USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 580 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 93 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 157 MET CE :methyl -130:sc= -0.156 (180deg=-0.294) USER MOD Set 2.1: A 98 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 150 TYR OH : rot 180:sc=-0.00235 USER MOD Single : A 103 MET CE :methyl -174:sc= 0 (180deg=-0.0247) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc=-0.00358 K(o=-0.0036,f=-0.55) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl -134:sc= -1.11 (180deg=-6.24!) USER MOD Single : A 122 GLN : amide:sc= -0.344 X(o=-0.34,f=-0.13) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot -26:sc= 0.88 USER MOD Single : A 137 MET CE :methyl 147:sc= -0.271 (180deg=-2.91!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.23) USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0.42) USER MOD Single : A 144 ASN : amide:sc= -0.249 X(o=-0.25,f=-0.24) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 LYS NZ :NH3+ -117:sc= 0.00463 (180deg=-0.522) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 93 1.785 13.641 -2.983 1.00 0.00 N ATOM 72 CA SER A 93 2.413 12.448 -2.429 1.00 0.00 C ATOM 73 C SER A 93 1.653 11.954 -1.202 1.00 0.00 C ATOM 74 O SER A 93 1.358 10.765 -1.079 1.00 0.00 O ATOM 75 CB SER A 93 3.869 12.737 -2.059 1.00 0.00 C ATOM 76 OG SER A 93 4.488 11.594 -1.495 1.00 0.00 O ATOM 0 HA SER A 93 2.387 11.668 -3.189 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.418 13.051 -2.947 1.00 0.00 H new ATOM 0 HB3 SER A 93 3.910 13.564 -1.350 1.00 0.00 H new ATOM 0 HG SER A 93 5.418 11.804 -1.268 1.00 0.00 H new ATOM 82 N GLU A 94 1.338 12.874 -0.297 1.00 0.00 N ATOM 83 CA GLU A 94 0.612 12.533 0.920 1.00 0.00 C ATOM 84 C GLU A 94 -0.871 12.324 0.628 1.00 0.00 C ATOM 85 O GLU A 94 -1.478 11.364 1.104 1.00 0.00 O ATOM 86 CB GLU A 94 0.787 13.633 1.969 1.00 0.00 C ATOM 87 CG GLU A 94 0.256 13.256 3.342 1.00 0.00 C ATOM 88 CD GLU A 94 1.147 13.744 4.466 1.00 0.00 C ATOM 89 OE1 GLU A 94 1.900 14.717 4.247 1.00 0.00 O ATOM 90 OE2 GLU A 94 1.093 13.155 5.566 1.00 0.00 O ATOM 0 H GLU A 94 1.574 13.862 -0.384 1.00 0.00 H new ATOM 0 HA GLU A 94 1.022 11.601 1.309 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.846 13.878 2.053 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.278 14.534 1.627 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.743 13.673 3.468 1.00 0.00 H new ATOM 0 HG3 GLU A 94 0.159 12.172 3.405 1.00 0.00 H new ATOM 97 N GLU A 95 -1.448 13.228 -0.157 1.00 0.00 N ATOM 98 CA GLU A 95 -2.860 13.142 -0.512 1.00 0.00 C ATOM 99 C GLU A 95 -3.159 11.838 -1.246 1.00 0.00 C ATOM 100 O GLU A 95 -4.264 11.303 -1.154 1.00 0.00 O ATOM 101 CB GLU A 95 -3.261 14.333 -1.384 1.00 0.00 C ATOM 102 CG GLU A 95 -3.605 15.582 -0.586 1.00 0.00 C ATOM 103 CD GLU A 95 -4.991 16.112 -0.900 1.00 0.00 C ATOM 104 OE1 GLU A 95 -5.306 16.277 -2.097 1.00 0.00 O ATOM 105 OE2 GLU A 95 -5.759 16.362 0.052 1.00 0.00 O ATOM 0 H GLU A 95 -0.960 14.028 -0.559 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.442 13.161 0.409 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.445 14.563 -2.069 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.120 14.053 -1.994 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -3.538 15.358 0.479 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -2.868 16.357 -0.796 1.00 0.00 H new ATOM 112 N GLU A 96 -2.168 11.333 -1.974 1.00 0.00 N ATOM 113 CA GLU A 96 -2.326 10.092 -2.723 1.00 0.00 C ATOM 114 C GLU A 96 -2.696 8.938 -1.796 1.00 0.00 C ATOM 115 O GLU A 96 -3.736 8.301 -1.966 1.00 0.00 O ATOM 116 CB GLU A 96 -1.038 9.761 -3.479 1.00 0.00 C ATOM 117 CG GLU A 96 -0.577 10.871 -4.409 1.00 0.00 C ATOM 118 CD GLU A 96 0.774 10.584 -5.035 1.00 0.00 C ATOM 119 OE1 GLU A 96 1.538 9.784 -4.457 1.00 0.00 O ATOM 120 OE2 GLU A 96 1.067 11.160 -6.104 1.00 0.00 O ATOM 0 H GLU A 96 -1.248 11.764 -2.061 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.135 10.231 -3.440 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.248 9.550 -2.759 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -1.191 8.851 -4.060 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.317 11.010 -5.198 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -0.524 11.807 -3.853 1.00 0.00 H new ATOM 127 N LEU A 97 -1.838 8.674 -0.816 1.00 0.00 N ATOM 128 CA LEU A 97 -2.075 7.597 0.138 1.00 0.00 C ATOM 129 C LEU A 97 -3.377 7.820 0.900 1.00 0.00 C ATOM 130 O LEU A 97 -4.073 6.868 1.251 1.00 0.00 O ATOM 131 CB LEU A 97 -0.906 7.493 1.118 1.00 0.00 C ATOM 132 CG LEU A 97 0.435 7.110 0.484 1.00 0.00 C ATOM 133 CD1 LEU A 97 1.528 8.084 0.903 1.00 0.00 C ATOM 134 CD2 LEU A 97 0.814 5.684 0.859 1.00 0.00 C ATOM 0 H LEU A 97 -0.972 9.191 -0.662 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.159 6.663 -0.418 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.791 8.450 1.626 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.155 6.755 1.881 1.00 0.00 H new ATOM 0 HG LEU A 97 0.329 7.165 -0.599 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.471 7.793 0.441 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.262 9.091 0.581 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.634 8.067 1.988 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.769 5.429 0.400 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.899 5.603 1.943 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.046 4.998 0.503 1.00 0.00 H new ATOM 146 N SER A 98 -3.704 9.085 1.152 1.00 0.00 N ATOM 147 CA SER A 98 -4.925 9.432 1.873 1.00 0.00 C ATOM 148 C SER A 98 -6.139 8.744 1.254 1.00 0.00 C ATOM 149 O SER A 98 -7.040 8.296 1.963 1.00 0.00 O ATOM 150 CB SER A 98 -5.128 10.948 1.873 1.00 0.00 C ATOM 151 OG SER A 98 -5.892 11.360 2.993 1.00 0.00 O ATOM 0 H SER A 98 -3.141 9.886 0.868 1.00 0.00 H new ATOM 0 HA SER A 98 -4.820 9.086 2.901 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.159 11.448 1.886 1.00 0.00 H new ATOM 0 HB3 SER A 98 -5.631 11.251 0.955 1.00 0.00 H new ATOM 0 HG SER A 98 -6.006 12.333 2.971 1.00 0.00 H new ATOM 157 N ASP A 99 -6.152 8.663 -0.072 1.00 0.00 N ATOM 158 CA ASP A 99 -7.251 8.028 -0.789 1.00 0.00 C ATOM 159 C ASP A 99 -7.052 6.516 -0.874 1.00 0.00 C ATOM 160 O ASP A 99 -8.006 5.768 -1.088 1.00 0.00 O ATOM 161 CB ASP A 99 -7.376 8.616 -2.196 1.00 0.00 C ATOM 162 CG ASP A 99 -7.998 9.998 -2.192 1.00 0.00 C ATOM 163 OD1 ASP A 99 -8.833 10.271 -1.304 1.00 0.00 O ATOM 164 OD2 ASP A 99 -7.650 10.809 -3.076 1.00 0.00 O ATOM 0 H ASP A 99 -5.413 9.030 -0.672 1.00 0.00 H new ATOM 0 HA ASP A 99 -8.170 8.223 -0.236 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -6.388 8.666 -2.655 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.980 7.950 -2.813 1.00 0.00 H new ATOM 169 N LEU A 100 -5.809 6.072 -0.708 1.00 0.00 N ATOM 170 CA LEU A 100 -5.492 4.650 -0.769 1.00 0.00 C ATOM 171 C LEU A 100 -5.877 3.944 0.528 1.00 0.00 C ATOM 172 O LEU A 100 -6.460 2.860 0.505 1.00 0.00 O ATOM 173 CB LEU A 100 -4.000 4.450 -1.050 1.00 0.00 C ATOM 174 CG LEU A 100 -3.558 4.776 -2.478 1.00 0.00 C ATOM 175 CD1 LEU A 100 -2.040 4.802 -2.576 1.00 0.00 C ATOM 176 CD2 LEU A 100 -4.139 3.766 -3.458 1.00 0.00 C ATOM 0 H LEU A 100 -5.007 6.676 -0.531 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.071 4.212 -1.582 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.430 5.071 -0.359 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.741 3.413 -0.834 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.935 5.765 -2.737 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.745 5.035 -3.599 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.645 5.562 -1.902 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -1.641 3.827 -2.297 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.815 4.012 -4.469 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.791 2.766 -3.199 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.227 3.796 -3.408 1.00 0.00 H new ATOM 188 N PHE A 101 -5.547 4.562 1.659 1.00 0.00 N ATOM 189 CA PHE A 101 -5.859 3.985 2.964 1.00 0.00 C ATOM 190 C PHE A 101 -7.365 3.827 3.147 1.00 0.00 C ATOM 191 O PHE A 101 -7.843 2.765 3.547 1.00 0.00 O ATOM 192 CB PHE A 101 -5.287 4.856 4.085 1.00 0.00 C ATOM 193 CG PHE A 101 -5.141 4.130 5.394 1.00 0.00 C ATOM 194 CD1 PHE A 101 -4.203 3.119 5.541 1.00 0.00 C ATOM 195 CD2 PHE A 101 -5.941 4.459 6.476 1.00 0.00 C ATOM 196 CE1 PHE A 101 -4.067 2.451 6.744 1.00 0.00 C ATOM 197 CE2 PHE A 101 -5.809 3.794 7.681 1.00 0.00 C ATOM 198 CZ PHE A 101 -4.871 2.789 7.815 1.00 0.00 C ATOM 0 H PHE A 101 -5.065 5.460 1.699 1.00 0.00 H new ATOM 0 HA PHE A 101 -5.400 2.997 3.011 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.312 5.235 3.778 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.935 5.721 4.229 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.572 2.851 4.707 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -6.676 5.244 6.377 