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 Single : A 93 SER OG : rot 14:sc= 0.562 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl -142:sc= -0.7 (180deg=-2.33) USER MOD Single : A 106 LYS NZ :NH3+ -152:sc=-0.00466 (180deg=-0.5) USER MOD Single : A 107 ASN : amide:sc= -0.896 K(o=-0.9,f=-2) 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 -126:sc= -2.58 (180deg=-8.92!) USER MOD Single : A 122 GLN : amide:sc=-0.00872 K(o=-0.0087,f=-1.5) USER MOD Single : A 124 THR OG1 : rot -70:sc= 0.587 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot -92:sc= -0.0174 USER MOD Single : A 137 MET CE :methyl -160:sc= -0.578 (180deg=-2.11) 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= -0.905 K(o=-0.9,f=-1.5) USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 150 TYR OH : rot 3:sc= 0.123 USER MOD Single : A 157 MET CE :methyl 140:sc= -5.59! (180deg=-10.6!) USER MOD Single : A 158 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0261) USER MOD Single : B 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 93 0.434 14.859 -3.517 1.00 0.00 N ATOM 72 CA SER A 93 0.990 13.511 -3.507 1.00 0.00 C ATOM 73 C SER A 93 0.222 12.611 -2.545 1.00 0.00 C ATOM 74 O SER A 93 -0.101 11.469 -2.872 1.00 0.00 O ATOM 75 CB SER A 93 2.469 13.550 -3.117 1.00 0.00 C ATOM 76 OG SER A 93 3.069 14.771 -3.513 1.00 0.00 O ATOM 0 HA SER A 93 0.897 13.100 -4.512 1.00 0.00 H new ATOM 0 HB2 SER A 93 2.567 13.426 -2.039 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.993 12.716 -3.583 1.00 0.00 H new ATOM 0 HG SER A 93 2.371 15.417 -3.749 1.00 0.00 H new ATOM 82 N GLU A 94 -0.066 13.132 -1.356 1.00 0.00 N ATOM 83 CA GLU A 94 -0.795 12.376 -0.343 1.00 0.00 C ATOM 84 C GLU A 94 -2.132 11.875 -0.885 1.00 0.00 C ATOM 85 O GLU A 94 -2.664 10.869 -0.416 1.00 0.00 O ATOM 86 CB GLU A 94 -1.026 13.239 0.898 1.00 0.00 C ATOM 87 CG GLU A 94 0.090 13.140 1.925 1.00 0.00 C ATOM 88 CD GLU A 94 -0.127 14.056 3.113 1.00 0.00 C ATOM 89 OE1 GLU A 94 -0.822 13.641 4.064 1.00 0.00 O ATOM 90 OE2 GLU A 94 0.398 15.190 3.092 1.00 0.00 O ATOM 0 H GLU A 94 0.195 14.076 -1.070 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.191 11.511 -0.071 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.135 14.279 0.592 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.966 12.944 1.365 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.167 12.110 2.274 1.00 0.00 H new ATOM 0 HG3 GLU A 94 1.039 13.387 1.449 1.00 0.00 H new ATOM 97 N GLU A 95 -2.670 12.583 -1.875 1.00 0.00 N ATOM 98 CA GLU A 95 -3.944 12.207 -2.478 1.00 0.00 C ATOM 99 C GLU A 95 -3.881 10.792 -3.044 1.00 0.00 C ATOM 100 O GLU A 95 -4.877 10.068 -3.045 1.00 0.00 O ATOM 101 CB GLU A 95 -4.320 13.193 -3.584 1.00 0.00 C ATOM 102 CG GLU A 95 -3.206 13.435 -4.589 1.00 0.00 C ATOM 103 CD GLU A 95 -3.728 13.680 -5.991 1.00 0.00 C ATOM 104 OE1 GLU A 95 -4.351 12.760 -6.561 1.00 0.00 O ATOM 105 OE2 GLU A 95 -3.513 14.791 -6.519 1.00 0.00 O ATOM 0 H GLU A 95 -2.244 13.419 -2.275 1.00 0.00 H new ATOM 0 HA GLU A 95 -4.707 12.235 -1.700 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.198 12.818 -4.111 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.602 14.144 -3.131 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.615 14.293 -4.270 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -2.538 12.574 -4.599 1.00 0.00 H new ATOM 112 N GLU A 96 -2.704 10.404 -3.524 1.00 0.00 N ATOM 113 CA GLU A 96 -2.512 9.075 -4.092 1.00 0.00 C ATOM 114 C GLU A 96 -2.824 7.994 -3.063 1.00 0.00 C ATOM 115 O GLU A 96 -3.768 7.221 -3.227 1.00 0.00 O ATOM 116 CB GLU A 96 -1.076 8.916 -4.595 1.00 0.00 C ATOM 117 CG GLU A 96 -0.707 9.890 -5.701 1.00 0.00 C ATOM 118 CD GLU A 96 0.778 9.890 -6.006 1.00 0.00 C ATOM 119 OE1 GLU A 96 1.555 10.404 -5.174 1.00 0.00 O ATOM 120 OE2 GLU A 96 1.165 9.376 -7.077 1.00 0.00 O ATOM 0 H GLU A 96 -1.870 10.991 -3.531 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.199 8.963 -4.931 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.390 9.052 -3.759 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.938 7.898 -4.958 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.260 9.634 -6.605 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -1.015 10.895 -5.413 1.00 0.00 H new ATOM 127 N LEU A 97 -2.026 7.947 -2.002 1.00 0.00 N ATOM 128 CA LEU A 97 -2.217 6.961 -0.946 1.00 0.00 C ATOM 129 C LEU A 97 -3.563 7.154 -0.254 1.00 0.00 C ATOM 130 O LEU A 97 -4.156 6.200 0.247 1.00 0.00 O ATOM 131 CB LEU A 97 -1.082 7.056 0.074 1.00 0.00 C ATOM 132 CG LEU A 97 0.309 6.736 -0.480 1.00 0.00 C ATOM 133 CD1 LEU A 97 1.301 7.829 -0.110 1.00 0.00 C ATOM 134 CD2 LEU A 97 0.786 5.382 0.025 1.00 0.00 C ATOM 0 H LEU A 97 -1.241 8.580 -1.851 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.207 5.970 -1.400 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.069 8.064 0.489 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.295 6.375 0.898 1.00 0.00 H new ATOM 0 HG LEU A 97 0.243 6.692 -1.567 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.283 7.581 -0.514 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.967 8.780 -0.526 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.365 7.910 0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.776 5.171 -0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.834 5.396 1.114 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.090 4.608 -0.298 1.00 0.00 H new ATOM 146 N SER A 98 -4.045 8.393 -0.233 1.00 0.00 N ATOM 147 CA SER A 98 -5.325 8.706 0.397 1.00 0.00 C ATOM 148 C SER A 98 -6.416 7.750 -0.077 1.00 0.00 C ATOM 149 O SER A 98 -7.209 7.251 0.721 1.00 0.00 O ATOM 150 CB SER A 98 -5.728 10.150 0.089 1.00 0.00 C ATOM 151 OG SER A 98 -6.804 10.565 0.912 1.00 0.00 O ATOM 0 H SER A 98 -3.570 9.196 -0.644 1.00 0.00 H new ATOM 0 HA SER A 98 -5.209 8.589 1.474 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.874 10.810 0.241 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.014 10.236 -0.959 1.00 0.00 H new ATOM 0 HG SER A 98 -7.042 11.491 0.697 1.00 0.00 H new ATOM 157 N ASP A 99 -6.446 7.497 -1.382 1.00 0.00 N ATOM 158 CA ASP A 99 -7.437 6.598 -1.965 1.00 0.00 C ATOM 159 C ASP A 99 -6.980 5.145 -1.870 1.00 0.00 C ATOM 160 O ASP A 99 -7.800 4.231 -1.788 1.00 0.00 O ATOM 161 CB ASP A 99 -7.691 6.970 -3.427 1.00 0.00 C ATOM 162 CG ASP A 99 -8.591 8.182 -3.568 1.00 0.00 C ATOM 163 OD1 ASP A 99 -8.081 9.316 -3.453 1.00 0.00 O ATOM 164 OD2 ASP A 99 -9.805 7.997 -3.794 1.00 0.00 O ATOM 0 H ASP A 99 -5.796 7.902 -2.056 1.00 0.00 H new ATOM 0 HA ASP A 99 -8.364 6.704 -1.401 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -6.739 7.169 -3.919 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -8.144 6.123 -3.941 1.00 0.00 H new ATOM 169 N LEU A 100 -5.666 4.939 -1.886 1.00 0.00 N ATOM 170 CA LEU A 100 -5.099 3.596 -1.806 1.00 0.00 C ATOM 171 C LEU A 100 -5.301 2.989 -0.419 1.00 0.00 C ATOM 172 O LEU A 100 -5.249 1.770 -0.256 1.00 0.00 O ATOM 173 CB LEU A 100 -3.606 3.629 -2.143 1.00 0.00 C ATOM 174 CG LEU A 100 -3.264 4.187 -3.527 1.00 0.00 C ATOM 175 CD1 LEU A 100 -1.813 4.649 -3.576 1.00 0.00 C ATOM 176 CD2 LEU A 100 -3.530 3.142 -4.600 1.00 0.00 C ATOM 0 H LEU A 100 -4.974 5.685 -1.954 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.620 2.972 -2.532 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.093 4.227 -1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.210 2.616 -2.069 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.903 5.049 -3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.590 5.042 -4.568 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.654 5.430 -2.832 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -1.155 3.806 -3.363 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.282 3.554 -5.578 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -2.916 2.262 -4.411 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.583 2.861 -4.581 1.00 0.00 H new ATOM 188 N PHE A 101 -5.521 3.841 0.578 1.00 0.00 N ATOM 189 CA PHE A 101 -5.718 3.376 1.948 1.00 0.00 C ATOM 190 C PHE A 101 -7.135 2.848 2.155 1.00 0.00 C ATOM 191 O PHE A 101 -7.327 1.723 2.616 1.00 0.00 O ATOM 192 CB PHE A 101 -5.434 4.507 2.938 1.00 0.00 C ATOM 193 CG PHE A 101 -5.314 4.042 4.361 1.00 0.00 C ATOM 194 CD1 PHE A 101 -4.415 3.045 4.706 1.00 0.00 C ATOM 195 CD2 PHE A 101 -6.100 4.604 5.355 1.00 0.00 C ATOM 196 CE1 PHE A 101 -4.303 2.617 6.015 1.00 0.00 C ATOM 197 CE2 PHE A 101 -5.992 4.179 6.665 1.00 0.00 C ATOM 198 CZ PHE A 101 -5.093 3.184 6.995 1.00 0.00 C ATOM 0 H PHE A 101 -5.567 4.854 0.464 1.00 0.00 H new ATOM 0 HA PHE A 101 -5.020 2.558 2.127 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.510 5.009 2.649 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -6.232 5.246 2.872 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.795 2.598 3.943 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -6.805 5.383 5.102 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -3.598 