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 -48:sc= 0.361 USER MOD Set 1.2: A 150 TYR OH : rot 180:sc= -0.975 USER MOD Single : A 93 SER OG : rot -22:sc= 0.337 USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -113:sc= 0 (180deg=-0.64) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=-0.48) 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 -127:sc= 0 (180deg=-2.88!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 THR OG1 : rot 50:sc= -2.74! USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot -66:sc= 1.12 USER MOD Single : A 137 MET CE :methyl -106:sc= 0 (180deg=-0.0947) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 176:sc= 0.127 (180deg=0.124) USER MOD Single : A 143 ASN : amide:sc= -0.334 K(o=-0.33,f=-2.7!) USER MOD Single : A 144 ASN :FLIP amide:sc= 0.524 F(o=0,f=0.52) USER MOD Single : A 157 MET CE :methyl 148:sc= -0.61 (180deg=-2.96!) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 93 1.843 14.722 -2.922 1.00 0.00 N ATOM 72 CA SER A 93 2.519 13.485 -2.550 1.00 0.00 C ATOM 73 C SER A 93 1.740 12.743 -1.468 1.00 0.00 C ATOM 74 O SER A 93 1.689 11.513 -1.458 1.00 0.00 O ATOM 75 CB SER A 93 3.937 13.782 -2.060 1.00 0.00 C ATOM 76 OG SER A 93 3.958 14.917 -1.213 1.00 0.00 O ATOM 0 HA SER A 93 2.573 12.850 -3.434 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.328 12.917 -1.524 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.592 13.950 -2.915 1.00 0.00 H new ATOM 0 HG SER A 93 3.171 15.473 -1.391 1.00 0.00 H new ATOM 82 N GLU A 94 1.135 13.500 -0.558 1.00 0.00 N ATOM 83 CA GLU A 94 0.358 12.916 0.529 1.00 0.00 C ATOM 84 C GLU A 94 -1.089 12.688 0.103 1.00 0.00 C ATOM 85 O GLU A 94 -1.750 11.768 0.586 1.00 0.00 O ATOM 86 CB GLU A 94 0.402 13.822 1.760 1.00 0.00 C ATOM 87 CG GLU A 94 -0.158 13.173 3.015 1.00 0.00 C ATOM 88 CD GLU A 94 -1.013 14.122 3.831 1.00 0.00 C ATOM 89 OE1 GLU A 94 -0.456 15.088 4.394 1.00 0.00 O ATOM 90 OE2 GLU A 94 -2.240 13.899 3.908 1.00 0.00 O ATOM 0 H GLU A 94 1.168 14.519 -0.552 1.00 0.00 H new ATOM 0 HA GLU A 94 0.800 11.952 0.780 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.434 14.119 1.945 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -0.160 14.732 1.551 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.753 12.303 2.735 1.00 0.00 H new ATOM 0 HG3 GLU A 94 0.665 12.811 3.631 1.00 0.00 H new ATOM 97 N GLU A 95 -1.575 13.531 -0.802 1.00 0.00 N ATOM 98 CA GLU A 95 -2.944 13.422 -1.292 1.00 0.00 C ATOM 99 C GLU A 95 -3.185 12.061 -1.939 1.00 0.00 C ATOM 100 O GLU A 95 -4.300 11.540 -1.912 1.00 0.00 O ATOM 101 CB GLU A 95 -3.239 14.537 -2.296 1.00 0.00 C ATOM 102 CG GLU A 95 -3.572 15.870 -1.645 1.00 0.00 C ATOM 103 CD GLU A 95 -2.446 16.878 -1.770 1.00 0.00 C ATOM 104 OE1 GLU A 95 -1.357 16.624 -1.213 1.00 0.00 O ATOM 105 OE2 GLU A 95 -2.653 17.922 -2.423 1.00 0.00 O ATOM 0 H GLU A 95 -1.041 14.298 -1.211 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.617 13.523 -0.440 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.375 14.666 -2.947 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.073 