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -3.333 1.666 6.846 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -6.439 4.060 8.517 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.766 2.268 8.755 1.00 0.00 H new ATOM 208 N ARG A 102 -8.110 4.889 2.856 1.00 0.00 N ATOM 209 CA ARG A 102 -9.563 4.866 2.992 1.00 0.00 C ATOM 210 C ARG A 102 -10.172 3.725 2.182 1.00 0.00 C ATOM 211 O ARG A 102 -11.221 3.189 2.540 1.00 0.00 O ATOM 212 CB ARG A 102 -10.160 6.202 2.543 1.00 0.00 C ATOM 213 CG ARG A 102 -9.743 6.615 1.141 1.00 0.00 C ATOM 214 CD ARG A 102 -10.670 6.032 0.085 1.00 0.00 C ATOM 215 NE ARG A 102 -11.192 7.059 -0.813 1.00 0.00 N ATOM 216 CZ ARG A 102 -12.200 7.872 -0.504 1.00 0.00 C ATOM 217 NH1 ARG A 102 -12.794 7.783 0.680 1.00 0.00 N ATOM 218 NH2 ARG A 102 -12.613 8.778 -1.380 1.00 0.00 N ATOM 0 H ARG A 102 -7.732 5.776 2.524 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.800 4.704 4.044 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.247 6.137 2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.860 6.979 3.246 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.744 7.702 1.066 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -8.722 6.284 0.952 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -10.132 5.282 -0.495 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.500 5.522 0.573 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.759 7.159 -1.731 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -12.479 7.089 1.358 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.566 8.408 0.912 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.158 8.852 -2.290 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.385 9.401 -1.144 1.00 0.00 H new ATOM 232 N MET A 103 -9.508 3.358 1.091 1.00 0.00 N ATOM 233 CA MET A 103 -9.985 2.279 0.233 1.00 0.00 C ATOM 234 C MET A 103 -9.410 0.937 0.674 1.00 0.00 C ATOM 235 O MET A 103 -10.031 -0.109 0.481 1.00 0.00 O ATOM 236 CB MET A 103 -9.608 2.554 -1.224 1.00 0.00 C ATOM 237 CG MET A 103 -10.660 2.094 -2.221 1.00 0.00 C ATOM 238 SD MET A 103 -9.956 1.178 -3.606 1.00 0.00 S ATOM 239 CE MET A 103 -8.904 2.428 -4.340 1.00 0.00 C ATOM 0 H MET A 103 -8.639 3.791 0.780 1.00 0.00 H new ATOM 0 HA MET A 103 -11.071 2.234 0.319 1.00 0.00 H new ATOM 0 HB2 MET A 103 -9.441 3.624 -1.352 1.00 0.00 H new ATOM 0 HB3 MET A 103 -8.665 2.055 -1.447 1.00 0.00 H new ATOM 0 HG2 MET A 103 -11.389 1.466 -1.709 1.00 0.00 H new ATOM 0 HG3 MET A 103 -11.198 2.962 -2.601 1.00 0.00 H new ATOM 0 HE1 MET A 103 -8.481 2.048 -5.270 1.00 0.00 H new ATOM 0 HE2 MET A 103 -9.492 3.322 -4.548 1.00 0.00 H new ATOM 0 HE3 MET A 103 -8.098 2.676 -3.650 1.00 0.00 H new ATOM 249 N PHE A 104 -8.221 0.972 1.268 1.00 0.00 N ATOM 250 CA PHE A 104 -7.563 -0.242 1.736 1.00 0.00 C ATOM 251 C PHE A 104 -8.164 -0.711 3.058 1.00 0.00 C ATOM 252 O PHE A 104 -8.312 -1.910 3.293 1.00 0.00 O ATOM 253 CB PHE A 104 -6.060 -0.001 1.900 1.00 0.00 C ATOM 254 CG PHE A 104 -5.208 -1.000 1.170 1.00 0.00 C ATOM 255 CD1 PHE A 104 -4.998 -2.264 1.696 1.00 0.00 C ATOM 256 CD2 PHE A 104 -4.617 -0.674 -0.040 1.00 0.00 C ATOM 257 CE1 PHE A 104 -4.214 -3.185 1.029 1.00 0.00 C ATOM 258 CE2 PHE A 104 -3.831 -1.591 -0.712 1.00 0.00 C ATOM 259 CZ PHE A 104 -3.629 -2.848 -0.177 1.00 0.00 C ATOM 0 H PHE A 104 -7.694 1.829 1.436 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.719 -1.022 0.991 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.820 1.000 1.541 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.810 -0.028 2.960 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -5.452 -2.532 2.638 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -4.772 0.308 -0.463 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.058 -4.168 1.449 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -3.375 -1.325 -1.654 1.00 0.00 H new ATOM 0 HZ PHE A 104 -3.015 -3.566 -0.700 1.00 0.00 H new ATOM 269 N ASP A 105 -8.509 0.242 3.917 1.00 0.00 N ATOM 270 CA ASP A 105 -9.093 -0.073 5.215 1.00 0.00 C ATOM 271 C ASP A 105 -10.553 -0.492 5.068 1.00 0.00 C ATOM 272 O ASP A 105 -11.457 0.185 5.558 1.00 0.00 O ATOM 273 CB ASP A 105 -8.984 1.131 6.153 1.00 0.00 C ATOM 274 CG ASP A 105 -9.072 0.736 7.614 1.00 0.00 C ATOM 275 OD1 ASP A 105 -8.832 -0.450 7.923 1.00 0.00 O ATOM 276 OD2 ASP A 105 -9.379 1.612 8.449 1.00 0.00 O ATOM 0 H ASP A 105 -8.394 1.239 3.737 1.00 0.00 H new ATOM 0 HA ASP A 105 -8.538 -0.907 5.643 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -8.038 1.643 5.974 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.779 1.840 5.923 1.00 0.00 H new ATOM 281 N LYS A 106 -10.775 -1.614 4.391 1.00 0.00 N ATOM 282 CA LYS A 106 -12.125 -2.126 4.180 1.00 0.00 C ATOM 283 C LYS A 106 -12.826 -2.381 5.510 1.00 0.00 C ATOM 284 O LYS A 106 -14.048 -2.273 5.610 1.00 0.00 O ATOM 285 CB LYS A 106 -12.080 -3.415 3.358 1.00 0.00 C ATOM 286 CG LYS A 106 -11.601 -3.210 1.930 1.00 0.00 C ATOM 287 CD LYS A 106 -12.451 -2.182 1.200 1.00 0.00 C ATOM 288 CE LYS A 106 -12.058 -2.073 -0.264 1.00 0.00 C ATOM 289 NZ LYS A 106 -12.658 -3.162 -1.083 1.00 0.00 N ATOM 0 H LYS A 106 -10.038 -2.186 3.979 1.00 0.00 H new ATOM 0 HA LYS A 106 -12.691 -1.373 3.632 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.423 -4.129 3.854 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.076 -3.858 3.338 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -10.561 -2.885 1.937 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -11.635 -4.158 1.394 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -13.503 -2.458 1.276 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -12.341 -1.210 1.681 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -12.378 -1.107 -0.655 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -10.972 -2.109 -0.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -12.366 -3.052 -2.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -12.333 -4.084 -0.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -13.695 -3.113 -1.020 1.00 0.00 H new ATOM 303 N ASN A 107 -12.044 -2.719 6.530 1.00 0.00 N ATOM 304 CA ASN A 107 -12.589 -2.989 7.856 1.00 0.00 C ATOM 305 C ASN A 107 -13.083 -1.705 8.515 1.00 0.00 C ATOM 306 O ASN A 107 -13.968 -1.736 9.370 1.00 0.00 O ATOM 307 CB ASN A 107 -11.532 -3.655 8.739 1.00 0.00 C ATOM 308 CG ASN A 107 -12.072 -4.034 10.104 1.00 0.00 C ATOM 309 OD1 ASN A 107 -13.237 -4.406 10.242 1.00 0.00 O ATOM 310 ND2 ASN A 107 -11.224 -3.940 11.122 1.00 0.00 N ATOM 0 H ASN A 107 -11.030 -2.813 6.464 1.00 0.00 H new ATOM 0 HA ASN A 107 -13.436 -3.665 7.741 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -11.156 -4.548 8.240 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.686 -2.978 8.861 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -11.530 -4.181 12.065 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.267 -3.627 10.961 1.00 0.00 H new ATOM 317 N ALA A 108 -12.505 -0.576 8.114 1.00 0.00 N ATOM 318 CA ALA A 108 -12.886 0.718 8.666 1.00 0.00 C ATOM 319 C ALA A 108 -12.559 0.797 10.154 1.00 0.00 C ATOM 320 O ALA A 108 -13.453 0.913 10.993 1.00 0.00 O ATOM 321 CB ALA A 108 -14.368 0.978 8.432 1.00 0.00 C ATOM 0 H ALA A 108 -11.770 -0.533 7.408 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.310 1.488 8.153 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -14.638 1.948 8.850 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -14.574 0.974 7.362 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.955 0.198 8.917 1.00 0.00 H new ATOM 327 N ASP A 109 -11.271 0.733 10.474 1.00 0.00 N ATOM 328 CA ASP A 109 -10.823 0.797 11.861 1.00 0.00 C ATOM 329 C ASP A 109 -9.753 1.870 12.037 1.00 0.00 C ATOM 330 O ASP A 109 -9.833 2.697 12.945 1.00 0.00 O ATOM 331 CB ASP A 109 -10.278 -0.561 12.306 1.00 0.00 C ATOM 332 CG ASP A 109 -9.295 -1.142 11.310 1.00 0.00 C ATOM 333 OD1 ASP A 109 -9.660 -1.274 10.123 1.00 0.00 O ATOM 334 OD2 ASP A 109 -8.159 -1.467 11.717 1.00 0.00 O ATOM 0 H ASP A 109 -10.519 0.637 9.792 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.680 1.058 12.482 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -9.790 -0.454 13.275 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -11.107 -1.256 12.442 1.00 0.00 H new ATOM 339 N GLY A 110 -8.753 1.850 11.161 1.00 0.00 N ATOM 340 CA GLY A 110 -7.682 2.826 11.238 1.00 0.00 C ATOM 341 C GLY A 110 -6.312 2.218 11.001 1.00 0.00 C ATOM 342 O GLY A 110 -5.337 2.940 10.794 1.00 0.00 O ATOM 0 H GLY A 110 -8.666 1.176 10.400 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -7.858 3.610 10.502 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -7.699 3.300 12.219 1.00 0.00 H new ATOM 346 N TYR A 111 -6.234 0.890 11.033 1.00 0.00 N ATOM 347 CA TYR A 111 -4.968 0.195 10.821 1.00 0.00 C ATOM 348 C TYR A 111 -5.152 -0.990 9.876 1.00 0.00 C ATOM 349 O TYR A 111 -6.278 -1.410 9.613 1.00 0.00 O ATOM 350 CB TYR A 111 -4.395 -0.293 12.157 1.00 0.00 C ATOM 351 CG TYR A 111 -4.718 0.608 13.330 1.00 0.00 C ATOM 352 CD1 TYR A 111 -4.403 1.960 13.297 1.00 0.00 C ATOM 353 CD2 TYR A 111 -5.338 0.106 14.467 1.00 0.00 C ATOM 354 CE1 TYR A 111 -4.696 2.787 14.365 1.00 0.00 C ATOM 355 CE2 TYR A 111 -5.635 0.926 15.539 1.00 0.00 C ATOM 356 CZ TYR A 111 -5.312 2.265 15.483 1.00 0.00 C ATOM 357 OH TYR A 111 -5.605 3.085 16.549 1.00 0.00 O ATOM 0 H TYR A 111 -7.030 0.275 11.203 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.269 0.899 10.369 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -4.779 -1.292 12.362 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -3.312 -0.380 12.066 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -3.921 2.372 12.423 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -5.592 -0.943 14.514 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -4.444 3.836 14.324 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -6.117 0.520 16.416 1.00 0.00 H new ATOM 0 HH TYR A 111 -6.039 2.561 17.255 1.00 0.00 H new ATOM 367 N ILE A 112 -4.044 -1.531 9.368 1.00 0.00 N ATOM 368 CA ILE A 112 -4.112 -2.671 8.458 1.00 0.00 C ATOM 369 C ILE A 112 -3.444 -3.901 9.063 1.00 0.00 C ATOM 370 O ILE A 112 -2.374 -3.808 9.663 1.00 0.00 O ATOM 371 CB ILE A 112 -3.453 -2.358 7.100 1.00 0.00 C ATOM 372 CG1 ILE A 112 -3.975 -1.030 6.547 1.00 0.00 C ATOM 373 CG2 ILE A 112 -3.708 -3.489 6.114 1.00 0.00 C ATOM 374 CD1 ILE A 112 -3.452 -0.698 5.165 1.00 0.00 C ATOM 0 H ILE A 112 -3.100 -1.202 9.569 1.00 0.00 H new ATOM 0 HA ILE A 112 -5.170 -2.876 8.297 1.00 0.00 H new ATOM 0 HB ILE A 112 -2.377 -2.268 7.247 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -5.064 -1.063 6.515 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.700 -0.228 7.232 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -3.236 -3.253 5.160 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -3.289 -4.415 6.507 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.781 -3.609 5.968 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.865 0.257 4.839 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.364 -0.632 5.194 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.750 -1.480 4.466 1.00 0.00 H new ATOM 386 N ASP A 113 -4.087 -5.053 8.901 1.00 0.00 N ATOM 387 CA ASP A 113 -3.560 -6.305 9.431 1.00 0.00 C ATOM 388 C ASP A 113 -3.579 -7.396 8.363 1.00 0.00 C ATOM 389 O ASP A 113 -3.742 -7.113 7.176 1.00 0.00 O ATOM 390 CB ASP A 113 -4.373 -6.747 10.652 1.00 0.00 C ATOM 391 CG ASP A 113 -3.530 -6.832 11.909 1.00 0.00 C ATOM 392 OD1 ASP A 113 -2.356 -7.247 11.809 1.00 0.00 O ATOM 393 OD2 ASP A 113 -4.043 -6.485 12.993 1.00 0.00 O ATOM 0 H ASP A 113 -4.974 -5.145 8.407 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.526 -6.140 9.735 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -5.191 -6.045 10.814 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -4.822 -7.720 10.453 1.00 0.00 H new ATOM 398 N LEU A 114 -3.412 -8.644 8.793 1.00 0.00 N ATOM 399 CA LEU A 114 -3.410 -9.777 7.873 1.00 0.00 C ATOM 400 C LEU A 114 -4.688 -9.808 7.040 1.00 0.00 C ATOM 401 O LEU A 114 -4.684 -10.257 5.894 1.00 0.00 O ATOM 402 CB LEU A 114 -3.259 -11.094 8.644 1.00 0.00 C ATOM 403 CG LEU A 114 -2.187 -11.107 9.744 1.00 0.00 C ATOM 404 CD1 LEU A 114 -1.061 -10.132 9.428 1.00 0.00 C ATOM 405 CD2 LEU A 114 -2.808 -10.788 11.097 1.00 0.00 C ATOM 0 H LEU A 114 -3.276 -8.896 9.772 1.00 0.00 H new ATOM 0 HA LEU A 114 -2.561 -9.659 7.200 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -4.220 -11.340 9.097 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.030 -11.886 7.931 1.00 0.00 H new ATOM 0 HG LEU A 114 -1.759 -12.109 9.785 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -0.318 -10.164 10.225 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.593 -10.410 8.484 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -1.465 -9.123 9.349 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -2.034 -10.802 11.865 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -3.268 -9.800 11.063 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -3.567 -11.534 11.334 1.00 0.00 H new ATOM 417 N GLU A 115 -5.781 -9.328 7.625 1.00 0.00 N ATOM 418 CA GLU A 115 -7.067 -9.302 6.937 1.00 0.00 C ATOM 419 C GLU A 115 -7.026 -8.352 5.744 1.00 0.00 C ATOM 420 O GLU A 115 -7.194 -8.771 4.598 1.00 0.00 O ATOM 421 CB GLU A 115 -8.177 -8.879 7.901 1.00 0.00 C ATOM 422 CG GLU A 115 -8.315 -9.829 9.075 1.00 0.00 C ATOM 423 OE1 GLU A 115 -8.057 -11.037 8.894 1.00 0.00 O ATOM 424 OE2 GLU A 115 -8.682 -9.364 10.174 1.00 0.00 O ATOM 0 H GLU A 115 -5.802 -8.952 8.573 1.00 0.00 H new ATOM 0 HA GLU A 115 -7.276 -10.308 6.572 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -7.970 -7.875 8.272 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -9.124 -8.831 7.363 1.00 0.00 H new ATOM 429 N GLU A 116 -6.802 -7.072 6.021 1.00 0.00 N ATOM 430 CA GLU A 116 -6.739 -6.062 4.971 1.00 0.00 C ATOM 431 C GLU A 116 -5.556 -6.314 4.042 1.00 0.00 C ATOM 432 O GLU A 116 -5.605 -5.986 2.856 1.00 0.00 O ATOM 433 CB GLU A 116 -6.634 -4.665 5.585 1.00 0.00 C ATOM 434 CG GLU A 116 -7.928 -4.183 6.220 1.00 0.00 C ATOM 435 CD GLU A 116 -8.087 -4.660 7.650 1.00 0.00 C ATOM 436 OE1 GLU A 116 -7.198 -4.364 8.477 1.00 0.00 O ATOM 437 OE2 GLU A 116 -9.100 -5.329 7.944 1.00 0.00 O ATOM 0 H GLU A 116 -6.661 -6.709 6.964 1.00 0.00 H new ATOM 0 HA GLU A 116 -7.656 -6.125 4.385 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.847 -4.666 6.339 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -6.333 -3.958 4.811 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.955 -3.094 6.199 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -8.773 -4.535 5.627 1.00 0.00 H new ATOM 444 N LEU A 117 -4.494 -6.901 4.585 1.00 0.00 N ATOM 445 CA LEU A 117 -3.300 -7.199 3.800 1.00 0.00 C ATOM 446 C LEU A 117 -3.654 -8.026 2.570 1.00 0.00 C ATOM 447 O LEU A 117 -3.015 -7.912 1.525 1.00 0.00 O ATOM 448 CB LEU A 117 -2.276 -7.946 4.654 1.00 0.00 C ATOM 449 CG LEU A 117 -1.387 -7.055 5.521 1.00 0.00 C ATOM 450 CD1 LEU A 117 -0.690 -7.878 6.591 1.00 0.00 C ATOM 451 CD2 LEU A 117 -0.369 -6.322 4.660 1.00 0.00 C ATOM 0 H LEU A 117 -4.435 -7.180 5.564 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.866 -6.255 3.470 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.805 -8.645 5.301 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.640 -8.539 3.997 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.016 -6.314 6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.061 -7.227 7.199 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.436 -8.357 7.225 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.072 -8.641 6.118 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.256 -5.692 5.293 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.256 -7.047 4.139 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.889 -5.701 3.931 1.00 0.00 H new ATOM 463 N LYS A 118 -4.683 -8.855 2.701 1.00 0.00 N ATOM 464 CA LYS A 118 -5.132 -9.697 1.599 1.00 0.00 C ATOM 465 C LYS A 118 -5.494 -8.847 0.386 1.00 0.00 C ATOM 466 O LYS A 118 -5.383 -9.295 -0.756 1.00 0.00 O ATOM 467 CB LYS A 118 -6.335 -10.535 2.033 1.00 0.00 C ATOM 468 CG LYS A 118 -6.908 -11.402 0.925 1.00 0.00 C ATOM 469 CD LYS A 118 -8.277 -11.944 1.299 1.00 0.00 C ATOM 470 CE LYS A 118 -9.270 -10.821 1.557 1.00 0.00 C ATOM 471 NZ LYS A 118 -10.642 -11.176 1.098 1.00 0.00 N ATOM 0 H LYS A 118 -5.222 -8.962 3.560 1.00 0.00 H new ATOM 0 HA LYS A 118 -4.317 -10.365 1.321 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -6.040 -11.173 2.866 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -7.116 -9.870 2.402 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -6.984 -10.819 0.007 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -6.230 -12.231 0.721 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -8.648 -12.582 0.497 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -8.192 -12.567 2.189 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -9.291 -10.593 2.623 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -8.938 -9.918 1.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -11.288 -10.385 1.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -10.627 -11.369 0.