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 64:sc= 0.0991 USER MOD Set 1.2: A 150 TYR OH : rot -15:sc= -1.7 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 160:sc= 1.11 (180deg=0.887) USER MOD Single : A 107 ASN : amide:sc= -0.284 K(o=-0.28,f=-2.2!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -156:sc= -0.0759 (180deg=-0.432) USER MOD Single : A 120 MET CE :methyl 150:sc= -6! (180deg=-11.3!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 THR OG1 : rot 40:sc= -0.515 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl 157:sc= -2.94 (180deg=-3.93!) 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= -0.253 K(o=-0.25,f=-2.3!) USER MOD Single : A 144 ASN : amide:sc= -0.0732 K(o=-0.073,f=-1.2!) USER MOD Single : A 157 MET CE :methyl -149:sc= -0.58 (180deg=-1.85!) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.0726) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 93 3.294 15.852 -0.954 1.00 0.00 N ATOM 72 CA SER A 93 3.592 14.479 -0.563 1.00 0.00 C ATOM 73 C SER A 93 2.800 14.086 0.679 1.00 0.00 C ATOM 74 O SER A 93 2.134 14.920 1.292 1.00 0.00 O ATOM 75 CB SER A 93 5.090 14.315 -0.301 1.00 0.00 C ATOM 76 OG SER A 93 5.554 13.058 -0.763 1.00 0.00 O ATOM 0 HA SER A 93 3.300 13.821 -1.382 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.639 15.114 -0.799 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.288 14.409 0.767 1.00 0.00 H new ATOM 0 HG SER A 93 6.514 12.978 -0.585 1.00 0.00 H new ATOM 82 N GLU A 94 2.876 12.810 1.047 1.00 0.00 N ATOM 83 CA GLU A 94 2.165 12.302 2.219 1.00 0.00 C ATOM 84 C GLU A 94 0.659 12.256 1.970 1.00 0.00 C ATOM 85 O GLU A 94 0.050 11.187 1.997 1.00 0.00 O ATOM 86 CB GLU A 94 2.465 13.168 3.446 1.00 0.00 C ATOM 87 CG GLU A 94 2.493 12.385 4.749 1.00 0.00 C ATOM 88 CD GLU A 94 3.714 12.698 5.591 1.00 0.00 C ATOM 89 OE1 GLU A 94 4.844 12.492 5.099 1.00 0.00 O ATOM 90 OE2 GLU A 94 3.541 13.149 6.743 1.00 0.00 O ATOM 0 H GLU A 94 3.423 12.107 0.550 1.00 0.00 H new ATOM 0 HA GLU A 94 2.514 11.287 2.407 1.00 0.00 H new ATOM 0 HB2 GLU A 94 3.427 13.661 3.307 1.00 0.00 H new ATOM 0 HB3 GLU A 94 1.713 13.953 3.519 1.00 0.00 H new ATOM 0 HG2 GLU A 94 1.594 12.609 5.323 1.00 0.00 H new ATOM 0 HG3 GLU A 94 2.473 11.318 4.528 1.00 0.00 H new ATOM 97 N GLU A 95 0.064 13.422 1.729 1.00 0.00 N ATOM 98 CA GLU A 95 -1.372 13.518 1.477 1.00 0.00 C ATOM 99 C GLU A 95 -1.830 12.464 0.471 1.00 0.00 C ATOM 100 O GLU A 95 -2.973 12.009 0.513 1.00 0.00 O ATOM 101 CB GLU A 95 -1.725 14.915 0.962 1.00 0.00 C ATOM 102 CG GLU A 95 -1.871 15.951 2.064 1.00 0.00 C ATOM 103 CD GLU A 95 -1.177 17.258 1.733 1.00 0.00 C ATOM 104 OE1 GLU A 95 0.068 17.259 1.629 1.00 0.00 O ATOM 105 OE2 GLU A 95 -1.878 18.280 1.579 1.00 0.00 O ATOM 0 H GLU A 95 0.555 14.315 1.703 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.890 13.338 2.419 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -0.952 15.243 0.267 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.657 14.861 0.400 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.930 16.141 2.241 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.460 15.550 2.991 1.00 0.00 H new ATOM 112 N GLU A 96 -0.932 12.080 -0.430 1.00 0.00 N ATOM 113 CA GLU A 96 -1.246 11.079 -1.443 1.00 0.00 C ATOM 114 C GLU A 96 -1.653 9.759 -0.796 1.00 0.00 C ATOM 115 O GLU A 96 -2.566 9.081 -1.267 1.00 0.00 O ATOM 116 CB GLU A 96 -0.044 10.860 -2.363 1.00 0.00 C ATOM 117 CG GLU A 96 0.547 12.150 -2.908 1.00 0.00 C ATOM 118 CD GLU A 96 1.201 11.965 -4.263 1.00 0.00 C ATOM 119 OE1 GLU A 96 0.467 11.777 -5.256 1.00 0.00 O ATOM 120 OE2 GLU A 96 2.448 12.009 -4.331 1.00 0.00 O ATOM 0 H GLU A 96 0.019 12.447 -0.479 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.085 11.447 -2.034 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.728 10.319 -1.816 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.346 10.227 -3.198 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.240 12.900 -2.988 1.00 0.00 H new ATOM 0 HG3 GLU A 96 1.284 12.534 -2.203 1.00 0.00 H new ATOM 127 N LEU A 97 -0.970 9.401 0.287 1.00 0.00 N ATOM 128 CA LEU A 97 -1.261 8.163 1.000 1.00 0.00 C ATOM 129 C LEU A 97 -2.512 8.312 1.859 1.00 0.00 C ATOM 130 O LEU A 97 -3.234 7.343 2.094 1.00 0.00 O ATOM 131 CB LEU A 97 -0.073 7.760 1.874 1.00 0.00 C ATOM 132 CG LEU A 97 1.163 7.284 1.107 1.00 0.00 C ATOM 133 CD1 LEU A 97 2.431 7.858 1.722 1.00 0.00 C ATOM 134 CD2 LEU A 97 1.219 5.763 1.082 1.00 0.00 C ATOM 0 H LEU A 97 -0.211 9.951 0.690 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.440 7.382 0.261 1.00 0.00 H new ATOM 0 HB2 LEU A 97 0.208 8.612 2.494 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.391 6.966 2.549 1.00 0.00 H new ATOM 0 HG LEU A 97 1.091 7.643 0.080 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.298 7.507 1.162 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.392 8.947 1.686 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.513 7.532 2.759 1.00 0.00 H new ATOM 0 HD21 LEU A 97 2.104 5.440 0.533 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.267 5.384 2.103 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.326 5.374 0.592 1.00 0.00 H new ATOM 146 N SER A 98 -2.764 9.532 2.326 1.00 0.00 N ATOM 147 CA SER A 98 -3.930 9.808 3.159 1.00 0.00 C ATOM 148 C SER A 98 -5.209 9.309 2.492 1.00 0.00 C ATOM 149 O SER A 98 -6.116 8.812 3.160 1.00 0.00 O ATOM 150 CB SER A 98 -4.040 11.308 3.438 1.00 0.00 C ATOM 151 OG SER A 98 -4.617 11.550 4.710 1.00 0.00 O ATOM 0 H SER A 98 -2.176 10.345 2.142 1.00 0.00 H new ATOM 0 HA SER A 98 -3.803 9.277 4.102 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.051 11.763 3.392 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.645 11.781 2.665 1.00 0.00 H new ATOM 0 HG SER A 98 -4.026 11.200 5.409 1.00 0.00 H new ATOM 157 N ASP A 99 -5.271 9.443 1.172 1.00 0.00 N ATOM 158 CA ASP A 99 -6.435 9.004 0.413 1.00 0.00 C ATOM 159 C ASP A 99 -6.341 7.516 0.086 1.00 0.00 C ATOM 160 O ASP A 99 -7.357 6.831 -0.033 1.00 0.00 O ATOM 161 CB ASP A 99 -6.564 9.814 -0.878 1.00 0.00 C ATOM 162 CG ASP A 99 -7.431 11.046 -0.704 1.00 0.00 C ATOM 163 OD1 ASP A 99 -8.318 11.028 0.175 1.00 0.00 O ATOM 164 OD2 ASP A 99 -7.222 12.028 -1.446 1.00 0.00 O ATOM 0 H ASP A 99 -4.528 9.852 0.605 1.00 0.00 H new ATOM 0 HA ASP A 99 -7.321 9.168 1.027 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -5.572 10.116 -1.215 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -6.987 9.183 -1.659 1.00 0.00 H new ATOM 169 N LEU A 100 -5.115 7.023 -0.058 1.00 0.00 N ATOM 170 CA LEU A 100 -4.889 5.617 -0.372 1.00 0.00 C ATOM 171 C LEU A 100 -5.283 4.724 0.802 1.00 0.00 C ATOM 172 O LEU A 100 -5.936 3.698 0.620 1.00 0.00 O ATOM 173 CB LEU A 100 -3.420 5.382 -0.736 1.00 0.00 C ATOM 174 CG LEU A 100 -3.048 5.712 -2.183 1.00 0.00 C ATOM 175 CD1 LEU A 100 -1.592 5.364 -2.453 1.00 0.00 C ATOM 176 CD2 LEU A 100 -3.963 4.973 -3.149 1.00 0.00 C ATOM 0 H LEU A 100 -4.263 7.576 0.038 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.514 5.358 -1.227 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -2.797 5.981 -0.072 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.177 4.337 -0.544 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.178 6.783 -2.337 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.346 5.606 -3.487 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -0.951 5.938 -1.784 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -1.435 4.299 -2.282 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.685 5.219 -4.174 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.864 3.899 -2.994 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.996 5.272 -2.972 1.00 0.00 H new ATOM 188 N PHE A 101 -4.880 5.122 2.007 1.00 0.00 N ATOM 189 CA PHE A 101 -5.189 4.355 3.211 1.00 0.00 C ATOM 190 C PHE A 101 -6.688 4.088 3.327 1.00 0.00 C ATOM 191 O PHE A 101 -7.107 2.967 3.616 1.00 0.00 O ATOM 192 CB PHE A 101 -4.698 5.099 4.456 1.00 0.00 C ATOM 193 CG PHE A 101 -4.536 4.214 5.659 1.00 0.00 C ATOM 194 CD1 PHE A 101 -3.660 3.141 5.634 1.00 0.00 C ATOM 195 CD2 PHE A 101 -5.261 4.456 6.814 1.00 0.00 C ATOM 196 CE1 PHE A 101 -3.509 2.326 6.741 1.00 0.00 C ATOM 197 CE2 PHE A 101 -5.115 3.645 7.923 1.00 0.00 C ATOM 198 CZ PHE A 101 -4.238 2.578 7.887 1.00 0.00 C ATOM 0 H PHE A 101 -4.339 5.970 2.175 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.674 3.397 3.137 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -3.742 5.573 4.233 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.402 5.897 4.694 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.089 2.939 4.740 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -5.948 5.288 6.848 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.822 1.493 6.710 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.686 3.845 8.818 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.123 1.943 8.753 1.00 0.00 H new ATOM 208 N ARG A 102 -7.489 