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 98 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 150 TYR OH : rot 180:sc= -0.264 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl -161:sc= 0 (180deg=-0.008) USER MOD Single : A 106 LYS NZ :NH3+ 167:sc= 0.143 (180deg=0.0473) USER MOD Single : A 107 ASN : amide:sc= -0.418 K(o=-0.42,f=-1.9) 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= -6.89! (180deg=-9.57!) USER MOD Single : A 122 GLN : amide:sc= -0.22 X(o=-0.22,f=0) USER MOD Single : A 124 THR OG1 : rot 63:sc= -0.153 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot -91:sc= 1.14 USER MOD Single : A 137 MET CE :methyl 142:sc= -2.97 (180deg=-5.93!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= -3.35 K(o=-3.3,f=-4!) USER MOD Single : A 144 ASN : amide:sc= -0.103 K(o=-0.1,f=-1.7!) USER MOD Single : A 157 MET CE :methyl 139:sc= -0.47 (180deg=-3) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 LYS NZ :NH3+ -116:sc= -0.931 (180deg=-2.55!) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 93 -3.121 13.608 -4.493 1.00 0.00 N ATOM 72 CA SER A 93 -2.289 12.434 -4.255 1.00 0.00 C ATOM 73 C SER A 93 -2.569 11.828 -2.883 1.00 0.00 C ATOM 74 O SER A 93 -3.030 10.691 -2.778 1.00 0.00 O ATOM 75 CB SER A 93 -0.809 12.802 -4.370 1.00 0.00 C ATOM 76 OG SER A 93 -0.023 11.665 -4.686 1.00 0.00 O ATOM 0 HA SER A 93 -2.534 11.690 -5.013 1.00 0.00 H new ATOM 0 HB2 SER A 93 -0.679 13.563 -5.140 1.00 0.00 H new ATOM 0 HB3 SER A 93 -0.465 13.236 -3.431 1.00 0.00 H new ATOM 0 HG SER A 93 0.919 11.927 -4.756 1.00 0.00 H new ATOM 82 N GLU A 94 -2.283 12.591 -1.833 1.00 0.00 N ATOM 83 CA GLU A 94 -2.499 12.127 -0.466 1.00 0.00 C ATOM 84 C GLU A 94 -3.947 11.695 -0.251 1.00 0.00 C ATOM 85 O GLU A 94 -4.222 10.774 0.518 1.00 0.00 O ATOM 86 CB GLU A 94 -2.126 13.227 0.533 1.00 0.00 C ATOM 87 CG GLU A 94 -1.005 12.833 1.480 1.00 0.00 C ATOM 88 CD GLU A 94 0.246 12.384 0.750 1.00 0.00 C ATOM 89 OE1 GLU A 94 0.298 11.209 0.329 1.00 0.00 O ATOM 90 OE2 GLU A 94 1.172 13.208 0.598 1.00 0.00 O ATOM 0 H GLU A 94 -1.901 13.534 -1.902 1.00 0.00 H new ATOM 0 HA GLU A 94 -1.858 11.261 -0.301 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.829 14.120 -0.017 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.008 13.491 1.117 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.762 13.680 2.122 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.350 12.029 2.130 1.00 0.00 H new ATOM 97 N GLU A 95 -4.870 12.364 -0.935 1.00 0.00 N ATOM 98 CA GLU A 95 -6.288 12.045 -0.815 1.00 0.00 C ATOM 99 C GLU A 95 -6.557 10.595 -1.204 1.00 0.00 C ATOM 100 O GLU A 95 -7.510 9.980 -0.724 1.00 0.00 O ATOM 101 CB GLU A 95 -7.121 12.983 -1.690 1.00 0.00 C ATOM 102 CG GLU A 95 -6.840 12.839 -3.177 1.00 0.00 C ATOM 103 CD GLU A 95 -8.087 13.002 -4.024 1.00 0.00 C ATOM 104 OE1 GLU A 95 -8.877 12.039 -4.108 1.00 0.00 O ATOM 105 OE2 GLU A 95 -8.274 14.093 -4.602 1.00 0.00 O ATOM 0 H GLU A 95 -4.662 13.129 -1.577 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.576 12.181 0.227 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.179 12.792 -1.509 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.927 14.013 -1.390 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -6.102 13.582 -3.477 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.402 11.859 -3.367 1.00 0.00 H new ATOM 112 N GLU A 96 -5.712 10.052 -2.075 1.00 0.00 N ATOM 113 CA GLU A 96 -5.861 8.674 -2.525 1.00 0.00 C ATOM 114 C GLU A 96 -5.642 7.700 -1.373 1.00 0.00 C ATOM 115 O GLU A 96 -6.553 6.970 -0.982 1.00 0.00 O ATOM 116 CB GLU A 96 -4.875 8.374 -3.656 1.00 0.00 C ATOM 117 CG GLU A 96 -5.105 9.212 -4.903 1.00 0.00 C ATOM 118 CD GLU A 96 -4.088 8.929 -5.991 1.00 0.00 C ATOM 119 OE1 GLU A 96 -3.766 7.742 -6.208 1.00 0.00 O ATOM 120 OE2 GLU A 96 -3.614 9.894 -6.626 1.00 0.00 O ATOM 0 H GLU A 96 -4.918 10.546 -2.482 1.00 0.00 H new ATOM 0 HA GLU A 96 -6.878 8.548 -2.897 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -3.860 8.544 -3.296 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -4.947 7.319 -3.919 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -6.106 9.018 -5.287 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -5.064 10.269 -4.639 1.00 0.00 H new ATOM 127 N LEU A 97 -4.428 7.693 -0.833 1.00 0.00 N ATOM 128 CA LEU A 97 -4.090 6.808 0.274 1.00 0.00 C ATOM 129 C LEU A 97 -4.980 7.079 1.483 1.00 0.00 C ATOM 130 O LEU A 97 -5.267 6.176 2.268 1.00 0.00 O ATOM 131 CB LEU A 97 -2.619 6.977 0.653 1.00 0.00 C ATOM 132 CG LEU A 97 -1.626 6.516 -0.415 1.00 0.00 C ATOM 133 CD1 LEU A 97 -0.279 7.201 -0.229 1.00 0.00 C ATOM 134 CD2 LEU A 97 -1.472 5.003 -0.375 1.00 0.00 C ATOM 0 H LEU A 97 -3.662 8.290 -1.144 1.00 0.00 H new ATOM 0 HA LEU A 97 -4.259 5.780 -0.048 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -2.433 8.028 0.873 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -2.428 6.421 1.571 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.015 6.797 -1.394 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.413 6.859 -0.999 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.406 8.281 -0.309 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.122 6.954 0.754 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.762 4.689 -1.141 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -1.105 4.700 0.606 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -2.438 4.534 -0.562 1.00 0.00 H new ATOM 146 N SER A 98 -5.421 8.326 1.625 1.00 0.00 N ATOM 147 CA SER A 98 -6.285 8.710 2.738 1.00 0.00 C ATOM 148 C SER A 98 -7.459 7.744 2.867 1.00 0.00 C ATOM 149 O SER A 98 -7.694 7.174 3.932 1.00 0.00 O ATOM 150 CB SER A 98 -6.801 10.137 2.543 1.00 0.00 C ATOM 151 OG SER A 98 -7.334 10.657 3.749 1.00 0.00 O ATOM 0 H SER A 98 -5.195 9.087 0.984 1.00 0.00 H new ATOM 0 HA SER A 98 -5.698 8.668 3.655 1.00 0.00 H new ATOM 0 HB2 SER A 98 -5.989 10.776 2.195 1.00 0.00 H new ATOM 0 HB3 SER A 98 -7.568 10.147 1.769 1.00 0.00 H new ATOM 0 HG SER A 98 -7.655 11.570 3.598 1.00 0.00 H new ATOM 157 N ASP A 99 -8.184 7.557 1.769 1.00 0.00 N ATOM 158 CA ASP A 99 -9.324 6.650 1.750 1.00 0.00 C ATOM 159 C ASP A 99 -8.858 5.215 1.521 1.00 0.00 C ATOM 160 O ASP A 99 -9.497 4.263 1.969 1.00 0.00 O ATOM 161 CB ASP A 99 -10.313 7.061 0.657 1.00 0.00 C ATOM 162 CG ASP A 99 -11.204 8.209 1.086 1.00 0.00 C ATOM 163 OD1 ASP A 99 -10.702 9.129 1.766 1.00 0.00 O ATOM 164 OD2 ASP A 99 -12.405 8.189 0.743 1.00 0.00 O ATOM 0 H ASP A 99 -8.001 8.023 0.880 1.00 0.00 H new ATOM 0 HA ASP A 99 -9.825 6.706 2.716 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.762 7.348 -0.239 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -10.932 6.204 0.390 1.00 0.00 H new ATOM 169 N LEU A 100 -7.736 5.074 0.822 1.00 0.00 N ATOM 170 CA LEU A 100 -7.168 3.762 0.529 1.00 0.00 C ATOM 171 C LEU A 100 -6.885 2.992 1.816 1.00 0.00 C ATOM 172 O LEU A 100 -6.934 1.763 1.840 1.00 0.00 O ATOM 173 CB LEU A 100 -5.877 3.921 -0.277 1.00 0.00 C ATOM 174 CG LEU A 100 -5.490 2.717 -1.138 1.00 0.00 C ATOM 175 CD1 LEU A 100 -6.629 2.341 -2.073 1.00 0.00 C ATOM 176 CD2 LEU A 100 -4.223 3.014 -1.929 1.00 0.00 C ATOM 0 H LEU A 100 -7.200 5.856 0.446 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.893 3.197 -0.057 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.978 4.792 -0.924 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.060 4.130 0.414 1.00 0.00 H new ATOM 0 HG LEU A 100 -5.294 1.871 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -6.335 1.483 -2.677 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -7.512 2.087 -1.487 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.857 3.184 -2.726 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.962 2.147 -2.536 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.392 3.874 -2.577 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.407 3.234 -1.240 1.00 0.00 H new ATOM 188 N PHE A 101 -6.583 3.726 2.883 1.00 0.00 N ATOM 189 CA PHE A 101 -6.284 3.116 4.175 1.00 0.00 C ATOM 190 C PHE A 101 -7.528 2.477 4.783 1.00 0.00 C ATOM 191 O PHE A 101 -7.529 1.292 5.117 1.00 0.00 O ATOM 192 CB PHE A 101 -5.714 4.163 5.134 1.00 0.00 C ATOM 193 CG PHE A 101 -4.944 3.575 6.283 1.00 0.00 C ATOM 194 CD1 PHE A 101 -4.041 2.544 6.076 1.00 0.00 C ATOM 195 CD2 PHE A 101 -5.123 4.056 7.570 1.00 0.00 C ATOM 196 CE1 PHE A 101 -3.331 2.005 7.131 1.00 0.00 C ATOM 197 CE2 PHE A 101 -4.415 3.519 8.629 1.00 0.00 C ATOM 198 CZ PHE A 101 -3.518 2.492 8.409 1.00 0.00 C ATOM 0 H PHE A 101 -6.539 4.745 2.878 1.00 0.00 H new ATOM 0 HA PHE A 101 -5.542 2.334 4.014 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -5.061 4.836 4.577 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -6.532 4.766 5.527 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.891 2.158 5.079 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -5.823 4.859 7.748 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.630 1.203 6.956 