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -10.970 -12.023 1.605 1.00 0.00 H new ATOM 485 N ILE A 119 -5.922 -7.615 0.642 1.00 0.00 N ATOM 486 CA ILE A 119 -6.295 -6.695 -0.424 1.00 0.00 C ATOM 487 C ILE A 119 -5.135 -6.488 -1.395 1.00 0.00 C ATOM 488 O ILE A 119 -5.344 -6.188 -2.571 1.00 0.00 O ATOM 489 CB ILE A 119 -6.742 -5.334 0.151 1.00 0.00 C ATOM 490 CG1 ILE A 119 -7.967 -5.519 1.048 1.00 0.00 C ATOM 491 CG2 ILE A 119 -7.044 -4.345 -0.967 1.00 0.00 C ATOM 492 CD1 ILE A 119 -8.020 -4.552 2.210 1.00 0.00 C ATOM 0 H ILE A 119 -6.019 -7.231 1.582 1.00 0.00 H new ATOM 0 HA ILE A 119 -7.131 -7.139 -0.963 1.00 0.00 H new ATOM 0 HB ILE A 119 -5.926 -4.928 0.749 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -8.868 -5.400 0.446 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -7.973 -6.538 1.434 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -7.357 -3.394 -0.537 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.149 -4.193 -1.570 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -7.843 -4.739 -1.595 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -8.915 -4.743 2.802 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -7.137 -4.685 2.835 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -8.046 -3.530 1.832 1.00 0.00 H new ATOM 504 N MET A 120 -3.913 -6.660 -0.898 1.00 0.00 N ATOM 505 CA MET A 120 -2.723 -6.501 -1.728 1.00 0.00 C ATOM 506 C MET A 120 -2.557 -7.704 -2.648 1.00 0.00 C ATOM 507 O MET A 120 -2.084 -7.579 -3.777 1.00 0.00 O ATOM 508 CB MET A 120 -1.472 -6.338 -0.857 1.00 0.00 C ATOM 509 CG MET A 120 -1.714 -5.582 0.442 1.00 0.00 C ATOM 510 SD MET A 120 -0.597 -4.183 0.655 1.00 0.00 S ATOM 511 CE MET A 120 -1.002 -3.677 2.324 1.00 0.00 C ATOM 0 H MET A 120 -3.721 -6.909 0.072 1.00 0.00 H new ATOM 0 HA MET A 120 -2.847 -5.603 -2.332 1.00 0.00 H new ATOM 0 HB2 MET A 120 -1.075 -7.325 -0.622 1.00 0.00 H new ATOM 0 HB3 MET A 120 -0.707 -5.816 -1.432 1.00 0.00 H new ATOM 0 HG2 MET A 120 -2.744 -5.225 0.463 1.00 0.00 H new ATOM 0 HG3 MET A 120 -1.596 -6.266 1.282 1.00 0.00 H new ATOM 0 HE1 MET A 120 -1.122 -2.594 2.357 1.00 0.00 H new ATOM 0 HE2 MET A 120 -1.931 -4.155 2.634 1.00 0.00 H new ATOM 0 HE3 MET A 120 -0.199 -3.973 2.999 1.00 0.00 H new ATOM 521 N LEU A 121 -2.953 -8.871 -2.150 1.00 0.00 N ATOM 522 CA LEU A 121 -2.856 -10.108 -2.915 1.00 0.00 C ATOM 523 C LEU A 121 -3.688 -10.028 -4.190 1.00 0.00 C ATOM 524 O LEU A 121 -3.276 -10.510 -5.243 1.00 0.00 O ATOM 525 CB LEU A 121 -3.323 -11.289 -2.062 1.00 0.00 C ATOM 526 CG LEU A 121 -2.519 -12.576 -2.238 1.00 0.00 C ATOM 527 CD1 LEU A 121 -2.530 -13.018 -3.691 1.00 0.00 C ATOM 528 CD2 LEU A 121 -1.092 -12.385 -1.746 1.00 0.00 C ATOM 0 H LEU A 121 -3.346 -8.985 -1.216 1.00 0.00 H new ATOM 0 HA LEU A 121 -1.813 -10.255 -3.195 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.285 -10.996 -1.013 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.367 -11.496 -2.297 1.00 0.00 H new ATOM 0 HG LEU A 121 -2.986 -13.358 -1.639 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.952 -13.936 -3.796 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -3.557 -13.197 -4.009 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -2.089 -12.238 -4.312 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.534 -13.312 -1.879 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -0.614 -11.589 -2.316 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -1.104 -12.117 -0.689 1.00 0.00 H new ATOM 540 N GLN A 122 -4.863 -9.414 -4.090 1.00 0.00 N ATOM 541 CA GLN A 122 -5.753 -9.271 -5.240 1.00 0.00 C ATOM 542 C GLN A 122 -4.995 -8.752 -6.461 1.00 0.00 C ATOM 543 O GLN A 122 -5.383 -9.011 -7.600 1.00 0.00 O ATOM 544 CB GLN A 122 -6.908 -8.326 -4.900 1.00 0.00 C ATOM 545 CG GLN A 122 -8.203 -9.047 -4.562 1.00 0.00 C ATOM 546 CD GLN A 122 -8.048 -10.011 -3.403 1.00 0.00 C ATOM 547 OE1 GLN A 122 -7.724 -11.184 -3.595 1.00 0.00 O ATOM 548 NE2 GLN A 122 -8.278 -9.522 -2.191 1.00 0.00 N ATOM 0 H GLN A 122 -5.222 -9.008 -3.226 1.00 0.00 H new ATOM 0 HA GLN A 122 -6.155 -10.255 -5.481 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -6.619 -7.701 -4.055 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -7.082 -7.660 -5.745 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -8.971 -8.312 -4.319 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -8.551 -9.592 -5.439 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -8.544 -8.544 -2.078 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -8.189 -10.124 -1.373 1.00 0.00 H new ATOM 557 N ALA A 123 -3.916 -8.016 -6.213 1.00 0.00 N ATOM 558 CA ALA A 123 -3.107 -7.459 -7.289 1.00 0.00 C ATOM 559 C ALA A 123 -2.286 -8.537 -7.994 1.00 0.00 C ATOM 560 O ALA A 123 -1.916 -8.381 -9.157 1.00 0.00 O ATOM 561 CB ALA A 123 -2.192 -6.370 -6.748 1.00 0.00 C ATOM 0 H ALA A 123 -3.582 -7.792 -5.275 1.00 0.00 H new ATOM 0 HA ALA A 123 -3.785 -7.026 -8.024 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.592 -5.961 -7.561 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -2.794 -5.576 -6.306 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -1.534 -6.792 -5.989 1.00 0.00 H new ATOM 567 N THR A 124 -1.998 -9.629 -7.288 1.00 0.00 N ATOM 568 CA THR A 124 -1.215 -10.718 -7.864 1.00 0.00 C ATOM 569 C THR A 124 -2.049 -11.990 -8.000 1.00 0.00 C ATOM 570 O THR A 124 -2.066 -12.622 -9.056 1.00 0.00 O ATOM 571 CB THR A 124 0.025 -10.991 -7.009 1.00 0.00 C ATOM 572 OG1 THR A 124 0.885 -11.915 -7.652 1.00 0.00 O ATOM 573 CG2 THR A 124 -0.295 -11.542 -5.638 1.00 0.00 C ATOM 0 H THR A 124 -2.293 -9.782 -6.324 1.00 0.00 H new ATOM 0 HA THR A 124 -0.900 -10.412 -8.862 1.00 0.00 H new ATOM 0 HB THR A 124 0.505 -10.020 -6.887 1.00 0.00 H new ATOM 0 HG1 THR A 124 1.672 -12.075 -7.090 1.00 0.00 H new ATOM 0 HG21 THR A 124 0.631 -11.711 -5.089 1.00 0.00 H new ATOM 0 HG22 THR A 124 -0.914 -10.828 -5.095 1.00 0.00 H new ATOM 0 HG23 THR A 124 -0.833 -12.484 -5.741 1.00 0.00 H new ATOM 581 N GLY A 125 -2.740 -12.357 -6.926 1.00 0.00 N ATOM 582 CA GLY A 125 -3.570 -13.550 -6.940 1.00 0.00 C ATOM 583 C GLY A 125 -2.870 -14.753 -7.545 1.00 0.00 C ATOM 584 O GLY A 125 -3.509 -15.598 -8.172 1.00 0.00 O ATOM 0 H GLY A 125 -2.741 -11.848 -6.042 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -3.872 -13.788 -5.920 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -4.481 -13.346 -7.503 1.00 0.00 H new ATOM 588 N GLU A 126 -1.554 -14.831 -7.364 1.00 0.00 N ATOM 589 CA GLU A 126 -0.779 -15.943 -7.906 1.00 0.00 C ATOM 590 C GLU A 126 0.353 -16.347 -6.964 1.00 0.00 C ATOM 591 O GLU A 126 0.837 -15.538 -6.171 1.00 0.00 O ATOM 592 CB GLU A 126 -0.212 -15.570 -9.278 1.00 0.00 C ATOM 593 CG GLU A 126 -0.655 -16.504 -10.393 1.00 0.00 C ATOM 594 CD GLU A 126 0.478 -16.869 -11.332 1.00 0.00 C ATOM 595 OE1 GLU A 126 1.327 -15.995 -11.607 1.00 0.00 O ATOM 596 OE2 GLU A 126 0.517 -18.029 -11.793 1.00 0.00 O ATOM 0 H GLU A 126 -1.005 -14.142 -6.850 1.00 0.00 H new ATOM 0 HA GLU A 126 -1.448 -16.797 -8.012 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -0.518 -14.553 -9.524 1.00 0.00 H new ATOM 0 HB3 GLU A 126 0.877 -15.572 -9.225 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -1.068 -17.414 -9.957 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -1.455 -16.031 -10.962 1.00 0.00 H new ATOM 603 N THR A 127 0.772 -17.606 -7.065 1.00 0.00 N ATOM 604 CA THR A 127 1.850 -18.133 -6.235 1.00 0.00 C ATOM 605 C THR A 127 1.514 -18.013 -4.745 1.00 0.00 C ATOM 606 O THR A 127 0.782 -18.841 -4.202 1.00 0.00 O ATOM 607 CB THR A 127 3.168 -17.420 -6.565 1.00 0.00 C ATOM 608 OG1 THR A 127 3.556 -17.683 -7.901 1.00 0.00 O ATOM 609 CG2 THR A 127 4.316 -17.830 -5.666 1.00 0.00 C ATOM 0 H THR A 127 0.378 -18.283 -7.718 1.00 0.00 H new ATOM 0 HA THR A 127 1.966 -19.194 -6.456 1.00 0.00 H new ATOM 0 HB THR A 127 2.969 -16.360 -6.410 1.00 0.00 H new ATOM 0 HG1 THR A 127 4.397 -17.219 -8.095 1.00 0.00 H new ATOM 0 HG21 THR A 127 5.216 -17.288 -5.955 1.00 0.00 H new ATOM 0 HG22 THR A 127 4.069 -17.596 -4.630 1.00 0.00 H new ATOM 0 HG23 THR A 127 4.491 -18.901 -5.765 1.00 0.00 H new ATOM 617 N ILE A 128 2.052 -16.986 -4.087 1.00 0.00 N ATOM 618 CA ILE A 128 1.811 -16.763 -2.660 1.00 0.00 C ATOM 619 C ILE A 128 0.341 -16.984 -2.297 1.00 0.00 C ATOM 620 O ILE A 128 -0.040 -18.068 -1.853 1.00 0.00 O ATOM 621 CB ILE A 128 2.236 -15.339 -2.228 1.00 0.00 C ATOM 622 CG1 ILE A 128 2.208 -14.380 -3.424 1.00 0.00 C ATOM 623 CG2 ILE A 128 3.622 -15.367 -1.602 1.00 0.00 C ATOM 624 CD1 ILE A 128 2.138 -12.920 -3.032 1.00 0.00 C ATOM 0 H ILE A 128 2.660 -16.292 -4.521 1.00 0.00 H new ATOM 0 HA ILE A 128 2.420 -17.491 -2.125 1.00 0.00 H new ATOM 0 HB ILE A 128 1.525 -14.979 -1.484 1.00 0.00 H new ATOM 0 HG12 ILE A 128 3.100 -14.542 -4.029 1.00 0.00 H new ATOM 0 HG13 ILE A 128 1.349 -14.620 -4.051 1.00 0.00 H new ATOM 0 HG21 ILE A 128 3.907 -14.358 -1.303 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.613 -16.016 -0.726 1.00 0.00 H new ATOM 0 HG23 ILE A 128 4.341 -15.747 -2.327 1.00 0.00 H new ATOM 0 HD11 ILE A 128 2.122 -12.303 -3.930 1.00 0.00 H new ATOM 0 HD12 ILE A 128 1.232 -12.742 -2.453 1.00 0.00 H new ATOM 0 HD13 ILE A 128 3.010 -12.663 -2.431 1.00 0.00 H new ATOM 636 N THR A 129 -0.481 -15.957 -2.492 1.00 0.00 N ATOM 637 CA THR A 129 -1.906 -16.044 -2.192 1.00 0.00 C ATOM 638 C THR A 129 -2.151 -16.468 -0.746 1.00 0.00 C ATOM 639 O THR A 129 -3.174 -17.078 -0.437 1.00 0.00 O ATOM 640 CB THR A 129 -2.591 -17.026 -3.145 1.00 0.00 C ATOM 641 OG1 THR A 129 -2.326 -18.364 -2.764 1.00 0.00 O ATOM 642 CG2 THR A 129 -2.156 -16.864 -4.587 1.00 0.00 C ATOM 0 H THR A 129 -0.183 -15.052 -2.858 1.00 0.00 H new ATOM 0 HA THR A 129 -2.332 -15.050 -2.329 1.00 0.00 H new ATOM 0 HB THR A 129 -3.655 -16.800 -3.076 