1.840 6.271 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -6.610 4.625 7.430 1.00 0.00 H new ATOM 0 HZ PHE A 101 -5.008 2.850 8.018 1.00 0.00 H new ATOM 208 N ARG A 102 -8.123 3.668 1.816 1.00 0.00 N ATOM 209 CA ARG A 102 -9.523 3.285 1.970 1.00 0.00 C ATOM 210 C ARG A 102 -9.859 2.049 1.137 1.00 0.00 C ATOM 211 O ARG A 102 -10.861 1.378 1.386 1.00 0.00 O ATOM 212 CB ARG A 102 -10.435 4.446 1.566 1.00 0.00 C ATOM 213 CG ARG A 102 -10.701 5.431 2.693 1.00 0.00 C ATOM 214 CD ARG A 102 -9.625 6.503 2.761 1.00 0.00 C ATOM 215 NE ARG A 102 -9.532 7.100 4.091 1.00 0.00 N ATOM 216 CZ ARG A 102 -8.818 8.190 4.366 1.00 0.00 C ATOM 217 NH1 ARG A 102 -8.136 8.804 3.408 1.00 0.00 N ATOM 218 NH2 ARG A 102 -8.787 8.667 5.603 1.00 0.00 N ATOM 0 H ARG A 102 -7.981 4.603 1.433 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.688 3.042 3.020 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -9.983 4.978 0.729 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.385 4.045 1.213 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.674 5.899 2.546 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.744 4.897 3.642 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -8.663 6.069 2.490 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -9.841 7.281 2.029 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.044 6.656 4.854 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -8.157 8.442 2.455 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -7.591 9.638 3.625 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -9.310 8.199 6.343 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -8.240 9.502 5.814 1.00 0.00 H new ATOM 232 N MET A 103 -9.024 1.755 0.145 1.00 0.00 N ATOM 233 CA MET A 103 -9.244 0.603 -0.723 1.00 0.00 C ATOM 234 C MET A 103 -8.978 -0.710 0.011 1.00 0.00 C ATOM 235 O MET A 103 -9.510 -1.755 -0.363 1.00 0.00 O ATOM 236 CB MET A 103 -8.351 0.698 -1.961 1.00 0.00 C ATOM 237 CG MET A 103 -9.017 1.389 -3.140 1.00 0.00 C ATOM 238 SD MET A 103 -7.958 1.454 -4.597 1.00 0.00 S ATOM 239 CE MET A 103 -7.673 3.217 -4.731 1.00 0.00 C ATOM 0 H MET A 103 -8.190 2.298 -0.078 1.00 0.00 H new ATOM 0 HA MET A 103 -10.290 0.612 -1.029 1.00 0.00 H new ATOM 0 HB2 MET A 103 -7.440 1.238 -1.701 1.00 0.00 H new ATOM 0 HB3 MET A 103 -8.052 -0.306 -2.261 1.00 0.00 H new ATOM 0 HG2 MET A 103 -9.939 0.865 -3.389 1.00 0.00 H new ATOM 0 HG3 MET A 103 -9.295 2.403 -2.852 1.00 0.00 H new ATOM 0 HE1 MET A 103 -7.667 3.506 -5.782 1.00 0.00 H new ATOM 0 HE2 MET A 103 -8.467 3.754 -4.212 1.00 0.00 H new ATOM 0 HE3 MET A 103 -6.712 3.465 -4.281 1.00 0.00 H new ATOM 249 N PHE A 104 -8.149 -0.656 1.049 1.00 0.00 N ATOM 250 CA PHE A 104 -7.817 -1.851 1.819 1.00 0.00 C ATOM 251 C PHE A 104 -8.681 -1.957 3.071 1.00 0.00 C ATOM 252 O PHE A 104 -9.360 -2.961 3.286 1.00 0.00 O ATOM 253 CB PHE A 104 -6.338 -1.842 2.214 1.00 0.00 C ATOM 254 CG PHE A 104 -5.397 -1.948 1.048 1.00 0.00 C ATOM 255 CD1 PHE A 104 -5.446 -1.026 0.018 1.00 0.00 C ATOM 256 CD2 PHE A 104 -4.460 -2.967 0.985 1.00 0.00 C ATOM 257 CE1 PHE A 104 -4.580 -1.115 -1.053 1.00 0.00 C ATOM 258 CE2 PHE A 104 -3.590 -3.061 -0.085 1.00 0.00 C ATOM 259 CZ PHE A 104 -3.650 -2.133 -1.105 1.00 0.00 C ATOM 0 H PHE A 104 -7.696 0.198 1.376 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.014 -2.717 1.187 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.123 -0.923 2.760 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -6.149 -2.670 2.897 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -6.171 -0.226 0.052 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -4.409 -3.696 1.781 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.630 -0.388 -1.850 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -2.864 -3.860 -0.123 1.00 0.00 H new ATOM 0 HZ PHE A 104 -2.971 -2.204 -1.942 1.00 0.00 H new ATOM 269 N ASP A 105 -8.644 -0.919 3.901 1.00 0.00 N ATOM 270 CA ASP A 105 -9.418 -0.900 5.138 1.00 0.00 C ATOM 271 C ASP A 105 -10.890 -1.219 4.877 1.00 0.00 C ATOM 272 O ASP A 105 -11.324 -2.358 5.049 1.00 0.00 O ATOM 273 CB ASP A 105 -9.284 0.462 5.828 1.00 0.00 C ATOM 274 CG ASP A 105 -8.514 0.374 7.131 1.00 0.00 C ATOM 275 OD1 ASP A 105 -8.515 -0.710 7.749 1.00 0.00 O ATOM 276 OD2 ASP A 105 -7.911 1.391 7.532 1.00 0.00 O ATOM 0 H ASP A 105 -8.087 -0.080 3.740 1.00 0.00 H new ATOM 0 HA ASP A 105 -9.018 -1.672 5.796 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -8.781 1.158 5.157 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -10.277 0.868 6.022 1.00 0.00 H new ATOM 281 N LYS A 106 -11.655 -0.208 4.469 1.00 0.00 N ATOM 282 CA LYS A 106 -13.079 -0.386 4.192 1.00 0.00 C ATOM 283 C LYS A 106 -13.843 -0.779 5.455 1.00 0.00 C ATOM 284 O LYS A 106 -15.007 -1.175 5.389 1.00 0.00 O ATOM 285 CB LYS A 106 -13.277 -1.453 3.120 1.00 0.00 C ATOM 286 CG LYS A 106 -13.302 -0.899 1.704 1.00 0.00 C ATOM 287 CD LYS A 106 -12.074 -1.324 0.913 1.00 0.00 C ATOM 288 CE LYS A 106 -12.408 -2.413 -0.094 1.00 0.00 C ATOM 289 NZ LYS A 106 -13.186 -3.522 0.524 1.00 0.00 N ATOM 0 H LYS A 106 -11.313 0.742 4.323 1.00 0.00 H new ATOM 0 HA LYS A 106 -13.472 0.566 3.834 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -12.476 -2.188 3.199 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -14.212 -1.979 3.312 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -14.201 -1.244 1.194 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -13.354 0.189 1.740 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -11.659 -0.461 0.393 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -11.306 -1.683 1.598 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -12.979 -1.983 -0.917 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -11.486 -2.809 -0.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -12.998 -4.406 0.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -12.903 -3.633 1.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -14.201 -3.303 0.476 1.00 0.00 H new ATOM 303 N ASN A 107 -13.181 -0.673 6.601 1.00 0.00 N ATOM 304 CA ASN A 107 -13.792 -1.021 7.878 1.00 0.00 C ATOM 305 C ASN A 107 -13.982 0.215 8.759 1.00 0.00 C ATOM 306 O ASN A 107 -14.505 0.118 9.869 1.00 0.00 O ATOM 307 CB ASN A 107 -12.925 -2.053 8.603 1.00 0.00 C ATOM 308 CG ASN A 107 -13.487 -2.442 9.957 1.00 0.00 C ATOM 309 OD1 ASN A 107 -14.698 -2.405 10.174 1.00 0.00 O ATOM 310 ND2 ASN A 107 -12.605 -2.817 10.877 1.00 0.00 N ATOM 0 H ASN A 107 -12.217 -0.347 6.672 1.00 0.00 H new ATOM 0 HA ASN A 107 -14.776 -1.446 7.680 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -12.833 -2.944 7.983 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -11.920 -1.650 8.733 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -12.923 -3.089 11.807 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -11.610 -2.833 10.653 1.00 0.00 H new ATOM 317 N ALA A 108 -13.555 1.375 8.263 1.00 0.00 N ATOM 318 CA ALA A 108 -13.683 2.619 9.013 1.00 0.00 C ATOM 319 C ALA A 108 -12.861 2.573 10.297 1.00 0.00 C ATOM 320 O ALA A 108 -13.289 3.073 11.338 1.00 0.00 O ATOM 321 CB ALA A 108 -15.145 2.898 9.328 1.00 0.00 C ATOM 0 H ALA A 108 -13.119 1.477 7.347 1.00 0.00 H new ATOM 0 HA ALA A 108 -13.296 3.429 8.394 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -15.225 3.830 9.888 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -15.708 2.984 8.398 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -15.551 2.081 9.924 1.00 0.00 H new ATOM 327 N ASP A 109 -11.679 1.971 10.217 1.00 0.00 N ATOM 328 CA ASP A 109 -10.796 1.861 11.373 1.00 0.00 C ATOM 329 C ASP A 109 -9.496 2.623 11.138 1.00 0.00 C ATOM 330 O ASP A 109 -9.041 3.374 12.000 1.00 0.00 O ATOM 331 CB ASP A 109 -10.494 0.392 11.674 1.00 0.00 C ATOM 332 CG ASP A 109 -9.810 -0.307 10.516 1.00 0.00 C ATOM 333 OD1 ASP A 109 -10.325 -0.218 9.381 1.00 0.00 O ATOM 334 OD2 ASP A 109 -8.760 -0.944 10.743 1.00 0.00 O ATOM 0 H ASP A 109 -11.310 1.552 9.364 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.304 2.302 12.231 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -9.860 0.328 12.559 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -11.424 -0.126 11.910 1.00 0.00 H new ATOM 339 N GLY A 110 -8.903 2.425 9.964 1.00 0.00 N ATOM 340 CA GLY A 110 -7.663 3.104 9.639 1.00 0.00 C ATOM 341 C GLY A 110 -6.439 2.262 9.945 1.00 0.00 C ATOM 342 O GLY A 110 -5.373 2.797 10.249 1.00 0.00 O ATOM 0 H GLY A 110 -9.259 1.808 9.234 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -7.663 3.367 8.581 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -7.607 4.037 10.199 1.00 0.00 H new ATOM 346 N TYR A 111 -6.589 0.943 9.865 1.00 0.00 N ATOM 347 CA TYR A 111 -5.480 0.034 10.137 1.00 0.00 C ATOM 348 C TYR A 111 -5.480 -1.142 9.162 1.00 0.00 C ATOM 349 O TYR A 111 -6.533 -1.704 8.860 1.00 0.00 O ATOM 350 CB TYR A 111 -5.561 -0.491 11.574 1.00 0.00 C ATOM 351 CG TYR A 111 -5.997 0.550 12.582 1.00 0.00 C ATOM 352 CD1 TYR A 111 -5.273 1.721 12.757 