14.233 -2.929 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.473 16.279 -2.103 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.795 15.709 -0.590 1.00 0.00 H new ATOM 112 N GLU A 96 -2.134 11.491 -2.519 1.00 0.00 N ATOM 113 CA GLU A 96 -2.235 10.191 -3.172 1.00 0.00 C ATOM 114 C GLU A 96 -2.617 9.108 -2.169 1.00 0.00 C ATOM 115 O GLU A 96 -3.692 8.514 -2.263 1.00 0.00 O ATOM 116 CB GLU A 96 -0.910 9.832 -3.848 1.00 0.00 C ATOM 117 CG GLU A 96 -0.521 10.783 -4.968 1.00 0.00 C ATOM 118 CD GLU A 96 -1.348 10.575 -6.222 1.00 0.00 C ATOM 119 OE1 GLU A 96 -1.806 9.436 -6.449 1.00 0.00 O ATOM 120 OE2 GLU A 96 -1.537 11.552 -6.978 1.00 0.00 O ATOM 0 H GLU A 96 -1.204 11.908 -2.550 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.016 10.252 -3.930 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.119 9.825 -3.098 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.978 8.821 -4.249 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.640 11.811 -4.625 1.00 0.00 H new ATOM 0 HG3 GLU A 96 0.534 10.646 -5.206 1.00 0.00 H new ATOM 127 N LEU A 97 -1.734 8.856 -1.208 1.00 0.00 N ATOM 128 CA LEU A 97 -1.985 7.843 -0.188 1.00 0.00 C ATOM 129 C LEU A 97 -3.253 8.166 0.597 1.00 0.00 C ATOM 130 O LEU A 97 -3.924 7.270 1.106 1.00 0.00 O ATOM 131 CB LEU A 97 -0.793 7.738 0.766 1.00 0.00 C ATOM 132 CG LEU A 97 0.494 7.196 0.136 1.00 0.00 C ATOM 133 CD1 LEU A 97 1.702 7.999 0.600 1.00 0.00 C ATOM 134 CD2 LEU A 97 0.669 5.721 0.470 1.00 0.00 C ATOM 0 H LEU A 97 -0.840 9.338 -1.114 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.122 6.885 -0.690 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.589 8.726 1.179 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.070 7.094 1.601 1.00 0.00 H new ATOM 0 HG LEU A 97 0.415 7.298 -0.946 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.605 7.597 0.140 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.580 9.042 0.308 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.787 7.934 1.685 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.588 5.351 0.015 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.724 5.597 1.552 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.180 5.157 0.083 1.00 0.00 H new ATOM 146 N SER A 98 -3.580 9.452 0.687 1.00 0.00 N ATOM 147 CA SER A 98 -4.771 9.890 1.407 1.00 0.00 C ATOM 148 C SER A 98 -6.004 9.136 0.919 1.00 0.00 C ATOM 149 O SER A 98 -6.719 8.518 1.707 1.00 0.00 O ATOM 150 CB SER A 98 -4.976 11.396 1.232 1.00 0.00 C ATOM 151 OG SER A 98 -4.399 12.117 2.307 1.00 0.00 O ATOM 0 H SER A 98 -3.037 10.208 0.270 1.00 0.00 H new ATOM 0 HA SER A 98 -4.627 9.673 2.466 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.530 11.720 0.292 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.042 11.617 1.172 1.00 0.00 H new ATOM 0 HG SER A 98 -4.680 11.718 3.157 1.00 0.00 H new ATOM 157 N ASP A 99 -6.237 9.184 -0.387 1.00 0.00 N ATOM 158 CA ASP A 99 -7.374 8.497 -0.986 1.00 0.00 C ATOM 159 C ASP A 99 -7.039 7.033 -1.271 1.00 0.00 C ATOM 160 O ASP A 99 -7.916 6.245 -1.625 1.00 0.00 O