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.479 -18.403 -2.273 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.679 -17.590 -5.209 1.00 0.00 H new ATOM 0 HG22 THR A 129 -2.394 -15.856 -4.928 1.00 0.00 H new ATOM 0 HG23 THR A 129 -1.081 -17.029 -4.663 1.00 0.00 H new ATOM 650 N GLU A 130 -1.214 -16.137 0.139 1.00 0.00 N ATOM 651 CA GLU A 130 -1.343 -16.483 1.553 1.00 0.00 C ATOM 652 C GLU A 130 -0.070 -16.145 2.322 1.00 0.00 C ATOM 653 O GLU A 130 -0.057 -15.231 3.146 1.00 0.00 O ATOM 654 CB GLU A 130 -1.673 -17.970 1.715 1.00 0.00 C ATOM 655 CG GLU A 130 -3.132 -18.230 2.053 1.00 0.00 C ATOM 656 CD GLU A 130 -3.729 -19.359 1.236 1.00 0.00 C ATOM 657 OE1 GLU A 130 -3.437 -20.534 1.544 1.00 0.00 O ATOM 658 OE2 GLU A 130 -4.488 -19.068 0.288 1.00 0.00 O ATOM 0 H GLU A 130 -0.360 -15.631 -0.096 1.00 0.00 H new ATOM 0 HA GLU A 130 -2.160 -15.891 1.966 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.423 -18.493 0.792 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -1.045 -18.391 2.500 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -3.218 -18.469 3.113 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -3.708 -17.320 1.883 1.00 0.00 H new ATOM 665 N ASP A 131 0.998 -16.890 2.053 1.00 0.00 N ATOM 666 CA ASP A 131 2.276 -16.669 2.724 1.00 0.00 C ATOM 667 C ASP A 131 2.682 -15.199 2.667 1.00 0.00 C ATOM 668 O ASP A 131 3.396 -14.709 3.542 1.00 0.00 O ATOM 669 CB ASP A 131 3.365 -17.537 2.091 1.00 0.00 C ATOM 670 CG ASP A 131 3.429 -18.922 2.704 1.00 0.00 C ATOM 671 OD1 ASP A 131 3.754 -19.025 3.906 1.00 0.00 O ATOM 672 OD2 ASP A 131 3.155 -19.904 1.982 1.00 0.00 O ATOM 0 H ASP A 131 1.004 -17.652 1.375 1.00 0.00 H new ATOM 0 HA ASP A 131 2.158 -16.950 3.771 1.00 0.00 H new ATOM 0 HB2 ASP A 131 3.179 -17.625 1.020 1.00 0.00 H new ATOM 0 HB3 ASP A 131 4.331 -17.046 2.208 1.00 0.00 H new ATOM 677 N ASP A 132 2.220 -14.500 1.635 1.00 0.00 N ATOM 678 CA ASP A 132 2.534 -13.086 1.470 1.00 0.00 C ATOM 679 C ASP A 132 1.774 -12.238 2.485 1.00 0.00 C ATOM 680 O ASP A 132 2.213 -11.148 2.850 1.00 0.00 O ATOM 681 CB ASP A 132 2.197 -12.629 0.051 1.00 0.00 C ATOM 682 CG ASP A 132 2.577 -11.183 -0.196 1.00 0.00 C ATOM 683 OD1 ASP A 132 3.785 -10.903 -0.347 1.00 0.00 O ATOM 684 OD2 ASP A 132 1.666 -10.329 -0.239 1.00 0.00 O ATOM 0 H ASP A 132 1.628 -14.889 0.902 1.00 0.00 H new ATOM 0 HA ASP A 132 3.602 -12.954 1.641 1.00 0.00 H new ATOM 0 HB2 ASP A 132 2.716 -13.266 -0.666 1.00 0.00 H new ATOM 0 HB3 ASP A 132 1.129 -12.756 -0.125 1.00 0.00 H new ATOM 689 N ILE A 133 0.632 -12.747 2.939 1.00 0.00 N ATOM 690 CA ILE A 133 -0.184 -12.036 3.914 1.00 0.00 C ATOM 691 C ILE A 133 0.594 -11.801 5.204 1.00 0.00 C ATOM 692 O ILE A 133 0.623 -10.690 5.733 1.00 0.00 O ATOM 693 CB ILE A 133 -1.473 -12.815 4.247 1.00 0.00 C ATOM 694 CG1 ILE A 133 -2.212 -13.220 2.967 1.00 0.00 C ATOM 695 CG2 ILE A 133 -2.376 -11.984 5.147 1.00 0.00 C ATOM 696 CD1 ILE A 133 -2.767 -12.049 2.185 1.00 0.00 C ATOM 0 H ILE A 133 0.253 -13.648 2.647 1.00 0.00 H new ATOM 0 HA ILE A 133 -0.452 -11.079 3.466 1.00 0.00 H new ATOM 0 HB ILE A 133 -1.195 -13.725 4.779 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -1.531 -13.782 2.328 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -3.030 -13.891 3.228 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -3.282 -12.547 5.373 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -1.852 -11.752 6.074 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -2.642 -11.057 4.639 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -3.276 -12.415 1.293 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -3.474 -11.499 2.806 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -1.951 -11.388 1.892 1.00 0.00 H new ATOM 708 N GLU A 134 1.219 -12.861 5.707 1.00 0.00 N ATOM 709 CA GLU A 134 1.996 -12.784 6.938 1.00 0.00 C ATOM 710 C GLU A 134 3.381 -12.195 6.687 1.00 0.00 C ATOM 711 O GLU A 134 3.984 -11.601 7.582 1.00 0.00 O ATOM 712 CB GLU A 134 2.128 -14.174 7.563 1.00 0.00 C ATOM 713 CG GLU A 134 1.003 -14.519 8.525 1.00 0.00 C ATOM 714 CD GLU A 134 0.369 -15.863 8.226 1.00 0.00 C ATOM 715 OE1 GLU A 134 0.958 -16.896 8.609 1.00 0.00 O ATOM 716 OE2 GLU A 134 -0.717 -15.883 7.608 1.00 0.00 O ATOM 0 H GLU A 134 1.202 -13.787 5.279 1.00 0.00 H new ATOM 0 HA GLU A 134 1.468 -12.124 7.626 1.00 0.00 H new ATOM 0 HB2 GLU A 134 2.156 -14.919 6.768 1.00 0.00 H new ATOM 0 HB3 GLU A 134 3.079 -14.236 8.092 1.00 0.00 H new ATOM 0 HG2 GLU A 134 1.390 -14.523 9.544 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.239 -13.743 8.478 1.00 0.00 H new ATOM 723 N GLU A 135 3.887 -12.368 5.470 1.00 0.00 N ATOM 724 CA GLU A 135 5.207 -11.858 5.113 1.00 0.00 C ATOM 725 C GLU A 135 5.157 -10.370 4.780 1.00 0.00 C ATOM 726 O GLU A 135 6.110 -9.637 5.042 1.00 0.00 O ATOM 727 CB GLU A 135 5.775 -12.639 3.925 1.00 0.00 C ATOM 728 CG GLU A 135 6.793 -13.696 4.324 1.00 0.00 C ATOM 729 CD GLU A 135 7.968 -13.764 3.368 1.00 0.00 C ATOM 730 OE1 GLU A 135 7.735 -13.949 2.155 1.00 0.00 O ATOM 731 OE2 GLU A 135 9.120 -13.633 3.832 1.00 0.00 O ATOM 0 H GLU A 135 3.405 -12.856 4.716 1.00 0.00 H new ATOM 0 HA GLU A 135 5.859 -11.991 5.976 1.00 0.00 H new ATOM 0 HB2 GLU A 135 4.955 -13.119 3.391 1.00 0.00 H new ATOM 0 HB3 GLU A 135 6.242 -11.940 3.231 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.158 -13.482 5.328 1.00 0.00 H new ATOM 0 HG3 GLU A 135 6.304 -14.669 4.363 1.00 0.00 H new ATOM 738 N LEU A 136 4.046 -9.927 4.201 1.00 0.00 N ATOM 739 CA LEU A 136 3.893 -8.524 3.837 1.00 0.00 C ATOM 740 C LEU A 136 3.754 -7.652 5.079 1.00 0.00 C ATOM 741 O LEU A 136 4.345 -6.577 5.165 1.00 0.00 O ATOM 742 CB LEU A 136 2.678 -8.332 2.923 1.00 0.00 C ATOM 743 CG LEU A 136 2.415 -6.886 2.485 1.00 0.00 C ATOM 744 CD1 LEU A 136 3.723 -6.130 2.316 1.00 0.00 C ATOM 745 CD2 LEU A 136 1.613 -6.857 1.192 1.00 0.00 C ATOM 0 H LEU A 136 3.244 -10.515 3.975 1.00 0.00 H new ATOM 0 HA LEU A 136 4.790 -8.219 3.298 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.812 -8.946 2.033 1.00 0.00 H new ATOM 0 HB3 LEU A 136 1.793 -8.706 3.438 1.00 0.00 H new ATOM 0 HG LEU A 136 1.833 -6.394 3.264 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.514 -5.106 2.005 1.00 0.00 H new ATOM 0 HD12 LEU A 136 4.262 -6.119 3.264 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.332 -6.622 1.558 1.00 0.00 H new ATOM 0 HD21 LEU A 136 1.436 -5.823 0.897 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.170 -7.368 0.407 1.00 0.00 H new ATOM 0 HD23 LEU A 136 0.658 -7.359 1.345 1.00 0.00 H new ATOM 757 N MET A 137 2.968 -8.126 6.037 1.00 0.00 N ATOM 758 CA MET A 137 2.741 -7.400 7.286 1.00 0.00 C ATOM 759 C MET A 137 4.049 -6.857 7.857 1.00 0.00 C ATOM 760 O MET A 137 4.095 -5.743 8.379 1.00 0.00 O ATOM 761 CB MET A 137 2.071 -8.314 8.315 1.00 0.00 C ATOM 762 CG MET A 137 1.551 -7.575 9.538 1.00 0.00 C ATOM 763 SD MET A 137 0.382 -6.268 9.117 1.00 0.00 S ATOM 764 CE MET A 137 0.326 -5.353 10.656 1.00 0.00 C ATOM 0 H MET A 137 2.473 -9.016 5.975 1.00 0.00 H new ATOM 0 HA MET A 137 2.085 -6.557 7.067 1.00 0.00 H new ATOM 0 HB2 MET A 137 1.243 -8.838 7.838 1.00 0.00 H new ATOM 0 HB3 MET A 137 2.786 -9.072 8.635 1.00 0.00 H new ATOM 0 HG2 MET A 137 1.069 -8.286 10.209 1.00 0.00 H new ATOM 0 HG3 MET A 137 2.392 -7.144 10.081 1.00 0.00 H new ATOM 0 HE1 MET A 137 0.174 -4.295 10.445 1.00 0.00 H new ATOM 0 HE2 MET A 137 -0.496 -5.722 11.269 1.00 0.00 H new ATOM 0 HE3 MET A 137 1.266 -5.484 11.192 1.00 0.00 H new ATOM 774 N LYS A 138 5.110 -7.651 7.752 1.00 0.00 N ATOM 775 CA LYS A 138 6.420 -7.250 8.256 1.00 0.00 C ATOM 776 C LYS A 138 6.871 -5.932 7.630 1.00 0.00 C ATOM 777 O LYS A 138 7.699 -5.218 8.194 1.00 0.00 O ATOM 778 CB LYS A 138 7.452 -8.342 7.969 1.00 0.00 C ATOM 779 CG LYS A 138 8.443 -8.556 9.103 1.00 0.00 C ATOM 780 CD LYS A 138 9.839 -8.848 8.576 1.00 0.00 C ATOM 781 CE LYS A 138 10.622 -7.568 8.334 1.00 0.00 C ATOM 782 NZ LYS A 138 11.811 -7.799 7.468 1.00 0.00 N ATOM 0 H LYS A 138 5.089 -8.576 7.323 1.00 0.00 H new ATOM 0 HA LYS A 138 6.337 -7.106 9.333 1.00 0.00 H new ATOM 0 HB2 LYS A 138 6.932 -9.279 7.771 1.00 0.00 H new ATOM 0 HB3 LYS A 138 8.000 -8.084 7.063 1.00 0.00 H new ATOM 0 HG2 LYS A 138 8.470 -7.669 9.736 1.00 0.00 H new ATOM 0 HG3 LYS A 138 8.109 -9.384 9.728 1.00 0.00 H new ATOM 0 HD2 LYS A 138 10.375 -9.474 9.289 1.00 0.00 H new ATOM 0 HD3 LYS A 138 9.767 -9.413 7.647 1.00 0.00 H new ATOM 0 HE2 LYS A 138 9.972 -6.828 7.868 1.00 0.00 H new ATOM 0 HE3 LYS A 138 10.944 -7.153 9.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 12.318 -6.902 7.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 12.444 -8.486 7.