1.00 0.00 C ATOM 353 CD2 TYR A 111 -7.133 0.358 13.359 1.00 0.00 C ATOM 354 CE1 TYR A 111 -5.668 2.674 13.676 1.00 0.00 C ATOM 355 CE2 TYR A 111 -7.535 1.306 14.280 1.00 0.00 C ATOM 356 CZ TYR A 111 -6.800 2.462 14.436 1.00 0.00 C ATOM 357 OH TYR A 111 -7.196 3.408 15.352 1.00 0.00 O ATOM 0 H TYR A 111 -7.464 0.481 9.615 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.553 0.593 10.008 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.258 -1.328 11.606 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -4.584 -0.878 11.865 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -4.386 1.890 12.165 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.711 -0.547 13.241 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -5.094 3.580 13.799 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -8.421 1.142 14.875 1.00 0.00 H new ATOM 0 HH TYR A 111 -8.012 3.106 15.803 1.00 0.00 H new ATOM 367 N ILE A 112 -4.295 -1.521 8.678 1.00 0.00 N ATOM 368 CA ILE A 112 -4.184 -2.642 7.747 1.00 0.00 C ATOM 369 C ILE A 112 -3.376 -3.781 8.359 1.00 0.00 C ATOM 370 O ILE A 112 -2.259 -3.580 8.836 1.00 0.00 O ATOM 371 CB ILE A 112 -3.531 -2.227 6.412 1.00 0.00 C ATOM 372 CG1 ILE A 112 -4.156 -0.927 5.890 1.00 0.00 C ATOM 373 CG2 ILE A 112 -3.670 -3.348 5.388 1.00 0.00 C ATOM 374 CD1 ILE A 112 -3.841 -0.631 4.435 1.00 0.00 C ATOM 0 H ILE A 112 -3.409 -1.073 8.913 1.00 0.00 H new ATOM 0 HA ILE A 112 -5.202 -2.977 7.546 1.00 0.00 H new ATOM 0 HB ILE A 112 -2.469 -2.046 6.581 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -5.238 -0.981 6.013 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.806 -0.096 6.503 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -3.206 -3.044 4.450 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -3.178 -4.246 5.762 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.726 -3.557 5.219 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.319 0.304 4.142 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.762 -0.543 4.307 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -4.216 -1.441 3.810 1.00 0.00 H new ATOM 386 N ASP A 113 -3.949 -4.979 8.346 1.00 0.00 N ATOM 387 CA ASP A 113 -3.283 -6.151 8.903 1.00 0.00 C ATOM 388 C ASP A 113 -3.314 -7.314 7.916 1.00 0.00 C ATOM 389 O ASP A 113 -3.626 -7.134 6.739 1.00 0.00 O ATOM 390 CB ASP A 113 -3.947 -6.561 10.220 1.00 0.00 C ATOM 391 CG ASP A 113 -2.934 -6.848 11.311 1.00 0.00 C ATOM 392 OD1 ASP A 113 -1.848 -7.374 10.989 1.00 0.00 O ATOM 393 OD2 ASP A 113 -3.227 -6.547 12.487 1.00 0.00 O ATOM 0 H ASP A 113 -4.873 -5.165 7.956 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.242 -5.892 9.096 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -4.617 -5.767 10.549 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -4.560 -7.447 10.055 1.00 0.00 H new ATOM 398 N LEU A 114 -2.987 -8.508 8.403 1.00 0.00 N ATOM 399 CA LEU A 114 -2.977 -9.702 7.564 1.00 0.00 C ATOM 400 C LEU A 114 -4.309 -9.874 6.839 1.00 0.00 C ATOM 401 O LEU A 114 -4.359 -10.413 5.733 1.00 0.00 O ATOM 402 CB LEU A 114 -2.680 -10.941 8.410 1.00 0.00 C ATOM 403 CG LEU A 114 -1.222 -11.091 8.849 1.00 0.00 C ATOM 404 CD1 LEU A 114 -0.953 -10.263 10.096 1.00 0.00 C ATOM 405 CD2 LEU A 114 -0.889 -12.554 9.095 1.00 0.00 C ATOM 0 H LEU A 114 -2.725 -8.674 9.375 1.00 0.00 H new ATOM 0 HA LEU A 114 -2.193 -9.582 6.817 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -3.310 -10.915 9.299 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -2.966 -11.827 7.843 1.00 0.00 H new ATOM 0 HG LEU A 114 -0.580 -10.723 8.049 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.089 -10.382 10.394 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -1.153 -9.212 9.885 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -1.602 -10.601 10.904 1.00 0.00 H new ATOM 0 HD21 LEU A 114 0.152 -12.643 9.406 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -1.537 -12.948 9.878 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -1.043 -13.121 8.177 1.00 0.00 H new ATOM 417 N GLU A 115 -5.384 -9.408 7.467 1.00 0.00 N ATOM 418 CA GLU A 115 -6.714 -9.508 6.878 1.00 0.00 C ATOM 419 C GLU A 115 -6.842 -8.585 5.671 1.00 0.00 C ATOM 420 O GLU A 115 -7.299 -8.999 4.606 1.00 0.00 O ATOM 421 CB GLU A 115 -7.782 -9.162 7.916 1.00 0.00 C ATOM 422 CG GLU A 115 -9.162 -9.643 7.510 1.00 0.00 C ATOM 423 OE1 GLU A 115 -9.405 -9.790 6.294 1.00 0.00 O ATOM 424 OE2 GLU A 115 -9.998 -9.874 8.408 1.00 0.00 O ATOM 0 H GLU A 115 -5.360 -8.958 8.382 1.00 0.00 H new ATOM 0 HA GLU A 115 -6.862 -10.535 6.546 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -7.512 -9.608 8.873 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -7.805 -8.082 8.063 1.00 0.00 H new ATOM 429 N GLU A 116 -6.432 -7.332 5.845 1.00 0.00 N ATOM 430 CA GLU A 116 -6.498 -6.350 4.769 1.00 0.00 C ATOM 431 C GLU A 116 -5.376 -6.575 3.762 1.00 0.00 C ATOM 432 O GLU A 116 -5.521 -6.266 2.580 1.00 0.00 O ATOM 433 CB GLU A 116 -6.418 -4.932 5.336 1.00 0.00 C ATOM 434 CG GLU A 116 -7.777 -4.325 5.647 1.00 0.00 C ATOM 435 CD GLU A 116 -8.083 -4.308 7.131 1.00 0.00 C ATOM 436 OE1 GLU A 116 -7.178 -3.961 7.920 1.00 0.00 O ATOM 437 OE2 GLU A 116 -9.227 -4.640 7.506 1.00 0.00 O ATOM 0 H GLU A 116 -6.051 -6.973 6.721 1.00 0.00 H new ATOM 0 HA GLU A 116 -7.452 -6.472 4.256 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.819 -4.947 6.246 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.898 -4.293 4.622 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.812 -3.306 5.261 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -8.551 -4.890 5.127 1.00 0.00 H new ATOM 444 N LEU A 117 -4.257 -7.120 4.233 1.00 0.00 N ATOM 445 CA LEU A 117 -3.118 -7.387 3.362 1.00 0.00 C ATOM 446 C LEU A 117 -3.526 -8.310 2.221 1.00 0.00 C ATOM 447 O LEU A 117 -2.990 -8.224 1.117 1.00 0.00 O ATOM 448 CB LEU A 117 -1.963 -7.998 4.156 1.00 0.00 C ATOM 449 CG LEU A 117 -0.878 -7.003 4.578 1.00 0.00 C ATOM 450 CD1 LEU A 117 -0.979 -6.695 6.064 1.00 0.00 C ATOM 451 CD2 LEU A 117 0.503 -7.540 4.236 1.00 0.00 C ATOM 0 H LEU A 117 -4.116 -7.384 5.208 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.780 -6.441 2.939 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.367 -8.475 5.049 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.503 -8.783 3.556 1.00 0.00 H new ATOM 0 HG LEU A 117 -1.032 -6.076 4.026 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.199 -5.986 6.343 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.956 -6.263 6.280 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.854 -7.615 6.636 1.00 0.00 H new ATOM 0 HD21 LEU A 117 1.260 -6.819 4.544 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.666 -8.483 4.758 1.00 0.00 H new ATOM 0 HD23 LEU A 117 0.574 -7.704 3.161 1.00 0.00 H new ATOM 463 N LYS A 118 -4.496 -9.181 2.485 1.00 0.00 N ATOM 464 CA LYS A 118 -4.988 -10.096 1.464 1.00 0.00 C ATOM 465 C LYS A 118 -5.408 -9.311 0.225 1.00 0.00 C ATOM 466 O LYS A 118 -5.372 -9.820 -0.895 1.00 0.00 O ATOM 467 CB LYS A 118 -6.169 -10.908 1.999 1.00 0.00 C ATOM 468 CG LYS A 118 -6.744 -11.884 0.987 1.00 0.00 C ATOM 469 CD LYS A 118 -8.048 -12.488 1.479 1.00 0.00 C ATOM 470 CE LYS A 118 -9.143 -11.438 1.587 1.00 0.00 C ATOM 471 NZ LYS A 118 -10.470 -12.047 1.881 1.00 0.00 N ATOM 0 H LYS A 118 -4.954 -9.271 3.392 1.00 0.00 H new ATOM 0 HA LYS A 118 -4.188 -10.786 1.195 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -5.849 -11.460 2.883 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -6.955 -10.223 2.318 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -6.913 -11.371 0.040 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -6.023 -12.678 0.795 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -8.365 -13.277 0.797 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -7.891 -12.953 2.452 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -8.888 -10.727 2.373 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -9.200 -10.876 0.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -11.189 -11.298 1.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -10.726 -12.707 1.