148 9.698 -11.054 -4.449 1.00 0.00 H new ATOM 855 N TRP A 149 8.820 -5.095 -2.019 1.00 0.00 N ATOM 856 CA TRP A 149 7.899 -4.720 -0.953 1.00 0.00 C ATOM 857 C TRP A 149 7.428 -5.946 -0.179 1.00 0.00 C ATOM 858 O TRP A 149 7.414 -7.059 -0.706 1.00 0.00 O ATOM 859 CB TRP A 149 6.699 -3.957 -1.520 1.00 0.00 C ATOM 860 CG TRP A 149 7.082 -2.675 -2.195 1.00 0.00 C ATOM 861 CD1 TRP A 149 7.675 -2.534 -3.418 1.00 0.00 C ATOM 862 CD2 TRP A 149 6.919 -1.351 -1.673 1.00 0.00 C ATOM 863 NE1 TRP A 149 7.876 -1.204 -3.693 1.00 0.00 N ATOM 864 CE2 TRP A 149 7.424 -0.458 -2.636 1.00 0.00 C ATOM 865 CE3 TRP A 149 6.390 -0.836 -0.486 1.00 0.00 C ATOM 866 CZ2 TRP A 149 7.415 0.922 -2.449 1.00 0.00 C ATOM 867 CZ3 TRP A 149 6.384 0.535 -0.301 1.00 0.00 C ATOM 868 CH2 TRP A 149 6.894 1.399 -1.278 1.00 0.00 C ATOM 0 H TRP A 149 8.384 -5.207 -2.934 1.00 0.00 H new ATOM 0 HA TRP A 149 8.434 -4.067 -0.264 1.00 0.00 H new ATOM 0 HB2 TRP A 149 6.175 -4.594 -2.233 1.00 0.00 H new ATOM 0 HB3 TRP A 149 5.999 -3.740 -0.713 1.00 0.00 H new ATOM 0 HD1 TRP A 149 7.946 -3.349 -4.072 1.00 0.00 H new ATOM 0 HE1 TRP A 149 8.294 -0.832 -4.546 1.00 0.00 H new ATOM 0 HE3 TRP A 149 5.994 -1.496 0.272 1.00 0.00 H new ATOM 0 HZ2 TRP A 149 7.805 1.591 -3.201 1.00 0.00 H new ATOM 0 HZ3 TRP A 149 5.979 0.946 0.612 1.00 0.00 H new ATOM 0 HH2 TRP A 149 6.875 2.465 -1.103 1.00 0.00 H new ATOM 879 N SER A 150 7.065 -5.732 1.083 1.00 0.00 N ATOM 880 CA SER A 150 6.613 -6.812 1.954 1.00 0.00 C ATOM 881 C SER A 150 5.565 -7.689 1.275 1.00 0.00 C ATOM 882 O SER A 150 5.752 -8.900 1.153 1.00 0.00 O ATOM 883 CB SER A 150 6.045 -6.240 3.254 1.00 0.00 C ATOM 884 OG SER A 150 5.621 -7.274 4.124 1.00 0.00 O ATOM 0 H SER A 150 7.076 -4.814 1.527 1.00 0.00 H new ATOM 0 HA SER A 150 7.479 -7.436 2.176 1.00 0.00 H new ATOM 0 HB2 SER A 150 6.802 -5.632 3.749 1.00 0.00 H new ATOM 0 HB3 SER A 150 5.205 -5.582 3.029 1.00 0.00 H new ATOM 0 HG SER A 150 5.264 -6.882 4.948 1.00 0.00 H new ATOM 890 N THR A 151 4.459 -7.087 0.840 1.00 0.00 N ATOM 891 CA THR A 151 3.400 -7.855 0.187 1.00 0.00 C ATOM 892 C THR A 151 2.661 -7.059 -0.888 1.00 0.00 C ATOM 893 O THR A 151 2.436 -5.856 -0.751 1.00 0.00 O ATOM 894 CB THR A 151 2.382 -8.396 1.208 1.00 0.00 C ATOM 895 OG1 THR A 151 1.172 -8.776 0.542 1.00 0.00 O ATOM 896 CG2 THR A 151 2.081 -7.363 2.284 1.00 0.00 C ATOM 0 H THR A 151 4.274 -6.088 0.925 1.00 0.00 H new ATOM 0 HA THR A 151 3.905 -8.689 -0.301 1.00 0.00 H new ATOM 0 HB THR A 151 2.818 -9.271 1.689 1.00 0.00 H new ATOM 0 HG1 THR A 151 0.531 -9.120 1.199 1.00 0.00 H new ATOM 