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.563 3.902 9.628 1.00 0.00 H new ATOM 0 HZ PHE A 101 -2.964 2.071 9.235 1.00 0.00 H new ATOM 208 N ARG A 102 -8.586 3.269 4.928 1.00 0.00 N ATOM 209 CA ARG A 102 -9.838 2.783 5.500 1.00 0.00 C ATOM 210 C ARG A 102 -10.332 1.534 4.773 1.00 0.00 C ATOM 211 O ARG A 102 -11.069 0.726 5.339 1.00 0.00 O ATOM 212 CB ARG A 102 -10.906 3.876 5.440 1.00 0.00 C ATOM 213 CG ARG A 102 -10.927 4.774 6.668 1.00 0.00 C ATOM 214 CD ARG A 102 -10.958 6.245 6.286 1.00 0.00 C ATOM 215 NE ARG A 102 -11.891 7.006 7.114 1.00 0.00 N ATOM 216 CZ ARG A 102 -12.247 8.264 6.865 1.00 0.00 C ATOM 217 NH1 ARG A 102 -11.751 8.906 5.814 1.00 0.00 N ATOM 218 NH2 ARG A 102 -13.101 8.882 7.668 1.00 0.00 N ATOM 0 H ARG A 102 -8.601 4.252 4.657 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.650 2.519 6.541 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -10.737 4.489 4.555 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.885 3.410 5.324 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.799 4.537 7.277 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.047 4.575 7.280 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -9.958 6.667 6.386 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.242 6.342 5.238 1.00 0.00 H new ATOM 0 HE ARG A 102 -12.293 6.546 7.931 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -11.093 8.435 5.192 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -12.027 9.870 5.628 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -13.485 8.394 8.477 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.374 9.846 7.477 1.00 0.00 H new ATOM 232 N MET A 103 -9.926 1.383 3.516 1.00 0.00 N ATOM 233 CA MET A 103 -10.332 0.235 2.714 1.00 0.00 C ATOM 234 C MET A 103 -9.807 -1.070 3.309 1.00 0.00 C ATOM 235 O MET A 103 -10.396 -2.132 3.110 1.00 0.00 O ATOM 236 CB MET A 103 -9.830 0.389 1.277 1.00 0.00 C ATOM 237 CG MET A 103 -10.781 -0.180 0.237 1.00 0.00 C ATOM 238 SD MET A 103 -10.326 0.281 -1.446 1.00 0.00 S ATOM 239 CE MET A 103 -9.140 -1.002 -1.839 1.00 0.00 C ATOM 0 H MET A 103 -9.316 2.041 3.031 1.00 0.00 H new ATOM 0 HA MET A 103 -11.421 0.197 2.714 1.00 0.00 H new ATOM 0 HB2 MET A 103 -9.668 1.447 1.069 1.00 0.00 H new ATOM 0 HB3 MET A 103 -8.864 -0.106 1.183 1.00 0.00 H new ATOM 0 HG2 MET A 103 -10.796 -1.267 0.320 1.00 0.00 H new ATOM 0 HG3 MET A 103 -11.792 0.170 0.445 1.00 0.00 H new ATOM 0 HE1 MET A 103 -8.526 -0.684 -2.682 1.00 0.00 H new ATOM 0 HE2 MET A 103 -8.502 -1.185 -0.974 1.00 0.00 H new ATOM 0 HE3 MET A 103 -9.669 -1.919 -2.100 1.00 0.00 H new ATOM 249 N PHE A 104 -8.697 -0.986 4.036 1.00 0.00 N ATOM 250 CA PHE A 104 -8.099 -2.167 4.651 1.00 0.00 C ATOM 251 C PHE A 104 -8.398 -2.223 6.145 1.00 0.00 C ATOM 252 O PHE A 104 -8.707 -3.284 6.687 1.00 0.00 O ATOM 253 CB PHE A 104 -6.586 -2.177 4.429 1.00 0.00 C ATOM 254 CG PHE A 104 -6.189 -2.257 2.984 1.00 0.00 C ATOM 255 CD1 PHE A 104 -6.529 -1.246 2.103 1.00 0.00 C ATOM 256 CD2 PHE A 104 -5.474 -3.343 2.507 1.00 0.00 C ATOM 257 CE1 PHE A 104 -6.165 -1.313 0.774 1.00 0.00 C ATOM 258 CE2 PHE A 104 -5.107 -3.415 1.177 1.00 0.00 C ATOM 259 CZ PHE A 104 -5.453 -2.399 0.309 1.00 0.00 C ATOM 0 H PHE A 104 -8.195 -0.116 4.213 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.539 -3.045 4.177 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.158 -1.274 4.865 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -6.155 -3.024 4.963 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -7.087 -0.393 2.460 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -5.201 -4.141 3.181 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -6.437 -0.516 0.098 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -4.549 -4.267 0.816 1.00 0.00 H new ATOM 0 HZ PHE A 104 -5.167 -2.454 -0.731 1.00 0.00 H new ATOM 269 N ASP A 105 -8.294 -1.077 6.809 1.00 0.00 N ATOM 270 CA ASP A 105 -8.544 -1.002 8.244 1.00 0.00 C ATOM 271 C ASP A 105 -9.929 -1.550 8.595 1.00 0.00 C ATOM 272 O ASP A 105 -10.061 -2.713 8.977 1.00 0.00 O ATOM 273 CB ASP A 105 -8.387 0.441 8.734 1.00 0.00 C ATOM 274 CG ASP A 105 -7.795 0.515 10.127 1.00 0.00 C ATOM 275 OD1 ASP A 105 -6.807 -0.202 10.390 1.00 0.00 O ATOM 276 OD2 ASP A 105 -8.318 1.291 10.954 1.00 0.00 O ATOM 0 H ASP A 105 -8.039 -0.189 6.378 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.807 -1.624 8.752 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.749 0.990 8.041 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.360 0.932 8.729 1.00 0.00 H new ATOM 281 N LYS A 106 -10.958 -0.714 8.468 1.00 0.00 N ATOM 282 CA LYS A 106 -12.325 -1.129 8.776 1.00 0.00 C ATOM 283 C LYS A 106 -12.466 -1.543 10.240 1.00 0.00 C ATOM 284 O LYS A 106 -13.469 -2.139 10.631 1.00 0.00 O ATOM 285 CB LYS A 106 -12.732 -2.291 7.878 1.00 0.00 C ATOM 286 CG LYS A 106 -13.313 -1.858 6.542 1.00 0.00 C ATOM 287 CD LYS A 106 -12.322 -2.066 5.407 1.00 0.00 C ATOM 288 CE LYS A 106 -12.464 -3.446 4.786 1.00 0.00 C ATOM 289 NZ LYS A 106 -11.241 -4.274 4.982 1.00 0.00 N ATOM 0 H LYS A 106 -10.871 0.253 8.155 1.00 0.00 H new ATOM 0 HA LYS A 106 -12.980 -0.277 8.596 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.861 -2.921 7.698 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.466 -2.903 8.402 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -14.223 -2.423 6.340 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -13.596 -0.806 6.591 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -12.478 -1.305 4.643 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -11.307 -1.938 5.782 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -13.321 -3.955 5.226 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -12.666 -3.345 3.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.451 -5.265 4.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.482 -3.924 4.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -10.935 -4.212 5.974 1.00 0.00 H new ATOM 303 N ASN A 107 -11.454 -1.232 11.039 1.00 0.00 N ATOM 304 CA ASN A 107 -11.459 -1.579 12.455 1.00 0.00 C ATOM 305 C ASN A 107 -11.527 -0.331 13.334 1.00 0.00 C ATOM 306 O ASN A 107 -11.808 -0.420 14.529 1.00 0.00 O ATOM 307 CB ASN A 107 -10.207 -2.387 12.795 1.00 0.00 C ATOM 308 CG ASN A 107 -10.184 -2.840 14.242 1.00 0.00 C ATOM 309 OD1 ASN A 107 -11.224 -2.930 14.893 1.00 0.00 O ATOM 310 ND2 ASN A 107 -8.992 -3.128 14.752 1.00 0.00 N ATOM 0 H ASN A 107 -10.616 -0.739 10.730 1.00 0.00 H new ATOM 0 HA ASN A 107 -12.347 -2.179 12.653 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -10.153 -3.259 12.144 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -9.322 -1.783 12.593 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -8.913 -3.438 15.720 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -8.155 -3.039 14.175 1.00 0.00 H new ATOM 317 N ALA A 108 -11.266 0.832 12.739 1.00 0.00 N ATOM 318 CA ALA A 108 -11.297 2.095 13.472 1.00 0.00 C ATOM 319 C ALA A 108 -10.071 2.241 14.368 1.00 0.00 C ATOM 320 O ALA A 108 -10.147 2.819 15.452 1.00 0.00 O ATOM 321 CB ALA A 108 -12.572 2.206 14.298 1.00 0.00 C ATOM 0 H ALA A 108 -11.031 0.925 11.751 1.00 0.00 H new ATOM 0 HA ALA A 108 -11.283 2.904 12.742 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -12.575 3.154 14.836 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -13.438 2.160 13.638 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -12.616 1.383 15.012 1.00 0.00 H new ATOM 327 N ASP A 109 -8.940 1.719 13.904 1.00 0.00 N ATOM 328 CA ASP A 109 -7.694 1.797 14.660 1.00 0.00 C ATOM 329 C ASP A 109 -6.658 2.621 13.903 1.00 0.00 C ATOM 330 O ASP A 109 -6.002 3.491 14.476 1.00 0.00 O ATOM 331 CB ASP A 109 -7.149 0.394 14.937 1.00 0.00 C ATOM 332 CG ASP A 109 -6.819 -0.361 13.665 1.00 0.00 C ATOM 333 OD1 ASP A 109 -7.640 -0.326 12.725 1.00 0.00 O ATOM 334 OD2 ASP A 109 -5.740 -0.987 13.609 1.00 0.00 O ATOM 0 H ASP A 109 -8.860 1.237 13.008 1.00 0.00 H new ATOM 0 HA ASP A 109 -7.901 2.287 15.611 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.253 0.471 15.553 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -7.883 -0.171 15.511 1.00 0.00 H new ATOM 339 N GLY A 110 -6.524 2.347 12.609 1.00 0.00 N ATOM 340 CA GLY A 110 -5.574 3.077 11.791 1.00 0.00 C ATOM 341 C GLY A 110 -4.299 2.300 11.525 1.00 0.00 C ATOM 342 O GLY A 110 -3.247 2.892 11.286 1.00 0.00 O ATOM 0 H GLY A 110 -7.057 1.632 12.113 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -6.042 3.332 10.840 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -5.324 4.016 12.285 1.00 0.00 H new ATOM 346 N TYR A 111 -4.387 0.973 11.564 1.00 0.00 N ATOM 347 CA TYR A 111 -3.221 0.129 11.321 1.00 0.00 C ATOM 348 C TYR A 111 -3.606 -1.135 10.556 1.00 0.00 C ATOM 349 O TYR A 111 -4.757 -1.569 10.600 1.00 0.00 O ATOM 350 CB TYR A 111 -2.545 -0.252 12.642 1.00 0.00 C ATOM 351 CG TYR A 111 -2.628 0.821 13.706 1.00 0.00 C ATOM 352 CD1 TYR A 111 -1.984 2.040 13.541 1.00 0.00 C ATOM 353 CD2 TYR A 111 -3.350 