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -10.423 -12.562 2.783 1.00 0.00 H new ATOM 485 N ILE A 119 -5.791 -8.055 0.445 1.00 0.00 N ATOM 486 CA ILE A 119 -6.204 -7.170 -0.633 1.00 0.00 C ATOM 487 C ILE A 119 -5.045 -6.924 -1.596 1.00 0.00 C ATOM 488 O ILE A 119 -5.254 -6.645 -2.776 1.00 0.00 O ATOM 489 CB ILE A 119 -6.718 -5.826 -0.064 1.00 0.00 C ATOM 490 CG1 ILE A 119 -7.976 -6.067 0.773 1.00 0.00 C ATOM 491 CG2 ILE A 119 -7.004 -4.822 -1.174 1.00 0.00 C ATOM 492 CD1 ILE A 119 -8.162 -5.068 1.892 1.00 0.00 C ATOM 0 H ILE A 119 -5.823 -7.628 1.371 1.00 0.00 H new ATOM 0 HA ILE A 119 -7.016 -7.651 -1.179 1.00 0.00 H new ATOM 0 HB ILE A 119 -5.937 -5.403 0.568 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -8.848 -6.034 0.120 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -7.933 -7.070 1.197 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -7.363 -3.890 -0.738 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.090 -4.631 -1.736 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -7.764 -5.226 -1.843 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -9.074 -5.302 2.441 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -7.309 -5.116 2.568 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -8.238 -4.064 1.475 1.00 0.00 H new ATOM 504 N MET A 120 -3.820 -7.040 -1.086 1.00 0.00 N ATOM 505 CA MET A 120 -2.630 -6.842 -1.905 1.00 0.00 C ATOM 506 C MET A 120 -2.522 -7.941 -2.956 1.00 0.00 C ATOM 507 O MET A 120 -2.048 -7.709 -4.068 1.00 0.00 O ATOM 508 CB MET A 120 -1.369 -6.834 -1.034 1.00 0.00 C ATOM 509 CG MET A 120 -1.530 -6.088 0.282 1.00 0.00 C ATOM 510 SD MET A 120 -0.403 -4.687 0.433 1.00 0.00 S ATOM 511 CE MET A 120 -1.215 -3.733 1.714 1.00 0.00 C ATOM 0 H MET A 120 -3.628 -7.270 -0.111 1.00 0.00 H new ATOM 0 HA MET A 120 -2.718 -5.877 -2.404 1.00 0.00 H new ATOM 0 HB2 MET A 120 -1.079 -7.863 -0.823 1.00 0.00 H new ATOM 0 HB3 MET A 120 -0.553 -6.382 -1.598 1.00 0.00 H new ATOM 0 HG2 MET A 120 -2.557 -5.734 0.370 1.00 0.00 H new ATOM 0 HG3 MET A 120 -1.358 -6.777 1.109 1.00 0.00 H new ATOM 0 HE1 MET A 120 -1.375 -2.714 1.362 1.00 0.00 H new ATOM 0 HE2 MET A 120 -2.175 -4.189 1.954 1.00 0.00 H new ATOM 0 HE3 MET A 120 -0.589 -3.715 2.606 1.00 0.00 H new ATOM 521 N LEU A 121 -2.968 -9.139 -2.591 1.00 0.00 N ATOM 522 CA LEU A 121 -2.926 -10.283 -3.497 1.00 0.00 C ATOM 523 C LEU A 121 -3.720 -10.003 -4.766 1.00 0.00 C ATOM 524 O LEU A 121 -3.236 -10.233 -5.875 1.00 0.00 O ATOM 525 CB LEU A 121 -3.475 -11.530 -2.805 1.00 0.00 C ATOM 526 CG LEU A 121 -2.818 -11.861 -1.466 1.00 0.00 C ATOM 527 CD1 LEU A 121 -3.578 -12.970 -0.757 1.00 0.00 C ATOM 528 CD2 LEU A 121 -1.363 -12.253 -1.672 1.00 0.00 C ATOM 0 H LEU A 121 -3.363 -9.343 -1.673 1.00 0.00 H new ATOM 0 HA LEU A 121 -1.886 -10.456 -3.772 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.545 -11.399 -2.646 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -3.354 -12.382 -3.474 1.00 0.00 H new ATOM 0 HG LEU A 121 -2.849 -10.972 -0.837 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -3.095 -13.191 0.195 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -4.604 -12.650 -0.577 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -3.581 -13.865 -1.379 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.909 -12.486 -0.709 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.310 -13.129 -2.319 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -0.826 -11.426 -2.136 1.00 0.00 H new ATOM 540 N GLN A 122 -4.939 -9.497 -4.601 1.00 0.00 N ATOM 541 CA GLN A 122 -5.792 -9.179 -5.741 1.00 0.00 C ATOM 542 C GLN A 122 -5.047 -8.291 -6.734 1.00 0.00 C ATOM 543 O GLN A 122 -5.335 -8.298 -7.931 1.00 0.00 O ATOM 544 CB GLN A 122 -7.072 -8.483 -5.269 1.00 0.00 C ATOM 545 CG GLN A 122 -8.340 -9.245 -5.617 1.00 0.00 C ATOM 546 CD GLN A 122 -8.634 -9.239 -7.105 1.00 0.00 C ATOM 547 OE1 GLN A 122 -8.107 -8.414 -7.850 1.00 0.00 O ATOM 548 NE2 GLN A 122 -9.481 -10.163 -7.544 1.00 0.00 N ATOM 0 H GLN A 122 -5.357 -9.299 -3.692 1.00 0.00 H new ATOM 0 HA GLN A 122 -6.062 -10.110 -6.240 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -7.025 -8.346 -4.189 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -7.121 -7.489 -5.714 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -8.246 -10.275 -5.273 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -9.182 -8.806 -5.082 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -9.895 -10.828 -6.890 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -9.718 -10.208 -8.535 1.00 0.00 H new ATOM 557 N ALA A 123 -4.082 -7.532 -6.224 1.00 0.00 N ATOM 558 CA ALA A 123 -3.285 -6.641 -7.055 1.00 0.00 C ATOM 559 C ALA A 123 -2.168 -7.400 -7.765 1.00 0.00 C ATOM 560 O ALA A 123 -1.654 -6.950 -8.789 1.00 0.00 O ATOM 561 CB ALA A 123 -2.704 -5.519 -6.209 1.00 0.00 C ATOM 0 H ALA A 123 -3.834 -7.518 -5.235 1.00 0.00 H new ATOM 0 HA ALA A 123 -3.937 -6.213 -7.817 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -2.110 -4.858 -6.840 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -3.514 -4.952 -5.751 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -2.071 -5.942 -5.429 1.00 0.00 H new ATOM 567 N THR A 124 -1.796 -8.556 -7.218 1.00 0.00 N ATOM 568 CA THR A 124 -0.742 -9.373 -7.805 1.00 0.00 C ATOM 569 C THR A 124 -1.319 -10.314 -8.853 1.00 0.00 C ATOM 570 O THR A 124 -0.899 -10.306 -10.010 1.00 0.00 O ATOM 571 CB THR A 124 -0.026 -10.181 -6.721 1.00 0.00 C ATOM 572 OG1 THR A 124 -0.812 -11.288 -6.318 1.00 0.00 O ATOM 573 CG2 THR A 124 0.295 -9.373 -5.483 1.00 0.00 C ATOM 0 H THR A 124 -2.210 -8.945 -6.371 1.00 0.00 H new ATOM 0 HA THR A 124 -0.023 -8.709 -8.284 1.00 0.00 H new ATOM 0 HB THR A 124 0.910 -10.505 -7.176 1.00 0.00 H new ATOM 0 HG1 THR A 124 -1.595 -10.970 -5.822 1.00 0.00 H new ATOM 0 HG21 THR A 124 0.802 -10.007 -4.756 1.00 0.00 H new ATOM 0 HG22 THR A 124 0.943 -8.539 -5.751 1.00 0.00 H new ATOM 0 HG23 THR A 124 -0.629 -8.990 -5.049 1.00 0.00 H new ATOM 581 N GLY A 125 -2.286 -11.122 -8.437 1.00 0.00 N ATOM 582 CA GLY A 125 -2.912 -12.059 -9.348 1.00 0.00 C ATOM 583 C GLY A 125 -2.220 -13.409 -9.368 1.00 0.00 C ATOM 584 O GLY A 125 -2.878 -14.450 -9.370 1.00 0.00 O ATOM 0 H GLY A 125 -2.648 -11.145 -7.484 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -3.955 -12.195 -9.063 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -2.908 -11.639 -10.354 1.00 0.00 H new ATOM 588 N GLU A 126 -0.890 -13.393 -9.384 1.00 0.00 N ATOM 589 CA GLU A 126 -0.108 -14.625 -9.407 1.00 0.00 C ATOM 590 C GLU A 126 -0.493 -15.542 -8.250 1.00 0.00 C ATOM 591 O GLU A 126 -1.411 -15.243 -7.486 1.00 0.00 O ATOM 592 CB GLU A 126 1.388 -14.305 -9.345 1.00 0.00 C ATOM 593 CG GLU A 126 2.225 -15.117 -10.319 1.00 0.00 C ATOM 594 CD GLU A 126 3.665 -15.263 -9.870 1.00 0.00 C ATOM 595 OE1 GLU A 126 4.195 -14.313 -9.255 1.00 0.00 O ATOM 596 OE2 GLU A 126 4.264 -16.327 -10.131 1.00 0.00 O ATOM 0 H GLU A 126 -0.331 -12.540 -9.381 1.00 0.00 H new ATOM 0 HA GLU A 126 -0.325 -15.143 -10.341 1.00 0.00 H new ATOM 0 HB2 GLU A 126 1.533 -13.244 -9.551 1.00 0.00 H new ATOM 0 HB3 GLU A 126 1.748 -14.485 -8.332 1.00 0.00 H new ATOM 0 HG2 GLU A 126 1.783 -16.106 -10.435 1.00 0.00 H new ATOM 0 HG3 GLU A 126 2.201 -14.640 -11.299 1.00 0.00 H new ATOM 603 N THR A 127 0.213 -16.662 -8.128 1.00 0.00 N ATOM 604 CA THR A 127 -0.057 -17.624 -7.066 1.00 0.00 C ATOM 605 C THR A 127 0.589 -17.187 -5.755 1.00 0.00 C ATOM 606 O THR A 127 1.772 -17.432 -5.523 1.00 0.00 O ATOM 607 CB THR A 127 0.453 -19.011 -7.459 1.00 0.00 C ATOM 608 OG1 THR A 127 -0.168 -19.453 -8.653 1.00 0.00 O ATOM 609 CG2 THR A 127 0.210 -20.063 -6.397 1.00 0.00 C ATOM 0 H THR A 127 0.976 -16.925 -8.752 1.00 0.00 H new ATOM 0 HA THR A 127 -1.136 -17.669 -6.922 1.00 0.00 H new ATOM 0 HB THR A 127 1.529 -18.896 -7.592 1.00 0.00 H new ATOM 0 HG1 THR A 127 0.172 -20.341 -8.889 1.00 0.00 H new ATOM 0 HG21 THR A 127 0.596 -21.023 -6.741 1.00 0.00 H new ATOM 0 HG22 THR A 127 0.719 -19.776 -5.477 1.00 0.00 H new ATOM 0 HG23 THR A 127 -0.860 -20.149 -6.208 1.00 0.00 H new ATOM 617 N ILE A 128 -0.199 -16.546 -4.901 1.00 0.00 N ATOM 618 CA ILE A 128 0.292 -16.083 -3.610 1.00 0.00 C ATOM 619 C ILE A 128 -0.786 -16.216 -2.542 1.00 0.00 C ATOM 620 O ILE A 128 -1.979 -16.137 -2.835 1.00 0.00 O ATOM 621 CB ILE A 128 0.779 -14.619 -3.683 1.00 0.00 C ATOM 622 CG1 ILE A 128 2.027 -14.526 -4.560 1.00 0.00 C ATOM 623 CG2 ILE A 128 1.073 -14.070 -2.292 1.00 0.00 C ATOM 624 CD1 ILE A 128 3.167 -15.392 -4.070 1.00 0.00 C ATOM 0 H ILE A 128 -1.181 -16.335 -5.079 1.00 0.00 H new ATOM 0 HA ILE A 128 1.139 -16.713 -3.340 1.00 0.00 H new ATOM 0 HB ILE A 128 -0.015 -14.017 -4.124 1.00 0.00 H new ATOM 0 HG12 ILE A 128 1.770 -14.817 -5.578 1.00 0.00 H new ATOM 0 HG13 ILE A 128 2.359 -13.488 -4.600 1.00 0.00 H new ATOM 0 HG21 ILE A 128 1.414 -13.038 -2.373 1.00 0.00 H new ATOM 0 HG22 ILE A 128 0.167 -14.106 -1.687 1.00 0.00 H new ATOM 0 HG23 ILE A 128 1.849 -14.673 -1.820 1.00 0.00 H new ATOM 0 HD11 ILE A 128 4.022 -15.280 -4.737 1.00 0.00 H new ATOM 0 HD12 ILE A 128 3.450 -15.086 -3.063 1.00 0.00 H new ATOM 0 HD13 ILE A 128 2.852 -16.435 -4.057 1.00 0.00 H new ATOM 636 N THR A 129 -0.356 -16.427 -1.303 1.00 0.00 N ATOM 637 CA THR A 129 -1.286 -16.582 -0.192 1.00 0.00 C ATOM 638 C THR A 129 -0.542 -16.771 1.127 1.00 0.00 C ATOM 639 O THR A 129 0.304 -17.656 1.253 1.00 0.00 O ATOM 640 CB THR A 129 -2.207 -17.779 -0.445 1.00 0.00 C ATOM 641 OG1 THR A 129 -2.825 -18.203 0.758 1.00 0.00 O ATOM 642 CG2 THR A 129 -1.486 -18.973 -1.039 1.00 0.00 C ATOM 0 H THR A 129 0.628 -16.494 -1.044 1.00 0.00 H new ATOM 0 HA THR A 129 -1.883 -15.673 -0.120 1.00 0.00 H new ATOM 0 HB THR A 129 -2.947 -17.427 -1.163 1.00 0.00 H new ATOM 0 HG1 THR A 129 -2.282 -18.904 1.175 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.195 -19.786 -1.194 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.042 -18.692 -1.994 1.00 0.00 H new ATOM 0 HG23 THR A 129 -0.701 -19.300 -0.357 1.00 0.00 H new ATOM 650 N GLU A 130 -0.872 -15.938 2.111 1.00 0.00 N ATOM 651 CA GLU A 130 -0.247 -16.012 3.431 1.00 0.00 C ATOM 652 C GLU A 130 1.214 -15.571 3.386 1.00 0.00 C ATOM 653 O GLU A 130 1.597 -14.603 4.043 1.00 0.00 O ATOM 654 CB GLU A 130 -0.345 -17.434 3.989 1.00 0.00 C ATOM 655 CG GLU A 130 -1.736 -18.036 3.881 1.00 0.00 C ATOM 656 CD GLU A 130 -1.711 -19.548 3.765 1.00 0.00 C ATOM 657 OE1 GLU A 130 -0.938 -20.188 4.509 1.00 0.00 O ATOM 658 OE2 GLU A 130 -2.464 -20.092 2.930 1.00 0.00 O ATOM 0 H GLU A 130 -1.571 -15.201 2.019 1.00 0.00 H new ATOM 0 HA GLU A 130 -0.786 -15.329 4.088 1.00 0.00 H new ATOM 0 HB2 GLU A 130 0.360 -18.073 3.458 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.042 -17.426 5.036 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -2.319 -17.752 4.757 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -2.242 -17.617 3.011 1.00 0.00 H new ATOM 665 N ASP A 131 2.028 -16.291 2.617 1.00 0.00 N ATOM 666 CA ASP A 131 3.453 -15.983 2.494 1.00 0.00 C ATOM 667 C ASP A 131 3.695 -14.483 2.326 1.00 0.00 C ATOM 668 O ASP A 131 4.229 -13.828 3.221 1.00 0.00 O ATOM 669 CB ASP A 131 4.056 -16.741 1.311 1.00 0.00 C ATOM 670 CG ASP A 131 4.623 -18.088 1.717 1.00 0.00 C ATOM 671 OD1 ASP A 131 5.386 -18.137 2.704 1.00 0.00 O ATOM 672 OD2 ASP A 131 4.305 -19.092 1.046 1.00 0.00 O ATOM 0 H ASP A 131 1.725 -17.095 2.067 1.00 0.00 H new ATOM 0 HA ASP A 131 3.939 -16.300 3.417 1.00 0.00 H new ATOM 0 HB2 ASP A 131 3.291 -16.887 0.548 1.00 0.00 H new ATOM 0 HB3 ASP A 131 4.845 -16.138 0.861 1.00 0.00 H new ATOM 677 N ASP A 132 3.305 -13.947 1.174 1.00 0.00 N ATOM 678 CA ASP A 132 3.488 -12.527 0.892 1.00 0.00 C ATOM 679 C ASP A 132 2.812 -11.660 1.951 1.00 0.00 C ATOM 680 O ASP A 132 3.296 -10.578 2.280 1.00 0.00 O ATOM 681 CB ASP A 132 2.931 -12.184 -0.490 1.00 0.00 C ATOM 682 CG ASP A 132 3.715 -12.842 -1.608 1.00 0.00 C ATOM 683 OD1 ASP A 132 4.202 -13.974 -1.406 1.00 0.00 O ATOM 684 OD2 ASP A 132 3.842 -12.225 -2.687 1.00 0.00 O ATOM 0 H ASP A 132 2.861 -14.473 0.421 1.00 0.00 H new ATOM 0 HA ASP A 132 4.558 -12.320 0.911 1.00 0.00 H new ATOM 0 HB2 ASP A 132 1.889 -12.498 -0.547 1.00 0.00 H new ATOM 0 HB3 ASP A 132 2.946 -11.103 -0.627 1.00 0.00 H new ATOM 689 N ILE A 133 1.690 -12.138 2.478 1.00 0.00 N ATOM 690 CA ILE A 133 0.951 -11.400 3.494 1.00 0.00 C ATOM 691 C ILE A 133 1.731 -11.321 4.804 1.00 0.00 C ATOM 692 O ILE A 133 1.734 -10.289 5.474 1.00 0.00 O ATOM 693 CB ILE A 133 -0.423 -12.043 3.760 1.00 0.00 C ATOM 694 CG1 ILE A 133 -1.174 -12.234 2.434 1.00 0.00 C ATOM 695 CG2 ILE A 133 -1.225 -11.187 4.733 1.00 0.00 C ATOM 696 CD1 ILE A 133 -2.683 -12.220 2.566 1.00 0.00 C ATOM 0 H ILE A 133 1.273 -13.032 2.218 1.00 0.00 H new ATOM 0 HA ILE A 133 0.805 -10.391 3.108 1.00 0.00 H new ATOM 0 HB ILE A 133 -0.282 -13.023 4.216 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -0.874 -11.446 1.743 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -0.868 -13.181 1.990 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -2.194 -11.652 4.913 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -0.683 -11.102 5.675 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -1.372 -10.194 4.308 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -3.135 -12.361 1.584 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -2.998 -13.025 3.230 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -3.003 -11.263 2.979 1.00 0.00 H new ATOM 708 N GLU A 134 2.388 -12.417 5.167 1.00 0.00 N ATOM 709 CA GLU A 134 3.166 -12.468 6.400 1.00 0.00 C ATOM 710 C GLU A 134 4.492 -11.730 6.244 1.00 0.00 C ATOM 711 O GLU A 134 5.026 -11.183 7.209 1.00 0.00 O ATOM 712 CB GLU A 134 3.422 -13.920 6.805 1.00 0.00 C ATOM 713 CG GLU A 134 2.211 -14.604 7.418 1.00 0.00 C ATOM 714 CD GLU A 134 2.553 -15.935 8.057 1.00 0.00 C ATOM 715 OE1 GLU A 134 3.168 -16.781 7.374 1.00 0.00 O ATOM 716 OE2 GLU A 134 2.208 -16.132 9.241 1.00 0.00 O ATOM 0 H GLU A 134 2.398 -13.282 4.626 1.00 0.00 H new ATOM 0 HA GLU A 134 2.589 -11.974 7.182 1.00 0.00 H new ATOM 0 HB2 GLU A 134 3.741 -14.482 5.927 1.00 0.00 H new ATOM 0 HB3 GLU A 134 4.245 -13.949 7.519 1.00 0.00 H new ATOM 0 HG2 GLU A 134 1.769 -13.948 8.168 1.00 0.00 H new ATOM 0 HG3 GLU A 134 1.457 -14.759 6.646 1.00 0.00 H new ATOM 723 N GLU A 135 5.022 -11.723 5.025 1.00 0.00 N ATOM 724 CA GLU A 135 6.289 -11.056 4.746 1.00 0.00 C ATOM 725 C GLU A 135 6.079 -9.577 4.436 1.00 0.00 C ATOM 726 O GLU A 135 6.852 -8.726 4.876 1.00 0.00 O ATOM 727 CB GLU A 135 6.998 -11.737 3.574 1.00 0.00 C ATOM 728 CG GLU A 135 7.401 -13.175 3.859 1.00 0.00 C ATOM 729 CD GLU A 135 8.378 -13.288 5.013 1.00 0.00 C ATOM 730 OE1 GLU A 135 7.962 -13.057 6.168 1.00 0.00 O ATOM 731 OE2 GLU A 135 9.559 -13.607 4.762 1.00 0.00 O ATOM 0 H GLU A 135 4.594 -12.171 4.215 1.00 0.00 H new ATOM 0 HA GLU A 135 6.911 -11.133 5.638 1.00 0.00 H new ATOM 0 HB2 GLU A 135 6.343 -11.718 2.703 1.00 0.00 H new ATOM 0 HB3 GLU A 135 7.888 -11.163 3.316 1.00 0.00 H new ATOM 0 HG2 GLU A 135 6.510 -13.761 4.084 1.00 0.00 H new ATOM 0 HG3 GLU A 135 7.849 -13.607 2.964 1.00 0.00 H new ATOM 738 N LEU A 136 5.034 -9.279 3.673 1.00 0.00 N ATOM 739 CA LEU A 136 4.728 -7.902 3.300 1.00 0.00 C ATOM 740 C LEU A 136 4.350 -7.072 4.522 1.00 0.00 C ATOM 741 O LEU A 136 4.937 -6.022 4.779 1.00 0.00 O ATOM 742 CB LEU A 136 3.589 -7.868 2.279 1.00 0.00 C ATOM 743 CG LEU A 136 3.153 -6.469 1.839 1.00 0.00 C ATOM 744 CD1 LEU A 136 4.366 -5.596 1.568 1.00 0.00 C ATOM 745 CD2 LEU A 136 2.265 -6.550 0.607 1.00 0.00 C ATOM 0 H LEU A 136 4.384 -9.971 3.300 1.00 0.00 H new ATOM 0 HA LEU A 136 5.624 -7.470 2.854 1.00 0.00 H new ATOM 0 HB2 LEU A 136 3.896 -8.430 1.397 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.727 -8.384 2.702 1.00 0.00 H new ATOM 0 HG LEU A 136 2.577 -6.016 2.646 1.00 0.00 H new ATOM 0 HD11 LEU A 136 4.038 -4.604 1.256 1.00 0.00 H new ATOM 0 HD12 LEU A 136 4.964 -5.512 2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.968 -6.045 0.778 1.00 0.00 H new ATOM 0 HD21 LEU A 136 1.965 -5.546 0.308 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.815 -7.021 -0.208 1.00 0.00 H new ATOM 0 HD23 LEU A 136 1.378 -7.141 0.836 1.00 0.00 H new ATOM 757 N MET A 137 3.359 -7.552 5.266 1.00 0.00 N ATOM 758 CA MET A 137 2.882 -6.863 6.464 1.00 0.00 C ATOM 759 C MET A 137 4.043 -6.381 7.332 1.00 0.00 C ATOM 760 O MET A 137 3.966 -5.321 7.954 1.00 0.00 O ATOM 761 CB MET A 137 1.977 -7.788 7.279 1.00 0.00 C ATOM 762 CG MET A 137 1.219 -7.076 8.388 1.00 0.00 C ATOM 763 SD MET A 137 2.128 -7.050 9.945 1.00 0.00 S ATOM 764 CE MET A 137 1.248 -5.765 10.828 1.00 0.00 C ATOM 0 H MET A 137 2.867 -8.421 5.060 1.00 0.00 H new ATOM 0 HA MET A 137 2.315 -5.990 6.141 1.00 0.00 H new ATOM 0 HB2 MET A 137 1.261 -8.265 6.609 1.00 0.00 H new ATOM 0 HB3 MET A 137 2.582 -8.582 7.716 1.00 0.00 H new ATOM 0 HG2 MET A 137 1.007 -6.053 8.079 1.00 0.00 H new ATOM 0 HG3 MET A 137 0.259 -7.569 8.541 1.00 0.00 H new ATOM 0 HE1 MET A 137 1.875 -5.382 11.633 1.00 0.00 H new ATOM 0 HE2 MET A 137 1.003 -4.954 10.142 1.00 0.00 H new ATOM 0 HE3 MET A 137 0.330 -6.175 11.248 1.00 0.00 H new ATOM 774 N LYS A 138 5.117 -7.164 7.370 1.00 0.00 N ATOM 775 CA LYS A 138 6.290 -6.811 8.163 1.00 0.00 C ATOM 776 C LYS A 138 6.814 -5.429 7.780 1.00 0.00 C ATOM 777 O LYS A 138 7.474 -4.762 8.577 1.00 0.00 O ATOM 778 CB LYS A 138 7.390 -7.860 7.977 1.00 0.00 C ATOM 779 CG LYS A 138 7.895 -8.448 9.285 1.00 0.00 C ATOM 780 CD LYS A 138 9.208 -9.188 9.093 1.00 0.00 C ATOM 781 CE LYS A 138 10.075 -9.116 10.339 1.00 0.00 C ATOM 782 NZ LYS A 138 11.183 -10.111 10.304 1.00 0.00 N ATOM 0 H LYS A 138 5.199 -8.045 6.862 1.00 0.00 H new ATOM 0 HA LYS A 138 5.995 -6.786 9.212 1.00 0.00 H new ATOM 0 HB2 LYS A 138 7.010 -8.665 7.348 1.00 0.00 H new ATOM 0 HB3 LYS A 138 8.226 -7.407 7.444 1.00 0.00 H new ATOM 0 HG2 LYS A 138 8.029 -7.650 10.016 1.00 0.00 H new ATOM 0 HG3 LYS A 138 7.148 -9.130 9.691 1.00 0.00 H new ATOM 0 HD2 LYS A 138 9.007 -10.231 8.848 1.00 0.00 H new ATOM 0 HD3 LYS A 138 9.748 -8.761 8.248 1.00 0.00 H new ATOM 0 HE2 LYS A 138 10.491 -8.113 10.434 1.00 0.00 H new ATOM 0 HE3 LYS A 138 9.458 -9.290 11.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 11.751 -10.029 11.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 10.786 -11.070 10.