ATOM 161 CB ASP A 99 -7.792 9.197 -2.281 1.00 0.00 C ATOM 162 CG ASP A 99 -8.638 10.429 -2.025 1.00 0.00 C ATOM 163 OD1 ASP A 99 -8.077 11.453 -1.579 1.00 0.00 O ATOM 164 OD2 ASP A 99 -9.861 10.371 -2.269 1.00 0.00 O ATOM 0 H ASP A 99 -5.653 9.692 -1.052 1.00 0.00 H new ATOM 0 HA ASP A 99 -8.202 8.530 -0.278 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -6.901 9.481 -2.841 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -8.351 8.499 -2.904 1.00 0.00 H new ATOM 169 N LEU A 100 -5.765 6.677 -1.117 1.00 0.00 N ATOM 170 CA LEU A 100 -5.315 5.312 -1.360 1.00 0.00 C ATOM 171 C LEU A 100 -5.670 4.399 -0.190 1.00 0.00 C ATOM 172 O LEU A 100 -6.139 3.278 -0.389 1.00 0.00 O ATOM 173 CB LEU A 100 -3.804 5.289 -1.599 1.00 0.00 C ATOM 174 CG LEU A 100 -3.283 4.066 -2.354 1.00 0.00 C ATOM 175 CD1 LEU A 100 -4.064 3.859 -3.643 1.00 0.00 C ATOM 176 CD2 LEU A 100 -1.798 4.216 -2.648 1.00 0.00 C ATOM 0 H LEU A 100 -5.027 7.317 -0.825 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.826 4.942 -2.249 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.527 6.185 -2.155 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.299 5.343 -0.635 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.424 3.188 -1.724 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.678 2.984 -4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.118 3.707 -3.409 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.957 4.738 -4.279 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.443 3.337 -3.186 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.636 5.105 -3.258 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.250 4.314 -1.711 1.00 0.00 H new ATOM 188 N PHE A 101 -5.442 4.880 1.030 1.00 0.00 N ATOM 189 CA PHE A 101 -5.739 4.094 2.225 1.00 0.00 C ATOM 190 C PHE A 101 -7.192 3.627 2.224 1.00 0.00 C ATOM 191 O PHE A 101 -7.492 2.499 2.617 1.00 0.00 O ATOM 192 CB PHE A 101 -5.458 4.905 3.493 1.00 0.00 C ATOM 193 CG PHE A 101 -5.626 4.106 4.756 1.00 0.00 C ATOM 194 CD1 PHE A 101 -4.604 3.290 5.219 1.00 0.00 C ATOM 195 CD2 PHE A 101 -6.807 4.167 5.476 1.00 0.00 C ATOM 196 CE1 PHE A 101 -4.759 2.551 6.378 1.00 0.00 C ATOM 197 CE2 PHE A 101 -6.968 3.432 6.635 1.00 0.00 C ATOM 198 CZ PHE A 101 -5.943 2.622 7.085 1.00 0.00 C ATOM 0 H PHE A 101 -5.055 5.805 1.217 1.00 0.00 H new ATOM 0 HA PHE A 101 -5.090 3.219 2.214 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.441 5.294 3.450 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -6.127 5.765 3.523 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.677 3.231 4.668 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -7.612 4.797 5.128 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -3.956 1.920 6.729 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -7.894 3.491 7.188 1.00 0.00 H new ATOM 0 HZ PHE A 101 -6.068 2.045 7.989 1.00 0.00 H new ATOM 208 N ARG A 102 -8.089 4.500 1.778 1.00 0.00 N ATOM 209 CA ARG A 102 -9.510 4.176 1.725 1.00 0.00 C ATOM 210 C ARG A 102 -9.768 3.022 0.762 1.00 0.00 C ATOM 211 O ARG A 102 -10.555 2.121 1.053 1.00 