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 11.503 -8.171 6.547 1.00 0.00 H new ATOM 796 N ASP A 139 6.323 -5.619 6.460 1.00 0.00 N ATOM 797 CA ASP A 139 6.670 -4.390 5.754 1.00 0.00 C ATOM 798 C ASP A 139 5.779 -3.232 6.194 1.00 0.00 C ATOM 799 O ASP A 139 6.267 -2.146 6.503 1.00 0.00 O ATOM 800 CB ASP A 139 6.542 -4.596 4.245 1.00 0.00 C ATOM 801 CG ASP A 139 7.628 -3.878 3.468 1.00 0.00 C ATOM 802 OD1 ASP A 139 8.820 -4.113 3.759 1.00 0.00 O ATOM 803 OD2 ASP A 139 7.288 -3.081 2.569 1.00 0.00 O ATOM 0 H ASP A 139 5.636 -6.200 5.980 1.00 0.00 H new ATOM 0 HA ASP A 139 7.702 -4.141 5.999 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.584 -5.662 4.022 1.00 0.00 H new ATOM 0 HB3 ASP A 139 5.567 -4.240 3.914 1.00 0.00 H new ATOM 808 N GLY A 140 4.471 -3.470 6.213 1.00 0.00 N ATOM 809 CA GLY A 140 3.536 -2.433 6.613 1.00 0.00 C ATOM 810 C GLY A 140 3.822 -1.897 8.000 1.00 0.00 C ATOM 811 O GLY A 140 4.160 -0.725 8.164 1.00 0.00 O ATOM 0 H GLY A 140 4.042 -4.360 5.959 1.00 0.00 H new ATOM 0 HA2 GLY A 140 3.578 -1.614 5.895 1.00 0.00 H new ATOM 0 HA3 GLY A 140 2.522 -2.832 6.583 1.00 0.00 H new ATOM 815 N ASP A 141 3.678 -2.755 9.002 1.00 0.00 N ATOM 816 CA ASP A 141 3.913 -2.362 10.385 1.00 0.00 C ATOM 817 C ASP A 141 5.407 -2.261 10.682 1.00 0.00 C ATOM 818 O ASP A 141 5.876 -1.255 11.215 1.00 0.00 O ATOM 819 CB ASP A 141 3.250 -3.362 11.335 1.00 0.00 C ATOM 820 CG ASP A 141 3.495 -3.029 12.795 1.00 0.00 C ATOM 821 OD1 ASP A 141 3.175 -1.894 13.207 1.00 0.00 O ATOM 822 OD2 ASP A 141 4.006 -3.904 13.525 1.00 0.00 O ATOM 0 H ASP A 141 3.399 -3.729 8.882 1.00 0.00 H new ATOM 0 HA ASP A 141 3.472 -1.377 10.539 1.00 0.00 H new ATOM 0 HB2 ASP A 141 2.177 -3.381 11.145 1.00 0.00 H new ATOM 0 HB3 ASP A 141 3.629 -4.363 11.126 1.00 0.00 H new ATOM 827 N LYS A 142 6.151 -3.311 10.333 1.00 0.00 N ATOM 828 CA LYS A 142 7.599 -3.351 10.558 1.00 0.00 C ATOM 829 C LYS A 142 7.973 -2.814 11.935 1.00 0.00 C ATOM 830 O LYS A 142 9.054 -2.259 12.129 1.00 0.00 O ATOM 831 CB LYS A 142 8.340 -2.557 9.490 1.00 0.00 C ATOM 832 CG LYS A 142 7.591 -1.336 8.979 1.00 0.00 C ATOM 833 CD LYS A 142 8.335 -0.665 7.835 1.00 0.00 C ATOM 834 CE LYS A 142 9.111 0.552 8.312 1.00 0.00 C ATOM 835 NZ LYS A 142 9.503 1.440 7.183 1.00 0.00 N ATOM 0 H LYS A 142 5.774 -4.150 9.891 1.00 0.00 H new ATOM 0 HA LYS A 142 7.897 -4.398 10.502 1.00 0.00 H new ATOM 0 HB2 LYS A 142 9.300 -2.236 9.894 1.00 0.00 H new ATOM 0 HB3 LYS A 142 8.553 -3.216 8.648 1.00 0.00 H new ATOM 0 HG2 LYS A 142 6.597 -1.631 8.644 1.00 0.00 H new ATOM 0 HG3 LYS A 142 7.455 -0.624 9.793 1.00 0.00 H new ATOM 0 HD2 LYS A 142 9.021 -1.378 7.378 1.00 0.00 H new ATOM 0 HD3 LYS A 142 7.625 -0.366 7.064 1.00 0.00 H new ATOM 0 HE2 LYS A 142 8.504 1.114 9.022 1.00 0.00 H new ATOM 0 HE3 LYS A 142 10.005 0.227 8.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 10.373 1.953 7.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 9.670 0.866 6.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 8.740 2.122 6.997 1.00 0.00 H new ATOM 849 N ASN A 143 7.068 -2.984 12.878 1.00 0.00 N ATOM 850 CA ASN A 143 7.282 -2.521 14.246 1.00 0.00 C ATOM 851 C ASN A 143 7.253 -3.683 15.240 1.00 0.00 C ATOM 852 O ASN A 143 7.542 -3.502 16.423 1.00 0.00 O ATOM 853 CB ASN A 143 6.222 -1.486 14.625 1.00 0.00 C ATOM 854 CG ASN A 143 6.766 -0.411 15.545 1.00 0.00 C ATOM 855 OD1 ASN A 143 7.627 -0.674 16.384 1.00 0.00 O ATOM 856 ND2 ASN A 143 6.264 0.809 15.391 1.00 0.00 N ATOM 0 H ASN A 143 6.169 -3.442 12.726 1.00 0.00 H new ATOM 0 HA ASN A 143 8.269 -2.061 14.291 1.00 0.00 H new ATOM 0 HB2 ASN A 143 5.831 -1.022 13.719 1.00 0.00 H new ATOM 0 HB3 ASN A 143 5.386 -1.988 15.112 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.591 1.573 15.982 1.00 0.00 H new ATOM 0 HD22 ASN A 143 5.551 0.981 14.682 1.00 0.00 H new ATOM 863 N ASN A 144 6.904 -4.874 14.757 1.00 0.00 N ATOM 864 CA ASN A 144 6.842 -6.058 15.609 1.00 0.00 C ATOM 865 C ASN A 144 5.711 -5.945 16.629 1.00 0.00 C ATOM 866 O ASN A 144 5.753 -6.575 17.685 1.00 0.00 O ATOM 867 CB ASN A 144 8.175 -6.267 16.332 1.00 0.00 C ATOM 868 CG ASN A 144 8.326 -7.676 16.871 1.00 0.00 C ATOM 869 OD1 ASN A 144 8.352 -7.889 18.083 1.00 0.00 O ATOM 870 ND2 ASN A 144 8.425 -8.646 15.970 1.00 0.00 N ATOM 0 H ASN A 144 6.660 -5.044 13.781 1.00 0.00 H new ATOM 0 HA ASN A 144 6.644 -6.918 14.969 1.00 0.00 H new ATOM 0 HB2 ASN A 144 8.995 -6.054 15.646 1.00 0.00 H new ATOM 0 HB3 ASN A 144 8.255 -5.556 17.154 1.00 0.00 H new ATOM 0 HD21 ASN A 144 8.527 -9.615 16.273 1.00 0.00 H new ATOM 0 HD22 ASN A 144 8.399 -8.423 14.975 1.00 0.00 H new ATOM 877 N ASP A 145 4.700 -5.144 16.306 1.00 0.00 N ATOM 878 CA ASP A 145 3.560 -4.959 17.199 1.00 0.00 C ATOM 879 C ASP A 145 2.273 -5.491 16.570 1.00 0.00 C ATOM 880 O ASP A 145 1.305 -5.783 17.271 1.00 0.00 O ATOM 881 CB ASP A 145 3.396 -3.480 17.561 1.00 0.00 C ATOM 882 CG ASP A 145 3.190 -2.598 16.345 1.00 0.00 C ATOM 883 OD1 ASP A 145 2.567 -3.065 15.369 1.00 0.00 O ATOM 884 OD2 ASP A 145 3.650 -1.437 16.370 1.00 0.00 O ATOM 0 H ASP A 145 4.646 -4.614 15.436 1.00 0.00 H new ATOM 0 HA ASP A 145 3.755 -5.527 18.109 1.00 0.00 H new ATOM 0 HB2 ASP A 145 2.546 -3.367 18.234 1.00 0.00 H new ATOM 0 HB3 ASP A 145 4.279 -3.143 18.103 1.00 0.00 H new ATOM 889 N GLY A 146 2.268 -5.617 15.245 1.00 0.00 N ATOM 890 CA GLY A 146 1.094 -6.115 14.553 1.00 0.00 C ATOM 891 C GLY A 146 -0.002 -5.073 14.441 1.00 0.00 C ATOM 892 O GLY A 146 -1.121 -5.287 14.907 1.00 0.00 O ATOM 0 H GLY A 146 3.055 -5.383 14.640 1.00 0.00 H new ATOM 0 HA2 GLY A 146 1.379 -6.446 13.554 1.00 0.00 H new ATOM 0 HA3 GLY A 146 0.708 -6.987 15.081 1.00 0.00 H new ATOM 896 N ARG A 147 0.320 -3.941 13.821 1.00 0.00 N ATOM 897 CA ARG A 147 -0.648 -2.863 13.650 1.00 0.00 C ATOM 898 C ARG A 147 -0.040 -1.701 12.870 1.00 0.00 C ATOM 899 O ARG A 147 0.857 -1.014 13.359 1.00 0.00 O ATOM 900 CB ARG A 147 -1.146 -2.375 15.014 1.00 0.00 C ATOM 901 CG ARG A 147 -2.655 -2.463 15.177 1.00 0.00 C ATOM 902 CD ARG A 147 -3.107 -1.873 16.503 1.00 0.00 C ATOM 903 NE ARG A 147 -4.507 -2.177 16.788 1.00 0.00 N ATOM 904 CZ ARG A 147 -4.950 -3.385 17.128 1.00 0.00 C ATOM 905 NH1 ARG A 147 -4.105 -4.405 17.227 1.00 0.00 N ATOM 906 NH2 ARG A 147 -6.239 -3.575 17.371 1.00 0.00 N ATOM 0 H ARG A 147 1.242 -3.747 13.430 1.00 0.00 H new ATOM 0 HA ARG A 147 -1.492 -3.254 13.081 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -0.669 -2.964 15.798 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -0.833 -1.341 15.157 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -3.142 -1.935 14.357 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -2.969 -3.505 15.115 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -2.481 -2.263 17.306 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -2.967 -0.792 16.486 1.00 0.00 H new ATOM 0 HE ARG A 147 -5.186 -1.418 16.723 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -3.112 -4.264 17.042 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -4.449 -5.329 17.488 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -6.892 -2.795 17.297 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -6.578 -4.501 17.632 1.00 0.00 H new ATOM 920 N ILE A 148 -0.539 -1.484 11.657 1.00 0.00 N ATOM 921 CA ILE A 148 -0.050 -0.403 10.811 1.00 0.00 C ATOM 922 C ILE A 148 -1.154 0.618 10.558 1.00 0.00 C ATOM 923 O ILE A 148 -2.284 0.251 10.245 1.00 0.00 O ATOM 924 CB ILE A 148 0.490 -0.950 9.471 1.00 0.00 C ATOM 925 CG1 ILE A 148 1.425 0.063 8.812 1.00 0.00 C ATOM 926 CG2 ILE A 148 -0.638 -1.331 8.529 1.00 0.00 C ATOM 927 CD1 ILE A 148 0.715 1.269 8.242 1.00 0.00 C ATOM 0 H ILE A 148 -1.282 -2.043 11.239 1.00 0.00 H new ATOM 0 HA ILE A 148 0.770 0.089 11.334 1.00 0.00 H new ATOM 0 HB ILE A 148 1.058 -1.855 9.689 1.00 0.00 H new ATOM 0 HG12 ILE A 148 2.158 0.398 9.546 1.00 0.00 H new ATOM 0 HG13 ILE A 148 1.977 -0.433 8.014 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -0.221 -1.712 7.597 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -1.254 -2.102 8.992 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -1.250 -0.454 8.321 1.00 0.00 H new ATOM 0 HD11 ILE A 148 1.445 1.942 7.792 1.00 0.00 H new ATOM 0 HD12 ILE A 148 0.002 0.947 7.483 1.00 0.00 H new ATOM 0 HD13 ILE A 148 0.185 1.790 9.040 1.00 0.00 H new ATOM 939 N ASP A 149 -0.830 1.900 10.714 1.00 0.00 N ATOM 940 CA ASP A 149 -1.814 2.961 10.523 1.00 0.00 C ATOM 941 C ASP A 149 -1.461 3.868 9.346 1.00 0.00 C ATOM 942 O ASP A 149 -0.417 3.718 8.715 1.00 0.00 O ATOM 943 CB ASP A 149 -1.936 3.797 11.800 1.00 0.00 C ATOM 944 CG ASP A 149 -0.669 4.569 12.113 1.00 0.00 C ATOM 945 OD1 ASP A 149 0.414 4.140 11.662 1.00 0.00 O ATOM 946 OD2 ASP A 149 -0.759 5.602 12.809 1.00 0.00 O ATOM 0 H ASP A 149 0.101 2.227 10.971 1.00 0.00 H new ATOM 0 HA ASP A 149 -2.768 2.484 10.299 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -2.766 4.495 11.695 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -2.174 3.142 12.638 1.00 0.00 H new ATOM 951 N TYR A 150 -2.357 4.810 9.063 1.00 0.00 N ATOM 952 CA TYR A 150 -2.180 5.762 7.966 1.00 0.00 C ATOM 953 C TYR A 150 -0.751 6.303 7.907 1.00 0.00 C ATOM 954 O TYR A 150 -0.245 6.621 6.831 1.00 0.00 O ATOM 955 CB TYR A 150 -3.171 6.919 8.122 1.00 0.00 C ATOM 956 CG TYR A 150 -3.092 7.962 7.026 1.00 0.00 C ATOM 957 CD1 TYR A 150 -2.580 7.654 5.772 1.00 0.00 C ATOM 958 CD2 TYR A 150 -3.538 9.259 7.250 1.00 0.00 C ATOM 959 CE1 TYR A 150 -2.513 8.608 4.774 1.00 0.00 C ATOM 960 CE2 TYR A 150 -3.474 10.218 6.257 1.00 0.00 C ATOM 961 CZ TYR A 150 -2.961 9.888 5.022 1.00 0.00 C ATOM 962 OH TYR A 150 -2.897 10.840 4.030 1.00 0.00 O ATOM 0 H TYR A 150 -3.224 4.936 9.585 1.00 0.00 H new ATOM 0 HA TYR A 150 -2.371 5.235 7.031 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -4.183 6.514 8.149 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -2.996 7.404 9.082 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -2.228 6.652 5.573 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -3.942 9.522 8.217 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -2.112 8.352 3.805 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -3.825 11.221 6.448 1.00 0.00 H new ATOM 0 HH TYR A 150 -3.254 11.688 4.367 1.00 0.00 H new ATOM 972 N ASP A 151 -0.105 6.406 9.064 1.00 0.00 N ATOM 973 CA ASP A 151 1.264 6.910 9.131 1.00 0.00 C ATOM 974 C ASP A 151 2.237 5.933 8.481 1.00 0.00 C ATOM 975 O ASP A 151 2.772 6.201 7.405 1.00 0.00 O ATOM 976 CB ASP A 151 1.667 7.162 10.586 1.00 0.00 C ATOM 977 CG ASP A 151 3.054 7.763 10.706 1.00 0.00 C ATOM 978 OD1 ASP A 151 4.011 7.156 10.182 1.00 0.00 O ATOM 979 OD2 ASP A 151 3.182 8.841 11.324 1.00 0.00 O ATOM 0 H ASP A 151 -0.505 6.148 9.966 1.00 0.00 H new ATOM 0 HA ASP A 151 1.305 7.851 8.583 1.00 0.00 H new ATOM 0 HB2 ASP A 151 0.943 7.831 11.050 1.00 0.00 H new ATOM 0 HB3 ASP A 151 1.632 6.223 11.138 1.00 0.00 H new ATOM 984 N GLU A 152 2.461 4.798 9.135 1.00 0.00 N ATOM 985 CA GLU A 152 3.369 3.783 8.612 1.00 0.00 C ATOM 986 C GLU A 152 2.956 3.359 7.205 1.00 0.00 C ATOM 987 O GLU A 152 3.777 2.872 6.427 1.00 0.00 O ATOM 988 CB GLU A 152 3.401 2.566 9.539 1.00 0.00 C ATOM 989 CG GLU A 152 4.517 2.615 10.569 1.00 0.00 C ATOM 990 CD GLU A 152 4.235 1.742 11.777 1.00 0.00 C ATOM 991 OE1 GLU A 152 4.042 0.521 11.595 1.00 0.00 O ATOM 992 OE2 GLU A 152 4.206 2.279 12.904 1.00 0.00 O ATOM 0 H GLU A 152 2.027 4.558 10.026 1.00 0.00 H new ATOM 0 HA GLU A 152 4.368 4.215 8.563 1.00 0.00 H new ATOM 0 HB2 GLU A 152 2.444 2.488 10.056 1.00 0.00 H new ATOM 0 HB3 GLU A 152 3.513 1.664 8.937 1.00 0.00 H new ATOM 0 HG2 GLU A 152 5.450 2.295 10.104 1.00 0.00 H new ATOM 0 HG3 GLU A 152 4.660 3.645 10.895 1.00 0.00 H new ATOM 999 N PHE A 153 1.680 3.555 6.881 1.00 0.00 N ATOM 1000 CA PHE A 153 1.164 3.200 5.565 1.00 0.00 C ATOM 1001 C PHE A 153 1.933 3.939 4.475 1.00 0.00 C ATOM 1002 O PHE A 153 2.228 3.381 3.420 1.00 0.00 O ATOM 1003 CB PHE A 153 -0.333 3.527 5.478 1.00 0.00 C ATOM 1004 CG PHE A 153 -0.883 3.518 4.077 1.00 0.00 C ATOM 1005 CD1 PHE A 153 -0.376 2.650 3.124 1.00 0.00 C ATOM 1006 CD2 PHE A 153 -1.902 4.384 3.714 1.00 0.00 C ATOM 1007 CE1 PHE A 153 -0.875 2.645 1.838 1.00 0.00 C ATOM 1008 CE2 PHE A 153 -2.405 4.382 2.427 1.00 0.00 C ATOM 1009 CZ PHE A 153 -1.890 3.511 1.488 1.00 0.00 C ATOM 0 H PHE A 153 0.987 3.957 7.512 1.00 0.00 H new ATOM 0 HA PHE A 153 1.297 2.129 5.415 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.887 2.806 6.079 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -0.506 4.509 5.918 1.00 0.00 H new ATOM 0 HD1 PHE A 153 0.419 1.969 3.391 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -2.307 5.068 4.445 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -0.471 1.963 1.105 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -3.200 5.061 2.156 1.00 0.00 H new ATOM 0 HZ PHE A 153 -2.281 3.508 0.481 1.00 0.00 H new ATOM 1019 N LEU A 154 2.258 5.196 4.740 1.00 0.00 N ATOM 1020 CA LEU A 154 2.997 6.007 3.784 1.00 0.00 C ATOM 1021 C LEU A 154 4.359 5.387 3.481 1.00 0.00 C ATOM 1022 O LEU A 154 4.968 5.679 2.452 1.00 0.00 O ATOM 1023 CB LEU A 154 3.155 7.432 4.321 1.00 0.00 C ATOM 1024 CG LEU A 154 1.851 8.117 4.756 1.00 0.00 C ATOM 1025 CD1 LEU A 154 1.885 9.598 4.413 1.00 0.00 C ATOM 1026 CD2 LEU A 154 0.638 7.451 4.112 1.00 0.00 C ATOM 0 H LEU A 154 2.022 5.676 5.608 1.00 0.00 H new ATOM 0 HA LEU A 154 2.435 6.045 2.851 1.00 0.00 H new ATOM 0 HB2 LEU A 154 3.835 7.409 5.172 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.628 8.042 3.552 1.00 0.00 H new ATOM 0 HG LEU A 154 1.762 8.011 5.837 1.00 0.00 H new ATOM 0 HD11 LEU A 154 0.953 10.066 4.729 1.00 0.00 H new ATOM 0 HD12 LEU A 154 2.721 10.072 4.927 1.00 0.00 H new ATOM 0 HD13 LEU A 154 2.006 9.719 3.337 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -0.271 7.957 4.438 1.00 0.00 H new ATOM 0 HD22 LEU A 154 0.720 7.516 3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 154 0.597 6.403 4.410 1.00 0.00 H new ATOM 1038 N GLU A 155 4.824 4.514 4.373 1.00 0.00 N ATOM 1039 CA GLU A 155 6.103 3.840 4.184 1.00 0.00 C ATOM 1040 C GLU A 155 6.008 2.828 3.044 1.00 0.00 C ATOM 1041 O GLU A 155 7.009 2.490 2.412 1.00 0.00 O ATOM 1042 CB GLU A 155 6.530 3.136 5.474 1.00 0.00 C ATOM 1043 CG GLU A 155 6.585 4.059 6.681 1.00 0.00 C ATOM 1044 CD GLU A 155 7.930 4.743 6.830 1.00 0.00 C ATOM 1045 OE1 GLU A 155 8.421 5.312 5.833 1.00 0.00 O ATOM 1046 OE2 GLU A 155 8.492 4.710 7.945 1.00 0.00 O ATOM 0 H GLU A 155 4.334 4.259 5.231 1.00 0.00 H new ATOM 0 HA GLU A 155 6.852 4.589 3.927 1.00 0.00 H new ATOM 0 HB2 GLU A 155 5.835 2.322 5.681 1.00 0.00 H new ATOM 0 HB3 GLU A 155 7.512 2.687 5.325 1.00 0.00 H new ATOM 0 HG2 GLU A 155 5.805 4.815 6.592 1.00 0.00 H new ATOM 0 HG3 GLU A 155 6.371 3.485 7.583 1.00 0.00 H new ATOM 1053 N PHE A 156 4.792 2.355 2.783 1.00 0.00 N ATOM 1054 CA PHE A 156 4.553 1.390 1.714 1.00 0.00 C ATOM 1055 C PHE A 156 4.964 1.973 0.365 1.00 0.00 C ATOM 1056 O PHE A 156 5.848 1.445 -0.310 1.00 0.00 O ATOM 1057 CB PHE A 156 3.071 1.001 1.681 1.00 0.00 C ATOM 1058 CG PHE A 156 2.819 -0.476 1.785 1.00 0.00 C ATOM 1059 CD1 PHE A 156 2.891 -1.120 3.010 1.00 0.00 C ATOM 1060 CD2 PHE A 156 2.496 -1.217 0.660 1.00 0.00 C ATOM 1061 CE1 PHE A 156 2.645 -2.476 3.110 1.00 0.00 C ATOM 1062 CE2 PHE A 156 2.252 -2.573 0.754 1.00 0.00 C ATOM 1063 CZ PHE A 156 2.326 -3.203 1.981 1.00 0.00 C ATOM 0 H PHE A 156 3.955 2.625 3.299 1.00 0.00 H new ATOM 0 HA PHE A 156 5.154 0.502 1.909 1.00 0.00 H new ATOM 0 HB2 PHE A 156 2.557 1.504 2.500 1.00 0.00 H new ATOM 0 HB3 PHE A 156 2.631 1.369 0.754 1.00 0.00 H new ATOM 0 HD1 PHE A 156 3.142 -0.556 3.896 1.00 0.00 H new ATOM 0 HD2 PHE A 156 2.434 -0.729 -0.301 1.00 0.00 H new ATOM 0 HE1 PHE A 156 2.702 -2.966 4.071 1.00 0.00 H new ATOM 0 HE2 PHE A 156 2.004 -3.140 -0.131 1.00 0.00 H new ATOM 0 HZ PHE A 156 2.134 -4.263 2.057 1.00 0.00 H new ATOM 1073 N MET A 157 4.311 3.065 -0.018 1.00 0.00 N ATOM 1074 CA MET A 157 4.596 3.727 -1.285 1.00 0.00 C ATOM 1075 C MET A 157 6.013 4.300 -1.308 1.00 0.00 C ATOM 1076 O MET A 157 6.593 4.494 -2.376 1.00 0.00 O ATOM 1077 CB MET A 157 3.571 4.838 -1.544 1.00 0.00 C ATOM 1078 CG MET A 157 3.847 6.125 -0.780 1.00 0.00 C ATOM 1079 SD MET A 157 4.602 7.396 -1.812 1.00 0.00 S ATOM 1080 CE MET A 157 3.156 8.078 -2.620 1.00 0.00 C ATOM 0 H MET A 157 3.578 3.511 0.533 1.00 0.00 H new ATOM 0 HA MET A 157 4.523 2.982 -2.077 1.00 0.00 H new ATOM 0 HB2 MET A 157 3.551 5.058 -2.611 1.00 0.00 H new ATOM 0 HB3 MET A 157 2.580 4.473 -1.275 1.00 0.00 H new ATOM 0 HG2 MET A 157 2.913 6.505 -0.367 1.00 0.00 H new ATOM 0 HG3 MET A 157 4.504 5.909 0.063 1.00 0.00 H new ATOM 0 HE1 MET A 157 3.326 8.121 -3.696 1.00 0.00 H new ATOM 0 HE2 MET A 157 2.292 7.446 -2.414 1.00 0.00 H new ATOM 0 HE3 MET A 157 2.968 9.083 -2.242 1.00 0.00 H new ATOM 1090 N LYS A 158 6.565 4.572 -0.125 1.00 0.00 N ATOM 1091 CA LYS A 158 7.913 5.126 -0.016 1.00 0.00 C ATOM 1092 C LYS A 158 8.888 4.385 -0.928 1.00 0.00 C ATOM 1093 O LYS A 158 9.822 4.979 -1.468 1.00 0.00 O ATOM 1094 CB LYS A 158 8.397 5.061 1.435 1.00 0.00 C ATOM 1095 CG LYS A 158 8.611 6.429 2.063 1.00 0.00 C ATOM 1096 CD LYS A 158 10.040 6.601 2.556 1.00 0.00 C ATOM 1097 CE LYS A 158 10.518 8.035 2.393 1.00 0.00 C ATOM 1098 NZ LYS A 158 10.564 8.756 3.695 1.00 0.00 N ATOM 0 H LYS A 158 6.099 4.418 0.769 1.00 0.00 H new ATOM 0 HA LYS A 158 7.876 6.168 -0.333 1.00 0.00 H new ATOM 0 HB2 LYS A 158 7.669 4.507 2.028 1.00 0.00 H new ATOM 0 HB3 LYS A 158 9.332 4.502 1.474 1.00 0.00 H new ATOM 0 HG2 LYS A 158 8.381 7.205 1.333 1.00 0.00 H new ATOM 0 HG3 LYS A 158 7.920 6.560 2.896 1.00 0.00 H new ATOM 0 HD2 LYS A 158 10.101 6.313 3.606 1.00 0.00 H new ATOM 0 HD3 LYS A 158 10.699 5.932 2.003 1.00 0.00 H new ATOM 0 HE2 LYS A 158 11.510 8.038 1.941 1.00 0.00 H new ATOM 0 HE3 LYS A 158 9.854 8.563 1.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 10.895 9.730 3.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 9.613 8.776 4.