5.124 3.103 1.00 0.00 N ATOM 209 CA ARG A 102 -8.940 5.000 3.186 1.00 0.00 C ATOM 210 C ARG A 102 -9.466 4.001 2.160 1.00 0.00 C ATOM 211 O ARG A 102 -10.152 3.040 2.509 1.00 0.00 O ATOM 212 CB ARG A 102 -9.600 6.364 2.970 1.00 0.00 C ATOM 213 CG ARG A 102 -9.813 7.148 4.255 1.00 0.00 C ATOM 214 CD ARG A 102 -10.956 8.143 4.122 1.00 0.00 C ATOM 215 NE ARG A 102 -10.483 9.525 4.142 1.00 0.00 N ATOM 216 CZ ARG A 102 -11.289 10.583 4.213 1.00 0.00 C ATOM 217 NH1 ARG A 102 -12.605 10.420 4.272 1.00 0.00 N ATOM 218 NH2 ARG A 102 -10.777 11.806 4.225 1.00 0.00 N ATOM 0 H ARG A 102 -7.158 6.059 2.863 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.190 4.633 4.181 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.982 6.954 2.293 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.562 6.219 2.479 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.024 6.458 5.072 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -8.897 7.678 4.514 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -11.492 7.957 3.192 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.666 7.991 4.935 1.00 0.00 H new ATOM 0 HE ARG A 102 -9.477 9.689 4.099 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -13.004 9.481 4.263 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.218 11.234 4.326 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -9.766 11.936 4.180 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.394 12.617 4.279 1.00 0.00 H new ATOM 232 N MET A 103 -9.145 4.237 0.892 1.00 0.00 N ATOM 233 CA MET A 103 -9.589 3.361 -0.187 1.00 0.00 C ATOM 234 C MET A 103 -9.023 1.950 -0.032 1.00 0.00 C ATOM 235 O MET A 103 -9.525 1.004 -0.638 1.00 0.00 O ATOM 236 CB MET A 103 -9.173 3.939 -1.541 1.00 0.00 C ATOM 237 CG MET A 103 -9.717 5.334 -1.801 1.00 0.00 C ATOM 238 SD MET A 103 -9.839 5.716 -3.559 1.00 0.00 S ATOM 239 CE MET A 103 -8.532 6.928 -3.734 1.00 0.00 C ATOM 0 H MET A 103 -8.579 5.028 0.586 1.00 0.00 H new ATOM 0 HA MET A 103 -10.676 3.298 -0.136 1.00 0.00 H new ATOM 0 HB2 MET A 103 -8.085 3.967 -1.596 1.00 0.00 H new ATOM 0 HB3 MET A 103 -9.515 3.272 -2.332 1.00 0.00 H new ATOM 0 HG2 MET A 103 -10.702 5.426 -1.344 1.00 0.00 H new ATOM 0 HG3 MET A 103 -9.071 6.067 -1.318 1.00 0.00 H new ATOM 0 HE1 MET A 103 -8.482 7.262 -4.770 1.00 0.00 H new ATOM 0 HE2 MET A 103 -8.738 7.781 -3.087 1.00 0.00 H new ATOM 0 HE3 MET A 103 -7.580 6.480 -3.451 1.00 0.00 H new ATOM 249 N PHE A 104 -7.976 1.813 0.777 1.00 0.00 N ATOM 250 CA PHE A 104 -7.351 0.513 0.998 1.00 0.00 C ATOM 251 C PHE A 104 -7.920 -0.170 2.238 1.00 0.00 C ATOM 252 O PHE A 104 -8.148 -1.379 2.241 1.00 0.00 O ATOM 253 CB PHE A 104 -5.836 0.672 1.141 1.00 0.00 C ATOM 254 CG PHE A 104 -5.058 -0.510 0.642 1.00 0.00 C ATOM 255 CD1 PHE A 104 -5.209 -1.754 1.232 1.00 0.00 C ATOM 256 CD2 PHE A 104 -4.174 -0.377 -0.417 1.00 0.00 C ATOM 257 CE1 PHE A 104 -4.493 -2.843 0.777 1.00 0.00 C ATOM 258 CE2 PHE A 104 -3.455 -1.464 -0.877 1.00 0.00 C ATOM 259 CZ PHE A 104 -3.614 -2.698 -0.279 1.00 0.00 C ATOM 0 H PHE A 104 -7.544 2.583 1.288 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.568 -0.114 0.133 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.519 1.561 0.596 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.594 0.839 2.191 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -5.895 -1.873 2.058 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -4.046 0.586 -0.888 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.620 -3.807 1.246 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -2.769 -1.348 -1.703 1.00 0.00 H new ATOM 0 HZ PHE A 104 -3.052 -3.549 -0.636 1.00 0.00 H new ATOM 269 N ASP A 105 -8.143 0.611 3.290 1.00 0.00 N ATOM 270 CA ASP A 105 -8.681 0.076 4.536 1.00 0.00 C ATOM 271 C ASP A 105 -10.034 -0.593 4.306 1.00 0.00 C ATOM 272 O ASP A 105 -10.126 -1.820 4.251 1.00 0.00 O ATOM 273 CB ASP A 105 -8.808 1.190 5.579 1.00 0.00 C ATOM 274 CG ASP A 105 -9.322 0.684 6.914 1.00 0.00 C ATOM 275 OD1 ASP A 105 -9.614 -0.526 7.019 1.00 0.00 O ATOM 276 OD2 ASP A 105 -9.432 1.498 7.854 1.00 0.00 O ATOM 0 H ASP A 105 -7.960 1.614 3.305 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.990 -0.680 4.909 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.835 1.660 5.723 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.482 1.960 5.203 1.00 0.00 H new ATOM 281 N LYS A 106 -11.082 0.218 4.172 1.00 0.00 N ATOM 282 CA LYS A 106 -12.433 -0.297 3.945 1.00 0.00 C ATOM 283 C LYS A 106 -12.941 -1.099 5.143 1.00 0.00 C ATOM 284 O LYS A 106 -13.985 -1.748 5.065 1.00 0.00 O ATOM 285 CB LYS A 106 -12.459 -1.173 2.693 1.00 0.00 C ATOM 286 CG LYS A 106 -12.879 -0.429 1.436 1.00 0.00 C ATOM 287 CD LYS A 106 -11.704 -0.208 0.497 1.00 0.00 C ATOM 288 CE LYS A 106 -11.085 -1.525 0.058 1.00 0.00 C ATOM 289 NZ LYS A 106 -10.528 -1.446 -1.320 1.00 0.00 N ATOM 0 H LYS A 106 -11.022 1.235 4.217 1.00 0.00 H new ATOM 0 HA LYS A 106 -13.092 0.560 3.808 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.468 -1.600 2.538 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.143 -2.006 2.857 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -13.656 -0.994 0.921 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -13.313 0.533 1.710 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -12.037 0.348 -0.379 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.950 0.402 0.994 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.294 -1.804 0.754 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -11.838 -2.312 0.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -9.837 -2.211 -1.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -11.298 -1.545 -2.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -10.059 -0.527 -1.453 1.00 0.00 H new ATOM 303 N ASN A 107 -12.204 -1.054 6.246 1.00 0.00 N ATOM 304 CA ASN A 107 -12.586 -1.779 7.452 1.00 0.00 C ATOM 305 C ASN A 107 -13.136 -0.832 8.517 1.00 0.00 C ATOM 306 O ASN A 107 -13.747 -1.271 9.492 1.00 0.00 O ATOM 307 CB ASN A 107 -11.387 -2.548 8.009 1.00 0.00 C ATOM 308 CG ASN A 107 -11.771 -3.919 8.531 1.00 0.00 C ATOM 309 OD1 ASN A 107 -12.769 -4.500 8.107 1.00 0.00 O ATOM 310 ND2 ASN A 107 -10.977 -4.442 9.459 1.00 0.00 N ATOM 0 H ASN A 107 -11.337 -0.523 6.331 1.00 0.00 H new ATOM 0 HA ASN A 107 -13.373 -2.484 7.183 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -10.634 -2.657 7.228 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.930 -1.971 8.813 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -11.185 -5.361 9.849 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.159 -3.924 9.781 1.00 0.00 H new ATOM 317 N ALA A 108 -12.916 0.467 8.330 1.00 0.00 N ATOM 318 CA ALA A 108 -13.391 1.469 9.278 1.00 0.00 C ATOM 319 C ALA A 108 -12.660 1.349 10.611 1.00 0.00 C ATOM 320 O ALA A 108 -13.223 1.636 11.668 1.00 0.00 O ATOM 321 CB ALA A 108 -14.896 1.341 9.479 1.00 0.00 C ATOM 0 H ALA A 108 -12.412 0.850 7.530 1.00 0.00 H new ATOM 0 HA ALA A 108 -13.179 2.455 8.865 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -15.234 2.096 10.189 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -15.404 1.486 8.526 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -15.128 0.349 9.866 1.00 0.00 H new ATOM 327 N ASP A 109 -11.402 0.925 10.553 1.00 0.00 N ATOM 328 CA ASP A 109 -10.590 0.768 11.755 1.00 0.00 C ATOM 329 C ASP A 109 -9.400 1.721 11.731 1.00 0.00 C ATOM 330 O ASP A 109 -9.113 2.397 12.719 1.00 0.00 O ATOM 331 CB ASP A 109 -10.102 -0.676 11.882 1.00 0.00 C ATOM 332 CG ASP A 109 -9.306 -1.126 10.672 1.00 0.00 C ATOM 333 OD1 ASP A 109 -9.453 -0.504 9.599 1.00 0.00 O ATOM 334 OD2 ASP A 109 -8.535 -2.100 10.798 1.00 0.00 O ATOM 0 H ASP A 109 -10.922 0.684 9.686 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.210 1.009 12.619 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -9.485 -0.771 12.775 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -10.959 -1.336 12.015 1.00 0.00 H new ATOM 339 N GLY A 110 -8.712 1.772 10.595 1.00 0.00 N ATOM 340 CA GLY A 110 -7.562 2.647 10.462 1.00 0.00 C ATOM 341 C GLY A 110 -6.244 1.896 10.468 1.00 0.00 C ATOM 342 O GLY A 110 -5.184 2.497 10.640 1.00 0.00 O ATOM 0 H GLY A 110 -8.931 1.223 9.764 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -7.648 3.213 9.534 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -7.566 3.370 11.278 1.00 0.00 H new ATOM 346 N TYR A 111 -6.305 0.580 10.278 1.00 0.00 N ATOM 347 CA TYR A 111 -5.100 -0.244 10.262 1.00 0.00 C ATOM 348 C TYR A 111 -5.230 -1.371 9.243 1.00 0.00 C ATOM 349 O TYR A 111 -6.337 -1.738 8.851 1.00 0.00 O ATOM 350 CB TYR A 111 -4.827 -0.831 11.651 1.00 0.00 C ATOM 351 CG TYR A 111 -5.321 0.030 12.794 1.00 0.00 C ATOM 352 CD1 TYR A 111 -4.760 1.275 13.044 1.00 0.00 C ATOM 353 CD2 TYR A 111 -6.348 -0.406 13.623 1.00 0.00 C ATOM 354 CE1 TYR A 111 -5.209 2.063 14.088 1.00 0.00 C ATOM 355 CE2 TYR A 111 -6.802 0.376 14.667 1.00 0.00 C ATOM 356 CZ TYR A 111 -6.230 1.610 14.896 