0.00 O ATOM 212 CB ARG A 102 -10.318 5.402 1.297 1.00 0.00 C ATOM 213 CG ARG A 102 -11.796 5.308 1.646 1.00 0.00 C ATOM 214 CD ARG A 102 -12.186 6.312 2.721 1.00 0.00 C ATOM 215 NE ARG A 102 -12.485 5.662 3.995 1.00 0.00 N ATOM 216 CZ ARG A 102 -11.556 5.261 4.860 1.00 0.00 C ATOM 217 NH1 ARG A 102 -10.268 5.434 4.589 1.00 0.00 N ATOM 218 NH2 ARG A 102 -11.916 4.685 5.999 1.00 0.00 N ATOM 0 H ARG A 102 -7.857 5.437 1.448 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.826 3.871 2.723 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -9.897 6.288 1.771 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.215 5.537 0.220 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -12.393 5.483 0.751 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -12.025 4.299 1.990 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -11.375 7.027 2.860 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.057 6.878 2.390 1.00 0.00 H new ATOM 0 HE ARG A 102 -13.464 5.506 4.236 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -9.986 5.876 3.714 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -9.561 5.125 5.256 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.904 4.549 6.212 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.205 4.378 6.662 1.00 0.00 H new ATOM 232 N MET A 103 -9.101 3.057 -0.387 1.00 0.00 N ATOM 233 CA MET A 103 -9.258 2.015 -1.394 1.00 0.00 C ATOM 234 C MET A 103 -8.763 0.671 -0.871 1.00 0.00 C ATOM 235 O MET A 103 -9.363 -0.370 -1.141 1.00 0.00 O ATOM 236 CB MET A 103 -8.499 2.390 -2.668 1.00 0.00 C ATOM 237 CG MET A 103 -9.167 3.493 -3.472 1.00 0.00 C ATOM 238 SD MET A 103 -8.602 3.544 -5.184 1.00 0.00 S ATOM 239 CE MET A 103 -7.717 5.100 -5.201 1.00 0.00 C ATOM 0 H MET A 103 -8.447 3.796 -0.644 1.00 0.00 H new ATOM 0 HA MET A 103 -10.320 1.925 -1.624 1.00 0.00 H new ATOM 0 HB2 MET A 103 -7.491 2.707 -2.400 1.00 0.00 H new ATOM 0 HB3 MET A 103 -8.399 1.504 -3.295 1.00 0.00 H new ATOM 0 HG2 MET A 103 -10.247 3.347 -3.454 1.00 0.00 H new ATOM 0 HG3 MET A 103 -8.967 4.454 -2.999 1.00 0.00 H new ATOM 0 HE1 MET A 103 -7.307 5.274 -6.196 1.00 0.00 H new ATOM 0 HE2 MET A 103 -8.400 5.910 -4.943 1.00 0.00 H new ATOM 0 HE3 MET A 103 -6.905 5.065 -4.475 1.00 0.00 H new ATOM 249 N PHE A 104 -7.665 0.700 -0.123 1.00 0.00 N ATOM 250 CA PHE A 104 -7.090 -0.518 0.437 1.00 0.00 C ATOM 251 C PHE A 104 -7.880 -0.986 1.654 1.00 0.00 C ATOM 252 O PHE A 104 -8.204 -2.167 1.780 1.00 0.00 O ATOM 253 CB PHE A 104 -5.627 -0.288 0.819 1.00 0.00 C ATOM 254 CG PHE A 104 -4.729 -1.442 0.475 1.00 0.00 C ATOM 255 CD1 PHE A 104 -4.736 -2.595 1.243 1.00 0.00 C ATOM 256 CD2 PHE A 104 -3.878 -1.373 -0.617 1.00 0.00 C ATOM 257 CE1 PHE A 104 -3.911 -3.658 0.929 1.00 0.00 C ATOM 258 CE2 PHE A 104 -3.052 -2.433 -0.936 1.00 0.00 C ATOM 259 CZ PHE A 104 -3.068 -3.577 -0.163 1.00 0.00 C ATOM 0 H PHE A 104 -7.156 1.553 0.109 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.141 -1.296 -0.325 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.264 0.607 0.314 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.565 -0.097 1.890 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -5.394 -2.664 2.097 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.861 -0.481 -1.225 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -3.925 -4.551 1.536 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -2.394 -2.367 -1.790 1.00 0.00 H new ATOM 0 HZ PHE A 104 -2.423 -4.407 -0.411 1.00 0.00 H new ATOM 269 N ASP A 105 -8.189 -0.053 2.550 1.00 0.00 N ATOM 270 CA ASP A 105 -8.942 -0.373 3.756 1.00 0.00 C ATOM 271 C ASP A 105 -10.396 -0.692 3.420 1.00 0.00 C ATOM 272 O ASP A 105 -11.310 0.038 3.807 1.00 0.00 O ATOM 273 CB ASP A 105 -8.877 0.791 4.749 1.00 0.00 C ATOM 274 CG ASP A 105 -8.925 0.324 6.191 1.00 0.00 C ATOM 275 OD1 ASP A 105 -8.613 -0.859 6.443 1.00 0.00 O ATOM 276 OD2 ASP A 105 -9.274 1.141 7.069 1.00 0.00 O ATOM 0 H ASP A 105 -7.929 0.930 2.463 1.00 0.00 H new ATOM 0 HA ASP A 105 -8.492 -1.254 4.213 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.960 1.356 4.583 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.708 1.471 4.562 1.00 0.00 H new ATOM 281 N LYS A 106 -10.603 -1.787 2.696 1.00 0.00 N ATOM 282 CA LYS A 106 -11.945 -2.204 2.307 1.00 0.00 C ATOM 283 C LYS A 106 -12.800 -2.504 3.534 1.00 0.00 C ATOM 284 O LYS A 106 -14.024 -2.379 3.494 1.00 0.00 O ATOM 285 CB LYS A 106 -11.877 -3.437 1.404 1.00 0.00 C ATOM 286 CG LYS A 106 -11.307 -3.150 0.023 1.00 0.00 C ATOM 287 CD LYS A 106 -9.977 -3.854 -0.191 1.00 0.00 C ATOM 288 CE LYS A 106 -9.835 -4.353 -1.620 1.00 0.00 C ATOM 289 NZ LYS A 106 -10.218 -5.786 -1.749 1.00 0.00 N ATOM 0 H LYS A 106 -9.858 -2.402 2.367 1.00 0.00 H new ATOM 0 HA LYS A 106 -12.407 -1.384 1.757 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.266 -4.199 1.889 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -12.879 -3.853 1.295 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -12.017 -3.473 -0.738 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -11.174 -2.075 -0.100 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -9.161 -3.170 0.039 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -9.893 -4.694 0.499 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.460 -3.750 -2.279 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -8.804 -4.222 -1.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -9.377 -6.350 -1.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.619 -6.120 -0.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -10.926 -5.889 -2.504 1.00 0.00 H new ATOM 303 N ASN A 107 -12.149 -2.900 4.623 1.00 0.00 N ATOM 304 CA ASN A 107 -12.851 -3.216 5.861 1.00 0.00 C ATOM 305 C ASN A 107 -13.424 -1.954 6.498 1.00 0.00 C ATOM 306 O ASN A 107 -14.443 -2.003 7.187 1.00 0.00 O ATOM 307 CB ASN A 107 -11.908 -3.915 6.842 1.00 0.00 C ATOM 308 CG ASN A 107 -12.627 -4.414 8.080 1.00 0.00 C ATOM 309 OD1 ASN A 107 -13.762 -4.886 8.006 1.00 0.00 O ATOM 310 ND2 ASN A 107 -11.968 -4.312 9.229 1.00 0.00 N ATOM 0 H ASN A 107 -11.136 -3.010 4.673 1.00 0.00 H new ATOM 0 HA ASN A 107 -13.676 -3.887 5.621 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -11.426 -4.755 6.342 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -11.118 -3.224 7.138 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -12.401 -4.631 10.095 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -11.029 -3.914 9.245 1.00 0.00 H new ATOM 317 N ALA A 108 -12.762 -0.826 6.263 1.00 0.00 N ATOM 318 CA ALA A 108 -13.204 0.449 6.813 1.00 0.00 C ATOM 319 C ALA A 108 -13.189 0.424 8.337 1.00 0.00 C ATOM 320 O ALA A 108 -14.240 0.402 8.979 1.00 0.00 O ATOM 321 CB ALA A 108 -14.596 0.791 6.300 1.00 0.00 C ATOM 0 H ALA A 108 -11.917 -0.770 5.695 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.508 1.220 6.483 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -14.914 1.746 6.719 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -14.576 0.860 5.212 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -15.296 0.012 6.601 1.00 0.00 H new ATOM 327 N ASP A 109 -11.991 0.426 8.912 1.00 0.00 N ATOM 328 CA ASP A 109 -11.838 0.402 10.362 1.00 0.00 C ATOM 329 C ASP A 109 -10.887 1.500 10.830 1.00 0.00 C ATOM 330 O ASP A 109 -11.157 2.190 11.813 1.00 0.00 O ATOM 331 CB ASP A 109 -11.322 -0.963 10.819 1.00 0.00 C ATOM 332 CG ASP A 109 -9.986 -1.315 10.194 1.00 0.00 C ATOM 333 OD1 ASP A 109 -9.764 -0.947 9.021 1.00 0.00 O ATOM 334 OD2 ASP A 109 -9.162 -1.958 10.877 1.00 0.00 O ATOM 0 H ASP A 109 -11.112 0.444 8.396 1.00 0.00 H new ATOM 0 HA ASP A 109 -12.817 0.581 10.807 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -11.224 -0.967 11.905 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -12.053 -1.729 10.562 1.00 0.00 H new ATOM 339 N GLY A 110 -9.774 1.654 10.121 1.00 0.00 N ATOM 340 CA GLY A 110 -8.801 2.669 10.481 1.00 0.00 C ATOM 341 C GLY A 110 -7.378 2.237 10.186 1.00 0.00 C ATOM 342 O GLY A 110 -6.526 3.064 9.865 1.00 0.00 O ATOM 0 H GLY A 110 -9.528 1.095 9.304 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -9.019 3.587 9.936 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -8.895 2.899 11.542 1.00 0.00 H new ATOM 346 N TYR A 111 -7.124 0.936 10.295 1.00 0.00 N ATOM 347 CA TYR A 111 -5.796 0.385 10.037 1.00 0.00 C ATOM 348 C TYR A 111 -5.902 -0.907 9.234 1.00 0.00 C ATOM 349 O TYR A 111 -7.000 -1.339 8.882 1.00 0.00 O ATOM 350 CB TYR A 111 -5.048 0.121 11.352 1.00 0.00 C ATOM 351 CG TYR A 111 -5.891 0.314 12.595 1.00 0.00 C ATOM 352 CD1 TYR A 111 -6.179 1.586 13.071 1.00 0.00 C ATOM 353 CD2 TYR A 111 -6.398 -0.777 13.289 1.00 0.00 C ATOM 354 CE1 TYR A 111 -6.948 1.767 14.204 1.00 0.00 C ATOM 355 CE2 TYR A 111 -7.169 -0.605 14.424 1.00 0.00 C ATOM 356 CZ TYR A 111 -7.441 0.669 14.877 1.00 0.00 C ATOM 357 OH TYR A 111 -8.207 0.844 16.006 1.00 0.00 O ATOM 0 H TYR A 111 -7.822 0.242 10.561 1.00 0.00 H new ATOM 0 HA TYR A 111 -5.234 1.118 9.459 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -4.666 -0.900 11.341 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -4.185 0.784 11.405 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.795 2.449 12.546 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -6.187 -1.776 12.937 