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 11.217 8.267 4.340 1.00 0.00 H new ATOM 1112 N GLY A 159 8.659 3.088 -1.102 1.00 0.00 N ATOM 1113 CA GLY A 159 9.519 2.295 -1.958 1.00 0.00 C ATOM 1114 C GLY A 159 9.337 2.644 -3.421 1.00 0.00 C ATOM 1115 O GLY A 159 10.298 2.652 -4.191 1.00 0.00 O ATOM 0 H GLY A 159 7.894 2.573 -0.666 1.00 0.00 H new ATOM 0 HA2 GLY A 159 10.559 2.453 -1.674 1.00 0.00 H new ATOM 0 HA3 GLY A 159 9.305 1.237 -1.808 1.00 0.00 H new ATOM 1119 N VAL A 160 8.099 2.939 -3.801 1.00 0.00 N ATOM 1120 CA VAL A 160 7.783 3.299 -5.174 1.00 0.00 C ATOM 1121 C VAL A 160 8.503 4.580 -5.585 1.00 0.00 C ATOM 1122 O VAL A 160 8.746 4.814 -6.769 1.00 0.00 O ATOM 1123 CB VAL A 160 6.265 3.490 -5.359 1.00 0.00 C ATOM 1124 CG1 VAL A 160 5.932 3.770 -6.813 1.00 0.00 C ATOM 1125 CG2 VAL A 160 5.508 2.269 -4.857 1.00 0.00 C ATOM 0 H VAL A 160 7.296 2.935 -3.172 1.00 0.00 H new ATOM 0 HA VAL A 160 8.121 2.480 -5.809 1.00 0.00 H new ATOM 0 HB VAL A 160 5.953 4.352 -4.769 1.00 0.00 H new ATOM 0 HG11 VAL A 160 4.855 3.902 -6.921 1.00 0.00 H new ATOM 0 HG12 VAL A 160 6.443 4.678 -7.135 1.00 0.00 H new ATOM 0 HG13 VAL A 160 6.259 2.932 -7.429 1.00 0.00 H new ATOM 0 HG21 VAL A 160 4.438 2.422 -4.996 1.00 0.00 H new ATOM 0 HG22 VAL A 160 5.824 1.389 -5.417 1.00 0.00 H new ATOM 0 HG23 VAL A 160 5.719 2.120 -3.798 1.00 0.00 H new ATOM 1135 N GLU A 161 8.843 5.406 -4.600 1.00 0.00 N ATOM 1136 CA GLU A 161 9.536 6.662 -4.861 1.00 0.00 C ATOM 1137 C GLU A 161 11.047 6.480 -4.765 1.00 0.00 C ATOM 1138 O GLU A 161 11.492 5.331 -4.557 1.00 0.00 O ATOM 1139 CB GLU A 161 9.075 7.737 -3.875 1.00 0.00 C ATOM 1140 CG GLU A 161 8.885 9.105 -4.511 1.00 0.00 C ATOM 1141 CD GLU A 161 7.846 9.943 -3.792 1.00 0.00 C ATOM 1142 OE1 GLU A 161 6.842 9.368 -3.321 1.00 0.00 O ATOM 1143 OE2 GLU A 161 8.037 11.173 -3.699 1.00 0.00 O ATOM 1144 OXT GLU A 161 11.774 7.487 -4.899 1.00 0.00 O ATOM 0 H GLU A 161 8.650 5.228 -3.614 1.00 0.00 H new ATOM 0 HA GLU A 161 9.291 6.980 -5.874 1.00 0.00 H new ATOM 0 HB2 GLU A 161 8.135 7.423 -3.421 1.00 0.00 H new ATOM 0 HB3 GLU A 161 9.806 7.818 -3.071 1.00 0.00 H new ATOM 0 HG2 GLU A 161 9.837 9.636 -4.513 1.00 0.00 H new ATOM 0 HG3 GLU A 161 8.588 8.979 -5.552 1.00 0.00 H new ATOM 1226 N PHE B 132 6.470 -6.311 -4.922 1.00 0.00 N ATOM 1227 CA PHE B 132 6.488 -6.843 -6.279 1.00 0.00 C ATOM 1228 C PHE B 132 5.671 -5.965 -7.240 1.00 0.00 C ATOM 1229 O PHE B 132 6.090 -4.855 -7.568 1.00 0.00 O ATOM 1230 CB PHE B 132 5.999 -8.299 -6.283 1.00 0.00 C ATOM 1231 CG PHE B 132 5.130 -8.663 -5.109 1.00 0.00 C ATOM 1232 CD1 PHE B 132 5.699 -9.044 -3.904 1.00 0.00 C ATOM 1233 CD2 PHE B 132 3.750 -8.636 -5.213 1.00 0.00 C ATOM 1234 CE1 PHE B 132 4.907 -9.388 -2.825 1.00 0.00 C ATOM 1235 CE2 PHE B 132 2.953 -8.981 -4.138 1.00 0.00 C ATOM 1236 CZ PHE B 132 3.532 -9.357 -2.942 1.00 0.00 C ATOM 0 HA PHE B 132 7.516 -6.829 -6.640 1.00 0.00 H new ATOM 0 HB2 PHE B 132 5.442 -8.481 -7.202 1.00 0.00 H new ATOM 0 HB3 PHE B 132 6.865 -8.961 -6.298 1.00 0.00 H new ATOM 0 HD1 PHE B 132 6.774 -9.072 -3.807 1.00 0.00 H new ATOM 0 HD2 PHE B 132 3.291 -8.342 -6.145 1.00 0.00 H new ATOM 0 HE1 PHE B 132 5.363 -9.681 -1.891 1.00 0.00 H new ATOM 0 HE2 PHE B 132 1.877 -8.957 -4.233 1.00 0.00 H new ATOM 0 HZ PHE B 132 2.911 -9.626 -2.101 1.00 0.00 H new ATOM 1246 N ASP B 133 4.515 -6.453 -7.697 1.00 0.00 N ATOM 1247 CA ASP B 133 3.677 -5.691 -8.619 1.00 0.00 C ATOM 1248 C ASP B 133 2.982 -4.533 -7.908 1.00 0.00 C ATOM 1249 O ASP B 133 2.355 -3.688 -8.547 1.00 0.00 O ATOM 1250 CB ASP B 133 2.634 -6.606 -9.264 1.00 0.00 C ATOM 1251 CG ASP B 133 1.695 -7.221 -8.244 1.00 0.00 C ATOM 1252 OD1 ASP B 133 0.826 -6.492 -7.721 1.00 0.00 O ATOM 1253 OD2 ASP B 133 1.828 -8.432 -7.969 1.00 0.00 O ATOM 0 H ASP B 133 4.142 -7.368 -7.444 1.00 0.00 H new ATOM 0 HA ASP B 133 4.323 -5.277 -9.394 1.00 0.00 H new ATOM 0 HB2 ASP B 133 2.054 -6.036 -9.990 1.00 0.00 H new ATOM 0 HB3 ASP B 133 3.141 -7.400 -9.813 1.00 0.00 H new ATOM 1258 N LEU B 134 3.099 -4.497 -6.586 1.00 0.00 N ATOM 1259 CA LEU B 134 2.486 -3.444 -5.791 1.00 0.00 C ATOM 1260 C LEU B 134 3.143 -2.103 -6.086 1.00 0.00 C ATOM 1261 O LEU B 134 2.478 -1.069 -6.156 1.00 0.00 O ATOM 1262 CB LEU B 134 2.620 -3.764 -4.302 1.00 0.00 C ATOM 1263 CG LEU B 134 1.757 -4.922 -3.798 1.00 0.00 C ATOM 1264 CD1 LEU B 134 2.022 -6.182 -4.608 1.00 0.00 C ATOM 1265 CD2 LEU B 134 2.025 -5.178 -2.322 1.00 0.00 C ATOM 0 H LEU B 134 3.615 -5.188 -6.042 1.00 0.00 H new ATOM 0 HA LEU B 134 1.430 -3.385 -6.053 1.00 0.00 H new ATOM 0 HB2 LEU B 134 3.664 -3.993 -4.090 1.00 0.00 H new ATOM 0 HB3 LEU B 134 2.367 -2.870 -3.732 1.00 0.00 H new ATOM 0 HG LEU B 134 0.709 -4.648 -3.922 1.00 0.00 H new ATOM 0 HD11 LEU B 134 1.398 -6.993 -4.233 1.00 0.00 H new ATOM 0 HD12 LEU B 134 1.786 -5.997 -5.656 1.00 0.00 H new ATOM 0 HD13 LEU B 134 3.072 -6.460 -4.516 1.00 0.00 H new ATOM 0 HD21 LEU B 134 1.404 -6.005 -1.977 1.00 0.00 H new ATOM 0 HD22 LEU B 134 3.076 -5.431 -2.182 1.00 0.00 H new ATOM 0 HD23 LEU B 134 1.788 -4.282 -1.748 1.00 0.00 H new ATOM 1277 N ARG B 135 4.458 -2.134 -6.254 1.00 0.00 N ATOM 1278 CA ARG B 135 5.227 -0.929 -6.538 1.00 0.00 C ATOM 1279 C ARG B 135 4.811 -0.312 -7.870 1.00 0.00 C ATOM 1280 O ARG B 135 4.444 0.861 -7.932 1.00 0.00 O ATOM 1281 CB ARG B 135 6.723 -1.251 -6.557 1.00 0.00 C ATOM 1282 CG ARG B 135 7.603 -0.047 -6.851 1.00 0.00 C ATOM 1283 CD ARG B 135 9.077 -0.418 -6.838 1.00 0.00 C ATOM 1284 NE ARG B 135 9.874 0.471 -7.680 1.00 0.00 N ATOM 1285 CZ ARG B 135 9.955 0.362 -9.004 1.00 0.00 C ATOM 1286 NH1 ARG B 135 9.290 -0.593 -9.642 1.00 0.00 N ATOM 1287 NH2 ARG B 135 10.705 1.211 -9.693 1.00 0.00 N ATOM 0 H ARG B 135 5.017 -2.985 -6.198 1.00 0.00 H new ATOM 0 HA ARG B 135 5.024 -0.205 -5.748 1.00 0.00 H new ATOM 0 HB2 ARG B 135 7.008 -1.671 -5.592 1.00 0.00 H new ATOM 0 HB3 ARG B 135 6.911 -2.019 -7.307 1.00 0.00 H new ATOM 0 HG2 ARG B 135 7.340 0.368 -7.824 1.00 0.00 H new ATOM 0 HG3 ARG B 135 7.416 0.731 -6.111 1.00 0.00 H new ATOM 0 HD2 ARG B 135 9.451 -0.380 -5.815 1.00 0.00 H new ATOM 0 HD3 ARG B 135 9.195 -1.445 -7.182 1.00 0.00 H new ATOM 0 HE ARG B 135 10.399 1.219 -7.227 1.00 0.00 H new ATOM 0 HH11 ARG B 135 8.712 -1.250 -9.117 1.00 0.00 H new ATOM 0 HH12 ARG B 135 9.357 -0.670 -10.657 1.00 0.00 H new ATOM 0 HH21 ARG B 135 11.219 1.947 -9.208 1.00 0.00 H new ATOM 0 HH22 ARG B 135 10.768 1.128 -10.708 1.00 0.00 H new ATOM 1301 N GLY B 136 4.874 -1.107 -8.933 1.00 0.00 N ATOM 1302 CA GLY B 136 4.504 -0.616 -10.247 1.00 0.00 C ATOM 1303 C GLY B 136 3.013 -0.380 -10.384 1.00 0.00 C ATOM 1304 O GLY B 136 2.342 -1.045 -11.172 1.00 0.00 O ATOM 0 H GLY B 136 5.174 -2.081 -8.908 1.00 0.00 H new ATOM 0 HA2 GLY B 136 5.035 0.315 -10.445 1.00 0.00 H new ATOM 0 HA3 GLY B 136 4.825 -1.333 -11.002 1.00 0.00 H new ATOM 1308 N LYS B 137 2.496 0.574 -9.614 1.00 0.00 N ATOM 1309 CA LYS B 137 1.075 0.908 -9.645 1.00 0.00 C ATOM 1310 C LYS B 137 0.749 1.966 -8.597 1.00 0.00 C ATOM 1311 O LYS B 137 -0.093 2.837 -8.819 1.00 0.00 O ATOM 1312 CB LYS B 137 0.221 -0.340 -9.404 1.00 0.00 C ATOM 1313 CG LYS B 137 0.573 -1.082 -8.125 1.00 0.00 C ATOM 1314 CD LYS B 137 -0.519 -2.065 -7.736 1.00 0.00 C ATOM 1315 CE LYS B 137 -1.384 -1.523 -6.609 1.00 0.00 C ATOM 1316 NZ LYS B 137 -0.603 -1.323 -5.357 1.00 0.00 N ATOM 0 H LYS B 137 3.043 1.132 -8.958 1.00 0.00 H new ATOM 0 HA LYS B 137 0.845 1.307 -10.633 1.00 0.00 H new ATOM 0 HB2 LYS B 137 -0.829 -0.050 -9.368 1.00 0.00 H new ATOM 0 HB3 LYS B 137 0.336 -1.017 -10.250 1.00 0.00 H new ATOM 0 HG2 LYS B 137 1.514 -1.616 -8.259 1.00 0.00 H new ATOM 0 HG3 LYS B 137 0.725 -0.366 -7.317 1.00 0.00 H new ATOM 0 HD2 LYS B 137 -1.143 -2.279 -8.604 1.00 0.00 H new ATOM 0 HD3 LYS B 137 -0.068 -3.008 -7.428 1.00 0.00 H new ATOM 0 HE2 LYS B 137 -1.828 -0.576 -6.915 1.00 0.00 H new ATOM 0 HE3 LYS B 137 -2.206 -2.213 -6.418 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 -0.976 -1.946 -4.612 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 0.397 -1.552 -5.531 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 -0.683 -0.332 -5.052 1.00 0.00 H new ATOM 1330 N PHE B 138 1.422 1.882 -7.453 1.00 0.00 N ATOM 1331 CA PHE B 138 1.209 2.829 -6.365 1.00 0.00 C ATOM 1332 C PHE B 138 1.430 4.265 -6.834 1.00 0.00 C ATOM 1333 O PHE B 138 0.804 5.196 -6.328 1.00 0.00 O ATOM 1334 CB PHE B 138 2.147 2.507 -5.199 1.00 0.00 C ATOM 1335 CG PHE B 138 1.427 2.127 -3.938 1.00 0.00 C ATOM 1336 CD1 PHE B 138 0.944 3.101 -3.080 1.00 0.00 C ATOM 1337 CD2 PHE B 138 1.233 0.795 -3.612 1.00 0.00 C ATOM 1338 CE1 PHE B 138 0.280 2.753 -1.918 1.00 0.00 C ATOM 1339 CE2 PHE B 138 0.570 0.440 -2.452 1.00 0.00 C ATOM 1340 CZ PHE B 138 0.093 1.421 -1.604 1.00 0.00 C ATOM 0 H PHE B 138 2.121 1.166 -7.256 1.00 0.00 H new ATOM 0 HA PHE B 138 0.175 2.737 -6.031 1.00 0.00 H new ATOM 0 HB2 PHE B 138 2.809 1.691 -5.490 1.00 0.00 H new ATOM 0 HB3 PHE B 138 2.778 3.374 -5.001 1.00 0.00 H new ATOM 0 HD1 PHE B 138 1.088 4.144 -3.321 1.00 0.00 H new ATOM 0 HD2 PHE B 138 1.604 0.025 -4.272 1.00 0.00 H new ATOM 0 HE1 PHE B 138 -0.092 3.522 -1.257 1.00 0.00 H new ATOM 0 HE2 PHE B 138 0.425 -0.602 -2.209 1.00 0.00 H new ATOM 0 HZ PHE B 138 -0.425 1.147 -0.697 1.00 0.00 H new