1.00 0.00 C ATOM 357 OH TYR A 111 -6.679 2.391 15.935 1.00 0.00 O ATOM 0 H TYR A 111 -7.173 0.063 10.134 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.263 0.393 9.977 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -5.299 -1.811 11.718 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -3.754 -0.985 11.764 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -3.960 1.634 12.413 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -6.798 -1.372 13.448 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -4.762 3.029 14.270 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -7.602 0.023 15.301 1.00 0.00 H new ATOM 0 HH TYR A 111 -7.402 1.926 16.405 1.00 0.00 H new ATOM 367 N ILE A 112 -4.095 -1.922 8.815 1.00 0.00 N ATOM 368 CA ILE A 112 -4.103 -3.010 7.843 1.00 0.00 C ATOM 369 C ILE A 112 -3.500 -4.282 8.431 1.00 0.00 C ATOM 370 O ILE A 112 -2.445 -4.248 9.064 1.00 0.00 O ATOM 371 CB ILE A 112 -3.334 -2.633 6.560 1.00 0.00 C ATOM 372 CG1 ILE A 112 -3.801 -1.268 6.043 1.00 0.00 C ATOM 373 CG2 ILE A 112 -3.521 -3.709 5.496 1.00 0.00 C ATOM 374 CD1 ILE A 112 -3.262 -0.915 4.672 1.00 0.00 C ATOM 0 H ILE A 112 -3.166 -1.635 9.124 1.00 0.00 H new ATOM 0 HA ILE A 112 -5.147 -3.191 7.588 1.00 0.00 H new ATOM 0 HB ILE A 112 -2.271 -2.565 6.793 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -4.890 -1.257 6.009 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.496 -0.498 6.752 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -2.973 -3.430 4.596 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -3.143 -4.660 5.870 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.581 -3.807 5.260 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.637 0.065 4.375 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.173 -0.893 4.704 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.588 -1.663 3.949 1.00 0.00 H new ATOM 386 N ASP A 113 -4.179 -5.404 8.217 1.00 0.00 N ATOM 387 CA ASP A 113 -3.713 -6.689 8.725 1.00 0.00 C ATOM 388 C ASP A 113 -3.628 -7.716 7.602 1.00 0.00 C ATOM 389 O ASP A 113 -3.769 -7.378 6.427 1.00 0.00 O ATOM 390 CB ASP A 113 -4.646 -7.194 9.827 1.00 0.00 C ATOM 391 CG ASP A 113 -3.894 -7.865 10.960 1.00 0.00 C ATOM 392 OD1 ASP A 113 -2.793 -8.398 10.708 1.00 0.00 O ATOM 393 OD2 ASP A 113 -4.406 -7.857 12.099 1.00 0.00 O ATOM 0 H ASP A 113 -5.054 -5.449 7.695 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.715 -6.549 9.141 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -5.222 -6.358 10.223 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.359 -7.899 9.400 1.00 0.00 H new ATOM 398 N LEU A 114 -3.397 -8.972 7.970 1.00 0.00 N ATOM 399 CA LEU A 114 -3.293 -10.050 6.992 1.00 0.00 C ATOM 400 C LEU A 114 -4.526 -10.093 6.091 1.00 0.00 C ATOM 401 O LEU A 114 -4.456 -10.547 4.949 1.00 0.00 O ATOM 402 CB LEU A 114 -3.115 -11.395 7.700 1.00 0.00 C ATOM 403 CG LEU A 114 -1.664 -11.855 7.859 1.00 0.00 C ATOM 404 CD1 LEU A 114 -1.157 -11.551 9.261 1.00 0.00 C ATOM 405 CD2 LEU A 114 -1.538 -13.341 7.556 1.00 0.00 C ATOM 0 H LEU A 114 -3.278 -9.269 8.939 1.00 0.00 H new ATOM 0 HA LEU A 114 -2.419 -9.857 6.369 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -3.571 -11.331 8.688 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.663 -12.156 7.145 1.00 0.00 H new ATOM 0 HG LEU A 114 -1.050 -11.306 7.145 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -0.124 -11.885 9.355 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -1.209 -10.477 9.442 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -1.775 -12.072 9.992 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.499 -13.650 7.674 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -2.165 -13.907 8.244 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -1.859 -13.532 6.532 1.00 0.00 H new ATOM 417 N GLU A 115 -5.653 -9.618 6.613 1.00 0.00 N ATOM 418 CA GLU A 115 -6.899 -9.602 5.855 1.00 0.00 C ATOM 419 C GLU A 115 -6.864 -8.528 4.772 1.00 0.00 C ATOM 420 O GLU A 115 -7.077 -8.814 3.594 1.00 0.00 O ATOM 421 CB GLU A 115 -8.086 -9.361 6.790 1.00 0.00 C ATOM 422 CG GLU A 115 -8.530 -10.625 7.499 1.00 0.00 C ATOM 423 OE1 GLU A 115 -7.779 -11.112 8.370 1.00 0.00 O ATOM 424 OE2 GLU A 115 -9.629 -11.128 7.184 1.00 0.00 O ATOM 0 H GLU A 115 -5.729 -9.239 7.557 1.00 0.00 H new ATOM 0 HA GLU A 115 -7.015 -10.573 5.374 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -7.815 -8.609 7.531 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.920 -8.957 6.217 1.00 0.00 H new ATOM 429 N GLU A 116 -6.596 -7.292 5.180 1.00 0.00 N ATOM 430 CA GLU A 116 -6.534 -6.175 4.245 1.00 0.00 C ATOM 431 C GLU A 116 -5.314 -6.290 3.337 1.00 0.00 C ATOM 432 O GLU A 116 -5.396 -6.035 2.136 1.00 0.00 O ATOM 433 CB GLU A 116 -6.497 -4.847 5.004 1.00 0.00 C ATOM 434 CG GLU A 116 -7.868 -4.221 5.200 1.00 0.00 C ATOM 435 CD GLU A 116 -8.012 -3.543 6.549 1.00 0.00 C ATOM 436 OE1 GLU A 116 -7.432 -2.452 6.729 1.00 0.00 O ATOM 437 OE2 GLU A 116 -8.703 -4.104 7.425 1.00 0.00 O ATOM 0 H GLU A 116 -6.418 -7.039 6.152 1.00 0.00 H new ATOM 0 HA GLU A 116 -7.429 -6.205 3.624 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -6.037 -5.008 5.979 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.861 -4.146 4.463 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -8.047 -3.492 4.410 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -8.633 -4.991 5.101 1.00 0.00 H new ATOM 444 N LEU A 117 -4.182 -6.679 3.917 1.00 0.00 N ATOM 445 CA LEU A 117 -2.947 -6.829 3.155 1.00 0.00 C ATOM 446 C LEU A 117 -3.165 -7.708 1.926 1.00 0.00 C ATOM 447 O LEU A 117 -2.455 -7.585 0.930 1.00 0.00 O ATOM 448 CB LEU A 117 -1.847 -7.423 4.035 1.00 0.00 C ATOM 449 CG LEU A 117 -0.422 -7.014 3.650 1.00 0.00 C ATOM 450 CD1 LEU A 117 0.235 -6.234 4.778 1.00 0.00 C ATOM 451 CD2 LEU A 117 0.407 -8.239 3.294 1.00 0.00 C ATOM 0 H LEU A 117 -4.095 -6.896 4.910 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.637 -5.840 2.819 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.028 -7.126 5.068 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.920 -8.510 3.998 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.476 -6.368 2.774 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.246 -5.953 4.485 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -0.346 -5.335 4.985 1.00 0.00 H new ATOM 0 HD13 LEU A 117 0.276 -6.854 5.673 1.00 0.00 H new ATOM 0 HD21 LEU A 117 1.416 -7.929 3.023 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.451 -8.910 4.152 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.052 -8.757 2.452 1.00 0.00 H new ATOM 463 N LYS A 118 -4.156 -8.590 2.003 1.00 0.00 N ATOM 464 CA LYS A 118 -4.473 -9.481 0.894 1.00 0.00 C ATOM 465 C LYS A 118 -4.941 -8.685 -0.321 1.00 0.00 C ATOM 466 O LYS A 118 -4.780 -9.117 -1.463 1.00 0.00 O ATOM 467 CB LYS A 118 -5.559 -10.472 1.315 1.00 0.00 C ATOM 468 CG LYS A 118 -5.838 -11.550 0.279 1.00 0.00 C ATOM 469 CD LYS A 118 -6.960 -11.146 -0.664 1.00 0.00 C ATOM 470 CE LYS A 118 -8.259 -10.886 0.084 1.00 0.00 C ATOM 471 NZ LYS A 118 -8.510 -11.908 1.138 1.00 0.00 N ATOM 0 H LYS A 118 -4.753 -8.707 2.822 1.00 0.00 H new ATOM 0 HA LYS A 118 -3.570 -10.029 0.623 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -5.262 -10.947 2.250 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -6.480 -9.925 1.514 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -4.933 -11.746 -0.295 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -6.103 -12.479 0.783 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -6.670 -10.249 -1.211 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -7.116 -11.933 -1.402 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -8.223 -9.896 0.540 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -9.089 -10.882 -0.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -9.529 -11.957 1.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -8.177 -12.836 0.