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 11.787 -9.929 9.477 1.00 0.00 H new ATOM 796 N ASP A 139 6.515 -5.005 6.556 1.00 0.00 N ATOM 797 CA ASP A 139 6.953 -3.704 6.066 1.00 0.00 C ATOM 798 C ASP A 139 5.961 -2.612 6.451 1.00 0.00 C ATOM 799 O ASP A 139 6.345 -1.568 6.977 1.00 0.00 O ATOM 800 CB ASP A 139 7.118 -3.739 4.547 1.00 0.00 C ATOM 801 CG ASP A 139 8.263 -2.868 4.069 1.00 0.00 C ATOM 802 OD1 ASP A 139 8.400 -1.735 4.577 1.00 0.00 O ATOM 803 OD2 ASP A 139 9.023 -3.318 3.185 1.00 0.00 O ATOM 0 H ASP A 139 5.970 -5.545 5.884 1.00 0.00 H new ATOM 0 HA ASP A 139 7.914 -3.477 6.528 1.00 0.00 H new ATOM 0 HB2 ASP A 139 7.289 -4.767 4.227 1.00 0.00 H new ATOM 0 HB3 ASP A 139 6.192 -3.408 4.076 1.00 0.00 H new ATOM 808 N GLY A 140 4.681 -2.860 6.182 1.00 0.00 N ATOM 809 CA GLY A 140 3.651 -1.887 6.504 1.00 0.00 C ATOM 810 C GLY A 140 3.759 -1.370 7.924 1.00 0.00 C ATOM 811 O GLY A 140 3.997 -0.182 8.143 1.00 0.00 O ATOM 0 H GLY A 140 4.339 -3.717 5.747 1.00 0.00 H new ATOM 0 HA2 GLY A 140 3.719 -1.049 5.810 1.00 0.00 H new ATOM 0 HA3 GLY A 140 2.670 -2.341 6.360 1.00 0.00 H new ATOM 815 N ASP A 141 3.578 -2.261 8.890 1.00 0.00 N ATOM 816 CA ASP A 141 3.650 -1.886 10.296 1.00 0.00 C ATOM 817 C ASP A 141 5.099 -1.731 10.748 1.00 0.00 C ATOM 818 O ASP A 141 5.580 -0.615 10.944 1.00 0.00 O ATOM 819 CB ASP A 141 2.933 -2.926 11.158 1.00 0.00 C ATOM 820 CG ASP A 141 2.914 -2.546 12.625 1.00 0.00 C ATOM 821 OD1 ASP A 141 2.745 -1.345 12.924 1.00 0.00 O ATOM 822 OD2 ASP A 141 3.068 -3.448 13.475 1.00 0.00 O ATOM 0 H ASP A 141 3.380 -3.248 8.726 1.00 0.00 H new ATOM 0 HA ASP A 141 3.153 -0.923 10.417 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.909 -3.045 10.803 1.00 0.00 H new ATOM 0 HB3 ASP A 141 3.425 -3.892 11.042 1.00 0.00 H new ATOM 827 N LYS A 142 5.790 -2.854 10.912 1.00 0.00 N ATOM 828 CA LYS A 142 7.185 -2.838 11.342 1.00 0.00 C ATOM 829 C LYS A 142 7.350 -2.065 12.647 1.00 0.00 C ATOM 830 O LYS A 142 8.410 -1.499 12.914 1.00 0.00 O ATOM 831 CB LYS A 142 8.066 -2.218 10.255 1.00 0.00 C ATOM 832 CG LYS A 142 9.556 -2.398 10.503 1.00 0.00 C ATOM 833 CD LYS A 142 10.328 -1.111 10.247 1.00 0.00 C ATOM 834 CE LYS A 142 11.206 -1.223 9.011 1.00 0.00 C ATOM 835 NZ LYS A 142 11.461 0.105 8.387 1.00 0.00 N ATOM 0 H LYS A 142 5.408 -3.786 10.754 1.00 0.00 H new ATOM 0 HA LYS A 142 7.496 -3.869 11.513 1.00 0.00 H new ATOM 0 HB2 LYS A 142 7.810 -2.663 9.294 1.00 0.00 H new ATOM 0 HB3 LYS A 142 7.844 -1.153 10.183 1.00 0.00 H new ATOM 0 HG2 LYS A 142 9.718 -2.721 11.531 1.00 0.00 H new ATOM 0 HG3 LYS A 142 9.940 -3.188 9.857 1.00 0.00 H new ATOM 0 HD2 LYS A 142 9.628 -0.284 10.124 1.00 0.00 H new ATOM 0 HD3 LYS A 142 10.947 -0.878 11.114 1.00 0.00 H new ATOM 0 HE2 LYS A 142 12.155 -1.685 9.281 1.00 0.00 H new ATOM 0 HE3 LYS A 142 10.727 -1.879 8.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 12.063 -0.016 7.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 10.557 0.536 8.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 11.941 0.724 9.071 1.00 0.00 H new ATOM 849 N ASN A 143 6.296 -2.044 13.458 1.00 0.00 N ATOM 850 CA ASN A 143 6.328 -1.338 14.735 1.00 0.00 C ATOM 851 C ASN A 143 6.160 -2.302 15.910 1.00 0.00 C ATOM 852 O ASN A 143 6.091 -1.878 17.064 1.00 0.00 O ATOM 853 CB ASN A 143 5.233 -0.269 14.776 1.00 0.00 C ATOM 854 CG ASN A 143 5.778 1.125 14.538 1.00 0.00 C ATOM 855 OD1 ASN A 143 6.835 1.296 13.931 1.00 0.00 O ATOM 856 ND2 ASN A 143 5.057 2.132 15.019 1.00 0.00 N ATOM 0 H ASN A 143 5.410 -2.507 13.254 1.00 0.00 H new ATOM 0 HA ASN A 143 7.303 -0.859 14.827 1.00 0.00 H new ATOM 0 HB2 ASN A 143 4.479 -0.495 14.022 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.734 -0.301 15.745 1.00 0.00 H new ATOM 0 HD21 ASN A 143 5.374 3.093 14.891 1.00 0.00 H new ATOM 0 HD22 ASN A 143 4.186 1.944 15.516 1.00 0.00 H new ATOM 863 N ASN A 144 6.097 -3.599 15.614 1.00 0.00 N ATOM 864 CA ASN A 144 5.941 -4.612 16.652 1.00 0.00 C ATOM 865 C ASN A 144 4.639 -4.416 17.426 1.00 0.00 C ATOM 866 O ASN A 144 4.518 -4.851 18.571 1.00 0.00 O ATOM 867 CB ASN A 144 7.131 -4.573 17.613 1.00 0.00 C ATOM 868 CG ASN A 144 7.686 -5.954 17.902 1.00 0.00 C ATOM 869 OD1 ASN A 144 8.193 -6.632 17.009 1.00 0.00 O ATOM 870 ND2 ASN A 144 7.591 -6.378 19.157 1.00 0.00 N ATOM 0 H ASN A 144 6.152 -3.971 14.666 1.00 0.00 H new ATOM 0 HA ASN A 144 5.904 -5.587 16.166 1.00 0.00 H new ATOM 0 HB2 ASN A 144 7.918 -3.950 17.188 1.00 0.00 H new ATOM 0 HB3 ASN A 144 6.824 -4.105 18.548 1.00 0.00 H new ATOM 0 HD21 ASN A 144 7.946 -7.299 19.412 1.00 0.00 H new ATOM 0 HD22 ASN A 144 7.163 -5.782 19.866 1.00 0.00 H new ATOM 877 N ASP A 145 3.667 -3.762 16.796 1.00 0.00 N ATOM 878 CA ASP A 145 2.377 -3.515 17.433 1.00 0.00 C ATOM 879 C ASP A 145 1.252 -4.244 16.701 1.00 0.00 C ATOM 880 O ASP A 145 0.199 -4.515 17.279 1.00 0.00 O ATOM 881 CB ASP A 145 2.083 -2.014 17.481 1.00 0.00 C ATOM 882 CG ASP A 145 2.157 -1.362 16.115 1.00 0.00 C ATOM 883 OD1 ASP A 145 1.831 -2.037 15.116 1.00 0.00 O ATOM 884 OD2 ASP A 145 2.538 -0.175 16.043 1.00 0.00 O ATOM 0 H ASP A 145 3.748 -3.395 15.848 1.00 0.00 H new ATOM 0 HA ASP A 145 2.429 -3.900 18.451 1.00 0.00 H new ATOM 0 HB2 ASP A 145 1.090 -1.855 17.902 1.00 0.00 H new ATOM 0 HB3 ASP A 145 2.794 -1.529 18.150 1.00 0.00 H new ATOM 889 N GLY A 146 1.479 -4.562 15.429 1.00 0.00 N ATOM 890 CA GLY A 146 0.473 -5.257 14.648 1.00 0.00 C ATOM 891 C GLY A 146 -0.677 -4.355 14.245 1.00 0.00 C ATOM 892 O GLY A 146 -1.838 -4.658 14.522 1.00 0.00 O ATOM 0 H GLY A 146 2.341 -4.351 14.927 1.00 0.00 H new ATOM 0 HA2 GLY A 146 0.936 -5.672 13.753 1.00 0.00 H new ATOM 0 HA3 GLY A 146 0.086 -6.097 15.225 1.00 0.00 H new ATOM 896 N ARG A 147 -0.357 -3.245 13.588 1.00 0.00 N ATOM 897 CA ARG A 147 -1.374 -2.298 13.146 1.00 0.00 C ATOM 898 C ARG A 147 -0.745 -1.147 12.365 1.00 0.00 C ATOM 899 O ARG A 147 0.049 -0.377 12.905 1.00 0.00 O ATOM 900 CB ARG A 147 -2.153 -1.754 14.348 1.00 0.00 C ATOM 901 CG ARG A 147 -3.603 -2.213 14.389 1.00 0.00 C ATOM 902 CD ARG A 147 -3.944 -2.875 15.715 1.00 0.00 C ATOM 903 NE ARG A 147 -5.167 -3.670 15.631 1.00 0.00 N ATOM 904 CZ ARG A 147 -6.392 -3.151 15.667 1.00 0.00 C ATOM 905 NH1 ARG A 147 -6.562 -1.840 15.784 1.00 0.00 N ATOM 906 NH2 ARG A 147 -7.451 -3.946 15.585 1.00 0.00 N ATOM 0 H ARG A 147 0.599 -2.979 13.350 1.00 0.00 H new ATOM 0 HA ARG A 147 -2.063 -2.825 12.486 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -1.655 -2.067 15.266 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -2.125 -0.665 14.326 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -4.260 -1.358 14.229 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -3.787 -2.913 13.574 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -3.117 -3.514 16.025 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -4.061 -2.110 16.483 1.00 0.00 H new ATOM 0 HE ARG A 147 -5.077 -4.682 15.539 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -5.751 -1.224 15.847 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -7.503 -1.448 15.811 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -7.326 -4.954 15.494 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -8.390 -3.549 15.613 1.00 0.00 H new ATOM 920 N ILE A 148 -1.108 -1.038 11.091 1.00 0.00 N ATOM 921 CA ILE A 148 -0.585 0.017 10.232 1.00 0.00 C ATOM 922 C ILE A 148 -1.710 0.920 9.739 1.00 0.00 C ATOM 923 O ILE A 148 -2.728 0.436 9.251 1.00 0.00 O ATOM 924 CB ILE A 148 0.182 -0.576 9.031 1.00 0.00 C ATOM 925 CG1 ILE A 148 1.156 0.453 8.460 1.00 0.00 C ATOM 926 CG2 ILE A 148 -0.767 -1.073 7.951 1.00 0.00 C ATOM 927 CD1 ILE A 148 0.477 1.606 7.758 1.00 0.00 C ATOM 0 H ILE A 148 -1.764 -1.669 10.630 1.00 0.00 H new ATOM 0 HA ILE A 148 0.109 0.613 10.824 1.00 0.00 H new ATOM 0 HB ILE A 148 0.749 -1.435 9.390 1.00 0.00 H new ATOM 0 HG12 ILE A 148 1.773 0.844 9.269 1.00 0.00 H new ATOM 0 HG13 ILE A 148 1.826 -0.044 7.759 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -0.191 -1.484 7.122 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -1.413 -1.848 8.363 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -1.378 -0.244 7.594 1.00 0.00 H new ATOM 0 HD11 ILE A 148 1.231 2.296 7.379 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -0.118 1.227 6.927 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -0.172 2.128 8.461 1.00 0.00 H new ATOM 939 N ASP A 149 -1.532 2.230 9.882 1.00 0.00 N ATOM 940 CA ASP A 149 -2.557 3.182 9.464 1.00 0.00 C ATOM 941 C ASP A 149 -2.088 4.074 8.318 1.00 0.00 C ATOM 942 O ASP A 149 -0.949 3.983 7.861 1.00 0.00 O ATOM 943 CB ASP A 149 -2.979 4.050 10.651 1.00 0.00 C ATOM 944 CG ASP A 149 -1.827 4.858 11.215 1.00 0.00 C ATOM 945 OD1 ASP A 149 -0.874 4.245 11.741 1.00 0.00 O ATOM 946 OD2 ASP A 149 -1.878 6.103 11.132 1.00 0.00 O ATOM 0 H ASP A 149 -0.695 2.655 10.281 1.00 0.00 H new ATOM 0 HA ASP A 149 -3.407 2.603 9.103 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -3.775 4.726 10.338 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -3.391 3.414 11.434 1.00 0.00 H new ATOM 951 N TYR A 150 -2.997 4.933 7.862 1.00 0.00 N ATOM 952 CA TYR A 150 -2.732 5.863 6.762 1.00 0.00 C ATOM 953 C TYR A 150 -1.337 6.482 6.856 1.00 0.00 C ATOM 954 O TYR A 150 -0.651 6.639 5.846 1.00 0.00 O ATOM 955 CB TYR A 150 -3.795 6.966 6.757 1.00 0.00 C ATOM 956 CG TYR A 150 -3.693 7.929 5.593 1.00 0.00 C ATOM 957 CD1 TYR A 150 -3.147 7.536 