0.613 14.875 1.00 0.00 C ATOM 354 CE1 TYR A 111 -2.056 3.022 14.511 1.00 0.00 C ATOM 355 CE2 TYR A 111 -3.428 1.590 15.849 1.00 0.00 C ATOM 356 CZ TYR A 111 -2.779 2.793 15.662 1.00 0.00 C ATOM 357 OH TYR A 111 -2.854 3.769 16.629 1.00 0.00 O ATOM 0 H TYR A 111 -5.248 0.462 11.760 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.520 0.702 10.714 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -3.004 -1.164 13.023 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -1.496 -0.479 12.450 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.418 2.224 12.640 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -3.859 -0.328 15.025 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -1.548 3.964 14.368 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.994 1.413 16.752 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.403 3.449 17.375 1.00 0.00 H new ATOM 367 N ILE A 112 -2.638 -1.729 9.855 1.00 0.00 N ATOM 368 CA ILE A 112 -2.894 -2.945 9.090 1.00 0.00 C ATOM 369 C ILE A 112 -1.989 -4.086 9.545 1.00 0.00 C ATOM 370 O ILE A 112 -0.782 -3.910 9.704 1.00 0.00 O ATOM 371 CB ILE A 112 -2.696 -2.716 7.578 1.00 0.00 C ATOM 372 CG1 ILE A 112 -3.453 -1.462 7.129 1.00 0.00 C ATOM 373 CG2 ILE A 112 -3.155 -3.937 6.794 1.00 0.00 C ATOM 374 CD1 ILE A 112 -3.418 -1.223 5.632 1.00 0.00 C ATOM 0 H ILE A 112 -1.678 -1.389 9.803 1.00 0.00 H new ATOM 0 HA ILE A 112 -3.934 -3.216 9.273 1.00 0.00 H new ATOM 0 HB ILE A 112 -1.635 -2.564 7.380 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -4.492 -1.543 7.449 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.030 -0.594 7.635 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -3.009 -3.761 5.728 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -2.573 -4.806 7.101 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.211 -4.120 6.990 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.976 -0.317 5.395 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.384 -1.108 5.306 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.869 -2.072 5.117 1.00 0.00 H new ATOM 386 N ASP A 113 -2.583 -5.256 9.754 1.00 0.00 N ATOM 387 CA ASP A 113 -1.833 -6.429 10.191 1.00 0.00 C ATOM 388 C ASP A 113 -1.932 -7.549 9.161 1.00 0.00 C ATOM 389 O ASP A 113 -2.509 -7.369 8.089 1.00 0.00 O ATOM 390 CB ASP A 113 -2.351 -6.916 11.545 1.00 0.00 C ATOM 391 CG ASP A 113 -2.252 -5.851 12.620 1.00 0.00 C ATOM 392 OD1 ASP A 113 -1.166 -5.714 13.222 1.00 0.00 O ATOM 393 OD2 ASP A 113 -3.260 -5.154 12.859 1.00 0.00 O ATOM 0 H ASP A 113 -3.582 -5.418 9.628 1.00 0.00 H new ATOM 0 HA ASP A 113 -0.786 -6.145 10.293 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -3.390 -7.229 11.442 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -1.783 -7.794 11.854 1.00 0.00 H new ATOM 398 N LEU A 114 -1.366 -8.707 9.492 1.00 0.00 N ATOM 399 CA LEU A 114 -1.390 -9.857 8.594 1.00 0.00 C ATOM 400 C LEU A 114 -2.807 -10.151 8.110 1.00 0.00 C ATOM 401 O LEU A 114 -3.010 -10.562 6.967 1.00 0.00 O ATOM 402 CB LEU A 114 -0.815 -11.087 9.300 1.00 0.00 C ATOM 403 CG LEU A 114 0.714 -11.146 9.368 1.00 0.00 C ATOM 404 CD1 LEU A 114 1.290 -11.588 8.033 1.00 0.00 C ATOM 405 CD2 LEU A 114 1.289 -9.798 9.778 1.00 0.00 C ATOM 0 H LEU A 114 -0.885 -8.873 10.376 1.00 0.00 H new ATOM 0 HA LEU A 114 -0.776 -9.619 7.725 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -1.209 -11.120 10.316 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -1.175 -11.980 8.789 1.00 0.00 H new ATOM 0 HG LEU A 114 0.993 -11.879 10.124 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.377 -11.624 8.100 1.00 0.00 H new ATOM 0 HD12 LEU A 114 0.909 -12.578 7.782 1.00 0.00 H new ATOM 0 HD13 LEU A 114 0.998 -10.879 7.258 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.376 -9.864 9.820 1.00 0.00 H new ATOM 0 HD22 LEU A 114 0.999 -9.042 9.049 1.00 0.00 H new ATOM 0 HD23 LEU A 114 0.904 -9.522 10.760 1.00 0.00 H new ATOM 417 N GLU A 115 -3.784 -9.938 8.986 1.00 0.00 N ATOM 418 CA GLU A 115 -5.181 -10.179 8.645 1.00 0.00 C ATOM 419 C GLU A 115 -5.660 -9.191 7.587 1.00 0.00 C ATOM 420 O GLU A 115 -6.228 -9.583 6.568 1.00 0.00 O ATOM 421 CB GLU A 115 -6.059 -10.075 9.893 1.00 0.00 C ATOM 422 CG GLU A 115 -7.187 -11.088 9.893 1.00 0.00 C ATOM 423 OE1 GLU A 115 -8.264 -10.775 9.343 1.00 0.00 O ATOM 424 OE2 GLU A 115 -6.993 -12.193 10.441 1.00 0.00 O ATOM 0 H GLU A 115 -3.634 -9.599 9.936 1.00 0.00 H new ATOM 0 HA GLU A 115 -5.261 -11.187 8.238 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -5.443 -10.221 10.780 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -6.477 -9.070 9.957 1.00 0.00 H new ATOM 429 N GLU A 116 -5.425 -7.906 7.835 1.00 0.00 N ATOM 430 CA GLU A 116 -5.832 -6.862 6.903 1.00 0.00 C ATOM 431 C GLU A 116 -4.946 -6.865 5.660 1.00 0.00 C ATOM 432 O GLU A 116 -5.359 -6.415 4.592 1.00 0.00 O ATOM 433 CB GLU A 116 -5.779 -5.493 7.582 1.00 0.00 C ATOM 434 CG GLU A 116 -6.810 -5.322 8.686 1.00 0.00 C ATOM 435 CD GLU A 116 -6.351 -4.365 9.769 1.00 0.00 C ATOM 436 OE1 GLU A 116 -6.359 -3.141 9.522 1.00 0.00 O ATOM 437 OE2 GLU A 116 -5.982 -4.840 10.864 1.00 0.00 O ATOM 0 H GLU A 116 -4.955 -7.564 8.673 1.00 0.00 H new ATOM 0 HA GLU A 116 -6.857 -7.065 6.594 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.783 -5.342 7.999 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.931 -4.718 6.831 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.742 -4.957 8.254 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -7.024 -6.293 9.132 1.00 0.00 H new ATOM 444 N LEU A 117 -3.728 -7.381 5.804 1.00 0.00 N ATOM 445 CA LEU A 117 -2.791 -7.448 4.689 1.00 0.00 C ATOM 446 C LEU A 117 -3.341 -8.322 3.564 1.00 0.00 C ATOM 447 O LEU A 117 -2.878 -8.248 2.427 1.00 0.00 O ATOM 448 CB LEU A 117 -1.439 -7.990 5.163 1.00 0.00 C ATOM 449 CG LEU A 117 -0.212 -7.244 4.631 1.00 0.00 C ATOM 450 CD1 LEU A 117 -0.006 -7.535 3.152 1.00 0.00 C ATOM 451 CD2 LEU A 117 -0.350 -5.747 4.871 1.00 0.00 C ATOM 0 H LEU A 117 -3.368 -7.758 6.681 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.653 -6.438 4.302 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.417 -7.962 6.252 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.363 -9.037 4.869 1.00 0.00 H new ATOM 0 HG LEU A 117 0.665 -7.598 5.173 1.00 0.00 H new ATOM 0 HD11 LEU A 117 0.871 -6.995 2.794 1.00 0.00 H new ATOM 0 HD12 LEU A 117 0.143 -8.605 3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.884 -7.213 2.592 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.531 -5.234 4.486 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.238 -5.377 4.359 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.442 -5.557 5.940 1.00 0.00 H new ATOM 463 N LYS A 118 -4.332 -9.148 3.884 1.00 0.00 N ATOM 464 CA LYS A 118 -4.942 -10.026 2.893 1.00 0.00 C ATOM 465 C LYS A 118 -5.874 -9.241 1.971 1.00 0.00 C ATOM 466 O LYS A 118 -6.171 -9.674 0.858 1.00 0.00 O ATOM 467 CB LYS A 118 -5.718 -11.146 3.586 1.00 0.00 C ATOM 468 CG LYS A 118 -6.243 -12.204 2.630 1.00 0.00 C ATOM 469 CD LYS A 118 -7.580 -12.758 3.093 1.00 0.00 C ATOM 470 CE LYS A 118 -8.647 -11.675 3.139 1.00 0.00 C ATOM 471 NZ LYS A 118 -10.021 -12.247 3.112 1.00 0.00 N ATOM 0 H LYS A 118 -4.729 -9.227 4.820 1.00 0.00 H new ATOM 0 HA LYS A 118 -4.146 -10.463 2.290 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -5.071 -11.623 4.323 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -6.557 -10.712 4.131 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -6.351 -11.775 1.634 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -5.520 -13.015 2.551 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -7.898 -13.555 2.420 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -7.468 -13.202 4.082 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -8.520 -11.079 4.042 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -8.517 -11.002 2.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -10.719 -11.476 3.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -10.152 -12.795 2.