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -7.999 -11.645 2.005 1.00 0.00 H new ATOM 485 N ILE A 119 -5.527 -7.520 -0.060 1.00 0.00 N ATOM 486 CA ILE A 119 -6.033 -6.648 -1.116 1.00 0.00 C ATOM 487 C ILE A 119 -5.001 -6.441 -2.227 1.00 0.00 C ATOM 488 O ILE A 119 -5.309 -6.613 -3.406 1.00 0.00 O ATOM 489 CB ILE A 119 -6.460 -5.281 -0.531 1.00 0.00 C ATOM 490 CG1 ILE A 119 -7.774 -5.427 0.238 1.00 0.00 C ATOM 491 CG2 ILE A 119 -6.600 -4.226 -1.621 1.00 0.00 C ATOM 492 CD1 ILE A 119 -7.827 -4.609 1.509 1.00 0.00 C ATOM 0 H ILE A 119 -5.664 -7.155 0.883 1.00 0.00 H new ATOM 0 HA ILE A 119 -6.902 -7.140 -1.554 1.00 0.00 H new ATOM 0 HB ILE A 119 -5.679 -4.949 0.153 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -8.599 -5.130 -0.410 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -7.925 -6.478 0.486 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -6.901 -3.279 -1.174 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -5.644 -4.100 -2.130 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -7.355 -4.544 -2.340 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -8.788 -4.763 2.001 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -7.024 -4.921 2.176 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -7.708 -3.553 1.267 1.00 0.00 H new ATOM 504 N MET A 120 -3.782 -6.067 -1.850 1.00 0.00 N ATOM 505 CA MET A 120 -2.724 -5.835 -2.830 1.00 0.00 C ATOM 506 C MET A 120 -2.448 -7.091 -3.650 1.00 0.00 C ATOM 507 O MET A 120 -2.172 -7.013 -4.848 1.00 0.00 O ATOM 508 CB MET A 120 -1.438 -5.374 -2.139 1.00 0.00 C ATOM 509 CG MET A 120 -0.789 -6.441 -1.272 1.00 0.00 C ATOM 510 SD MET A 120 -0.018 -5.761 0.210 1.00 0.00 S ATOM 511 CE MET A 120 -1.380 -4.835 0.914 1.00 0.00 C ATOM 0 H MET A 120 -3.503 -5.919 -0.880 1.00 0.00 H new ATOM 0 HA MET A 120 -3.066 -5.050 -3.504 1.00 0.00 H new ATOM 0 HB2 MET A 120 -0.724 -5.053 -2.898 1.00 0.00 H new ATOM 0 HB3 MET A 120 -1.661 -4.504 -1.522 1.00 0.00 H new ATOM 0 HG2 MET A 120 -1.541 -7.174 -0.981 1.00 0.00 H new ATOM 0 HG3 MET A 120 -0.037 -6.971 -1.857 1.00 0.00 H new ATOM 0 HE1 MET A 120 -1.281 -4.810 1.999 1.00 0.00 H new ATOM 0 HE2 MET A 120 -1.367 -3.817 0.525 1.00 0.00 H new ATOM 0 HE3 MET A 120 -2.322 -5.314 0.646 1.00 0.00 H new ATOM 521 N LEU A 121 -2.520 -8.247 -3.000 1.00 0.00 N ATOM 522 CA LEU A 121 -2.274 -9.516 -3.674 1.00 0.00 C ATOM 523 C LEU A 121 -3.412 -9.857 -4.629 1.00 0.00 C ATOM 524 O LEU A 121 -3.190 -10.437 -5.692 1.00 0.00 O ATOM 525 CB LEU A 121 -2.095 -10.635 -2.648 1.00 0.00 C ATOM 526 CG LEU A 121 -0.669 -10.800 -2.119 1.00 0.00 C ATOM 527 CD1 LEU A 121 -0.412 -9.837 -0.971 1.00 0.00 C ATOM 528 CD2 LEU A 121 -0.426 -12.237 -1.682 1.00 0.00 C ATOM 0 H LEU A 121 -2.746 -8.332 -2.009 1.00 0.00 H new ATOM 0 HA LEU A 121 -1.358 -9.418 -4.256 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -2.760 -10.446 -1.805 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.411 -11.576 -3.099 1.00 0.00 H new ATOM 0 HG LEU A 121 0.028 -10.565 -2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 121 0.607 -9.968 -0.607 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.544 -8.813 -1.319 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -1.115 -10.039 -0.163 1.00 0.00 H new ATOM 0 HD21 LEU A 121 0.593 -12.336 -1.309 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.129 -12.501 -0.892 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -0.568 -12.905 -2.532 1.00 0.00 H new ATOM 540 N GLN A 122 -4.630 -9.488 -4.249 1.00 0.00 N ATOM 541 CA GLN A 122 -5.801 -9.750 -5.078 1.00 0.00 C ATOM 542 C GLN A 122 -5.650 -9.091 -6.447 1.00 0.00 C ATOM 543 O GLN A 122 -6.243 -9.535 -7.431 1.00 0.00 O ATOM 544 CB GLN A 122 -7.067 -9.239 -4.386 1.00 0.00 C ATOM 545 CG GLN A 122 -7.890 -10.338 -3.733 1.00 0.00 C ATOM 546 CD GLN A 122 -9.253 -10.508 -4.375 1.00 0.00 C ATOM 547 OE1 GLN A 122 -9.368 -11.015 -5.491 1.00 0.00 O ATOM 548 NE2 GLN A 122 -10.296 -10.084 -3.671 1.00 0.00 N ATOM 0 H GLN A 122 -4.832 -9.007 -3.373 1.00 0.00 H new ATOM 0 HA GLN A 122 -5.886 -10.827 -5.219 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -6.787 -8.508 -3.628 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -7.686 -8.719 -5.117 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -7.344 -11.280 -3.794 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -8.017 -10.111 -2.675 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -10.155 -9.670 -2.750 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -11.238 -10.173 -4.052 1.00 0.00 H new ATOM 557 N ALA A 123 -4.853 -8.027 -6.501 1.00 0.00 N ATOM 558 CA ALA A 123 -4.622 -7.304 -7.744 1.00 0.00 C ATOM 559 C ALA A 123 -3.754 -8.114 -8.701 1.00 0.00 C ATOM 560 O ALA A 123 -3.932 -8.056 -9.918 1.00 0.00 O ATOM 561 CB ALA A 123 -3.972 -5.959 -7.455 1.00 0.00 C ATOM 0 H ALA A 123 -4.356 -7.647 -5.695 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.587 -7.139 -8.223 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -3.804 -5.427 -8.392 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -4.627 -5.368 -6.815 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -3.018 -6.117 -6.951 1.00 0.00 H new ATOM 567 N THR A 124 -2.811 -8.867 -8.144 1.00 0.00 N ATOM 568 CA THR A 124 -1.913 -9.686 -8.950 1.00 0.00 C ATOM 569 C THR A 124 -2.493 -11.079 -9.172 1.00 0.00 C ATOM 570 O THR A 124 -2.431 -11.618 -10.277 1.00 0.00 O ATOM 571 CB THR A 124 -0.540 -9.790 -8.281 1.00 0.00 C ATOM 572 OG1 THR A 124 0.252 -10.778 -8.915 1.00 0.00 O ATOM 573 CG2 THR A 124 -0.610 -10.135 -6.808 1.00 0.00 C ATOM 0 H THR A 124 -2.649 -8.927 -7.139 1.00 0.00 H new ATOM 0 HA THR A 124 -1.799 -9.203 -9.921 1.00 0.00 H new ATOM 0 HB THR A 124 -0.097 -8.799 -8.383 1.00 0.00 H new ATOM 0 HG1 THR A 124 0.118 -10.732 -9.885 1.00 0.00 H new ATOM 0 HG21 THR A 124 0.399 -10.192 -6.399 1.00 0.00 H new ATOM 0 HG22 THR A 124 -1.172 -9.365 -6.280 1.00 0.00 H new ATOM 0 HG23 THR A 124 -1.107 -11.097 -6.683 1.00 0.00 H new ATOM 581 N GLY A 125 -3.059 -11.658 -8.117 1.00 0.00 N ATOM 582 CA GLY A 125 -3.644 -12.984 -8.218 1.00 0.00 C ATOM 583 C GLY A 125 -2.720 -13.986 -8.886 1.00 0.00 C ATOM 584 O GLY A 125 -3.178 -14.945 -9.507 1.00 0.00 O ATOM 0 H GLY A 125 -3.123 -11.232 -7.192 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -3.898 -13.341 -7.220 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -4.575 -12.923 -8.782 1.00 0.00 H new ATOM 588 N GLU A 126 -1.415 -13.762 -8.762 1.00 0.00 N ATOM 589 CA GLU A 126 -0.426 -14.652 -9.361 1.00 0.00 C ATOM 590 C GLU A 126 0.019 -15.728 -8.374 1.00 0.00 C ATOM 591 O GLU A 126 1.209 -16.020 -8.252 1.00 0.00 O ATOM 592 CB GLU A 126 0.786 -13.850 -9.842 1.00 0.00 C ATOM 593 CG GLU A 126 1.414 -14.398 -11.113 1.00 0.00 C ATOM 594 CD GLU A 126 0.811 -13.797 -12.367 1.00 0.00 C ATOM 595 OE1 GLU A 126 -0.427 -13.863 -12.521 1.00 0.00 O ATOM 596 OE2 GLU A 126 1.576 -13.260 -13.195 1.00 0.00 O ATOM 0 H GLU A 126 -1.018 -12.972 -8.253 1.00 0.00 H new ATOM 0 HA GLU A 126 -0.892 -15.145 -10.214 1.00 0.00 H new ATOM 0 HB2 GLU A 126 0.483 -12.817 -10.013 1.00 0.00 H new ATOM 0 HB3 GLU A 126 1.538 -13.835 -9.053 1.00 0.00 H new ATOM 0 HG2 GLU A 126 2.486 -14.200 -11.099 1.00 0.00 H new ATOM 0 HG3 GLU A 126 1.290 -15.481 -11.138 1.00 0.00 H new ATOM 603 N THR A 127 -0.945 -16.316 -7.673 1.00 0.00 N ATOM 604 CA THR A 127 -0.657 -17.364 -6.698 1.00 0.00 C ATOM 605 C THR A 127 0.365 -16.895 -5.666 1.00 0.00 C ATOM 606 O THR A 127 1.516 -17.333 -5.672 1.00 0.00 O ATOM 607 CB THR A 127 -0.148 -18.622 -7.405 1.00 0.00 C ATOM 608 OG1 THR A 127 -1.049 -19.026 -8.420 1.00 0.00 O ATOM 609 CG2 THR A 127 0.049 -19.796 -6.471 1.00 0.00 C ATOM 0 H THR A 127 -1.934 -16.085 -7.762 1.00 0.00 H new ATOM 0 HA THR A 127 -1.584 -17.598 -6.175 1.00 0.00 H new ATOM 0 HB THR A 127 0.820 -18.346 -7.823 1.00 0.00 H new ATOM 0 HG1 THR A 127 -0.705 -19.831 -8.861 1.00 0.00 H new ATOM 0 HG21 THR A 127 0.411 -20.654 -7.037 1.00 0.00 H new ATOM 0 HG22 THR A 127 0.778 -19.533 -5.705 1.00 0.00 H new ATOM 0 HG23 THR A 127 -0.900 -20.048 -5.998 1.00 0.00 H new ATOM 617 N ILE A 128 -0.066 -16.003 -4.782 1.00 0.00 N ATOM 618 CA ILE A 128 0.808 -15.473 -3.741 1.00 0.00 C ATOM 619 C ILE A 128 0.101 -15.435 -2.387 1.00 0.00 C ATOM 620 O ILE A 128 0.726 -15.640 -1.346 1.00 0.00 O ATOM 621 CB ILE A 128 1.302 -14.055 -4.086 1.00 0.00 C ATOM 622 CG1 ILE A 128 0.128 -13.179 -4.537 1.00 0.00 C ATOM 623 CG2 ILE A 128 2.384 -14.110 -5.155 1.00 0.00 C ATOM 624 CD1 ILE A 128 -0.309 -13.429 -5.964 1.00 0.00 C ATOM 0 H ILE A 128 -1.016 -15.631 -4.765 1.00 0.00 H new ATOM 0 HA ILE A 128 1.664 -16.145 -3.682 1.00 0.00 H new ATOM 0 HB ILE A 128 1.737 -13.609 -3.191 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -0.718 -13.352 -3.872 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.407 -12.131 -4.431 1.00 0.00 H new ATOM 0 HG21 ILE A 128 2.720 -13.099 -5.385 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.226 -14.698 -4.790 1.00 0.00 H new ATOM 0 HG23 ILE A 128 1.982 -14.573 -6.056 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -1.143 -12.772 -6.209 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.522 -13.228 -6.640 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -0.621 -14.468 -6.072 1.00 0.00 H new ATOM 636 N THR A 129 -1.203 -15.166 -2.406 1.00 0.00 N ATOM 637 CA THR A 129 -1.996 -15.094 -1.180 1.00 0.00 C ATOM 638 C THR A 129 -1.720 -16.286 -0.267 1.00 0.00 C ATOM 639 O THR A 129 -1.270 -17.339 -0.719 1.00 0.00 O ATOM 640 CB THR A 129 -3.486 -15.033 -1.517 1.00 0.00 C ATOM 641 OG1 THR A 129 -3.847 -16.090 -2.388 1.00 0.00 O ATOM 642 CG2 THR A 129 -3.898 -13.735 -2.176 1.00 0.00 C ATOM 0 H THR A 129 -1.734 -14.994 -3.260 1.00 0.00 H new ATOM 0 HA THR A 129 -1.707 -14.186 -0.650 1.00 0.00 H new ATOM 0 HB THR A 129 -4.002 -15.116 -0.560 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.804 -16.035 -2.590 1.00 0.00 H new ATOM 0 HG21 THR A 129 -4.967 -13.758 -2.388 1.00 0.00 H new ATOM 0 