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -7.162 2.764 14.561 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -7.556 -1.463 14.953 1.00 0.00 H new ATOM 0 HH TYR A 111 -8.475 -0.030 16.358 1.00 0.00 H new ATOM 367 N ILE A 112 -4.759 -1.525 8.947 1.00 0.00 N ATOM 368 CA ILE A 112 -4.744 -2.770 8.187 1.00 0.00 C ATOM 369 C ILE A 112 -4.199 -3.920 9.028 1.00 0.00 C ATOM 370 O ILE A 112 -3.215 -3.764 9.750 1.00 0.00 O ATOM 371 CB ILE A 112 -3.896 -2.644 6.907 1.00 0.00 C ATOM 372 CG1 ILE A 112 -4.218 -1.336 6.178 1.00 0.00 C ATOM 373 CG2 ILE A 112 -4.134 -3.839 5.997 1.00 0.00 C ATOM 374 CD1 ILE A 112 -3.483 -1.175 4.864 1.00 0.00 C ATOM 0 H ILE A 112 -3.838 -1.187 9.227 1.00 0.00 H new ATOM 0 HA ILE A 112 -5.777 -2.979 7.909 1.00 0.00 H new ATOM 0 HB ILE A 112 -2.843 -2.628 7.187 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -5.291 -1.289 5.992 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.970 -0.497 6.828 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -3.529 -3.737 5.096 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -3.856 -4.755 6.519 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -5.188 -3.883 5.723 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.761 -0.226 4.405 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.408 -1.190 5.044 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.750 -1.993 4.195 1.00 0.00 H new ATOM 386 N ASP A 113 -4.849 -5.075 8.930 1.00 0.00 N ATOM 387 CA ASP A 113 -4.433 -6.252 9.682 1.00 0.00 C ATOM 388 C ASP A 113 -4.045 -7.389 8.742 1.00 0.00 C ATOM 389 O ASP A 113 -3.903 -7.190 7.536 1.00 0.00 O ATOM 390 CB ASP A 113 -5.555 -6.707 10.618 1.00 0.00 C ATOM 391 CG ASP A 113 -5.033 -7.162 11.967 1.00 0.00 C ATOM 392 OD1 ASP A 113 -4.391 -6.347 12.661 1.00 0.00 O ATOM 393 OD2 ASP A 113 -5.268 -8.335 12.329 1.00 0.00 O ATOM 0 H ASP A 113 -5.666 -5.221 8.337 1.00 0.00 H new ATOM 0 HA ASP A 113 -3.560 -5.983 10.277 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.259 -5.888 10.762 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -6.106 -7.523 10.151 1.00 0.00 H new ATOM 398 N LEU A 114 -3.876 -8.582 9.303 1.00 0.00 N ATOM 399 CA LEU A 114 -3.505 -9.751 8.515 1.00 0.00 C ATOM 400 C LEU A 114 -4.554 -10.043 7.446 1.00 0.00 C ATOM 401 O LEU A 114 -4.230 -10.519 6.358 1.00 0.00 O ATOM 402 CB LEU A 114 -3.328 -10.969 9.426 1.00 0.00 C ATOM 403 CG LEU A 114 -1.876 -11.334 9.741 1.00 0.00 C ATOM 404 CD1 LEU A 114 -1.742 -11.798 11.184 1.00 0.00 C ATOM 405 CD2 LEU A 114 -1.378 -12.409 8.785 1.00 0.00 C ATOM 0 H LEU A 114 -3.990 -8.764 10.300 1.00 0.00 H new ATOM 0 HA LEU A 114 -2.559 -9.539 8.017 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -3.852 -10.782 10.364 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.809 -11.827 8.958 1.00 0.00 H new ATOM 0 HG LEU A 114 -1.261 -10.444 9.609 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -0.702 -12.053 11.389 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -2.058 -10.999 11.854 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -2.369 -12.675 11.344 