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -10.154 -12.870 3.934 1.00 0.00 H new ATOM 485 N ILE A 119 -6.338 -8.088 2.448 1.00 0.00 N ATOM 486 CA ILE A 119 -7.243 -7.242 1.677 1.00 0.00 C ATOM 487 C ILE A 119 -6.663 -6.906 0.301 1.00 0.00 C ATOM 488 O ILE A 119 -7.365 -6.987 -0.707 1.00 0.00 O ATOM 489 CB ILE A 119 -7.583 -5.947 2.454 1.00 0.00 C ATOM 490 CG1 ILE A 119 -8.527 -6.277 3.613 1.00 0.00 C ATOM 491 CG2 ILE A 119 -8.211 -4.895 1.545 1.00 0.00 C ATOM 492 CD1 ILE A 119 -8.213 -5.527 4.888 1.00 0.00 C ATOM 0 H ILE A 119 -6.100 -7.718 3.368 1.00 0.00 H new ATOM 0 HA ILE A 119 -8.164 -7.805 1.522 1.00 0.00 H new ATOM 0 HB ILE A 119 -6.655 -5.531 2.845 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -9.550 -6.051 3.312 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -8.483 -7.348 3.812 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -8.436 -4.000 2.125 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -7.515 -4.643 0.745 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -9.131 -5.289 1.114 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -8.924 -5.813 5.663 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -7.202 -5.772 5.215 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -8.286 -4.455 4.707 1.00 0.00 H new ATOM 504 N MET A 120 -5.384 -6.541 0.255 1.00 0.00 N ATOM 505 CA MET A 120 -4.744 -6.214 -1.018 1.00 0.00 C ATOM 506 C MET A 120 -4.711 -7.439 -1.924 1.00 0.00 C ATOM 507 O MET A 120 -4.875 -7.331 -3.139 1.00 0.00 O ATOM 508 CB MET A 120 -3.321 -5.682 -0.807 1.00 0.00 C ATOM 509 CG MET A 120 -2.547 -6.401 0.286 1.00 0.00 C ATOM 510 SD MET A 120 -2.471 -5.461 1.827 1.00 0.00 S ATOM 511 CE MET A 120 -1.890 -3.872 1.239 1.00 0.00 C ATOM 0 H MET A 120 -4.777 -6.465 1.071 1.00 0.00 H new ATOM 0 HA MET A 120 -5.333 -5.430 -1.495 1.00 0.00 H new ATOM 0 HB2 MET A 120 -2.770 -5.767 -1.744 1.00 0.00 H new ATOM 0 HB3 MET A 120 -3.373 -4.621 -0.563 1.00 0.00 H new ATOM 0 HG2 MET A 120 -3.013 -7.368 0.478 1.00 0.00 H new ATOM 0 HG3 MET A 120 -1.534 -6.599 -0.063 1.00 0.00 H new ATOM 0 HE1 MET A 120 -1.088 -3.516 1.886 1.00 0.00 H new ATOM 0 HE2 MET A 120 -1.515 -3.976 0.221 1.00 0.00 H new ATOM 0 HE3 MET A 120 -2.712 -3.156 1.252 1.00 0.00 H new ATOM 521 N LEU A 121 -4.506 -8.606 -1.320 1.00 0.00 N ATOM 522 CA LEU A 121 -4.459 -9.857 -2.069 1.00 0.00 C ATOM 523 C LEU A 121 -5.866 -10.314 -2.447 1.00 0.00 C ATOM 524 O LEU A 121 -6.053 -11.028 -3.432 1.00 0.00 O ATOM 525 CB LEU A 121 -3.756 -10.942 -1.249 1.00 0.00 C ATOM 526 CG LEU A 121 -2.283 -11.165 -1.602 1.00 0.00 C ATOM 527 CD1 LEU A 121 -1.380 -10.474 -0.592 1.00 0.00 C ATOM 528 CD2 LEU A 121 -1.967 -12.653 -1.669 1.00 0.00 C ATOM 0 H LEU A 121 -4.370 -8.711 -0.315 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.894 -9.685 -2.985 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.826 -10.681 -0.193 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.292 -11.882 -1.381 1.00 0.00 H new ATOM 0 HG LEU A 121 -2.097 -10.730 -2.584 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -0.337 -10.644 -0.860 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.585 -9.403 -0.593 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -1.570 -10.879 0.402 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.916 -12.791 -1.921 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -2.171 -13.112 -0.702 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -2.588 -13.123 -2.432 1.00 0.00 H new ATOM 540 N GLN A 122 -6.854 -9.894 -1.662 1.00 0.00 N ATOM 541 CA GLN A 122 -8.243 -10.257 -1.922 1.00 0.00 C ATOM 542 C GLN A 122 -8.656 -9.828 -3.327 1.00 0.00 C ATOM 543 O GLN A 122 -9.498 -10.464 -3.960 1.00 0.00 O ATOM 544 CB GLN A 122 -9.165 -9.615 -0.882 1.00 0.00 C ATOM 545 CG GLN A 122 -9.956 -10.624 -0.065 1.00 0.00 C ATOM 546 CD GLN A 122 -11.100 -11.239 -0.849 1.00 0.00 C ATOM 547 OE1 GLN A 122 -12.237 -10.774 -0.778 1.00 0.00 O ATOM 548 NE2 GLN A 122 -10.802 -12.291 -1.602 1.00 0.00 N ATOM 0 H GLN A 122 -6.719 -9.303 -0.842 1.00 0.00 H new ATOM 0 HA GLN A 122 -8.333 -11.341 -1.850 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -8.567 -9.002 -0.207 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -9.860 -8.945 -1.389 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -9.287 -11.414 0.276 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -10.352 -10.135 0.825 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -9.845 -12.643 -1.631 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -11.530 -12.747 -2.152 1.00 0.00 H new ATOM 557 N ALA A 123 -8.051 -8.746 -3.808 1.00 0.00 N ATOM 558 CA ALA A 123 -8.347 -8.231 -5.138 1.00 0.00 C ATOM 559 C ALA A 123 -7.781 -9.147 -6.218 1.00 0.00 C ATOM 560 O ALA A 123 -8.284 -9.183 -7.341 1.00 0.00 O ATOM 561 CB ALA A 123 -7.789 -6.824 -5.292 1.00 0.00 C ATOM 0 H ALA A 123 -7.352 -8.209 -3.295 1.00 0.00 H new ATOM 0 HA ALA A 123 -9.430 -8.197 -5.257 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -8.016 -6.450 -6.290 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -8.242 -6.170 -4.547 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.709 -6.843 -5.149 1.00 0.00 H new ATOM 567 N THR A 124 -6.733 -9.888 -5.870 1.00 0.00 N ATOM 568 CA THR A 124 -6.099 -10.806 -6.809 1.00 0.00 C ATOM 569 C THR A 124 -6.750 -12.183 -6.741 1.00 0.00 C ATOM 570 O THR A 124 -7.113 -12.761 -7.766 1.00 0.00 O ATOM 571 CB THR A 124 -4.602 -10.921 -6.512 1.00 0.00 C ATOM 572 OG1 THR A 124 -4.333 -10.618 -5.154 1.00 0.00 O ATOM 573 CG2 THR A 124 -3.751 -10.005 -7.364 1.00 0.00 C ATOM 0 H THR A 124 -6.305 -9.870 -4.944 1.00 0.00 H new ATOM 0 HA THR A 124 -6.232 -10.408 -7.815 1.00 0.00 H new ATOM 0 HB THR A 124 -4.341 -11.954 -6.744 1.00 0.00 H new ATOM 0 HG1 THR A 124 -4.776 -11.276 -4.578 1.00 0.00 H new ATOM 0 HG21 THR A 124 -2.701 -10.137 -7.103 1.00 0.00 H new ATOM 0 HG22 THR A 124 -3.896 -10.248 -8.417 1.00 0.00 H new ATOM 0 HG23 THR A 124 -4.042 -8.969 -7.187 1.00 0.00 H new ATOM 581 N GLY A 125 -6.894 -12.704 -5.527 1.00 0.00 N ATOM 582 CA GLY A 125 -7.501 -14.009 -5.348 1.00 0.00 C ATOM 583 C GLY A 125 -6.743 -15.105 -6.070 1.00 0.00 C ATOM 584 O GLY A 125 -7.344 -16.031 -6.614 1.00 0.00 O ATOM 0 H GLY A 125 -6.601 -12.245 -4.664 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -7.546 -14.243 -4.284 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -8.528 -13.982 -5.712 1.00 0.00 H new ATOM 588 N GLU A 126 -5.418 -14.999 -6.077 1.00 0.00 N ATOM 589 CA GLU A 126 -4.575 -15.988 -6.738 1.00 0.00 C ATOM 590 C GLU A 126 -3.832 -16.841 -5.715 1.00 0.00 C ATOM 591 O GLU A 126 -4.015 -16.681 -4.508 1.00 0.00 O ATOM 592 CB GLU A 126 -3.573 -15.296 -7.665 1.00 0.00 C ATOM 593 CG GLU A 126 -4.133 -14.988 -9.044 1.00 0.00 C ATOM 594 CD GLU A 126 -3.179 -14.167 -9.890 1.00 0.00 C ATOM 595 OE1 GLU A 126 -2.320 -14.769 -10.568 1.00 0.00 O ATOM 596 OE2 GLU A 126 -3.291 -12.923 -9.874 1.00 0.00 O ATOM 0 H GLU A 126 -4.905 -14.238 -5.632 1.00 0.00 H new ATOM 0 HA GLU A 126 -5.218 -16.640 -7.329 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -3.242 -14.367 -7.200 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -2.693 -15.930 -7.773 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -4.357 -15.923 -9.558 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -5.075 -14.449 -8.938 1.00 0.00 H new ATOM 603 N THR A 127 -2.994 -17.748 -6.206 1.00 0.00 N ATOM 604 CA THR A 127 -2.221 -18.627 -5.336 1.00 0.00 C ATOM 605 C THR A 127 -1.323 -17.823 -4.398 1.00 0.00 C ATOM 606 O THR A 127 -0.900 -18.320 -3.354 1.00 0.00 O ATOM 607 CB THR A 127 -1.374 -19.588 -6.171 1.00 0.00 C ATOM 608 OG1 THR A 127 -0.607 -20.436 -5.335 1.00 0.00 O ATOM 609 CG2 THR A 127 -0.420 -18.882 -7.110 1.00 0.00 C ATOM 0 H THR A 127 -2.833 -17.894 -7.203 1.00 0.00 H new ATOM 0 HA THR A 127 -2.922 -19.201 -4.730 1.00 0.00 H new ATOM 0 HB THR A 127 -2.086 -20.160 -6.766 1.00 0.00 H new ATOM 0 HG1 THR A 127 -0.073 -21.044 -5.888 1.00 0.00 H new ATOM 0 HG21 THR A 127 0.151 -19.621 -7.672 1.00 0.00 H new ATOM 0 HG22 THR A 127 -0.986 -18.257 -7.801 1.00 0.00 H new ATOM 0 HG23 THR A 127 0.263 -18.258 -6.533 1.00 0.00 H new ATOM 617 N ILE A 128 -1.034 -16.579 -4.775 1.00 0.00 N ATOM 618 CA ILE A 128 -0.184 -15.711 -3.966 1.00 0.00 C ATOM 619 C ILE A 128 -0.663 -15.652 -2.518 1.00 0.00 C ATOM 620 O ILE A 128 0.123 -15.402 -1.604 1.00 0.00 O ATOM 621 CB ILE A 128 -0.139 -14.280 -4.535 1.00 0.00 C ATOM 622 CG1 ILE A 128 -1.552 -13.787 -4.854 1.00 0.00 C ATOM 623 CG2 ILE A 128 0.738 -14.230 -5.777 1.00 0.00 C ATOM 624 CD1 ILE A 128 -1.625 -12.303 -5.138 1.00 0.00 C ATOM 0 H ILE A 128 -1.376 -16.151 -5.635 1.00 0.00 H new ATOM 0 HA ILE A 128 0.817 -16.141 -3.995 1.00 0.00 H new ATOM 0 HB ILE A 128 0.293 -13.621 -3.782 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -1.932 -14.333 -5.717 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.208 -14.021 -4.015 1.00 0.00 H new ATOM 0 HG21 ILE A 128 0.759 -13.212 -6.167 1.00 0.00 H new ATOM 0 HG22 ILE A 128 1.751 -14.541 -5.520 1.00 0.00 H new ATOM 0 HG23 ILE A 128 0.333 -14.900 -6.535 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.656 -12.025 -5.356 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -1.276 -11.748 -4.267 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -0.996 -12.065 -5.996 1.00 0.00 H new ATOM 636 N THR A 129 -1.957 -15.884 -2.314 1.00 0.00 N ATOM 637 CA THR A 129 -2.537 -15.857 -0.975 1.00 0.00 C ATOM 638 C THR A 129 -1.826 -16.843 -0.053 1.00 0.00 C ATOM 639 O THR A 129 -1.260 -17.836 -0.508 1.00 0.00 O ATOM 640 CB THR A 129 -4.030 -16.184 -1.037 1.00 0.00 C ATOM 641 OG1 THR A 129 -4.297 -17.115 -2.071 1.00 0.00 O ATOM 642 CG2 THR A 129 -4.900 -14.969 -1.276 1.00 0.00 C ATOM 0 H THR A 129 -2.623 -16.093 -3.058 1.00 0.00 H new ATOM 0 HA THR A 129 -2.408 -14.853 -0.571 1.00 0.00 H new ATOM 0 HB THR A 129 -4.275 -16.599 -0.059 