HG22 THR A 129 -3.679 -12.902 -1.508 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.346 -13.608 -3.107 1.00 0.00 H new ATOM 650 N GLU A 130 -1.996 -16.109 1.022 1.00 0.00 N ATOM 651 CA GLU A 130 -1.781 -17.165 2.005 1.00 0.00 C ATOM 652 C GLU A 130 -0.317 -17.594 2.030 1.00 0.00 C ATOM 653 O GLU A 130 -0.007 -18.775 2.181 1.00 0.00 O ATOM 654 CB GLU A 130 -2.673 -18.369 1.697 1.00 0.00 C ATOM 655 CG GLU A 130 -4.157 -18.081 1.850 1.00 0.00 C ATOM 656 CD GLU A 130 -5.012 -18.916 0.917 1.00 0.00 C ATOM 657 OE1 GLU A 130 -4.841 -18.793 -0.314 1.00 0.00 O ATOM 658 OE2 GLU A 130 -5.852 -19.693 1.417 1.00 0.00 O ATOM 0 H GLU A 130 -2.370 -15.243 1.410 1.00 0.00 H new ATOM 0 HA GLU A 130 -2.043 -16.771 2.987 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -2.479 -18.703 0.678 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -2.401 -19.191 2.359 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -4.456 -18.273 2.880 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -4.340 -17.024 1.656 1.00 0.00 H new ATOM 665 N ASP A 131 0.578 -16.623 1.882 1.00 0.00 N ATOM 666 CA ASP A 131 2.011 -16.894 1.887 1.00 0.00 C ATOM 667 C ASP A 131 2.804 -15.601 1.733 1.00 0.00 C ATOM 668 O ASP A 131 3.843 -15.418 2.368 1.00 0.00 O ATOM 669 CB ASP A 131 2.373 -17.868 0.763 1.00 0.00 C ATOM 670 CG ASP A 131 3.327 -18.952 1.223 1.00 0.00 C ATOM 671 OD1 ASP A 131 3.134 -19.480 2.338 1.00 0.00 O ATOM 672 OD2 ASP A 131 4.269 -19.274 0.468 1.00 0.00 O ATOM 0 H ASP A 131 0.336 -15.640 1.757 1.00 0.00 H new ATOM 0 HA ASP A 131 2.269 -17.348 2.844 1.00 0.00 H new ATOM 0 HB2 ASP A 131 1.463 -18.328 0.378 1.00 0.00 H new ATOM 0 HB3 ASP A 131 2.825 -17.316 -0.061 1.00 0.00 H new ATOM 677 N ASP A 132 2.306 -14.706 0.887 1.00 0.00 N ATOM 678 CA ASP A 132 2.965 -13.428 0.649 1.00 0.00 C ATOM 679 C ASP A 132 2.506 -12.382 1.661 1.00 0.00 C ATOM 680 O ASP A 132 3.251 -11.461 1.996 1.00 0.00 O ATOM 681 CB ASP A 132 2.679 -12.941 -0.773 1.00 0.00 C ATOM 682 CG ASP A 132 3.902 -12.336 -1.434 1.00 0.00 C ATOM 683 OD1 ASP A 132 4.982 -12.958 -1.367 1.00 0.00 O ATOM 684 OD2 ASP A 132 3.779 -11.239 -2.019 1.00 0.00 O ATOM 0 H ASP A 132 1.447 -14.843 0.354 1.00 0.00 H new ATOM 0 HA ASP A 132 4.039 -13.573 0.767 1.00 0.00 H new ATOM 0 HB2 ASP A 132 2.320 -13.776 -1.375 1.00 0.00 H new ATOM 0 HB3 ASP A 132 1.880 -12.200 -0.747 1.00 0.00 H new ATOM 689 N ILE A 133 1.276 -12.529 2.144 1.00 0.00 N ATOM 690 CA ILE A 133 0.722 -11.596 3.117 1.00 0.00 C ATOM 691 C ILE A 133 1.348 -11.804 4.495 1.00 0.00 C ATOM 692 O ILE A 133 1.503 -10.857 5.266 1.00 0.00 O ATOM 693 CB ILE A 133 -0.814 -11.735 3.221 1.00 0.00 C ATOM 694 CG1 ILE A 133 -1.478 -11.258 1.926 1.00 0.00 C ATOM 695 CG2 ILE A 133 -1.352 -10.952 4.413 1.00 0.00 C ATOM 696 CD1 ILE A 133 -2.129 -12.370 1.137 1.00 0.00 C ATOM 0 H ILE A 133 0.645 -13.285 1.877 1.00 0.00 H new ATOM 0 HA ILE A 133 0.958 -10.591 2.767 1.00 0.00 H new ATOM 0 HB ILE A 133 -1.052 -12.788 3.372 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -2.230 -10.507 2.168 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -0.729 -10.770 1.302 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -2.435 -11.066 4.464 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -0.903 -11.332 5.331 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -1.103 -9.897 4.298 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -2.579 -11.960 0.233 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -1.377 -13.111 0.864 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -2.901 -12.843 1.744 1.00 0.00 H new ATOM 708 N GLU A 134 1.702 -13.048 4.798 1.00 0.00 N ATOM 709 CA GLU A 134 2.307 -13.378 6.083 1.00 0.00 C ATOM 710 C GLU A 134 3.657 -12.686 6.249 1.00 0.00 C ATOM 711 O GLU A 134 3.973 -12.169 7.320 1.00 0.00 O ATOM 712 CB GLU A 134 2.479 -14.893 6.214 1.00 0.00 C ATOM 713 CG GLU A 134 2.299 -15.405 7.634 1.00 0.00 C ATOM 714 CD GLU A 134 1.571 -16.734 7.686 1.00 0.00 C ATOM 715 OE1 GLU A 134 2.238 -17.781 7.551 1.00 0.00 O ATOM 716 OE2 GLU A 134 0.334 -16.727 7.861 1.00 0.00 O ATOM 0 H GLU A 134 1.581 -13.844 4.172 1.00 0.00 H new ATOM 0 HA GLU A 134 1.641 -13.023 6.869 1.00 0.00 H new ATOM 0 HB2 GLU A 134 1.759 -15.390 5.564 1.00 0.00 H new ATOM 0 HB3 GLU A 134 3.472 -15.170 5.860 1.00 0.00 H new ATOM 0 HG2 GLU A 134 3.276 -15.512 8.105 1.00 0.00 H new ATOM 0 HG3 GLU A 134 1.744 -14.668 8.215 1.00 0.00 H new ATOM 723 N GLU A 135 4.452 -12.684 5.183 1.00 0.00 N ATOM 724 CA GLU A 135 5.770 -12.060 5.213 1.00 0.00 C ATOM 725 C GLU A 135 5.683 -10.571 4.893 1.00 0.00 C ATOM 726 O GLU A 135 6.388 -9.756 5.490 1.00 0.00 O ATOM 727 CB GLU A 135 6.706 -12.751 4.220 1.00 0.00 C ATOM 728 CG GLU A 135 7.173 -14.123 4.677 1.00 0.00 C ATOM 729 CD GLU A 135 8.524 -14.078 5.365 1.00 0.00 C ATOM 730 OE1 GLU A 135 9.310 -13.153 5.071 1.00 0.00 O ATOM 731 OE2 GLU A 135 8.796 -14.969 6.197 1.00 0.00 O ATOM 0 H GLU A 135 4.206 -13.107 4.288 1.00 0.00 H new ATOM 0 HA GLU A 135 6.170 -12.171 6.221 1.00 0.00 H new ATOM 0 HB2 GLU A 135 6.196 -12.851 3.262 1.00 0.00 H new ATOM 0 HB3 GLU A 135 7.577 -12.117 4.053 1.00 0.00 H new ATOM 0 HG2 GLU A 135 6.435 -14.545 5.359 1.00 0.00 H new ATOM 0 HG3 GLU A 135 7.229 -14.789 3.816 1.00 0.00 H new ATOM 738 N LEU A 136 4.821 -10.221 3.944 1.00 0.00 N ATOM 739 CA LEU A 136 4.651 -8.829 3.542 1.00 0.00 C ATOM 740 C LEU A 136 4.239 -7.958 4.725 1.00 0.00 C ATOM 741 O LEU A 136 4.846 -6.919 4.983 1.00 0.00 O ATOM 742 CB LEU A 136 3.609 -8.723 2.425 1.00 0.00 C ATOM 743 CG LEU A 136 3.351 -7.305 1.903 1.00 0.00 C ATOM 744 CD1 LEU A 136 4.642 -6.502 1.862 1.00 0.00 C ATOM 745 CD2 LEU A 136 2.711 -7.356 0.524 1.00 0.00 C ATOM 0 H LEU A 136 4.230 -10.881 3.439 1.00 0.00 H new ATOM 0 HA LEU A 136 5.611 -8.468 3.172 1.00 0.00 H new ATOM 0 HB2 LEU A 136 3.930 -9.347 1.591 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.668 -9.136 2.788 1.00 0.00 H new ATOM 0 HG LEU A 136 2.663 -6.808 2.587 1.00 0.00 H new ATOM 0 HD11 LEU A 136 4.435 -5.499 1.488 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.061 -6.436 2.866 1.00 0.00 H new ATOM 0 HD13 LEU A 136 5.356 -6.995 1.202 1.00 0.00 H new ATOM 0 HD21 LEU A 136 2.534 -6.341 0.167 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.377 -7.873 -0.167 1.00 0.00 H new ATOM 0 HD23 LEU A 136 1.763 -7.890 0.582 1.00 0.00 H new ATOM 757 N MET A 137 3.204 -8.388 5.441 1.00 0.00 N ATOM 758 CA MET A 137 2.704 -7.650 6.602 1.00 0.00 C ATOM 759 C MET A 137 3.851 -7.203 7.507 1.00 0.00 C ATOM 760 O MET A 137 3.761 -6.173 8.175 1.00 0.00 O ATOM 761 CB MET A 137 1.720 -8.516 7.393 1.00 0.00 C ATOM 762 CG MET A 137 1.183 -7.843 8.647 1.00 0.00 C ATOM 763 SD MET A 137 -0.102 -6.629 8.290 1.00 0.00 S ATOM 764 CE MET A 137 0.293 -5.357 9.487 1.00 0.00 C ATOM 0 H MET A 137 2.692 -9.247 5.238 1.00 0.00 H new ATOM 0 HA MET A 137 2.189 -6.760 6.240 1.00 0.00 H new ATOM 0 HB2 MET A 137 0.883 -8.781 6.747 1.00 0.00 H new ATOM 0 HB3 MET A 137 2.213 -9.447 7.674 1.00 0.00 H new ATOM 0 HG2 MET A 137 0.783 -8.602 9.319 1.00 0.00 H new ATOM 0 HG3 MET A 137 2.004 -7.354 9.172 1.00 0.00 H new ATOM 0 HE1 MET A 137 -0.112 -4.402 9.151 1.00 0.00 H new ATOM 0 HE2 MET A 137 -0.144 -5.617 10.451 1.00 0.00 H new ATOM 0 HE3 MET A 137 1.375 -5.277 9.589 1.00 0.00 H new ATOM 774 N LYS A 138 4.928 -7.982 7.521 1.00 0.00 N ATOM 775 CA LYS A 138 6.092 -7.662 8.340 1.00 0.00 C ATOM 776 C LYS A 138 6.629 -6.273 8.005 1.00 0.00 C ATOM 777 O LYS A 138 7.247 -5.616 8.844 1.00 0.00 O ATOM 778 CB LYS A 138 7.188 -8.710 8.136 1.00 0.00 C ATOM 779 CG LYS A 138 7.917 -9.086 9.415 1.00 0.00 C ATOM 780 CD LYS A 138 8.643 -10.415 9.273 1.00 0.00 C ATOM 781 CE LYS A 138 9.821 -10.513 10.230 1.00 0.00 C ATOM 782 NZ LYS A 138 9.554 -11.466 11.343 1.00 0.00 N ATOM 0 H LYS A 138 5.019 -8.839 6.975 1.00 0.00 H new ATOM 0 HA LYS A 138 5.783 -7.669 9.385 1.00 0.00 H new ATOM 0 HB2 LYS A 138 6.745 -9.607 7.703 1.00 0.00 H new ATOM 0 HB3 LYS A 138 7.911 -8.331 7.414 1.00 0.00 H new ATOM 0 HG2 LYS A 138 8.633 -8.305 9.670 1.00 0.00 H new ATOM 0 HG3 LYS A 138 7.204 -9.146 10.237 1.00 0.00 H new ATOM 0 HD2 LYS A 138 7.948 -11.232 9.465 1.00 0.00 H new ATOM 0 HD3 LYS A 138 8.995 -10.530 8.248 1.00 0.00 H new ATOM 0 HE2 LYS A 138 10.708 -10.833 9.683 1.00 0.00 H new ATOM 0 HE3 LYS A 138 10.038 -9.527 10.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 10.381 -11.504 11.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 8.723 -11.147 11.