0 HG21 THR A 151 1.359 -7.773 2.990 1.00 0.00 H new ATOM 0 HG22 THR A 151 3.000 -7.108 2.811 1.00 0.00 H new ATOM 0 HG23 THR A 151 1.667 -6.467 1.822 1.00 0.00 H new ATOM 904 N PRO A 152 2.273 -7.748 -1.981 1.00 0.00 N ATOM 905 CA PRO A 152 1.550 -7.140 -3.110 1.00 0.00 C ATOM 906 C PRO A 152 0.238 -6.486 -2.686 1.00 0.00 C ATOM 907 O PRO A 152 -0.482 -7.015 -1.841 1.00 0.00 O ATOM 908 CB PRO A 152 1.266 -8.323 -4.042 1.00 0.00 C ATOM 909 CG PRO A 152 2.251 -9.372 -3.660 1.00 0.00 C ATOM 910 CD PRO A 152 2.517 -9.185 -2.193 1.00 0.00 C ATOM 0 HA PRO A 152 2.134 -6.343 -3.570 1.00 0.00 H new ATOM 0 HB2 PRO A 152 0.244 -8.681 -3.922 1.00 0.00 H new ATOM 0 HB3 PRO A 152 1.382 -8.037 -5.087 1.00 0.00 H new ATOM 0 HG2 PRO A 152 1.856 -10.368 -3.860 1.00 0.00 H new ATOM 0 HG3 PRO A 152 3.170 -9.272 -4.238 1.00 0.00 H new ATOM 0 HD2 PRO A 152 1.854 -9.799 -1.583 1.00 0.00 H new ATOM 0 HD3 PRO A 152 3.538 -9.462 -1.932 1.00 0.00 H new ATOM 918 N LYS A 153 -0.064 -5.333 -3.283 1.00 0.00 N ATOM 919 CA LYS A 153 -1.289 -4.596 -2.974 1.00 0.00 C ATOM 920 C LYS A 153 -2.526 -5.492 -3.028 1.00 0.00 C ATOM 921 O LYS A 153 -2.675 -6.307 -3.939 1.00 0.00 O ATOM 922 CB LYS A 153 -1.473 -3.432 -3.948 1.00 0.00 C ATOM 923 CG LYS A 153 -0.438 -2.331 -3.799 1.00 0.00 C ATOM 924 CD LYS A 153 -0.725 -1.153 -4.722 1.00 0.00 C ATOM 925 CE LYS A 153 -2.022 -0.436 -4.359 1.00 0.00 C ATOM 926 NZ LYS A 153 -3.225 -1.278 -4.610 1.00 0.00 N ATOM 0 H LYS A 153 0.526 -4.888 -3.986 1.00 0.00 H new ATOM 0 HA LYS A 153 -1.183 -4.218 -1.957 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -1.436 -3.816 -4.968 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -2.466 -3.005 -3.804 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -0.421 -1.986 -2.765 1.00 0.00 H new ATOM 0 HG3 LYS A 153 0.552 -2.731 -4.018 1.00 0.00 H new ATOM 0 HD2 LYS A 153 0.104 -0.447 -4.674 1.00 0.00 H new ATOM 0 HD3 LYS A 153 -0.784 -1.507 -5.751 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -1.994 -0.151 -3.307 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -2.099 0.485 -4.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -3.876 -0.773 -5.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -2.936 -2.174 -5.