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.500 -16.634 -2.900 1.00 0.00 H new ATOM 0 HG21 THR A 129 -5.947 -15.272 -1.309 1.00 0.00 H new ATOM 0 HG22 THR A 129 -4.755 -14.253 -0.467 1.00 0.00 H new ATOM 0 HG23 THR A 129 -4.626 -14.506 -2.224 1.00 0.00 H new ATOM 650 N GLU A 130 -1.859 -16.560 1.245 1.00 0.00 N ATOM 651 CA GLU A 130 -1.217 -17.422 2.231 1.00 0.00 C ATOM 652 C GLU A 130 0.285 -17.511 1.980 1.00 0.00 C ATOM 653 O GLU A 130 0.913 -18.531 2.266 1.00 0.00 O ATOM 654 CB GLU A 130 -1.835 -18.821 2.198 1.00 0.00 C ATOM 655 CG GLU A 130 -3.353 -18.817 2.286 1.00 0.00 C ATOM 656 CD GLU A 130 -3.997 -19.769 1.297 1.00 0.00 C ATOM 657 OE1 GLU A 130 -4.170 -20.957 1.642 1.00 0.00 O ATOM 658 OE2 GLU A 130 -4.328 -19.326 0.177 1.00 0.00 O ATOM 0 H GLU A 130 -2.323 -15.741 1.638 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.378 -16.985 3.217 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.534 -19.321 1.277 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -1.433 -19.407 3.025 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -3.655 -19.090 3.297 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -3.721 -17.807 2.105 1.00 0.00 H new ATOM 665 N ASP A 131 0.855 -16.437 1.443 1.00 0.00 N ATOM 666 CA ASP A 131 2.283 -16.393 1.152 1.00 0.00 C ATOM 667 C ASP A 131 2.731 -14.967 0.848 1.00 0.00 C ATOM 668 O ASP A 131 3.768 -14.514 1.335 1.00 0.00 O ATOM 669 CB ASP A 131 2.613 -17.308 -0.028 1.00 0.00 C ATOM 670 CG ASP A 131 3.896 -18.088 0.186 1.00 0.00 C ATOM 671 OD1 ASP A 131 4.151 -18.508 1.334 1.00 0.00 O ATOM 672 OD2 ASP A 131 4.645 -18.279 -0.795 1.00 0.00 O ATOM 0 H ASP A 131 0.349 -15.585 1.201 1.00 0.00 H new ATOM 0 HA ASP A 131 2.820 -16.743 2.034 1.00 0.00 H new ATOM 0 HB2 ASP A 131 1.790 -18.005 -0.185 1.00 0.00 H new ATOM 0 HB3 ASP A 131 2.702 -16.709 -0.935 1.00 0.00 H new ATOM 677 N ASP A 132 1.943 -14.265 0.041 1.00 0.00 N ATOM 678 CA ASP A 132 2.257 -12.889 -0.327 1.00 0.00 C ATOM 679 C ASP A 132 2.021 -11.944 0.847 1.00 0.00 C ATOM 680 O ASP A 132 2.695 -10.923 0.980 1.00 0.00 O ATOM 681 CB ASP A 132 1.413 -12.456 -1.529 1.00 0.00 C ATOM 682 CG ASP A 132 2.241 -12.291 -2.788 1.00 0.00 C ATOM 683 OD1 ASP A 132 2.996 -13.226 -3.129 1.00 0.00 O ATOM 684 OD2 ASP A 132 2.135 -11.227 -3.434 1.00 0.00 O ATOM 0 H ASP A 132 1.082 -14.626 -0.371 1.00 0.00 H new ATOM 0 HA ASP A 132 3.312 -12.842 -0.598 1.00 0.00 H new ATOM 0 HB2 ASP A 132 0.632 -13.195 -1.706 1.00 0.00 H new ATOM 0 HB3 ASP A 132 0.915 -11.514 -1.299 1.00 0.00 H new ATOM 689 N ILE A 133 1.059 -12.292 1.696 1.00 0.00 N ATOM 690 CA ILE A 133 0.733 -11.477 2.860 1.00 0.00 C ATOM 691 C ILE A 133 1.880 -11.481 3.870 1.00 0.00 C ATOM 692 O ILE A 133 2.091 -10.503 4.587 1.00 0.00 O ATOM 693 CB ILE A 133 -0.565 -11.973 3.540 1.00 0.00 C ATOM 694 CG1 ILE A 133 -1.782 -11.600 2.690 1.00 0.00 C ATOM 695 CG2 ILE A 133 -0.704 -11.399 4.946 1.00 0.00 C ATOM 696 CD1 ILE A 133 -2.317 -12.746 1.860 1.00 0.00 C ATOM 0 H ILE A 133 0.491 -13.134 1.599 1.00 0.00 H new ATOM 0 HA ILE A 133 0.577 -10.456 2.511 1.00 0.00 H new ATOM 0 HB ILE A 133 -0.511 -13.058 3.624 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -2.574 -11.236 3.345 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -1.513 -10.777 2.027 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -1.625 -11.765 5.399 1.00 0.00 H new ATOM 0 HG22 ILE A 133 0.147 -11.710 5.552 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -0.733 -10.311 4.893 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -3.178 -12.407 1.284 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -1.541 -13.096 1.180 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -2.618 -13.562 2.517 1.00 0.00 H new ATOM 708 N GLU A 134 2.614 -12.587 3.924 1.00 0.00 N ATOM 709 CA GLU A 134 3.734 -12.714 4.849 1.00 0.00 C ATOM 710 C GLU A 134 4.947 -11.929 4.357 1.00 0.00 C ATOM 711 O GLU A 134 5.676 -11.334 5.150 1.00 0.00 O ATOM 712 CB GLU A 134 4.103 -14.188 5.036 1.00 0.00 C ATOM 713 CG GLU A 134 4.191 -14.613 6.492 1.00 0.00 C ATOM 714 CD GLU A 134 3.792 -16.060 6.703 1.00 0.00 C ATOM 715 OE1 GLU A 134 2.635 -16.409 6.385 1.00 0.00 O ATOM 716 OE2 GLU A 134 4.636 -16.845 7.185 1.00 0.00 O ATOM 0 H GLU A 134 2.454 -13.407 3.339 1.00 0.00 H new ATOM 0 HA GLU A 134 3.426 -12.298 5.809 1.00 0.00 H new ATOM 0 HB2 GLU A 134 3.362 -14.806 4.530 1.00 0.00 H new ATOM 0 HB3 GLU A 134 5.061 -14.378 4.552 1.00 0.00 H new ATOM 0 HG2 GLU A 134 5.210 -14.466 6.848 1.00 0.00 H new ATOM 0 HG3 GLU A 134 3.547 -13.971 7.093 1.00 0.00 H new ATOM 723 N GLU A 135 5.159 -11.935 3.045 1.00 0.00 N ATOM 724 CA GLU A 135 6.286 -11.225 2.451 1.00 0.00 C ATOM 725 C GLU A 135 5.937 -9.765 2.181 1.00 0.00 C ATOM 726 O GLU A 135 6.797 -8.887 2.257 1.00 0.00 O ATOM 727 CB GLU A 135 6.715 -11.906 1.150 1.00 0.00 C ATOM 728 CG GLU A 135 8.036 -11.393 0.601 1.00 0.00 C ATOM 729 CD GLU A 135 8.871 -12.491 -0.029 1.00 0.00 C ATOM 730 OE1 GLU A 135 9.176 -13.480 0.670 1.00 0.00 O ATOM 731 OE2 GLU A 135 9.218 -12.363 -1.222 1.00 0.00 O ATOM 0 H GLU A 135 4.566 -12.423 2.374 1.00 0.00 H new ATOM 0 HA GLU A 135 7.112 -11.254 3.161 1.00 0.00 H new ATOM 0 HB2 GLU A 135 6.795 -12.980 1.321 1.00 0.00 H new ATOM 0 HB3 GLU A 135 5.938 -11.759 0.400 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.841 -10.619 -0.141 1.00 0.00 H new ATOM 0 HG3 GLU A 135 8.603 -10.927 1.406 1.00 0.00 H new ATOM 738 N LEU A 136 4.672 -9.511 1.863 1.00 0.00 N ATOM 739 CA LEU A 136 4.213 -8.157 1.579 1.00 0.00 C ATOM 740 C LEU A 136 4.224 -7.297 2.839 1.00 0.00 C ATOM 741 O LEU A 136 4.766 -6.192 2.844 1.00 0.00 O ATOM 742 CB LEU A 136 2.804 -8.187 0.980 1.00 0.00 C ATOM 743 CG LEU A 136 2.159 -6.816 0.762 1.00 0.00 C ATOM 744 CD1 LEU A 136 3.158 -5.848 0.149 1.00 0.00 C ATOM 745 CD2 LEU A 136 0.926 -6.942 -0.119 1.00 0.00 C ATOM 0 H LEU A 136 3.947 -10.225 1.796 1.00 0.00 H new ATOM 0 HA LEU A 136 4.899 -7.715 0.856 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.844 -8.708 0.023 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.160 -8.773 1.636 1.00 0.00 H new ATOM 0 HG LEU A 136 1.850 -6.422 1.730 1.00 0.00 H new ATOM 0 HD11 LEU A 136 2.682 -4.879 0.001 1.00 0.00 H new ATOM 0 HD12 LEU A 136 4.012 -5.735 0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 136 3.498 -6.235 -0.811 1.00 0.00 H new ATOM 0 HD21 LEU A 136 0.480 -5.958 -0.264 1.00 0.00 H new ATOM 0 HD22 LEU A 136 1.211 -7.357 -1.086 1.00 0.00 H new ATOM 0 HD23 LEU A 136 0.202 -7.601 0.360 1.00 0.00 H new ATOM 757 N MET A 137 3.617 -7.812 3.904 1.00 0.00 N ATOM 758 CA MET A 137 3.546 -7.098 5.178 1.00 0.00 C ATOM 759 C MET A 137 4.897 -6.490 5.550 1.00 0.00 C ATOM 760 O MET A 137 4.960 -5.451 6.208 1.00 0.00 O ATOM 761 CB MET A 137 3.081 -8.043 6.288 1.00 0.00 C ATOM 762 CG MET A 137 2.775 -7.337 7.599 1.00 0.00 C ATOM 763 SD MET A 137 1.219 -6.427 7.551 1.00 0.00 S ATOM 764 CE MET A 137 1.511 -5.193 8.816 1.00 0.00 C ATOM 0 H MET A 137 3.164 -8.726 3.911 1.00 0.00 H new ATOM 0 HA MET A 137 2.826 -6.288 5.066 1.00 0.00 H new ATOM 0 HB2 MET A 137 2.189 -8.572 5.953 1.00 0.00 H new ATOM 0 HB3 MET A 137 3.852 -8.794 6.461 1.00 0.00 H new ATOM 0 HG2 MET A 137 2.737 -8.072 8.403 1.00 0.00 H new ATOM 0 HG3 MET A 137 3.587 -6.649 7.835 1.00 0.00 H new ATOM 0 HE1 MET A 137 1.075 -4.243 8.506 1.00 0.00 H new ATOM 0 HE2 MET A 137 1.052 -5.515 9.751 1.00 0.00 H new ATOM 0 HE3 MET A 137 2.584 -5.069 8.962 1.00 0.00 H new ATOM 774 N LYS A 138 5.973 -7.144 5.125 1.00 0.00 N ATOM 775 CA LYS A 138 7.321 -6.666 5.412 1.00 0.00 C ATOM 776 C LYS A 138 7.515 -5.239 4.907 1.00 0.00 C ATOM 777 O LYS A 138 8.330 -4.486 5.440 1.00 0.00 O ATOM 778 CB LYS A 138 8.357 -7.592 4.772 1.00 0.00 C ATOM 779 CG LYS A 138 9.559 -7.868 5.661 1.00 0.00 C ATOM 780 CD LYS A 138 10.346 -9.074 5.174 1.00 0.00 C ATOM 781 CE LYS A 138 10.831 -9.929 6.333 1.00 0.00 C ATOM 782 NZ LYS A 138 10.911 -11.370 5.964 1.00 0.00 N ATOM 0 H LYS A 138 5.938 -8.006 4.581 1.00 0.00 H new ATOM 0 HA LYS A 138 7.458 -6.668 6.493 1.00 0.00 H new ATOM 0 HB2 LYS A 138 7.879 -8.538 4.518 1.00 0.00 H new ATOM 0 HB3 LYS A 138 8.701 -7.148 3.838 1.00 0.00 H new ATOM 0 HG2 LYS A 138 10.208 -6.992 5.680 1.00 0.00 H new ATOM 0 HG3 LYS A 138 9.225 -8.039 6.684 1.00 0.00 H new ATOM 0 HD2 LYS A 138 9.721 -9.675 4.514 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.200 -8.739 4.586 1.00 0.00 H new ATOM 0 HE2 LYS A 138 11.813 -9.581 6.655 1.00 0.00 H new ATOM 0 HE3 LYS A 138 10.157 -9.808 7.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 11.246 -11.920 6.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 9.969 -11.709 5.