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 9.372 -12.413 10.953 1.00 0.00 H new ATOM 796 N ASP A 139 6.389 -5.833 6.774 1.00 0.00 N ATOM 797 CA ASP A 139 6.847 -4.523 6.325 1.00 0.00 C ATOM 798 C ASP A 139 5.913 -3.421 6.814 1.00 0.00 C ATOM 799 O ASP A 139 6.358 -2.422 7.377 1.00 0.00 O ATOM 800 CB ASP A 139 6.936 -4.488 4.799 1.00 0.00 C ATOM 801 CG ASP A 139 8.306 -4.893 4.290 1.00 0.00 C ATOM 802 OD1 ASP A 139 9.313 -4.416 4.853 1.00 0.00 O ATOM 803 OD2 ASP A 139 8.371 -5.686 3.327 1.00 0.00 O ATOM 0 H ASP A 139 5.879 -6.365 6.069 1.00 0.00 H new ATOM 0 HA ASP A 139 7.837 -4.349 6.746 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.183 -5.155 4.379 1.00 0.00 H new ATOM 0 HB3 ASP A 139 6.703 -3.483 4.447 1.00 0.00 H new ATOM 808 N GLY A 140 4.615 -3.610 6.593 1.00 0.00 N ATOM 809 CA GLY A 140 3.639 -2.621 7.018 1.00 0.00 C ATOM 810 C GLY A 140 3.750 -2.291 8.493 1.00 0.00 C ATOM 811 O GLY A 140 4.065 -1.159 8.861 1.00 0.00 O ATOM 0 H GLY A 140 4.222 -4.428 6.128 1.00 0.00 H new ATOM 0 HA2 GLY A 140 3.772 -1.710 6.434 1.00 0.00 H new ATOM 0 HA3 GLY A 140 2.636 -2.991 6.807 1.00 0.00 H new ATOM 815 N ASP A 141 3.485 -3.279 9.338 1.00 0.00 N ATOM 816 CA ASP A 141 3.550 -3.086 10.781 1.00 0.00 C ATOM 817 C ASP A 141 4.992 -3.145 11.276 1.00 0.00 C ATOM 818 O ASP A 141 5.519 -4.220 11.561 1.00 0.00 O ATOM 819 CB ASP A 141 2.705 -4.144 11.494 1.00 0.00 C ATOM 820 CG ASP A 141 2.691 -3.958 12.999 1.00 0.00 C ATOM 821 OD1 ASP A 141 2.919 -2.819 13.458 1.00 0.00 O ATOM 822 OD2 ASP A 141 2.451 -4.950 13.717 1.00 0.00 O ATOM 0 H ASP A 141 3.223 -4.222 9.049 1.00 0.00 H new ATOM 0 HA ASP A 141 3.151 -2.098 11.010 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.683 -4.103 11.117 1.00 0.00 H new ATOM 0 HB3 ASP A 141 3.093 -5.135 11.257 1.00 0.00 H new ATOM 827 N LYS A 142 5.624 -1.979 11.376 1.00 0.00 N ATOM 828 CA LYS A 142 7.005 -1.893 11.838 1.00 0.00 C ATOM 829 C LYS A 142 7.069 -1.358 13.266 1.00 0.00 C ATOM 830 O LYS A 142 8.053 -0.733 13.661 1.00 0.00 O ATOM 831 CB LYS A 142 7.821 -0.992 10.909 1.00 0.00 C ATOM 832 CG LYS A 142 8.133 -1.626 9.563 1.00 0.00 C ATOM 833 CD LYS A 142 8.100 -0.599 8.443 1.00 0.00 C ATOM 834 CE LYS A 142 9.213 0.426 8.594 1.00 0.00 C ATOM 835 NZ LYS A 142 10.520 -0.099 8.113 1.00 0.00 N ATOM 0 H LYS A 142 5.201 -1.080 11.143 1.00 0.00 H new ATOM 0 HA LYS A 142 7.429 -2.897 11.825 1.00 0.00 H new ATOM 0 HB2 LYS A 142 7.274 -0.063 10.745 1.00 0.00 H new ATOM 0 HB3 LYS A 142 8.757 -0.728 11.402 1.00 0.00 H new ATOM 0 HG2 LYS A 142 9.116 -2.095 9.600 1.00 0.00 H new ATOM 0 HG3 LYS A 142 7.411 -2.416 9.355 1.00 0.00 H new ATOM 0 HD2 LYS A 142 8.197 -1.104 7.482 1.00 0.00 H new ATOM 0 HD3 LYS A 142 7.135 -0.092 8.441 1.00 0.00 H new ATOM 0 HE2 LYS A 142 8.956 1.326 8.036 1.00 0.00 H new ATOM 0 HE3 LYS A 142 9.301 0.715 9.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 11.252 0.630 8.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 10.778 -0.943 8.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 10.444 -0.351 7.107 1.00 0.00 H new ATOM 849 N ASN A 143 6.013 -1.607 14.034 1.00 0.00 N ATOM 850 CA ASN A 143 5.949 -1.149 15.418 1.00 0.00 C ATOM 851 C ASN A 143 6.000 -2.324 16.394 1.00 0.00 C ATOM 852 O ASN A 143 6.165 -2.132 17.599 1.00 0.00 O ATOM 853 CB ASN A 143 4.673 -0.338 15.648 1.00 0.00 C ATOM 854 CG ASN A 143 4.888 1.149 15.446 1.00 0.00 C ATOM 855 OD1 ASN A 143 6.012 1.644 15.540 1.00 0.00 O ATOM 856 ND2 ASN A 143 3.809 1.871 15.166 1.00 0.00 N ATOM 0 H ASN A 143 5.190 -2.123 13.722 1.00 0.00 H new ATOM 0 HA ASN A 143 6.817 -0.516 15.601 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.897 -0.686 14.966 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.311 -0.516 16.661 1.00 0.00 H new ATOM 0 HD21 ASN A 143 3.892 2.877 15.019 1.00 0.00 H new ATOM 0 HD22 ASN A 143 2.897 1.420 15.098 1.00 0.00 H new ATOM 863 N ASN A 144 5.856 -3.540 15.871 1.00 0.00 N ATOM 864 CA ASN A 144 5.884 -4.738 16.703 1.00 0.00 C ATOM 865 C ASN A 144 4.689 -4.769 17.650 1.00 0.00 C ATOM 866 O ASN A 144 4.826 -5.091 18.831 1.00 0.00 O ATOM 867 CB ASN A 144 7.188 -4.804 17.502 1.00 0.00 C ATOM 868 CG ASN A 144 7.550 -6.221 17.901 1.00 0.00 C ATOM 869 OD1 ASN A 144 7.286 -7.173 17.167 1.00 0.00 O ATOM 870 ND2 ASN A 144 8.159 -6.369 19.073 1.00 0.00 N ATOM 0 H ASN A 144 5.719 -3.720 14.876 1.00 0.00 H new ATOM 0 HA ASN A 144 5.828 -5.606 16.047 1.00 0.00 H new ATOM 0 HB2 ASN A 144 7.997 -4.379 16.908 1.00 0.00 H new ATOM 0 HB3 ASN A 144 7.094 -4.190 18.398 1.00 0.00 H new ATOM 0 HD21 ASN A 144 8.426 -7.299 19.395 1.00 0.00 H new ATOM 0 HD22 ASN A 144 8.359 -5.552 19.650 1.00 0.00 H new ATOM 877 N ASP A 145 3.516 -4.433 17.123 1.00 0.00 N ATOM 878 CA ASP A 145 2.294 -4.422 17.920 1.00 0.00 C ATOM 879 C ASP A 145 1.308 -5.470 17.414 1.00 0.00 C ATOM 880 O ASP A 145 0.637 -6.136 18.202 1.00 0.00 O ATOM 881 CB ASP A 145 1.648 -3.036 17.883 1.00 0.00 C ATOM 882 CG ASP A 145 1.393 -2.554 16.469 1.00 0.00 C ATOM 883 OD1 ASP A 145 0.321 -2.878 15.915 1.00 0.00 O ATOM 884 OD2 ASP A 145 2.265 -1.853 15.914 1.00 0.00 O ATOM 0 H ASP A 145 3.386 -4.165 16.148 1.00 0.00 H new ATOM 0 HA ASP A 145 2.558 -4.663 18.950 1.00 0.00 H new ATOM 0 HB2 ASP A 145 0.706 -3.063 18.430 1.00 0.00 H new ATOM 0 HB3 ASP A 145 2.294 -2.323 18.396 1.00 0.00 H new ATOM 889 N GLY A 146 1.226 -5.611 16.095 1.00 0.00 N ATOM 890 CA GLY A 146 0.320 -6.581 15.509 1.00 0.00 C ATOM 891 C GLY A 146 -0.404 -6.042 14.290 1.00 0.00 C ATOM 892 O GLY A 146 -0.830 -6.809 13.426 1.00 0.00 O ATOM 0 H GLY A 146 1.770 -5.071 15.422 1.00 0.00 H new ATOM 0 HA2 GLY A 146 0.880 -7.473 15.229 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -0.412 -6.886 16.256 1.00 0.00 H new ATOM 896 N ARG A 147 -0.546 -4.723 14.219 1.00 0.00 N ATOM 897 CA ARG A 147 -1.226 -4.089 13.096 1.00 0.00 C ATOM 898 C ARG A 147 -0.456 -2.864 12.609 1.00 0.00 C ATOM 899 O ARG A 147 0.460 -2.386 13.279 1.00 0.00 O ATOM 900 CB ARG A 147 -2.649 -3.690 13.496 1.00 0.00 C ATOM 901 CG ARG A 147 -3.726 -4.524 12.819 1.00 0.00 C ATOM 902 CD ARG A 147 -4.853 -4.872 13.780 1.00 0.00 C ATOM 903 NE ARG A 147 -4.864 -6.293 14.118 1.00 0.00 N ATOM 904 CZ ARG A 147 -5.832 -6.881 14.818 1.00 0.00 C ATOM 905 NH1 ARG A 147 -6.867 -6.175 15.256 1.00 0.00 N ATOM 906 NH2 ARG A 147 -5.764 -8.179 15.081 1.00 0.00 N ATOM 0 H ARG A 147 -0.200 -4.073 14.925 1.00 0.00 H new ATOM 0 HA ARG A 147 -1.273 -4.809 12.279 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -2.754 -3.784 14.577 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -2.806 -2.640 13.250 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -4.130 -3.976 11.968 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -3.285 -5.441 12.428 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -4.747 -4.283 14.691 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -5.809 -4.598 13.333 1.00 0.00 H new ATOM 0 HE ARG A 147 -4.085 -6.868 13.799 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -6.924 -5.176 15.057 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -7.605 -6.631 15.792 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -4.971 -8.726 14.747 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -6.505 -8.630 15.617 1.00 0.00 H new ATOM 920 N ILE A 148 -0.836 -2.362 11.439 1.00 0.00 N ATOM 921 CA ILE A 148 -0.187 -1.194 10.857 1.00 0.00 C ATOM 922 C ILE A 148 -1.170 -0.031 10.751 1.00 0.00 C ATOM 923 O ILE A 148 -2.282 -0.196 10.254 1.00 0.00 O ATOM 924 CB ILE A 148 0.402 -1.526 9.465 1.00 0.00 C ATOM 925 CG1 ILE A 148 1.412 -0.463 9.030 1.00 0.00 C ATOM 926 CG2 ILE A 148 -0.691 -1.683 8.421 1.00 0.00 C ATOM 927 CD1 ILE A 148 0.791 0.876 8.709 1.00 0.00 C ATOM 0 H ILE A 148 -1.593 -2.748 10.874 1.00 0.00 H new ATOM 0 HA ILE A 148 0.631 -0.901 11.515 1.00 0.00 H new ATOM 0 HB ILE A 148 0.922 -2.480 9.550 1.00 0.00 H new ATOM 0 HG12 ILE A 148 2.149 -0.330 9.822 1.00 0.00 H new ATOM 0 HG13 ILE A 148 1.949 -0.823 8.152 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -0.241 -1.916 7.456 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -1.360 -2.492 8.714 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -1.256 -0.754 8.344 1.00 0.00 H new ATOM 0 HD11 ILE A 148 1.571 1.576 8.409 1.00 0.00 H new ATOM 0 HD12 ILE A 148 0.075 0.759 7.895 1.00 0.00 H new ATOM 0 HD13 ILE A 148 0.278 1.260 9.591 1.00 0.00 H new ATOM 939 N ASP A 149 -0.759 1.141 11.232 1.00 0.00 N ATOM 940 CA ASP A 149 -1.617 2.324 11.201 1.00 0.00 C ATOM 941 C ASP A 149 -1.030 3.414 10.307 1.00 0.00 C ATOM 942 O ASP A 149 0.157 3.399 9.991 1.00 0.00 O ATOM 943 CB ASP A 149 -1.816 2.866 12.618 1.00 0.00 C ATOM 944 CG ASP A 149 -2.768 4.046 12.660 1.00 0.00 C ATOM 945 OD1 ASP A 149 -3.956 3.863 12.323 1.00 0.00 O ATOM 946 OD2 ASP A 149 -2.325 5.153 13.031 1.00 0.00 O ATOM 0 H ASP A 149 0.160 1.297 11.647 1.00 0.00 H new ATOM 0 HA ASP A 149 -2.581 2.028 10.787 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -2.200 2.071 13.257 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -0.852 3.167 13.027 1.00 0.00 H new ATOM 951 N TYR A 150 -1.880 4.358 9.903 1.00 0.00 N ATOM 952 CA TYR A 150 -1.465 5.465 9.039 1.00 0.00 C ATOM 953 C TYR A 150 -0.126 6.057 9.482 1.00 0.00 C ATOM 954 O TYR A 150 -0.078 6.969 10.306 1.00 0.00 O ATOM 955 CB TYR A 150 -2.542 6.553 9.030 1.00 0.00 C ATOM 956 CG TYR A 150 -2.357 7.601 7.952 1.00 0.00 C ATOM 957 CD1 TYR A 150 -1.788 7.281 6.725 1.00 0.00 C ATOM 958 CD2 TYR A 150 -2.756 8.915 8.165 1.00 0.00 C ATOM 959 CE1 TYR A 150 -1.622 8.240 5.743 1.00 0.00 C ATOM 960 CE2 TYR A 150 -2.594 9.878 7.189 1.00 0.00 C ATOM 961 CZ TYR A 150 -2.026 9.536 5.980 1.00 0.00 C ATOM 962 OH TYR A 150 -1.863 10.493 5.005 1.00 0.00 O ATOM 0 H TYR A 150 -2.866 4.378 10.162 1.00 0.00 H new ATOM 0 HA TYR A 150 -1.336 5.071 8.031 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -3.517 6.083 8.900 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -2.553 7.046 10.002 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -1.470 6.266 6.535 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -3.201 9.188 9.111 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -1.178 7.975 4.795 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -2.911 10.894 7.372 1.00 0.00 H new ATOM 0 HH TYR A 150 -1.245 10.161 4.321 1.00 0.00 H new ATOM 972 N ASP A 151 0.954 5.522 8.919 1.00 0.00 N ATOM 973 CA ASP A 151 2.309 5.972 9.230 1.00 0.00 C ATOM 974 C ASP A 151 3.323 5.079 8.527 1.00 0.00 C ATOM 975 O ASP A 151 4.028 5.516 7.618 1.00 0.00 O ATOM 976 CB ASP A 151 2.554 5.955 10.743 1.00 0.00 C ATOM 977 CG ASP A 151 3.957 6.400 11.109 1.00 0.00 C ATOM 978 OD1 ASP A 151 4.461 7.353 10.478 1.00 0.00 O ATOM 979 OD2 ASP A 151 4.552 5.795 12.026 1.00 0.00 O ATOM 0 H ASP A 151 0.916 4.766 8.236 1.00 0.00 H new ATOM 0 HA ASP A 151 2.424 6.997 8.876 1.00 0.00 H new ATOM 0 HB2 ASP A 151 1.830 6.607 11.232 1.00 0.00 H new ATOM 0 HB3 ASP A 151 2.385 4.948 11.124 1.00 0.00 H new ATOM 984 N GLU A 152 3.373 3.817 8.939 1.00 0.00 N ATOM 985 CA GLU A 152 4.281 2.855 8.330 1.00 0.00 C ATOM 986 C GLU A 152 3.810 2.524 6.917 1.00 0.00 C ATOM 987 O GLU A 152 4.604 2.139 6.057 1.00 0.00 O ATOM 988 CB GLU A 152 4.354 1.580 9.172 1.00 0.00 C ATOM 989 CG GLU A 152 4.603 1.839 10.649 1.00 0.00 C ATOM 990 CD GLU A 152 3.746 0.968 11.547 1.00 0.00 C ATOM 991 OE1 GLU A 152 2.513 1.165 11.563 1.00 0.00 O ATOM 992 OE2 GLU A 152 4.309 0.089 12.233 1.00 0.00 O ATOM 0 H GLU A 152 2.797 3.438 9.690 1.00 0.00 H new ATOM 0 HA GLU A 152 5.277 3.294 8.282 1.00 0.00 H new ATOM 0 HB2 GLU A 152 3.421 1.027 9.061 1.00 0.00 H new ATOM 0 HB3 GLU A 152 5.149 0.944 8.784 1.00 0.00 H new ATOM 0 HG2 GLU A 152 5.655 1.661 10.873 1.00 0.00 H new ATOM 0 HG3 GLU A 152 4.403 2.888 10.869 1.00 0.00 H new ATOM 999 N PHE A 153 2.509 2.688 6.688 1.00 0.00 N ATOM 1000 CA PHE A 153 1.913 2.423 5.386 1.00 0.00 C ATOM 1001 C PHE A 153 2.526 3.335 4.329 1.00 0.00 C ATOM 1002 O PHE A 153 2.651 2.960 3.164 1.00 0.00 O ATOM 1003 CB PHE A 153 0.392 2.623 5.462 1.00 0.00 C ATOM 1004 CG PHE A 153 -0.237 3.103 4.182 1.00 0.00 C ATOM 1005 CD1 PHE A 153 -0.032 2.419 2.997 1.00 0.00 C ATOM 1006 CD2 PHE A 153 -1.032 4.238 4.168 1.00 0.00 C ATOM 1007 CE1 PHE A 153 -0.607 2.855 1.820 1.00 0.00 C ATOM 1008 CE2 PHE A 153 -1.610 4.680 2.993 1.00 0.00 C ATOM 1009 CZ PHE A 153 -1.397 3.987 1.818 1.00 0.00 C ATOM 0 H PHE A 153 1.845 3.006 7.395 1.00 0.00 H new ATOM 0 HA PHE A 153 2.116 1.390 5.102 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.072 1.680 5.749 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.171 3.340 6.252 1.00 0.00 H new ATOM 0 HD1 PHE A 153 0.586 1.533 2.993 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -1.202 4.783 5.085 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -0.439 2.311 0.902 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -2.227 5.566 2.994 1.00 0.00 H new ATOM 0 HZ PHE A 153 -1.848 4.330 0.899 1.00 0.00 H new ATOM 1019 N LEU A 154 2.910 4.534 4.747 1.00 0.00 N ATOM 1020 CA LEU A 154 3.514 5.499 3.841 1.00 0.00 C ATOM 1021 C LEU A 154 4.851 4.981 3.317 1.00 0.00 C ATOM 1022 O LEU A 154 5.324 5.409 2.265 1.00 0.00 O ATOM 1023 CB LEU A 154 3.695 6.843 4.550 1.00 0.00 C ATOM 1024 CG LEU A 154 2.544 7.254 5.477 1.00 0.00 C ATOM 1025 CD1 LEU A 154 2.669 8.719 5.863 1.00 0.00 C ATOM 1026 CD2 LEU A 154 1.191 6.990 4.823 1.00 0.00 C ATOM 0 H LEU A 154 2.813 4.861 5.708 1.00 0.00 H new ATOM 0 HA LEU A 154 2.850 5.642 2.989 1.00 0.00 H new ATOM 0 HB2 LEU A 154 4.615 6.806 5.134 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.827 7.619 3.796 1.00 0.00 H new ATOM 0 HG LEU A 154 2.607 6.648 6.381 1.00 0.00 H new ATOM 0 HD11 LEU A 154 1.844 8.994 6.521 1.00 0.00 H new ATOM 0 HD12 LEU A 154 3.615 8.879 6.380 1.00 0.00 H new ATOM 0 HD13 LEU A 154 2.638 9.336 4.965 1.00 0.00 H new ATOM 0 HD21 LEU A 154 0.394 7.291 5.503 1.00 0.00 H new ATOM 0 HD22 LEU A 154 1.116 7.563 3.899 1.00 0.00 H new ATOM 0 HD23 LEU A 154 1.096 5.927 4.600 1.00 0.00 H new ATOM 1038 N GLU A 155 5.448 4.045 4.052 1.00 0.00 N ATOM 1039 CA GLU A 155 6.720 3.456 3.652 1.00 0.00 C ATOM 1040 C GLU A 155 6.517 2.461 2.509 1.00 0.00 C ATOM 1041 O GLU A 155 7.451 2.151 1.769 1.00 0.00 O ATOM 1042 CB GLU A 155 7.382 2.760 4.845 1.00 0.00 C ATOM 1043 CG GLU A 155 8.764 3.300 5.173 1.00 0.00 C ATOM 1044 CD GLU A 155 9.835 2.760 4.246 1.00 0.00 C ATOM 1045 OE1 GLU A 155 9.630 2.802 3.014 1.00 0.00 O ATOM 1046 OE2 GLU A 155 10.878 2.294 4.751 1.00 0.00 O ATOM 0 H GLU A 155 5.070 3.680 4.926 1.00 0.00 H new ATOM 0 HA GLU A 155 7.374 4.256 3.303 1.00 0.00 H new ATOM 0 HB2 GLU A 155 6.741 2.869 5.720 1.00 0.00 H new ATOM 0 HB3 GLU A 155 7.458 1.693 4.636 1.00 0.00 H new ATOM 0 HG2 GLU A 155 8.749 4.388 5.111 1.00 0.00 H new ATOM 0 HG3 GLU A 155 9.016 3.043 6.202 1.00 0.00 H new ATOM 1053 N PHE A 156 5.288 1.969 2.370 1.00 0.00 N ATOM 1054 CA PHE A 156 4.957 1.017 1.316 1.00 0.00 C ATOM 1055 C PHE A 156 5.189 1.637 -0.058 1.00 0.00 C ATOM 1056 O PHE A 156 5.993 1.143 -0.848 1.00 0.00 O ATOM 1057 CB PHE A 156 3.496 0.577 1.449 1.00 0.00 C ATOM 1058 CG PHE A 156 3.313 -0.909 1.545 1.00 0.00 C ATOM 1059 CD1 PHE A 156 3.316 -1.542 2.777 1.00 0.00 C ATOM 1060 CD2 PHE A 156 3.130 -1.672 0.404 1.00 0.00 C ATOM 1061 CE1 PHE A 156 3.140 -2.909 2.870 1.00 0.00 C ATOM 1062 CE2 PHE A 156 2.956 -3.040 0.489 1.00 0.00 C ATOM 1063 CZ PHE A 156 2.961 -3.660 1.725 1.00 0.00 C ATOM 0 H PHE A 156 4.505 2.215 2.976 1.00 0.00 H new ATOM 0 HA PHE A 156 5.605 0.147 1.419 1.00 0.00 H new ATOM 0 HB2 PHE A 156 3.066 1.044 2.335 1.00 0.00 H new ATOM 0 HB3 PHE A 156 2.936 0.947 0.590 1.00 0.00 H new ATOM 0 HD1 PHE A 156 3.458 -0.960 3.676 1.00 0.00 H new ATOM 0 HD2 PHE A 156 3.123 -1.192 -0.564 1.00 0.00 H new ATOM 0 HE1 PHE A 156 3.142 -3.390 3.837 1.00 0.00 H new ATOM 0 HE2 PHE A 156 2.816 -3.624 -0.409 1.00 0.00 H new ATOM 0 HZ PHE A 156 2.825 -4.729 1.795 1.00 0.00 H new ATOM 1073 N MET A 157 4.473 2.722 -0.333 1.00 0.00 N ATOM 1074 CA MET A 157 4.590 3.419 -1.609 1.00 0.00 C ATOM 1075 C MET A 157 6.039 3.806 -1.898 1.00 0.00 C ATOM 1076 O MET A 157 6.458 3.856 -3.054 1.00 0.00 O ATOM 1077 CB MET A 157 3.697 4.666 -1.615 1.00 0.00 C ATOM 1078 CG MET A 157 4.233 5.820 -0.778 1.00 0.00 C ATOM 1079 SD MET A 157 3.489 7.401 -1.224 1.00 0.00 S ATOM 1080 CE MET A 157 3.860 7.469 -2.975 1.00 0.00 C ATOM 0 H MET A 157 3.803 3.139 0.313 1.00 0.00 H new ATOM 0 HA MET A 157 4.260 2.740 -2.395 1.00 0.00 H new ATOM 0 HB2 MET A 157 3.572 5.005 -2.643 1.00 0.00 H new ATOM 0 HB3 MET A 157 2.708 4.393 -1.247 1.00 0.00 H new ATOM 0 HG2 MET A 157 4.044 5.618 0.276 1.00 0.00 H new ATOM 0 HG3 MET A 157 5.314 5.883 -0.902 1.00 0.00 H new ATOM 0 HE1 MET A 157 3.987 8.508 -3.280 1.00 0.00 H new ATOM 0 HE2 MET A 157 4.779 6.917 -3.174 1.00 0.00 H new ATOM 0 HE3 MET A 157 3.040 7.023 -3.538 1.00 0.00 H new ATOM 1090 N LYS A 158 6.798 4.081 -0.840 1.00 0.00 N ATOM 1091 CA LYS A 158 8.200 4.466 -0.980 1.00 0.00 C ATOM 1092 C LYS A 158 8.938 3.520 -1.925 1.00 0.00 C ATOM 1093 O LYS A 158 9.857 3.929 -2.633 1.00 0.00 O ATOM 1094 CB LYS A 158 8.884 4.485 0.389 1.00 0.00 C ATOM 1095 CG LYS A 158 9.345 5.868 0.815 1.00 0.00 C ATOM 1096 CD LYS A 158 10.661 5.810 1.576 1.00 0.00 C ATOM 1097 CE LYS A 158 10.447 5.941 3.076 1.00 0.00 C ATOM 1098 NZ LYS A 158 11.062 7.184 3.618 1.00 0.00 N ATOM 0 H LYS A 158 6.466 4.044 0.124 1.00 0.00 H new ATOM 0 HA LYS A 158 8.234 5.468 -1.408 1.00 0.00 H new ATOM 0 HB2 LYS A 158 8.194 4.094 1.137 1.00 0.00 H new ATOM 0 HB3 LYS A 158 9.743 3.815 0.367 1.00 0.00 H new ATOM 0 HG2 LYS A 158 9.461 6.501 -0.065 1.00 0.00 H new ATOM 0 HG3 LYS A 158 8.582 6.330 1.442 1.00 0.00 H new ATOM 0 HD2 LYS A 158 11.165 4.868 1.361 1.00 0.00 H new ATOM 0 HD3 LYS A 158 11.317 6.609 1.230 1.00 0.00 H new ATOM 0 HE2 LYS A 158 9.379 5.941 3.292 1.00 0.00 H new ATOM 0 HE3 LYS A 158 10.874 5.075 3.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 10.894 7.236 4.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 12.086 7.173 3.