4.377 1.00 0.00 C ATOM 958 CD2 TYR A 150 -4.150 9.235 5.713 1.00 0.00 C ATOM 959 CE1 TYR A 150 -3.060 8.417 3.316 1.00 0.00 C ATOM 960 CE2 TYR A 150 -4.067 10.122 4.656 1.00 0.00 C ATOM 961 CZ TYR A 150 -3.521 9.708 3.461 1.00 0.00 C ATOM 962 OH TYR A 150 -3.436 10.588 2.406 1.00 0.00 O ATOM 0 H TYR A 150 -3.940 5.005 8.244 1.00 0.00 H new ATOM 0 HA TYR A 150 -2.775 5.299 5.830 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -4.782 6.503 6.744 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -3.720 7.530 7.687 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -2.785 6.525 4.259 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -4.578 9.563 6.649 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -2.633 8.096 2.378 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -4.428 11.134 4.766 1.00 0.00 H new ATOM 0 HH TYR A 150 -3.078 10.124 1.621 1.00 0.00 H new ATOM 972 N ASP A 151 -0.923 6.834 8.068 1.00 0.00 N ATOM 973 CA ASP A 151 0.391 7.435 8.276 1.00 0.00 C ATOM 974 C ASP A 151 1.496 6.492 7.812 1.00 0.00 C ATOM 975 O ASP A 151 2.153 6.740 6.801 1.00 0.00 O ATOM 976 CB ASP A 151 0.586 7.790 9.752 1.00 0.00 C ATOM 977 CG ASP A 151 0.749 9.281 9.972 1.00 0.00 C ATOM 978 OD1 ASP A 151 1.873 9.790 9.776 1.00 0.00 O ATOM 979 OD2 ASP A 151 -0.246 9.939 10.340 1.00 0.00 O ATOM 0 H ASP A 151 -1.474 6.715 8.918 1.00 0.00 H new ATOM 0 HA ASP A 151 0.446 8.348 7.684 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -0.270 7.433 10.325 1.00 0.00 H new ATOM 0 HB3 ASP A 151 1.465 7.271 10.135 1.00 0.00 H new ATOM 984 N GLU A 152 1.693 5.407 8.552 1.00 0.00 N ATOM 985 CA GLU A 152 2.715 4.426 8.210 1.00 0.00 C ATOM 986 C GLU A 152 2.468 3.846 6.818 1.00 0.00 C ATOM 987 O GLU A 152 3.383 3.319 6.185 1.00 0.00 O ATOM 988 CB GLU A 152 2.746 3.304 9.250 1.00 0.00 C ATOM 989 CG GLU A 152 3.805 3.496 10.322 1.00 0.00 C ATOM 990 CD GLU A 152 3.454 2.794 11.619 1.00 0.00 C ATOM 991 OE1 GLU A 152 2.247 2.629 11.897 1.00 0.00 O ATOM 992 OE2 GLU A 152 4.385 2.409 12.358 1.00 0.00 O ATOM 0 H GLU A 152 1.159 5.185 9.392 1.00 0.00 H new ATOM 0 HA GLU A 152 3.681 4.930 8.206 1.00 0.00 H new ATOM 0 HB2 GLU A 152 1.768 3.234 9.726 1.00 0.00 H new ATOM 0 HB3 GLU A 152 2.922 2.355 8.743 1.00 0.00 H new ATOM 0 HG2 GLU A 152 4.760 3.119 9.956 1.00 0.00 H new ATOM 0 HG3 GLU A 152 3.935 4.561 10.513 1.00 0.00 H new ATOM 999 N PHE A 153 1.227 3.947 6.346 1.00 0.00 N ATOM 1000 CA PHE A 153 0.868 3.433 5.029 1.00 0.00 C ATOM 1001 C PHE A 153 1.674 4.137 3.945 1.00 0.00 C ATOM 1002 O PHE A 153 2.122 3.514 2.986 1.00 0.00 O ATOM 1003 CB PHE A 153 -0.636 3.608 4.782 1.00 0.00 C ATOM 1004 CG PHE A 153 -1.054 3.383 3.354 1.00 0.00 C ATOM 1005 CD1 PHE A 153 -0.364 2.496 2.544 1.00 0.00 C ATOM 1006 CD2 PHE A 153 -2.136 4.064 2.823 1.00 0.00 C ATOM 1007 CE1 PHE A 153 -0.744 2.293 1.233 1.00 0.00 C ATOM 1008 CE2 PHE A 153 -2.522 3.864 1.512 1.00 0.00 C ATOM 1009 CZ PHE A 153 -1.825 2.978 0.716 1.00 0.00 C ATOM 0 H PHE A 153 0.456 4.379 6.855 1.00 0.00 H new ATOM 0 HA PHE A 153 1.103 2.369 4.994 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -1.182 2.915 5.423 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -0.928 4.615 5.080 1.00 0.00 H new ATOM 0 HD1 PHE A 153 0.482 1.957 2.944 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -2.685 4.760 3.441 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -0.196 1.599 0.612 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -3.369 4.401 1.110 1.00 0.00 H new ATOM 0 HZ PHE A 153 -2.125 2.821 -0.310 1.00 0.00 H new ATOM 1019 N LEU A 154 1.865 5.437 4.109 1.00 0.00 N ATOM 1020 CA LEU A 154 2.628 6.217 3.147 1.00 0.00 C ATOM 1021 C LEU A 154 4.068 5.712 3.065 1.00 0.00 C ATOM 1022 O LEU A 154 4.773 5.979 2.092 1.00 0.00 O ATOM 1023 CB LEU A 154 2.588 7.699 3.528 1.00 0.00 C ATOM 1024 CG LEU A 154 1.184 8.279 3.758 1.00 0.00 C ATOM 1025 CD1 LEU A 154 1.138 9.741 3.342 1.00 0.00 C ATOM 1026 CD2 LEU A 154 0.125 7.480 3.004 1.00 0.00 C ATOM 0 H LEU A 154 1.503 5.973 4.898 1.00 0.00 H new ATOM 0 HA LEU A 154 2.177 6.100 2.161 1.00 0.00 H new ATOM 0 HB2 LEU A 154 3.175 7.840 4.436 1.00 0.00 H new ATOM 0 HB3 LEU A 154 3.076 8.273 2.740 1.00 0.00 H new ATOM 0 HG LEU A 154 0.964 8.209 4.823 1.00 0.00 H new ATOM 0 HD11 LEU A 154 0.136 10.136 3.512 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.857 10.310 3.931 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.388 9.826 2.284 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -0.858 7.915 3.187 1.00 0.00 H new ATOM 0 HD22 LEU A 154 0.341 7.507 1.936 1.00 0.00 H new ATOM 0 HD23 LEU A 154 0.134 6.446 3.350 1.00 0.00 H new ATOM 1038 N GLU A 155 4.492 4.963 4.082 1.00 0.00 N ATOM 1039 CA GLU A 155 5.838 4.403 4.109 1.00 0.00 C ATOM 1040 C GLU A 155 5.980 3.320 3.043 1.00 0.00 C ATOM 1041 O GLU A 155 7.073 3.071 2.535 1.00 0.00 O ATOM 1042 CB GLU A 155 6.146 3.822 5.490 1.00 0.00 C ATOM 1043 CG GLU A 155 7.617 3.893 5.866 1.00 0.00 C ATOM 1044 CD GLU A 155 8.376 2.637 5.489 1.00 0.00 C ATOM 1045 OE1 GLU A 155 7.835 1.530 5.698 1.00 0.00 O ATOM 1046 OE2 GLU A 155 9.513 2.758 4.986 1.00 0.00 O ATOM 0 H GLU A 155 3.922 4.732 4.896 1.00 0.00 H new ATOM 0 HA GLU A 155 6.550 5.201 3.899 1.00 0.00 H new ATOM 0 HB2 GLU A 155 5.562 4.357 6.239 1.00 0.00 H new ATOM 0 HB3 GLU A 155 5.822 2.782 5.518 1.00 0.00 H new ATOM 0 HG2 GLU A 155 8.073 4.751 5.372 1.00 0.00 H new ATOM 0 HG3 GLU A 155 7.706 4.059 6.940 1.00 0.00 H new ATOM 1053 N PHE A 156 4.859 2.687 2.700 1.00 0.00 N ATOM 1054 CA PHE A 156 4.845 1.639 1.684 1.00 0.00 C ATOM 1055 C PHE A 156 5.439 2.162 0.381 1.00 0.00 C ATOM 1056 O PHE A 156 6.475 1.685 -0.083 1.00 0.00 O ATOM 1057 CB PHE A 156 3.409 1.164 1.443 1.00 0.00 C ATOM 1058 CG PHE A 156 3.191 -0.298 1.702 1.00 0.00 C ATOM 1059 CD1 PHE A 156 3.618 -0.880 2.884 1.00 0.00 C ATOM 1060 CD2 PHE A 156 2.547 -1.087 0.764 1.00 0.00 C ATOM 1061 CE1 PHE A 156 3.407 -2.224 3.126 1.00 0.00 C ATOM 1062 CE2 PHE A 156 2.334 -2.432 0.999 1.00 0.00 C ATOM 1063 CZ PHE A 156 2.764 -3.001 2.182 1.00 0.00 C ATOM 0 H PHE A 156 3.947 2.883 3.113 1.00 0.00 H new ATOM 0 HA PHE A 156 5.446 0.801 2.037 1.00 0.00 H new ATOM 0 HB2 PHE A 156 2.737 1.738 2.081 1.00 0.00 H new ATOM 0 HB3 PHE A 156 3.134 1.383 0.411 1.00 0.00 H new ATOM 0 HD1 PHE A 156 4.122 -0.277 3.625 1.00 0.00 H new ATOM 0 HD2 PHE A 156 2.207 -0.646 -0.162 1.00 0.00 H new ATOM 0 HE1 PHE A 156 3.744 -2.666 4.052 1.00 0.00 H new ATOM 0 HE2 PHE A 156 1.832 -3.037 0.259 1.00 0.00 H new ATOM 0 HZ PHE A 156 2.598 -4.052 2.369 1.00 0.00 H new ATOM 1073 N MET A 157 4.767 3.149 -0.200 1.00 0.00 N ATOM 1074 CA MET A 157 5.210 3.754 -1.450 1.00 0.00 C ATOM 1075 C MET A 157 6.619 4.331 -1.316 1.00 0.00 C ATOM 1076 O MET A 157 7.367 4.398 -2.290 1.00 0.00 O ATOM 1077 CB MET A 157 4.226 4.848 -1.884 1.00 0.00 C ATOM 1078 CG MET A 157 4.305 6.125 -1.058 1.00 0.00 C ATOM 1079 SD MET A 157 3.835 7.588 -2.002 1.00 0.00 S ATOM 1080 CE MET A 157 2.373 6.992 -2.847 1.00 0.00 C ATOM 0 H MET A 157 3.908 3.549 0.178 1.00 0.00 H new ATOM 0 HA MET A 157 5.237 2.976 -2.213 1.00 0.00 H new ATOM 0 HB2 MET A 157 4.412 5.093 -2.930 1.00 0.00 H new ATOM 0 HB3 MET A 157 3.212 4.453 -1.825 1.00 0.00 H new ATOM 0 HG2 MET A 157 3.654 6.033 -0.189 1.00 0.00 H new ATOM 0 HG3 MET A 157 5.321 6.249 -0.683 1.00 0.00 H new ATOM 0 HE1 MET A 157 1.617 7.777 -2.863 1.00 0.00 H new ATOM 0 HE2 MET A 157 2.631 6.716 -3.869 1.00 0.00 H new ATOM 0 HE3 MET A 157 1.980 6.120 -2.324 1.00 0.00 H new ATOM 1090 N LYS A 158 6.974 4.750 -0.103 1.00 0.00 N ATOM 1091 CA LYS A 158 8.293 5.322 0.152 1.00 0.00 C ATOM 1092 C LYS A 158 9.397 4.405 -0.368 1.00 0.00 C ATOM 1093 O LYS A 158 10.481 4.864 -0.727 1.00 0.00 O ATOM 1094 CB LYS A 158 8.481 5.579 1.649 1.00 0.00 C ATOM 1095 CG LYS A 158 8.567 7.055 2.005 1.00 0.00 C ATOM 1096 CD LYS A 158 9.737 7.341 2.934 1.00 0.00 C ATOM 1097 CE LYS A 158 9.281 7.494 4.377 1.00 0.00 C ATOM 1098 NZ LYS A 158 10.072 6.638 5.303 1.00 0.00 N ATOM 0 H LYS A 158 6.368 4.704 0.716 1.00 0.00 H new ATOM 0 HA LYS A 158 8.359 6.271 -0.381 1.00 0.00 H new ATOM 0 HB2 LYS A 158 7.651 5.130 2.194 1.00 0.00 H new ATOM 0 HB3 LYS A 158 9.390 5.079 1.984 1.00 0.00 H new ATOM 0 HG2 LYS A 158 8.673 7.644 1.094 1.00 0.00 H new ATOM 0 HG3 LYS A 158 7.638 7.369 2.481 1.00 0.00 H new ATOM 0 HD2 LYS A 158 10.463 6.531 2.865 1.00 0.00 H new ATOM 0 HD3 LYS A 158 10.243 8.251 2.613 1.00 0.00 H new ATOM 0 HE2 LYS A 158 9.374 8.537 4.678 1.00 0.00 H new ATOM 0 HE3 LYS A 158 8.225 7.233 4.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 9.697 6.733 6.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 10.004 5.645 5.