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 11.574 -11.489 5.172 1.00 0.00 H new ATOM 796 N ASP A 139 6.759 -4.873 3.876 1.00 0.00 N ATOM 797 CA ASP A 139 6.846 -3.537 3.298 1.00 0.00 C ATOM 798 C ASP A 139 6.108 -2.519 4.161 1.00 0.00 C ATOM 799 O ASP A 139 6.657 -1.475 4.512 1.00 0.00 O ATOM 800 CB ASP A 139 6.267 -3.534 1.883 1.00 0.00 C ATOM 801 CG ASP A 139 7.000 -2.582 0.959 1.00 0.00 C ATOM 802 OD1 ASP A 139 8.098 -2.942 0.484 1.00 0.00 O ATOM 803 OD2 ASP A 139 6.478 -1.475 0.711 1.00 0.00 O ATOM 0 H ASP A 139 6.079 -5.484 3.424 1.00 0.00 H new ATOM 0 HA ASP A 139 7.898 -3.256 3.256 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.314 -4.543 1.472 1.00 0.00 H new ATOM 0 HB3 ASP A 139 5.214 -3.256 1.925 1.00 0.00 H new ATOM 808 N GLY A 140 4.861 -2.830 4.498 1.00 0.00 N ATOM 809 CA GLY A 140 4.069 -1.929 5.317 1.00 0.00 C ATOM 810 C GLY A 140 4.715 -1.651 6.659 1.00 0.00 C ATOM 811 O GLY A 140 5.130 -0.526 6.935 1.00 0.00 O ATOM 0 H GLY A 140 4.385 -3.688 4.220 1.00 0.00 H new ATOM 0 HA2 GLY A 140 3.926 -0.989 4.784 1.00 0.00 H new ATOM 0 HA3 GLY A 140 3.080 -2.360 5.475 1.00 0.00 H new ATOM 815 N ASP A 141 4.794 -2.679 7.494 1.00 0.00 N ATOM 816 CA ASP A 141 5.388 -2.542 8.817 1.00 0.00 C ATOM 817 C ASP A 141 6.909 -2.650 8.745 1.00 0.00 C ATOM 818 O ASP A 141 7.481 -3.706 9.015 1.00 0.00 O ATOM 819 CB ASP A 141 4.827 -3.610 9.758 1.00 0.00 C ATOM 820 CG ASP A 141 5.388 -3.499 11.162 1.00 0.00 C ATOM 821 OD1 ASP A 141 5.411 -2.375 11.705 1.00 0.00 O ATOM 822 OD2 ASP A 141 5.804 -4.537 11.719 1.00 0.00 O ATOM 0 H ASP A 141 4.454 -3.616 7.279 1.00 0.00 H new ATOM 0 HA ASP A 141 5.134 -1.556 9.206 1.00 0.00 H new ATOM 0 HB2 ASP A 141 3.741 -3.522 9.796 1.00 0.00 H new ATOM 0 HB3 ASP A 141 5.053 -4.598 9.357 1.00 0.00 H new ATOM 827 N LYS A 142 7.556 -1.548 8.380 1.00 0.00 N ATOM 828 CA LYS A 142 9.011 -1.514 8.272 1.00 0.00 C ATOM 829 C LYS A 142 9.626 -0.742 9.435 1.00 0.00 C ATOM 830 O LYS A 142 10.683 -0.128 9.294 1.00 0.00 O ATOM 831 CB LYS A 142 9.429 -0.874 6.946 1.00 0.00 C ATOM 832 CG LYS A 142 9.373 -1.828 5.764 1.00 0.00 C ATOM 833 CD LYS A 142 9.674 -1.113 4.457 1.00 0.00 C ATOM 834 CE LYS A 142 10.509 -1.978 3.528 1.00 0.00 C ATOM 835 NZ LYS A 142 11.179 -1.172 2.470 1.00 0.00 N ATOM 0 H LYS A 142 7.096 -0.666 8.154 1.00 0.00 H new ATOM 0 HA LYS A 142 9.376 -2.540 8.306 1.00 0.00 H new ATOM 0 HB2 LYS A 142 8.781 -0.021 6.744 1.00 0.00 H new ATOM 0 HB3 LYS A 142 10.444 -0.488 7.043 1.00 0.00 H new ATOM 0 HG2 LYS A 142 10.090 -2.635 5.912 1.00 0.00 H new ATOM 0 HG3 LYS A 142 8.385 -2.285 5.711 1.00 0.00 H new ATOM 0 HD2 LYS A 142 8.739 -0.845 3.964 1.00 0.00 H new ATOM 0 HD3 LYS A 142 10.203 -0.183 4.664 1.00 0.00 H new ATOM 0 HE2 LYS A 142 11.261 -2.512 4.108 1.00 0.00 H new ATOM 0 HE3 LYS A 142 9.872 -2.730 3.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 11.738 -1.799 1.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 10.461 -0.682 1.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 11.807 -0.471 2.913 1.00 0.00 H new ATOM 849 N ASN A 143 8.956 -0.776 10.583 1.00 0.00 N ATOM 850 CA ASN A 143 9.439 -0.078 11.770 1.00 0.00 C ATOM 851 C ASN A 143 9.882 -1.061 12.853 1.00 0.00 C ATOM 852 O ASN A 143 10.300 -0.652 13.937 1.00 0.00 O ATOM 853 CB ASN A 143 8.349 0.845 12.319 1.00 0.00 C ATOM 854 CG ASN A 143 8.505 2.275 11.838 1.00 0.00 C ATOM 855 OD1 ASN A 143 9.564 2.664 11.346 1.00 0.00 O ATOM 856 ND2 ASN A 143 7.447 3.065 11.978 1.00 0.00 N ATOM 0 H ASN A 143 8.078 -1.279 10.717 1.00 0.00 H new ATOM 0 HA ASN A 143 10.304 0.517 11.478 1.00 0.00 H new ATOM 0 HB2 ASN A 143 7.372 0.468 12.018 1.00 0.00 H new ATOM 0 HB3 ASN A 143 8.376 0.826 13.409 1.00 0.00 H new ATOM 0 HD21 ASN A 143 7.492 4.037 11.672 1.00 0.00 H new ATOM 0 HD22 ASN A 143 6.589 2.700 12.391 1.00 0.00 H new ATOM 863 N ASN A 144 9.791 -2.356 12.560 1.00 0.00 N ATOM 864 CA ASN A 144 10.185 -3.384 13.516 1.00 0.00 C ATOM 865 C ASN A 144 9.372 -3.270 14.802 1.00 0.00 C ATOM 866 O ASN A 144 9.903 -3.431 15.901 1.00 0.00 O ATOM 867 CB ASN A 144 11.678 -3.273 13.828 1.00 0.00 C ATOM 868 CG ASN A 144 12.345 -4.629 13.954 1.00 0.00 C ATOM 869 OD1 ASN A 144 11.675 -5.657 14.041 1.00 0.00 O ATOM 870 ND2 ASN A 144 13.673 -4.636 13.964 1.00 0.00 N ATOM 0 H ASN A 144 9.448 -2.717 11.669 1.00 0.00 H new ATOM 0 HA ASN A 144 9.987 -4.358 13.069 1.00 0.00 H new ATOM 0 HB2 ASN A 144 12.169 -2.701 13.041 1.00 0.00 H new ATOM 0 HB3 ASN A 144 11.812 -2.718 14.756 1.00 0.00 H new ATOM 0 HD21 ASN A 144 14.178 -5.519 14.046 1.00 0.00 H new ATOM 0 HD22 ASN A 144 14.188 -3.759 13.889 1.00 0.00 H new ATOM 877 N ASP A 145 8.081 -2.991 14.656 1.00 0.00 N ATOM 878 CA ASP A 145 7.192 -2.855 15.805 1.00 0.00 C ATOM 879 C ASP A 145 6.127 -3.947 15.800 1.00 0.00 C ATOM 880 O ASP A 145 5.818 -4.530 16.839 1.00 0.00 O ATOM 881 CB ASP A 145 6.528 -1.476 15.804 1.00 0.00 C ATOM 882 CG ASP A 145 5.995 -1.089 14.438 1.00 0.00 C ATOM 883 OD1 ASP A 145 6.781 -1.102 13.468 1.00 0.00 O ATOM 884 OD2 ASP A 145 4.791 -0.772 14.339 1.00 0.00 O ATOM 0 H ASP A 145 7.626 -2.855 13.753 1.00 0.00 H new ATOM 0 HA ASP A 145 7.790 -2.960 16.710 1.00 0.00 H new ATOM 0 HB2 ASP A 145 5.710 -1.470 16.525 1.00 0.00 H new ATOM 0 HB3 ASP A 145 7.250 -0.729 16.134 1.00 0.00 H new ATOM 889 N GLY A 146 5.574 -4.222 14.624 1.00 0.00 N ATOM 890 CA GLY A 146 4.553 -5.248 14.507 1.00 0.00 C ATOM 891 C GLY A 146 3.215 -4.700 14.046 1.00 0.00 C ATOM 892 O GLY A 146 2.176 -5.319 14.272 1.00 0.00 O ATOM 0 H GLY A 146 5.814 -3.754 13.750 1.00 0.00 H new ATOM 0 HA2 GLY A 146 4.890 -6.010 13.804 1.00 0.00 H new ATOM 0 HA3 GLY A 146 4.426 -5.739 15.472 1.00 0.00 H new ATOM 896 N ARG A 147 3.237 -3.540 13.396 1.00 0.00 N ATOM 897 CA ARG A 147 2.011 -2.922 12.905 1.00 0.00 C ATOM 898 C ARG A 147 2.320 -1.752 11.974 1.00 0.00 C ATOM 899 O ARG A 147 3.316 -1.051 12.150 1.00 0.00 O ATOM 900 CB ARG A 147 1.148 -2.445 14.077 1.00 0.00 C ATOM 901 CG ARG A 147 1.762 -1.296 14.863 1.00 0.00 C ATOM 902 CD ARG A 147 2.311 -1.764 16.201 1.00 0.00 C ATOM 903 NE ARG A 147 2.069 -0.790 17.262 1.00 0.00 N ATOM 904 CZ ARG A 147 0.877 -0.577 17.814 1.00 0.00 C ATOM 905 NH1 ARG A 147 -0.182 -1.268 17.411 1.00 0.00 N ATOM 906 NH2 ARG A 147 0.743 0.330 18.773 1.00 0.00 N ATOM 0 H ARG A 147 4.087 -3.012 13.198 1.00 0.00 H new ATOM 0 HA ARG A 147 1.460 -3.673 12.340 1.00 0.00 H new ATOM 0 HB2 ARG A 147 0.175 -2.134 13.697 1.00 0.00 H new ATOM 0 HB3 ARG A 147 0.973 -3.283 14.752 1.00 0.00 H new ATOM 0 HG2 ARG A 147 2.563 -0.842 14.279 1.00 0.00 H new ATOM 0 HG3 ARG A 147 1.010 -0.524 15.027 1.00 0.00 H new ATOM 0 HD2 ARG A 147 1.850 -2.715 16.469 1.00 0.00 H new ATOM 0 HD3 ARG A 147 3.382 -1.943 16.111 1.00 0.00 H new ATOM 0 HE ARG A 147 2.860 -0.241 17.600 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -0.085 -1.967 16.674 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -1.093 -1.100 17.838 1.00 0.00 H new ATOM 0 HH21 ARG A 147 1.553 0.864 19.087 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -0.171 0.494 19.196 1.00 0.00 H new ATOM 920 N ILE A 148 1.455 -1.549 10.986 1.00 0.00 N ATOM 921 CA ILE A 148 1.626 -0.466 10.026 1.00 0.00 C ATOM 922 C ILE A 148 0.479 0.535 10.145 1.00 0.00 C ATOM 923 O ILE A 148 -0.667 0.142 10.340 1.00 0.00 O ATOM 924 CB ILE A 148 1.714 -1.019 8.585 1.00 0.00 C ATOM 925 CG1 ILE A 148 2.398 -0.013 7.662 1.00 0.00 C ATOM 926 CG2 ILE A 148 0.343 -1.396 8.047 1.00 0.00 C ATOM 927 CD1 ILE A 148 1.561 1.210 7.374 1.00 0.00 C ATOM 0 H ILE A 148 0.626 -2.123 10.829 1.00 0.00 H new ATOM 0 HA ILE A 148 2.561 0.047 10.251 1.00 0.00 H new ATOM 0 HB ILE A 148 2.317 -1.926 8.616 1.00 0.00 H new ATOM 0 HG12 ILE A 148 3.340 0.300 8.113 1.00 0.00 H new ATOM 0 HG13 ILE A 148 2.643 -0.505 6.721 1.00 0.00 H new ATOM 0 HG21 ILE A 148 0.444 -1.781 7.032 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -0.099 -2.162 8.683 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -0.300 -0.516 8.039 1.00 0.00 H new ATOM 0 HD11 ILE A 148 2.111 1.880 6.712 1.00 0.00 H new ATOM 0 HD12 ILE A 148 0.630 0.909 6.894 1.00 0.00 H new ATOM 0 HD13 ILE A 148 1.337 1.726 8.308 1.00 0.00 H new ATOM 939 N ASP A 149 0.793 1.828 10.054 1.00 0.00 N ATOM 940 CA ASP A 149 -0.227 2.869 10.183 1.00 0.00 C ATOM 941 C ASP A 149 -0.401 3.676 8.897 1.00 0.00 C ATOM 942 O ASP A 149 0.332 3.497 7.927 1.00 0.00 O ATOM 943 CB ASP A 149 0.128 3.809 11.337 1.00 0.00 C ATOM 944 CG ASP A 149 1.420 4.562 11.093 1.00 0.00 C ATOM 945 OD1 ASP A 149 1.394 5.556 10.336 1.00 0.00 O ATOM 946 OD2 ASP A 149 2.459 4.159 11.658 1.00 0.00 O ATOM 0 H ASP A 149 1.738 2.177 9.893 1.00 0.00 H new ATOM 0 HA ASP A 149 -1.174 2.369 10.387 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -0.683 4.522 11.483 1.00 0.00 H new ATOM 0 HB3 ASP A 149 0.215 3.232 12.258 1.00 0.00 H new ATOM 951 N TYR A 150 -1.389 4.568 8.907 1.00 0.00 N ATOM 952 CA TYR A 150 -1.688 5.417 7.754 1.00 0.00 C ATOM 953 C TYR A 150 -0.425 6.067 7.189 1.00 0.00 C ATOM 954 O TYR A 150 -0.250 6.147 5.974 1.00 0.00 O ATOM 955 CB TYR A 150 -2.701 6.497 8.150 1.00 0.00 C ATOM 956 CG TYR A 150 -3.026 7.479 7.044 1.00 0.00 C ATOM 957 CD1 TYR A 150 -2.989 7.095 5.709 1.00 0.00 C ATOM 958 CD2 TYR A 150 -3.372 8.792 7.338 1.00 0.00 C ATOM 959 CE1 TYR A 