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 10.636 8.012 3.155 1.00 0.00 H new ATOM 1112 N GLY A 159 8.524 2.257 -1.935 1.00 0.00 N ATOM 1113 CA GLY A 159 9.154 1.282 -2.803 1.00 0.00 C ATOM 1114 C GLY A 159 8.994 1.637 -4.267 1.00 0.00 C ATOM 1115 O GLY A 159 9.880 1.372 -5.080 1.00 0.00 O ATOM 0 H GLY A 159 7.765 1.893 -1.359 1.00 0.00 H new ATOM 0 HA2 GLY A 159 10.214 1.213 -2.561 1.00 0.00 H new ATOM 0 HA3 GLY A 159 8.720 0.299 -2.619 1.00 0.00 H new ATOM 1119 N VAL A 160 7.860 2.245 -4.601 1.00 0.00 N ATOM 1120 CA VAL A 160 7.578 2.647 -5.970 1.00 0.00 C ATOM 1121 C VAL A 160 8.604 3.661 -6.467 1.00 0.00 C ATOM 1122 O VAL A 160 8.850 3.772 -7.668 1.00 0.00 O ATOM 1123 CB VAL A 160 6.167 3.253 -6.084 1.00 0.00 C ATOM 1124 CG1 VAL A 160 5.845 3.608 -7.525 1.00 0.00 C ATOM 1125 CG2 VAL A 160 5.129 2.294 -5.525 1.00 0.00 C ATOM 0 H VAL A 160 7.119 2.470 -3.937 1.00 0.00 H new ATOM 0 HA VAL A 160 7.635 1.752 -6.590 1.00 0.00 H new ATOM 0 HB VAL A 160 6.142 4.170 -5.496 1.00 0.00 H new ATOM 0 HG11 VAL A 160 4.843 4.034 -7.580 1.00 0.00 H new ATOM 0 HG12 VAL A 160 6.569 4.336 -7.891 1.00 0.00 H new ATOM 0 HG13 VAL A 160 5.891 2.709 -8.140 1.00 0.00 H new ATOM 0 HG21 VAL A 160 4.138 2.739 -5.614 1.00 0.00 H new ATOM 0 HG22 VAL A 160 5.159 1.359 -6.085 1.00 0.00 H new ATOM 0 HG23 VAL A 160 5.345 2.096 -4.475 1.00 0.00 H new ATOM 1135 N GLU A 161 9.201 4.397 -5.535 1.00 0.00 N ATOM 1136 CA GLU A 161 10.202 5.401 -5.880 1.00 0.00 C ATOM 1137 C GLU A 161 11.611 4.869 -5.642 1.00 0.00 C ATOM 1138 O GLU A 161 11.796 4.095 -4.679 1.00 0.00 O ATOM 1139 CB GLU A 161 9.979 6.676 -5.064 1.00 0.00 C ATOM 1140 CG GLU A 161 10.174 6.486 -3.569 1.00 0.00 C ATOM 1141 CD GLU A 161 10.598 7.762 -2.869 1.00 0.00 C ATOM 1142 OE1 GLU A 161 10.039 8.831 -3.195 1.00 0.00 O ATOM 1143 OE2 GLU A 161 11.488 7.693 -1.996 1.00 0.00 O ATOM 1144 OXT GLU A 161 12.519 5.231 -6.420 1.00 0.00 O ATOM 0 H GLU A 161 9.010 4.317 -4.536 1.00 0.00 H new ATOM 0 HA GLU A 161 10.096 5.634 -6.940 1.00 0.00 H new ATOM 0 HB2 GLU A 161 10.665 7.447 -5.416 1.00 0.00 H new ATOM 0 HB3 GLU A 161 8.968 7.041 -5.246 1.00 0.00 H new ATOM 0 HG2 GLU A 161 9.244 6.126 -3.128 1.00 0.00 H new ATOM 0 HG3 GLU A 161 10.927 5.716 -3.400 1.00 0.00 H new ATOM 1226 N PHE B 132 4.743 -5.894 -6.881 1.00 0.00 N ATOM 1227 CA PHE B 132 4.119 -6.424 -8.083 1.00 0.00 C ATOM 1228 C PHE B 132 3.074 -5.456 -8.650 1.00 0.00 C ATOM 1229 O PHE B 132 3.422 -4.511 -9.358 1.00 0.00 O ATOM 1230 CB PHE B 132 3.499 -7.800 -7.802 1.00 0.00 C ATOM 1231 CG PHE B 132 3.085 -8.021 -6.368 1.00 0.00 C ATOM 1232 CD1 PHE B 132 4.036 -8.162 -5.369 1.00 0.00 C ATOM 1233 CD2 PHE B 132 1.743 -8.098 -6.021 1.00 0.00 C ATOM 1234 CE1 PHE B 132 3.659 -8.373 -4.056 1.00 0.00 C ATOM 1235 CE2 PHE B 132 1.361 -8.308 -4.711 1.00 0.00 C ATOM 1236 CZ PHE B 132 2.320 -8.446 -3.727 1.00 0.00 C ATOM 0 HA PHE B 132 4.895 -6.542 -8.839 1.00 0.00 H new ATOM 0 HB2 PHE B 132 2.626 -7.928 -8.442 1.00 0.00 H new ATOM 0 HB3 PHE B 132 4.216 -8.571 -8.082 1.00 0.00 H new ATOM 0 HD1 PHE B 132 5.085 -8.106 -5.620 1.00 0.00 H new ATOM 0 HD2 PHE B 132 0.988 -7.992 -6.786 1.00 0.00 H new ATOM 0 HE1 PHE B 132 4.411 -8.481 -3.288 1.00 0.00 H new ATOM 0 HE2 PHE B 132 0.313 -8.364 -4.456 1.00 0.00 H new ATOM 0 HZ PHE B 132 2.023 -8.611 -2.702 1.00 0.00 H new ATOM 1246 N ASP B 133 1.798 -5.690 -8.344 1.00 0.00 N ATOM 1247 CA ASP B 133 0.725 -4.831 -8.833 1.00 0.00 C ATOM 1248 C ASP B 133 0.576 -3.586 -7.963 1.00 0.00 C ATOM 1249 O ASP B 133 -0.315 -2.767 -8.184 1.00 0.00 O ATOM 1250 CB ASP B 133 -0.595 -5.602 -8.869 1.00 0.00 C ATOM 1251 CG ASP B 133 -1.449 -5.232 -10.066 1.00 0.00 C ATOM 1252 OD1 ASP B 133 -1.669 -4.023 -10.287 1.00 0.00 O ATOM 1253 OD2 ASP B 133 -1.898 -6.152 -10.782 1.00 0.00 O ATOM 0 H ASP B 133 1.485 -6.466 -7.761 1.00 0.00 H new ATOM 0 HA ASP B 133 0.983 -4.513 -9.843 1.00 0.00 H new ATOM 0 HB2 ASP B 133 -0.387 -6.672 -8.891 1.00 0.00 H new ATOM 0 HB3 ASP B 133 -1.153 -5.405 -7.954 1.00 0.00 H new ATOM 1258 N LEU B 134 1.455 -3.445 -6.976 1.00 0.00 N ATOM 1259 CA LEU B 134 1.421 -2.300 -6.080 1.00 0.00 C ATOM 1260 C LEU B 134 2.305 -1.182 -6.614 1.00 0.00 C ATOM 1261 O LEU B 134 1.879 -0.033 -6.722 1.00 0.00 O ATOM 1262 CB LEU B 134 1.898 -2.707 -4.685 1.00 0.00 C ATOM 1263 CG LEU B 134 1.166 -3.898 -4.064 1.00 0.00 C ATOM 1264 CD1 LEU B 134 1.612 -5.199 -4.714 1.00 0.00 C ATOM 1265 CD2 LEU B 134 1.408 -3.945 -2.564 1.00 0.00 C ATOM 0 H LEU B 134 2.200 -4.113 -6.778 1.00 0.00 H new ATOM 0 HA LEU B 134 0.393 -1.942 -6.018 1.00 0.00 H new ATOM 0 HB2 LEU B 134 2.961 -2.942 -4.737 1.00 0.00 H new ATOM 0 HB3 LEU B 134 1.793 -1.850 -4.019 1.00 0.00 H new ATOM 0 HG LEU B 134 0.097 -3.775 -4.240 1.00 0.00 H new ATOM 0 HD11 LEU B 134 1.080 -6.034 -4.259 1.00 0.00 H new ATOM 0 HD12 LEU B 134 1.392 -5.167 -5.781 1.00 0.00 H new ATOM 0 HD13 LEU B 134 2.684 -5.329 -4.569 1.00 0.00 H new ATOM 0 HD21 LEU B 134 0.881 -4.798 -2.137 1.00 0.00 H new ATOM 0 HD22 LEU B 134 2.476 -4.045 -2.371 1.00 0.00 H new ATOM 0 HD23 LEU B 134 1.041 -3.026 -2.107 1.00 0.00 H new ATOM 1277 N ARG B 135 3.541 -1.532 -6.945 1.00 0.00 N ATOM 1278 CA ARG B 135 4.501 -0.565 -7.466 1.00 0.00 C ATOM 1279 C ARG B 135 3.937 0.183 -8.666 1.00 0.00 C ATOM 1280 O ARG B 135 4.124 1.393 -8.798 1.00 0.00 O ATOM 1281 CB ARG B 135 5.796 -1.270 -7.870 1.00 0.00 C ATOM 1282 CG ARG B 135 6.812 -0.349 -8.525 1.00 0.00 C ATOM 1283 CD ARG B 135 8.156 -1.037 -8.704 1.00 0.00 C ATOM 1284 NE ARG B 135 9.011 -0.329 -9.654 1.00 0.00 N ATOM 1285 CZ ARG B 135 10.332 -0.478 -9.716 1.00 0.00 C ATOM 1286 NH1 ARG B 135 10.954 -1.307 -8.888 1.00 0.00 N ATOM 1287 NH2 ARG B 135 11.033 0.205 -10.611 1.00 0.00 N ATOM 0 H ARG B 135 3.904 -2.482 -6.862 1.00 0.00 H new ATOM 0 HA ARG B 135 4.708 0.155 -6.674 1.00 0.00 H new ATOM 0 HB2 ARG B 135 6.245 -1.722 -6.985 1.00 0.00 H new ATOM 0 HB3 ARG B 135 5.558 -2.082 -8.557 1.00 0.00 H new ATOM 0 HG2 ARG B 135 6.437 -0.024 -9.495 1.00 0.00 H new ATOM 0 HG3 ARG B 135 6.939 0.546 -7.916 1.00 0.00 H new ATOM 0 HD2 ARG B 135 8.661 -1.102 -7.740 1.00 0.00 H new ATOM 0 HD3 ARG B 135 7.997 -2.058 -9.050 1.00 0.00 H new ATOM 0 HE ARG B 135 8.570 0.317 -10.308 1.00 0.00 H new ATOM 0 HH11 ARG B 135 10.420 -1.835 -8.198 1.00 0.00 H new ATOM 0 HH12 ARG B 135 11.967 -1.416 -8.941 1.00 0.00 H new ATOM 0 HH21 ARG B 135 10.560 0.843 -11.250 1.00 0.00 H new ATOM 0 HH22 ARG B 135 12.046 0.092 -10.660 1.00 0.00 H new ATOM 1301 N GLY B 136 3.259 -0.543 -9.547 1.00 0.00 N ATOM 1302 CA GLY B 136 2.699 0.078 -10.729 1.00 0.00 C ATOM 1303 C GLY B 136 1.316 0.661 -10.499 1.00 0.00 C ATOM 1304 O GLY B 136 0.587 0.938 -11.451 1.00 0.00 O ATOM 0 H GLY B 136 3.088 -1.545 -9.464 1.00 0.00 H new ATOM 0 HA2 GLY B 136 3.368 0.869 -11.068 1.00 0.00 H new ATOM 0 HA3 GLY B 136 2.647 -0.660 -11.529 1.00 0.00 H new ATOM 1308 N LYS B 137 0.961 0.855 -9.235 1.00 0.00 N ATOM 1309 CA LYS B 137 -0.335 1.417 -8.876 1.00 0.00 C ATOM 1310 C LYS B 137 -0.192 2.336 -7.670 1.00 0.00 C ATOM 1311 O LYS B 137 -1.106 2.460 -6.855 1.00 0.00 O ATOM 1312 CB LYS B 137 -1.336 0.303 -8.564 1.00 0.00 C ATOM 1313 CG LYS B 137 -1.433 -0.754 -9.650 1.00 0.00 C ATOM 1314 CD LYS B 137 -2.240 -0.258 -10.840 1.00 0.00 C ATOM 1315 CE LYS B 137 -3.734 -0.425 -10.611 1.00 0.00 C ATOM 1316 NZ LYS B 137 -4.404 0.878 -10.345 1.00 0.00 N ATOM 0 H LYS B 137 1.556 0.630 -8.438 1.00 0.00 H new ATOM 0 HA LYS B 137 -0.707 1.994 -9.723 1.00 0.00 H new ATOM 0 HB2 LYS B 137 -1.052 -0.177 -7.627 1.00 0.00 H new ATOM 0 HB3 LYS B 137 -2.321 0.744 -8.410 1.00 0.00 H new ATOM 0 HG2 LYS B 137 -0.432 -1.032 -9.979 1.00 0.00 H new ATOM 0 HG3 LYS B 137 -1.897 -1.653 -9.244 1.00 0.00 H new ATOM 0 HD2 LYS B 137 -2.014 0.793 -11.021 1.00 0.00 H new ATOM 0 HD3 LYS B 137 -1.945 -0.806 -11.735 1.00 0.00 H new ATOM 0 HE2 LYS B 137 -4.185 -0.893 -11.486 1.00 0.00 H new ATOM 0 HE3 LYS B 137 -3.899 -1.097 -9.769 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 -5.245 0.722 -9.754 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 -3.745 1.512 -9.849 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 -4.690 1.312 -11.246 1.00 0.00 H new ATOM 1330 N PHE B 138 0.971 2.969 -7.559 1.00 0.00 N ATOM 1331 CA PHE B 138 1.252 3.867 -6.449 1.00 0.00 C ATOM 1332 C PHE B 138 1.884 5.165 -6.944 1.00 0.00 C ATOM 1333 O PHE B 138 2.675 5.791 -6.238 1.00 0.00 O ATOM 1334 CB PHE B 138 2.179 3.174 -5.449 1.00 0.00 C ATOM 1335 CG PHE B 138 1.492 2.754 -4.183 1.00 0.00 C ATOM 1336 CD1 PHE B 138 1.210 3.677 -3.190 1.00 0.00 C ATOM 1337 CD2 PHE B 138 1.129 1.432 -3.989 1.00 0.00 C ATOM 1338 CE1 PHE B 138 0.577 3.288 -2.025 1.00 0.00 C ATOM 1339 CE2 PHE B 138 0.497 1.036 -2.827 1.00 0.00 C ATOM 1340 CZ PHE B 138 0.220 1.965 -1.843 1.00 0.00 C ATOM 0 H PHE B 138 1.736 2.875 -8.228 1.00 0.00 H new ATOM 0 HA PHE B 138 0.312 4.117 -5.957 1.00 0.00 H new ATOM 0 HB2 PHE B 138 2.619 2.296 -5.922 1.00 0.00 H new ATOM 0 HB3 PHE B 138 3.000 3.847 -5.201 1.00 0.00 H new ATOM 0 HD1 PHE B 138 1.488 4.712 -3.328 1.00 0.00 H new ATOM 0 HD2 PHE B 138 1.343 0.702 -4.756 1.00 0.00 H new ATOM 0 HE1 PHE B 138 0.361 4.017 -1.258 1.00 0.00 H new ATOM 0 HE2 PHE B 138 0.220 0.002 -2.688 1.00 0.00 H new ATOM 0 HZ PHE B 138 -0.275 1.658 -0.933 1.00 0.00 H new