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -3.705 -1.475 -3.709 1.00 0.00 H new ATOM 940 N PRO A 154 -3.437 -5.339 -2.049 1.00 0.00 N ATOM 941 CA PRO A 154 -4.673 -6.119 -1.982 1.00 0.00 C ATOM 942 C PRO A 154 -5.772 -5.532 -2.863 1.00 0.00 C ATOM 943 O PRO A 154 -5.506 -5.069 -3.973 1.00 0.00 O ATOM 944 CB PRO A 154 -5.050 -6.016 -0.510 1.00 0.00 C ATOM 945 CG PRO A 154 -4.550 -4.677 -0.086 1.00 0.00 C ATOM 946 CD PRO A 154 -3.337 -4.379 -0.932 1.00 0.00 C ATOM 0 HA PRO A 154 -4.545 -7.141 -2.338 1.00 0.00 H new ATOM 0 HB2 PRO A 154 -6.128 -6.099 -0.370 1.00 0.00 H new ATOM 0 HB3 PRO A 154 -4.590 -6.814 0.074 1.00 0.00 H new ATOM 0 HG2 PRO A 154 -5.317 -3.915 -0.227 1.00 0.00 H new ATOM 0 HG3 PRO A 154 -4.292 -4.678 0.973 1.00 0.00 H new ATOM 0 HD2 PRO A 154 -3.342 -3.349 -1.289 1.00 0.00 H new ATOM 0 HD3 PRO A 154 -2.414 -4.516 -0.369 1.00 0.00 H new ATOM 954 N HIS A 155 -7.009 -5.546 -2.365 1.00 0.00 N ATOM 955 CA HIS A 155 -8.136 -5.007 -3.117 1.00 0.00 C ATOM 956 C HIS A 155 -9.246 -4.542 -2.180 1.00 0.00 C ATOM 957 O HIS A 155 -9.394 -5.060 -1.074 1.00 0.00 O ATOM 958 CB HIS A 155 -8.674 -6.049 -4.102 1.00 0.00 C ATOM 959 CG HIS A 155 -9.008 -7.365 -3.472 1.00 0.00 C ATOM 960 ND1 HIS A 155 -8.066 -8.171 -2.867 1.00 0.00 N ATOM 961 CD2 HIS A 155 -10.188 -8.021 -3.362 1.00 0.00 C ATOM 962 CE1 HIS A 155 -8.651 -9.265 -2.414 1.00 0.00 C ATOM 963 NE2 HIS A 155 -9.939 -9.198 -2.700 1.00 0.00 N ATOM 0 H HIS A 155 -7.252 -5.923 -1.449 1.00 0.00 H new ATOM 0 HA HIS A 155 -7.781 -4.144 -3.681 1.00 0.00 H new ATOM 0 HB2 HIS A 155 -9.567 -5.651 -4.584 1.00 0.00 H new ATOM 0 HB3 HIS A 155 -7.933 -6.210 -4.885 1.00 0.00 H new ATOM 0 HD2 HIS A 155 -11.146 -7.682 -3.727 1.00 0.00 H new ATOM 0 HE1 HIS A 155 -8.160 -10.076 -1.898 1.00 0.00 H new ATOM 0 HE2 HIS A 155 -10.636 -9.906 -2.467 1.00 0.00 H new ATOM 972 N CYS A 156 -10.025 -3.561 -2.628 1.00 0.00 N ATOM 973 CA CYS A 156 -11.122 -3.032 -1.823 1.00 0.00 C ATOM 974 C CYS A 156 -12.430 -3.717 -2.187 1.00 0.00 C ATOM 975 O CYS A 156 -12.812 -3.767 -3.358 1.00 0.00 O ATOM 976 CB CYS A 156 -11.271 -1.525 -2.035 1.00 0.00 C ATOM 977 SG CYS A 156 -9.832 -0.533 -1.530 1.00 0.00 S ATOM 0 H CYS A 156 -9.918 -3.118 -3.540 1.00 0.00 H new ATOM 0 HA CYS A 156 -10.890 -3.227 -0.776 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -11.469 -1.339 -3.091 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -12.144 -1.180 -1.481 1.00 0.00 H new ATOM 982 N GLN A 157 -13.119 -4.241 -1.180 1.00 0.00 N ATOM 983 CA GLN A 157 -14.390 -4.918 -1.403 1.00 0.00 C ATOM 984 C GLN A 157 -15.556 -4.047 -0.945 1.00 0.00 C ATOM 985 O GLN A 157 -15.503 -3.436 0.123 1.00 0.00 O ATOM 986 CB GLN A 157 -14.415 -6.262 -0.674 1.00 0.00 C ATOM 987 CG GLN A 157 -15.702 -7.044 -0.883 1.00 0.00 C ATOM 988 CD GLN A 157 -15.959 -7.362 -2.343 1.00 0.00 C ATOM 989 OE1 GLN A 157 -15.159 -8.034 -2.995 1.00 0.00 O ATOM 990 NE2 GLN A 