150 -3.286 7.991 4.700 1.00 0.00 C ATOM 960 CE2 TYR A 150 -3.671 9.694 6.335 1.00 0.00 C ATOM 961 CZ TYR A 150 -3.626 9.289 5.018 1.00 0.00 C ATOM 962 OH TYR A 150 -3.923 10.184 4.016 1.00 0.00 O ATOM 0 H TYR A 150 -2.001 4.723 9.708 1.00 0.00 H new ATOM 0 HA TYR A 150 -2.114 4.785 6.975 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -3.623 6.013 8.474 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -2.312 7.047 9.007 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -2.724 6.079 5.456 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -3.408 9.113 8.368 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -3.252 7.676 3.667 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -3.939 10.711 6.581 1.00 0.00 H new ATOM 0 HH TYR A 150 -4.143 11.054 4.409 1.00 0.00 H new ATOM 972 N ASP A 151 0.449 6.531 8.074 1.00 0.00 N ATOM 973 CA ASP A 151 1.689 7.173 7.651 1.00 0.00 C ATOM 974 C ASP A 151 2.549 6.212 6.839 1.00 0.00 C ATOM 975 O ASP A 151 2.801 6.438 5.656 1.00 0.00 O ATOM 976 CB ASP A 151 2.471 7.675 8.867 1.00 0.00 C ATOM 977 CG ASP A 151 3.534 8.688 8.492 1.00 0.00 C ATOM 978 OD1 ASP A 151 4.350 8.388 7.595 1.00 0.00 O ATOM 979 OD2 ASP A 151 3.552 9.781 9.096 1.00 0.00 O ATOM 0 H ASP A 151 0.324 6.476 9.085 1.00 0.00 H new ATOM 0 HA ASP A 151 1.431 8.023 7.019 1.00 0.00 H new ATOM 0 HB2 ASP A 151 1.780 8.125 9.580 1.00 0.00 H new ATOM 0 HB3 ASP A 151 2.940 6.829 9.369 1.00 0.00 H new ATOM 984 N GLU A 152 2.994 5.137 7.480 1.00 0.00 N ATOM 985 CA GLU A 152 3.823 4.142 6.811 1.00 0.00 C ATOM 986 C GLU A 152 3.085 3.525 5.626 1.00 0.00 C ATOM 987 O GLU A 152 3.708 3.027 4.688 1.00 0.00 O ATOM 988 CB GLU A 152 4.244 3.050 7.797 1.00 0.00 C ATOM 989 CG GLU A 152 5.648 3.236 8.348 1.00 0.00 C ATOM 990 CD GLU A 152 5.850 2.536 9.678 1.00 0.00 C ATOM 991 OE1 GLU A 152 5.204 2.943 10.667 1.00 0.00 O ATOM 992 OE2 GLU A 152 6.653 1.581 9.731 1.00 0.00 O ATOM 0 H GLU A 152 2.795 4.933 8.459 1.00 0.00 H new ATOM 0 HA GLU A 152 4.716 4.642 6.435 1.00 0.00 H new ATOM 0 HB2 GLU A 152 3.537 3.029 8.626 1.00 0.00 H new ATOM 0 HB3 GLU A 152 4.183 2.081 7.301 1.00 0.00 H new ATOM 0 HG2 GLU A 152 6.371 2.854 7.627 1.00 0.00 H new ATOM 0 HG3 GLU A 152 5.849 4.301 8.468 1.00 0.00 H new ATOM 999 N PHE A 153 1.754 3.564 5.669 1.00 0.00 N ATOM 1000 CA PHE A 153 0.942 3.011 4.591 1.00 0.00 C ATOM 1001 C PHE A 153 1.248 3.719 3.277 1.00 0.00 C ATOM 1002 O PHE A 153 1.373 3.084 2.232 1.00 0.00 O ATOM 1003 CB PHE A 153 -0.551 3.129 4.928 1.00 0.00 C ATOM 1004 CG PHE A 153 -1.462 2.989 3.737 1.00 0.00 C ATOM 1005 CD1 PHE A 153 -1.147 2.122 2.703 1.00 0.00 C ATOM 1006 CD2 PHE A 153 -2.629 3.730 3.651 1.00 0.00 C ATOM 1007 CE1 PHE A 153 -1.978 1.996 1.608 1.00 0.00 C ATOM 1008 CE2 PHE A 153 -3.464 3.607 2.557 1.00 0.00 C ATOM 1009 CZ PHE A 153 -3.138 2.740 1.534 1.00 0.00 C ATOM 0 H PHE A 153 1.219 3.971 6.436 1.00 0.00 H new ATOM 0 HA PHE A 153 1.189 1.955 4.481 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.809 2.365 5.661 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -0.731 4.096 5.398 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -0.240 1.538 2.754 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -2.889 4.411 4.448 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -1.721 1.316 0.810 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -4.372 4.189 2.502 1.00 0.00 H new ATOM 0 HZ PHE A 153 -3.789 2.644 0.678 1.00 0.00 H new ATOM 1019 N LEU A 154 1.373 5.038 3.336 1.00 0.00 N ATOM 1020 CA LEU A 154 1.672 5.824 2.149 1.00 0.00 C ATOM 1021 C LEU A 154 2.975 5.357 1.501 1.00 0.00 C ATOM 1022 O LEU A 154 3.221 5.620 0.324 1.00 0.00 O ATOM 1023 CB LEU A 154 1.744 7.311 2.509 1.00 0.00 C ATOM 1024 CG LEU A 154 0.656 7.807 3.473 1.00 0.00 C ATOM 1025 CD1 LEU A 154 0.572 9.326 3.439 1.00 0.00 C ATOM 1026 CD2 LEU A 154 -0.704 7.192 3.145 1.00 0.00 C ATOM 0 H LEU A 154 1.272 5.584 4.192 1.00 0.00 H new ATOM 0 HA LEU A 154 0.870 5.680 1.425 1.00 0.00 H new ATOM 0 HB2 LEU A 154 2.719 7.514 2.952 1.00 0.00 H new ATOM 0 HB3 LEU A 154 1.685 7.894 1.590 1.00 0.00 H new ATOM 0 HG LEU A 154 0.931 7.490 4.479 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -0.203 9.663 4.127 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.531 9.750 3.737 1.00 0.00 H new ATOM 0 HD13 LEU A 154 0.328 9.654 2.429 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -1.450 7.565 3.846 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -0.992 7.465 2.130 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -0.641 6.107 3.224 1.00 0.00 H new ATOM 1038 N GLU A 155 3.799 4.647 2.271 1.00 0.00 N ATOM 1039 CA GLU A 155 5.063 4.127 1.765 1.00 0.00 C ATOM 1040 C GLU A 155 4.813 3.028 0.734 1.00 0.00 C ATOM 1041 O GLU A 155 5.598 2.843 -0.197 1.00 0.00 O ATOM 1042 CB GLU A 155 5.912 3.581 2.914 1.00 0.00 C ATOM 1043 CG GLU A 155 7.403 3.568 2.618 1.00 0.00 C ATOM 1044 CD GLU A 155 8.236 4.032 3.796 1.00 0.00 C ATOM 1045 OE1 GLU A 155 8.041 5.181 4.245 1.00 0.00 O ATOM 1046 OE2 GLU A 155 9.084 3.247 4.270 1.00 0.00 O ATOM 0 H GLU A 155 3.611 4.420 3.248 1.00 0.00 H new ATOM 0 HA GLU A 155 5.603 4.943 1.285 1.00 0.00 H new ATOM 0 HB2 GLU A 155 5.732 4.183 3.805 1.00 0.00 H new ATOM 0 HB3 GLU A 155 5.587 2.566 3.144 1.00 0.00 H new ATOM 0 HG2 GLU A 155 7.705 2.559 2.339 1.00 0.00 H new ATOM 0 HG3 GLU A 155 7.605 4.209 1.760 1.00 0.00 H new ATOM 1053 N PHE A 156 3.707 2.304 0.908 1.00 0.00 N ATOM 1054 CA PHE A 156 3.334 1.221 -0.002 1.00 0.00 C ATOM 1055 C PHE A 156 3.370 1.692 -1.454 1.00 0.00 C ATOM 1056 O PHE A 156 4.165 1.208 -2.260 1.00 0.00 O ATOM 1057 CB PHE A 156 1.928 0.714 0.337 1.00 0.00 C ATOM 1058 CG PHE A 156 1.867 -0.743 0.696 1.00 0.00 C ATOM 1059 CD1 PHE A 156 2.659 -1.257 1.709 1.00 0.00 C ATOM 1060 CD2 PHE A 156 1.007 -1.597 0.024 1.00 0.00 C ATOM 1061 CE1 PHE A 156 2.595 -2.595 2.046 1.00 0.00 C ATOM 1062 CE2 PHE A 156 0.941 -2.937 0.355 1.00 0.00 C ATOM 1063 CZ PHE A 156 1.736 -3.436 1.367 1.00 0.00 C ATOM 0 H PHE A 156 3.051 2.449 1.675 1.00 0.00 H new ATOM 0 HA PHE A 156 4.054 0.412 0.119 1.00 0.00 H new ATOM 0 HB2 PHE A 156 1.535 1.298 1.169 1.00 0.00 H new ATOM 0 HB3 PHE A 156 1.274 0.894 -0.516 1.00 0.00 H new ATOM 0 HD1 PHE A 156 3.335 -0.604 2.242 1.00 0.00 H new ATOM 0 HD2 PHE A 156 0.381 -1.211 -0.767 1.00 0.00 H new ATOM 0 HE1 PHE A 156 3.216 -2.983 2.840 1.00 0.00 H new ATOM 0 HE2 PHE A 156 0.268 -3.593 -0.177 1.00 0.00 H new ATOM 0 HZ PHE A 156 1.686 -4.483 1.627 1.00 0.00 H new ATOM 1073 N MET A 157 2.494 2.637 -1.774 1.00 0.00 N ATOM 1074 CA MET A 157 2.403 3.185 -3.124 1.00 0.00 C ATOM 1075 C MET A 157 3.609 4.057 -3.442 1.00 0.00 C ATOM 1076 O MET A 157 4.082 4.090 -4.576 1.00 0.00 O ATOM 1077 CB MET A 157 1.125 4.010 -3.277 1.00 0.00 C ATOM 1078 CG MET A 157 -0.083 3.393 -2.598 1.00 0.00 C ATOM 1079 SD MET A 157 -0.573 1.825 -3.341 1.00 0.00 S ATOM 1080 CE MET A 157 -1.357 1.020 -1.946 1.00 0.00 C ATOM 0 H MET A 157 1.832 3.043 -1.113 1.00 0.00 H new ATOM 0 HA MET A 157 2.382 2.349 -3.823 1.00 0.00 H new ATOM 0 HB2 MET A 157 1.294 5.005 -2.865 1.00 0.00 H new ATOM 0 HB3 MET A 157 0.909 4.137 -4.338 1.00 0.00 H new ATOM 0 HG2 MET A 157 0.139 3.237 -1.542 1.00 0.00 H new ATOM 0 HG3 MET A 157 -0.919 4.091 -2.648 1.00 0.00 H new ATOM 0 HE1 MET A 157 -2.258 0.506 -2.282 1.00 0.00 H new ATOM 0 HE2 MET A 157 -0.668 0.297 -1.509 1.00 0.00 H new ATOM 0 HE3 MET A 157 -1.623 1.766 -1.198 1.00 0.00 H new ATOM 1090 N LYS A 158 4.094 4.768 -2.433 1.00 0.00 N ATOM 1091 CA LYS A 158 5.247 5.652 -2.600 1.00 0.00 C ATOM 1092 C LYS A 158 6.368 4.963 -3.378 1.00 0.00 C ATOM 1093 O LYS A 158 7.148 5.616 -4.071 1.00 0.00 O ATOM 1094 CB LYS A 158 5.760 6.113 -1.237 1.00 0.00 C ATOM 1095 CG LYS A 158 5.444 7.567 -0.935 1.00 0.00 C ATOM 1096 CD LYS A 158 5.014 7.758 0.511 1.00 0.00 C ATOM 1097 CE LYS A 158 5.511 9.081 1.069 1.00 0.00 C ATOM 1098 NZ LYS A 158 5.886 8.972 2.506 1.00 0.00 N ATOM 0 H LYS A 158 3.709 4.752 -1.489 1.00 0.00 H new ATOM 0 HA LYS A 158 4.923 6.521 -3.174 1.00 0.00 H new ATOM 0 HB2 LYS A 158 5.323 5.485 -0.461 1.00 0.00 H new ATOM 0 HB3 LYS A 158 6.839 5.967 -1.195 1.00 0.00 H new ATOM 0 HG2 LYS A 158 6.322 8.180 -1.138 1.00 0.00 H new ATOM 0 HG3 LYS A 158 4.652 7.913 -1.599 1.00 0.00 H new ATOM 0 HD2 LYS A 158 3.927 7.720 0.577 1.00 0.00 H new ATOM 0 HD3 LYS A 158 5.399 6.938 1.118 1.00 0.00 H new ATOM 0 HE2 LYS A 158 6.373 9.417 0.493 1.00 0.00 H new ATOM 0 HE3 LYS A 158 4.736 9.838 0.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 6.220 9.895 2.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 5.057 8.676 3.