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 11.068 6.937 5.287 1.00 0.00 H new ATOM 1112 N GLY A 159 9.111 3.107 -0.411 1.00 0.00 N ATOM 1113 CA GLY A 159 10.088 2.151 -0.895 1.00 0.00 C ATOM 1114 C GLY A 159 10.329 2.282 -2.386 1.00 0.00 C ATOM 1115 O GLY A 159 11.410 1.960 -2.879 1.00 0.00 O ATOM 0 H GLY A 159 8.221 2.702 -0.120 1.00 0.00 H new ATOM 0 HA2 GLY A 159 11.028 2.294 -0.363 1.00 0.00 H new ATOM 0 HA3 GLY A 159 9.746 1.140 -0.672 1.00 0.00 H new ATOM 1119 N VAL A 160 9.317 2.758 -3.106 1.00 0.00 N ATOM 1120 CA VAL A 160 9.417 2.936 -4.546 1.00 0.00 C ATOM 1121 C VAL A 160 10.575 3.862 -4.908 1.00 0.00 C ATOM 1122 O VAL A 160 11.167 3.742 -5.980 1.00 0.00 O ATOM 1123 CB VAL A 160 8.111 3.512 -5.124 1.00 0.00 C ATOM 1124 CG1 VAL A 160 8.193 3.615 -6.637 1.00 0.00 C ATOM 1125 CG2 VAL A 160 6.919 2.664 -4.707 1.00 0.00 C ATOM 0 H VAL A 160 8.416 3.028 -2.711 1.00 0.00 H new ATOM 0 HA VAL A 160 9.598 1.952 -4.979 1.00 0.00 H new ATOM 0 HB VAL A 160 7.973 4.515 -4.721 1.00 0.00 H new ATOM 0 HG11 VAL A 160 7.260 4.024 -7.025 1.00 0.00 H new ATOM 0 HG12 VAL A 160 9.019 4.270 -6.913 1.00 0.00 H new ATOM 0 HG13 VAL A 160 8.359 2.624 -7.061 1.00 0.00 H new ATOM 0 HG21 VAL A 160 6.006 3.088 -5.126 1.00 0.00 H new ATOM 0 HG22 VAL A 160 7.049 1.647 -5.076 1.00 0.00 H new ATOM 0 HG23 VAL A 160 6.846 2.649 -3.620 1.00 0.00 H new ATOM 1135 N GLU A 161 10.891 4.786 -4.006 1.00 0.00 N ATOM 1136 CA GLU A 161 11.978 5.732 -4.231 1.00 0.00 C ATOM 1137 C GLU A 161 13.277 5.227 -3.613 1.00 0.00 C ATOM 1138 O GLU A 161 14.227 4.951 -4.376 1.00 0.00 O ATOM 1139 CB GLU A 161 11.619 7.100 -3.647 1.00 0.00 C ATOM 1140 CG GLU A 161 10.516 7.817 -4.409 1.00 0.00 C ATOM 1141 CD GLU A 161 11.052 8.686 -5.530 1.00 0.00 C ATOM 1142 OE1 GLU A 161 11.986 9.475 -5.275 1.00 0.00 O ATOM 1143 OE2 GLU A 161 10.538 8.577 -6.663 1.00 0.00 O ATOM 1144 OXT GLU A 161 13.335 5.112 -2.370 1.00 0.00 O ATOM 0 H GLU A 161 10.410 4.900 -3.114 1.00 0.00 H new ATOM 0 HA GLU A 161 12.124 5.830 -5.307 1.00 0.00 H new ATOM 0 HB2 GLU A 161 11.309 6.973 -2.610 1.00 0.00 H new ATOM 0 HB3 GLU A 161 12.510 7.727 -3.639 1.00 0.00 H new ATOM 0 HG2 GLU A 161 9.827 7.080 -4.823 1.00 0.00 H new ATOM 0 HG3 GLU A 161 9.944 8.435 -3.717 1.00 0.00 H new ATOM 1226 N PHE B 132 4.884 -5.927 -6.897 1.00 0.00 N ATOM 1227 CA PHE B 132 3.699 -5.842 -7.744 1.00 0.00 C ATOM 1228 C PHE B 132 2.974 -4.501 -7.574 1.00 0.00 C ATOM 1229 O PHE B 132 3.470 -3.470 -8.027 1.00 0.00 O ATOM 1230 CB PHE B 132 2.765 -7.030 -7.465 1.00 0.00 C ATOM 1231 CG PHE B 132 2.919 -7.624 -6.088 1.00 0.00 C ATOM 1232 CD1 PHE B 132 2.189 -7.138 -5.014 1.00 0.00 C ATOM 1233 CD2 PHE B 132 3.794 -8.677 -5.873 1.00 0.00 C ATOM 1234 CE1 PHE B 132 2.328 -7.691 -3.755 1.00 0.00 C ATOM 1235 CE2 PHE B 132 3.938 -9.233 -4.616 1.00 0.00 C ATOM 1236 CZ PHE B 132 3.204 -8.740 -3.556 1.00 0.00 C ATOM 0 HA PHE B 132 4.019 -5.893 -8.785 1.00 0.00 H new ATOM 0 HB2 PHE B 132 1.733 -6.705 -7.595 1.00 0.00 H new ATOM 0 HB3 PHE B 132 2.951 -7.807 -8.207 1.00 0.00 H new ATOM 0 HD1 PHE B 132 1.503 -6.317 -5.163 1.00 0.00 H new ATOM 0 HD2 PHE B 132 4.371 -9.068 -6.698 1.00 0.00 H new ATOM 0 HE1 PHE B 132 1.752 -7.303 -2.928 1.00 0.00 H new ATOM 0 HE2 PHE B 132 4.624 -10.053 -4.463 1.00 0.00 H new ATOM 0 HZ PHE B 132 3.315 -9.174 -2.573 1.00 0.00 H new ATOM 1246 N ASP B 133 1.806 -4.505 -6.929 1.00 0.00 N ATOM 1247 CA ASP B 133 1.045 -3.278 -6.721 1.00 0.00 C ATOM 1248 C ASP B 133 1.613 -2.479 -5.555 1.00 0.00 C ATOM 1249 O ASP B 133 0.883 -1.793 -4.841 1.00 0.00 O ATOM 1250 CB ASP B 133 -0.427 -3.603 -6.465 1.00 0.00 C ATOM 1251 CG ASP B 133 -1.319 -2.383 -6.583 1.00 0.00 C ATOM 1252 OD1 ASP B 133 -1.464 -1.860 -7.708 1.00 0.00 O ATOM 1253 OD2 ASP B 133 -1.873 -1.950 -5.550 1.00 0.00 O ATOM 0 H ASP B 133 1.370 -5.343 -6.544 1.00 0.00 H new ATOM 0 HA ASP B 133 1.123 -2.673 -7.624 1.00 0.00 H new ATOM 0 HB2 ASP B 133 -0.757 -4.361 -7.175 1.00 0.00 H new ATOM 0 HB3 ASP B 133 -0.533 -4.032 -5.469 1.00 0.00 H new ATOM 1258 N LEU B 134 2.924 -2.576 -5.372 1.00 0.00 N ATOM 1259 CA LEU B 134 3.609 -1.871 -4.304 1.00 0.00 C ATOM 1260 C LEU B 134 4.470 -0.760 -4.888 1.00 0.00 C ATOM 1261 O LEU B 134 4.568 0.331 -4.326 1.00 0.00 O ATOM 1262 CB LEU B 134 4.484 -2.843 -3.514 1.00 0.00 C ATOM 1263 CG LEU B 134 3.730 -3.826 -2.615 1.00 0.00 C ATOM 1264 CD1 LEU B 134 2.655 -4.561 -3.402 1.00 0.00 C ATOM 1265 CD2 LEU B 134 4.697 -4.818 -1.987 1.00 0.00 C ATOM 0 H LEU B 134 3.537 -3.143 -5.958 1.00 0.00 H new ATOM 0 HA LEU B 134 2.868 -1.435 -3.634 1.00 0.00 H new ATOM 0 HB2 LEU B 134 5.091 -3.413 -4.218 1.00 0.00 H new ATOM 0 HB3 LEU B 134 5.171 -2.266 -2.896 1.00 0.00 H new ATOM 0 HG LEU B 134 3.245 -3.259 -1.820 1.00 0.00 H new ATOM 0 HD11 LEU B 134 2.132 -5.254 -2.743 1.00 0.00 H new ATOM 0 HD12 LEU B 134 1.945 -3.841 -3.808 1.00 0.00 H new ATOM 0 HD13 LEU B 134 3.117 -5.115 -4.219 1.00 0.00 H new ATOM 0 HD21 LEU B 134 4.146 -5.510 -1.351 1.00 0.00 H new ATOM 0 HD22 LEU B 134 5.208 -5.375 -2.772 1.00 0.00 H new ATOM 0 HD23 LEU B 134 5.431 -4.280 -1.387 1.00 0.00 H new ATOM 1277 N ARG B 135 5.092 -1.055 -6.024 1.00 0.00 N ATOM 1278 CA ARG B 135 5.952 -0.092 -6.702 1.00 0.00 C ATOM 1279 C ARG B 135 5.400 0.256 -8.082 1.00 0.00 C ATOM 1280 O ARG B 135 4.476 -0.392 -8.573 1.00 0.00 O ATOM 1281 CB ARG B 135 7.368 -0.654 -6.835 1.00 0.00 C ATOM 1282 CG ARG B 135 8.440 0.415 -6.928 1.00 0.00 C ATOM 1283 CD ARG B 135 9.822 -0.154 -6.653 1.00 0.00 C ATOM 1284 NE ARG B 135 10.861 0.871 -6.731 1.00 0.00 N ATOM 1285 CZ ARG B 135 12.074 0.740 -6.198 1.00 0.00 C ATOM 1286 NH1 ARG B 135 12.406 -0.369 -5.549 1.00 0.00 N ATOM 1287 NH2 ARG B 135 12.958 1.721 -6.317 1.00 0.00 N ATOM 0 H ARG B 135 5.016 -1.956 -6.496 1.00 0.00 H new ATOM 0 HA ARG B 135 5.981 0.818 -6.103 1.00 0.00 H new ATOM 0 HB2 ARG B 135 7.578 -1.293 -5.978 1.00 0.00 H new ATOM 0 HB3 ARG B 135 7.418 -1.285 -7.723 1.00 0.00 H new ATOM 0 HG2 ARG B 135 8.422 0.864 -7.921 1.00 0.00 H new ATOM 0 HG3 ARG B 135 8.225 1.210 -6.214 1.00 0.00 H new ATOM 0 HD2 ARG B 135 9.836 -0.610 -5.663 1.00 0.00 H new ATOM 0 HD3 ARG B 135 10.038 -0.945 -7.371 1.00 0.00 H new ATOM 0 HE ARG B 135 10.644 1.738 -7.223 1.00 0.00 H new ATOM 0 HH11 ARG B 135 11.730 -1.127 -5.456 1.00 0.00 H new ATOM 0 HH12 ARG B 135 13.337 -0.463 -5.143 1.00 0.00 H new ATOM 0 HH21 ARG B 135 12.708 2.575 -6.816 1.00 0.00 H new ATOM 0 HH22 ARG B 135 13.888 1.622 -5.909 1.00 0.00 H new ATOM 1301 N GLY B 136 5.976 1.282 -8.702 1.00 0.00 N ATOM 1302 CA GLY B 136 5.531 1.697 -10.020 1.00 0.00 C ATOM 1303 C GLY B 136 4.846 3.047 -10.006 1.00 0.00 C ATOM 1304 O GLY B 136 5.322 3.984 -9.368 1.00 0.00 O ATOM 0 H GLY B 136 6.742 1.833 -8.315 1.00 0.00 H new ATOM 0 HA2 GLY B 136 6.388 1.736 -10.693 1.00 0.00 H new ATOM 0 HA3 GLY B 136 4.845 0.950 -10.420 1.00 0.00 H new ATOM 1308 N LYS B 137 3.725 3.142 -10.713 1.00 0.00 N ATOM 1309 CA LYS B 137 2.958 4.386 -10.793 1.00 0.00 C ATOM 1310 C LYS B 137 2.838 5.062 -9.427 1.00 0.00 C ATOM 1311 O LYS B 137 2.711 6.284 -9.340 1.00 0.00 O ATOM 1312 CB LYS B 137 1.563 4.109 -11.357 1.00 0.00 C ATOM 1313 CG LYS B 137 0.874 2.914 -10.716 1.00 0.00 C ATOM 1314 CD LYS B 137 0.794 1.735 -11.673 1.00 0.00 C ATOM 1315 CE LYS B 137 -0.494 1.759 -12.481 1.00 0.00 C ATOM 1316 NZ LYS B 137 -1.061 0.395 -12.664 1.00 0.00 N ATOM 0 H LYS B 137 3.323 2.369 -11.243 1.00 0.00 H new ATOM 0 HA LYS B 137 3.494 5.063 -11.459 1.00 0.00 H new ATOM 0 HB2 LYS B 137 0.942 4.994 -11.218 1.00 0.00 H new ATOM 0 HB3 LYS B 137 1.641 3.940 -12.431 1.00 0.00 H new ATOM 0 HG2 LYS B 137 1.417 2.619 -9.818 1.00 0.00 H new ATOM 0 HG3 LYS B 137 -0.131 3.198 -10.402 1.00 0.00 H new ATOM 0 HD2 LYS B 137 1.649 1.755 -12.349 1.00 0.00 H new ATOM 0 HD3 LYS B 137 0.854 0.804 -11.110 1.00 0.00 H new ATOM 0 HE2 LYS B 137 -1.226 2.392 -11.979 1.00 0.00 H new ATOM 0 HE3 LYS B 137 -0.302 2.206 -13.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 -1.938 0.455 -13.220 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 -0.373 -0.202 -13.166 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 -1.268 -0.022 -11.734 1.00 0.00 H new ATOM 1330 N PHE B 138 2.882 4.260 -8.365 1.00 0.00 N ATOM 1331 CA PHE B 138 2.781 4.773 -7.000 1.00 0.00 C ATOM 1332 C PHE B 138 3.646 6.017 -6.805 1.00 0.00 C ATOM 1333 O PHE B 138 3.320 6.892 -6.002 1.00 0.00 O ATOM 1334 CB PHE B 138 3.193 3.689 -6.003 1.00 0.00 C ATOM 1335 CG PHE B 138 2.121 2.669 -5.757 1.00 0.00 C ATOM 1336 CD1 PHE B 138 1.130 2.899 -4.817 1.00 0.00 C ATOM 1337 CD2 PHE B 138 2.103 1.482 -6.469 1.00 0.00 C ATOM 1338 CE1 PHE B 138 0.140 1.962 -4.591 1.00 0.00 C ATOM 1339 CE2 PHE B 138 1.115 0.541 -6.249 1.00 0.00 C ATOM 1340 CZ PHE B 138 0.132 0.782 -5.308 1.00 0.00 C ATOM 0 H PHE B 138 2.987 3.247 -8.424 1.00 0.00 H new ATOM 0 HA PHE B 138 1.743 5.055 -6.823 1.00 0.00 H new ATOM 0 HB2 PHE B 138 4.086 3.185 -6.373 1.00 0.00 H new ATOM 0 HB3 PHE B 138 3.462 4.159 -5.057 1.00 0.00 H new ATOM 0 HD1 PHE B 138 1.131 3.821 -4.254 1.00 0.00 H new ATOM 0 HD2 PHE B 138 2.870 1.289 -7.205 1.00 0.00 H new ATOM 0 HE1 PHE B 138 -0.627 2.152 -3.854 1.00 0.00 H new ATOM 0 HE2 PHE B 138 1.111 -0.381 -6.811 1.00 0.00 H new ATOM 0 HZ PHE B 138 -0.641 0.048 -5.134 1.00 0.00 H new