157 -17.080 -6.878 -2.866 1.00 0.00 N ATOM 0 H GLN A 157 -12.820 -4.210 -0.205 1.00 0.00 H new ATOM 0 HA GLN A 157 -14.495 -5.098 -2.473 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -13.574 -6.866 -1.014 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -14.274 -6.090 0.393 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -15.655 -7.973 -0.315 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -16.540 -6.471 -0.487 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -17.715 -6.326 -2.289 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -17.306 -7.059 -3.844 1.00 0.00 H new ATOM 999 N VAL A 158 -16.608 -4.001 -1.755 1.00 0.00 N ATOM 1000 CA VAL A 158 -17.786 -3.213 -1.428 1.00 0.00 C ATOM 1001 C VAL A 158 -18.614 -3.923 -0.370 1.00 0.00 C ATOM 1002 O VAL A 158 -19.025 -5.069 -0.559 1.00 0.00 O ATOM 1003 CB VAL A 158 -18.663 -2.964 -2.673 1.00 0.00 C ATOM 1004 CG1 VAL A 158 -19.918 -2.188 -2.299 1.00 0.00 C ATOM 1005 CG2 VAL A 158 -17.875 -2.232 -3.746 1.00 0.00 C ATOM 0 H VAL A 158 -16.667 -4.501 -2.642 1.00 0.00 H new ATOM 0 HA VAL A 158 -17.442 -2.251 -1.047 1.00 0.00 H new ATOM 0 HB VAL A 158 -18.968 -3.930 -3.076 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -20.523 -2.023 -3.191 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -20.494 -2.758 -1.570 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -19.637 -1.227 -1.868 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -18.511 -2.066 -4.615 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -17.535 -1.272 -3.357 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -17.012 -2.832 -4.037 1.00 0.00 H new ATOM 1015 N ASN A 159 -18.853 -3.248 0.747 1.00 0.00 N ATOM 1016 CA ASN A 159 -19.628 -3.842 1.825 1.00 0.00 C ATOM 1017 C ASN A 159 -21.064 -4.104 1.384 1.00 0.00 C ATOM 1018 O ASN A 159 -21.758 -4.888 2.066 1.00 0.00 O ATOM 1019 CB ASN A 159 -19.615 -2.941 3.064 1.00 0.00 C ATOM 1020 CG ASN A 159 -20.253 -1.588 2.811 1.00 0.00 C ATOM 1021 OD1 ASN A 159 -21.417 -1.500 2.419 1.00 0.00 O ATOM 1022 ND2 ASN A 159 -19.495 -0.524 3.041 1.00 0.00 N ATOM 1023 OXT ASN A 159 -21.484 -3.524 0.361 1.00 0.00 O ATOM 0 H ASN A 159 -18.525 -2.299 0.928 1.00 0.00 H new ATOM 0 HA ASN A 159 -19.165 -4.795 2.081 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -20.142 -3.440 3.877 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -18.586 -2.797 3.393 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -19.872 0.412 2.894 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -18.535 -0.642 3.365 1.00 0.00 H new TER 1030 ASN A 159