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 6.644 8.268 2.615 1.00 0.00 H new ATOM 1112 N GLY A 159 6.441 3.640 -3.259 1.00 0.00 N ATOM 1113 CA GLY A 159 7.468 2.887 -3.958 1.00 0.00 C ATOM 1114 C GLY A 159 7.166 2.726 -5.436 1.00 0.00 C ATOM 1115 O GLY A 159 8.075 2.541 -6.245 1.00 0.00 O ATOM 0 H GLY A 159 5.808 3.076 -2.692 1.00 0.00 H new ATOM 0 HA2 GLY A 159 8.427 3.391 -3.839 1.00 0.00 H new ATOM 0 HA3 GLY A 159 7.566 1.902 -3.501 1.00 0.00 H new ATOM 1119 N VAL A 160 5.885 2.798 -5.789 1.00 0.00 N ATOM 1120 CA VAL A 160 5.455 2.661 -7.175 1.00 0.00 C ATOM 1121 C VAL A 160 6.268 3.563 -8.102 1.00 0.00 C ATOM 1122 O VAL A 160 6.459 3.250 -9.277 1.00 0.00 O ATOM 1123 CB VAL A 160 3.960 3.003 -7.325 1.00 0.00 C ATOM 1124 CG1 VAL A 160 3.485 2.725 -8.741 1.00 0.00 C ATOM 1125 CG2 VAL A 160 3.127 2.226 -6.315 1.00 0.00 C ATOM 0 H VAL A 160 5.123 2.952 -5.128 1.00 0.00 H new ATOM 0 HA VAL A 160 5.619 1.621 -7.458 1.00 0.00 H new ATOM 0 HB VAL A 160 3.832 4.067 -7.126 1.00 0.00 H new ATOM 0 HG11 VAL A 160 2.427 2.973 -8.825 1.00 0.00 H new ATOM 0 HG12 VAL A 160 4.057 3.332 -9.442 1.00 0.00 H new ATOM 0 HG13 VAL A 160 3.630 1.670 -8.973 1.00 0.00 H new ATOM 0 HG21 VAL A 160 2.075 2.482 -6.438 1.00 0.00 H new ATOM 0 HG22 VAL A 160 3.262 1.157 -6.478 1.00 0.00 H new ATOM 0 HG23 VAL A 160 3.447 2.482 -5.305 1.00 0.00 H new ATOM 1135 N GLU A 161 6.743 4.682 -7.565 1.00 0.00 N ATOM 1136 CA GLU A 161 7.535 5.627 -8.344 1.00 0.00 C ATOM 1137 C GLU A 161 8.814 4.972 -8.856 1.00 0.00 C ATOM 1138 O GLU A 161 9.241 3.962 -8.259 1.00 0.00 O ATOM 1139 CB GLU A 161 7.878 6.856 -7.500 1.00 0.00 C ATOM 1140 CG GLU A 161 6.890 7.999 -7.661 1.00 0.00 C ATOM 1141 CD GLU A 161 7.094 9.095 -6.633 1.00 0.00 C ATOM 1142 OE1 GLU A 161 8.260 9.470 -6.389 1.00 0.00 O ATOM 1143 OE2 GLU A 161 6.088 9.579 -6.073 1.00 0.00 O ATOM 1144 OXT GLU A 161 9.379 5.476 -9.850 1.00 0.00 O ATOM 0 H GLU A 161 6.593 4.957 -6.594 1.00 0.00 H new ATOM 0 HA GLU A 161 6.941 5.940 -9.202 1.00 0.00 H new ATOM 0 HB2 GLU A 161 7.917 6.566 -6.450 1.00 0.00 H new ATOM 0 HB3 GLU A 161 8.874 7.206 -7.771 1.00 0.00 H new ATOM 0 HG2 GLU A 161 6.988 8.421 -8.661 1.00 0.00 H new ATOM 0 HG3 GLU A 161 5.875 7.611 -7.577 1.00 0.00 H new ATOM 1226 N PHE B 132 0.527 -6.274 -7.850 1.00 0.00 N ATOM 1227 CA PHE B 132 -0.770 -6.668 -8.384 1.00 0.00 C ATOM 1228 C PHE B 132 -1.859 -5.693 -7.955 1.00 0.00 C ATOM 1229 O PHE B 132 -2.279 -5.691 -6.800 1.00 0.00 O ATOM 1230 CB PHE B 132 -1.125 -8.079 -7.912 1.00 0.00 C ATOM 1231 CG PHE B 132 -0.996 -8.259 -6.424 1.00 0.00 C ATOM 1232 CD1 PHE B 132 0.226 -8.579 -5.854 1.00 0.00 C ATOM 1233 CD2 PHE B 132 -2.097 -8.106 -5.595 1.00 0.00 C ATOM 1234 CE1 PHE B 132 0.348 -8.743 -4.487 1.00 0.00 C ATOM 1235 CE2 PHE B 132 -1.980 -8.269 -4.228 1.00 0.00 C ATOM 1236 CZ PHE B 132 -0.756 -8.588 -3.673 1.00 0.00 C ATOM 0 HA PHE B 132 -0.705 -6.654 -9.472 1.00 0.00 H new ATOM 0 HB2 PHE B 132 -2.148 -8.308 -8.211 1.00 0.00 H new ATOM 0 HB3 PHE B 132 -0.477 -8.797 -8.415 1.00 0.00 H new ATOM 0 HD1 PHE B 132 1.093 -8.702 -6.486 1.00 0.00 H new ATOM 0 HD2 PHE B 132 -3.057 -7.857 -6.023 1.00 0.00 H new ATOM 0 HE1 PHE B 132 1.306 -8.992 -4.056 1.00 0.00 H new ATOM 0 HE2 PHE B 132 -2.845 -8.147 -3.594 1.00 0.00 H new ATOM 0 HZ PHE B 132 -0.663 -8.716 -2.605 1.00 0.00 H new ATOM 1246 N ASP B 133 -2.312 -4.861 -8.887 1.00 0.00 N ATOM 1247 CA ASP B 133 -3.351 -3.876 -8.593 1.00 0.00 C ATOM 1248 C ASP B 133 -2.792 -2.759 -7.717 1.00 0.00 C ATOM 1249 O ASP B 133 -2.863 -1.583 -8.075 1.00 0.00 O ATOM 1250 CB ASP B 133 -4.547 -4.542 -7.903 1.00 0.00 C ATOM 1251 CG ASP B 133 -5.848 -4.304 -8.645 1.00 0.00 C ATOM 1252 OD1 ASP B 133 -5.942 -3.291 -9.370 1.00 0.00 O ATOM 1253 OD2 ASP B 133 -6.774 -5.130 -8.500 1.00 0.00 O ATOM 0 H ASP B 133 -1.978 -4.848 -9.851 1.00 0.00 H new ATOM 0 HA ASP B 133 -3.691 -3.445 -9.535 1.00 0.00 H new ATOM 0 HB2 ASP B 133 -4.367 -5.614 -7.825 1.00 0.00 H new ATOM 0 HB3 ASP B 133 -4.636 -4.159 -6.886 1.00 0.00 H new ATOM 1258 N LEU B 134 -2.229 -3.139 -6.570 1.00 0.00 N ATOM 1259 CA LEU B 134 -1.642 -2.184 -5.636 1.00 0.00 C ATOM 1260 C LEU B 134 -0.834 -1.121 -6.373 1.00 0.00 C ATOM 1261 O LEU B 134 -0.969 0.073 -6.107 1.00 0.00 O ATOM 1262 CB LEU B 134 -0.739 -2.917 -4.643 1.00 0.00 C ATOM 1263 CG LEU B 134 -1.441 -3.966 -3.775 1.00 0.00 C ATOM 1264 CD1 LEU B 134 -1.232 -5.364 -4.344 1.00 0.00 C ATOM 1265 CD2 LEU B 134 -0.940 -3.894 -2.341 1.00 0.00 C ATOM 0 H LEU B 134 -2.168 -4.111 -6.266 1.00 0.00 H new ATOM 0 HA LEU B 134 -2.453 -1.691 -5.100 1.00 0.00 H new ATOM 0 HB2 LEU B 134 0.063 -3.405 -5.197 1.00 0.00 H new ATOM 0 HB3 LEU B 134 -0.272 -2.181 -3.989 1.00 0.00 H new ATOM 0 HG LEU B 134 -2.510 -3.752 -3.778 1.00 0.00 H new ATOM 0 HD11 LEU B 134 -1.739 -6.093 -3.712 1.00 0.00 H new ATOM 0 HD12 LEU B 134 -1.642 -5.411 -5.353 1.00 0.00 H new ATOM 0 HD13 LEU B 134 -0.166 -5.589 -4.374 1.00 0.00 H new ATOM 0 HD21 LEU B 134 -1.450 -4.646 -1.739 1.00 0.00 H new ATOM 0 HD22 LEU B 134 0.134 -4.080 -2.321 1.00 0.00 H new ATOM 0 HD23 LEU B 134 -1.144 -2.904 -1.933 1.00 0.00 H new ATOM 1277 N ARG B 135 0.003 -1.568 -7.303 1.00 0.00 N ATOM 1278 CA ARG B 135 0.832 -0.656 -8.082 1.00 0.00 C ATOM 1279 C ARG B 135 0.052 -0.076 -9.253 1.00 0.00 C ATOM 1280 O ARG B 135 -1.096 -0.446 -9.498 1.00 0.00 O ATOM 1281 CB ARG B 135 2.073 -1.374 -8.615 1.00 0.00 C ATOM 1282 CG ARG B 135 3.284 -0.467 -8.769 1.00 0.00 C ATOM 1283 CD ARG B 135 4.567 -1.268 -8.917 1.00 0.00 C ATOM 1284 NE ARG B 135 5.431 -0.729 -9.965 1.00 0.00 N ATOM 1285 CZ ARG B 135 6.718 -1.039 -10.097 1.00 0.00 C ATOM 1286 NH1 ARG B 135 7.296 -1.881 -9.249 1.00 0.00 N ATOM 1287 NH2 ARG B 135 7.430 -0.506 -11.080 1.00 0.00 N ATOM 0 H ARG B 135 0.125 -2.554 -7.535 1.00 0.00 H new ATOM 0 HA ARG B 135 1.138 0.154 -7.420 1.00 0.00 H new ATOM 0 HB2 ARG B 135 2.326 -2.192 -7.941 1.00 0.00 H new ATOM 0 HB3 ARG B 135 1.838 -1.819 -9.582 1.00 0.00 H new ATOM 0 HG2 ARG B 135 3.151 0.173 -9.641 1.00 0.00 H new ATOM 0 HG3 ARG B 135 3.361 0.188 -7.901 1.00 0.00 H new ATOM 0 HD2 ARG B 135 5.105 -1.270 -7.969 1.00 0.00 H new ATOM 0 HD3 ARG B 135 4.322 -2.305 -9.146 1.00 0.00 H new ATOM 0 HE ARG B 135 5.023 -0.077 -10.635 1.00 0.00 H new ATOM 0 HH11 ARG B 135 6.753 -2.294 -8.491 1.00 0.00 H new ATOM 0 HH12 ARG B 135 8.283 -2.115 -9.356 1.00 0.00 H new ATOM 0 HH21 ARG B 135 6.991 0.141 -11.735 1.00 0.00 H new ATOM 0 HH22 ARG B 135 8.417 -0.743 -11.182 1.00 0.00 H new ATOM 1301 N GLY B 136 0.694 0.829 -9.977 1.00 0.00 N ATOM 1302 CA GLY B 136 0.071 1.448 -11.124 1.00 0.00 C ATOM 1303 C GLY B 136 -1.034 2.413 -10.741 1.00 0.00 C ATOM 1304 O GLY B 136 -1.918 2.076 -9.955 1.00 0.00 O ATOM 0 H GLY B 136 1.644 1.147 -9.786 1.00 0.00 H new ATOM 0 HA2 GLY B 136 0.828 1.980 -11.701 1.00 0.00 H new ATOM 0 HA3 GLY B 136 -0.338 0.673 -11.772 1.00 0.00 H new ATOM 1308 N LYS B 137 -0.985 3.617 -11.302 1.00 0.00 N ATOM 1309 CA LYS B 137 -1.991 4.635 -11.018 1.00 0.00 C ATOM 1310 C LYS B 137 -2.065 4.936 -9.524 1.00 0.00 C ATOM 1311 O LYS B 137 -3.101 5.368 -9.019 1.00 0.00 O ATOM 1312 CB LYS B 137 -3.361 4.181 -11.525 1.00 0.00 C ATOM 1313 CG LYS B 137 -3.331 3.619 -12.937 1.00 0.00 C ATOM 1314 CD LYS B 137 -4.410 4.241 -13.810 1.00 0.00 C ATOM 1315 CE LYS B 137 -4.234 5.746 -13.927 1.00 0.00 C ATOM 1316 NZ LYS B 137 -5.153 6.487 -13.019 1.00 0.00 N ATOM 0 H LYS B 137 -0.260 3.912 -11.956 1.00 0.00 H new ATOM 0 HA LYS B 137 -1.699 5.548 -11.537 1.00 0.00 H new ATOM 0 HB2 LYS B 137 -3.756 3.423 -10.849 1.00 0.00 H new ATOM 0 HB3 LYS B 137 -4.049 5.026 -11.494 1.00 0.00 H new ATOM 0 HG2 LYS B 137 -2.353 3.802 -13.381 1.00 0.00 H new ATOM 0 HG3 LYS B 137 -3.468 2.538 -12.902 1.00 0.00 H new ATOM 0 HD2 LYS B 137 -4.380 3.792 -14.803 1.00 0.00 H new ATOM 0 HD3 LYS B 137 -5.391 4.020 -13.390 1.00 0.00 H new ATOM 0 HE2 LYS B 137 -3.203 6.010 -13.693 1.00 0.00 H new ATOM 0 HE3 LYS B 137 -4.416 6.053 -14.957 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 -5.817 7.054 -13.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 -5.685 5.810 -12.436 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 -4.599 7.115 -12.402 1.00 0.00 H new ATOM 1330 N PHE B 138 -0.959 4.708 -8.821 1.00 0.00 N ATOM 1331 CA PHE B 138 -0.903 4.959 -7.386 1.00 0.00 C ATOM 1332 C PHE B 138 0.339 5.768 -7.024 1.00 0.00 C ATOM 1333 O PHE B 138 0.848 5.675 -5.907 1.00 0.00 O ATOM 1334 CB PHE B 138 -0.909 3.637 -6.615 1.00 0.00 C ATOM 1335 CG PHE B 138 -2.286 3.128 -6.306 1.00 0.00 C ATOM 1336 CD1 PHE B 138 -3.043 3.710 -5.302 1.00 0.00 C ATOM 1337 CD2 PHE B 138 -2.821 2.068 -7.017 1.00 0.00 C ATOM 1338 CE1 PHE B 138 -4.310 3.244 -5.013 1.00 0.00 C ATOM 1339 CE2 PHE B 138 -4.089 1.596 -6.733 1.00 0.00 C ATOM 1340 CZ PHE B 138 -4.835 2.185 -5.730 1.00 0.00 C ATOM 0 H PHE B 138 -0.092 4.351 -9.222 1.00 0.00 H new ATOM 0 HA PHE B 138 -1.785 5.537 -7.108 1.00 0.00 H new ATOM 0 HB2 PHE B 138 -0.375 2.885 -7.196 1.00 0.00 H new ATOM 0 HB3 PHE B 138 -0.361 3.768 -5.682 1.00 0.00 H new ATOM 0 HD1 PHE B 138 -2.637 4.538 -4.739 1.00 0.00 H new ATOM 0 HD2 PHE B 138 -2.242 1.605 -7.802 1.00 0.00 H new ATOM 0 HE1 PHE B 138 -4.890 3.706 -4.228 1.00 0.00 H new ATOM 0 HE2 PHE B 138 -4.496 0.768 -7.294 1.00 0.00 H new ATOM 0 HZ PHE B 138 -5.826 1.819 -5.507 1.00 0.00 H new