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.344 -12.657 9.023 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -1.997 -13.300 8.886 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -1.436 -12.040 7.761 1.00 0.00 H new ATOM 417 N GLU A 115 -5.812 -9.754 7.763 1.00 0.00 N ATOM 418 CA GLU A 115 -6.907 -9.985 6.828 1.00 0.00 C ATOM 419 C GLU A 115 -6.746 -9.122 5.581 1.00 0.00 C ATOM 420 O GLU A 115 -6.637 -9.637 4.469 1.00 0.00 O ATOM 421 CB GLU A 115 -8.250 -9.690 7.499 1.00 0.00 C ATOM 422 CG GLU A 115 -8.742 -10.849 8.342 1.00 0.00 C ATOM 423 OE1 GLU A 115 -9.009 -10.638 9.544 1.00 0.00 O ATOM 424 OE2 GLU A 115 -8.859 -11.969 7.801 1.00 0.00 O ATOM 0 H GLU A 115 -6.098 -9.360 8.659 1.00 0.00 H new ATOM 0 HA GLU A 115 -6.883 -11.033 6.529 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.153 -8.804 8.126 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.992 -9.460 6.735 1.00 0.00 H new ATOM 429 N GLU A 116 -6.731 -7.808 5.774 1.00 0.00 N ATOM 430 CA GLU A 116 -6.581 -6.877 4.663 1.00 0.00 C ATOM 431 C GLU A 116 -5.241 -7.080 3.964 1.00 0.00 C ATOM 432 O GLU A 116 -5.116 -6.848 2.761 1.00 0.00 O ATOM 433 CB GLU A 116 -6.702 -5.434 5.157 1.00 0.00 C ATOM 434 CG GLU A 116 -8.133 -5.005 5.436 1.00 0.00 C ATOM 435 CD GLU A 116 -8.299 -3.498 5.442 1.00 0.00 C ATOM 436 OE1 GLU A 116 -7.283 -2.790 5.603 1.00 0.00 O ATOM 437 OE2 GLU A 116 -9.445 -3.026 5.286 1.00 0.00 O ATOM 0 H GLU A 116 -6.821 -7.364 6.688 1.00 0.00 H new ATOM 0 HA GLU A 116 -7.378 -7.073 3.946 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -6.113 -5.320 6.067 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -6.270 -4.766 4.412 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -8.791 -5.436 4.682 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -8.447 -5.405 6.400 1.00 0.00 H new ATOM 444 N LEU A 117 -4.241 -7.520 4.723 1.00 0.00 N ATOM 445 CA LEU A 117 -2.911 -7.762 4.173 1.00 0.00 C ATOM 446 C LEU A 117 -2.985 -8.671 2.951 1.00 0.00 C ATOM 447 O LEU A 117 -2.123 -8.620 2.074 1.00 0.00 O ATOM 448 CB LEU A 117 -2.000 -8.382 5.237 1.00 0.00 C ATOM 449 CG LEU A 117 -0.708 -7.611 5.512 1.00 0.00 C ATOM 450 CD1 LEU A 117 0.172 -7.584 4.271 1.00 0.00 C ATOM 451 CD2 LEU A 117 -1.021 -6.197 5.977 1.00 0.00 C ATOM 0 H LEU A 117 -4.327 -7.716 5.720 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.492 -6.804 3.863 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.560 -8.467 6.168 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.742 -9.395 4.927 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.164 -8.122 6.307 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.087 -7.031 4.485 1.00 0.00 H new ATOM 0 HD12 LEU A 117 0.424 -8.604 3.981 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.363 -7.097 3.456 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.090 -5.663 6.168 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.586 -5.676 5.204 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.611 -6.237 6.893 1.00 0.00 H new ATOM 463 N LYS A 118 -4.024 -9.496 2.895 1.00 0.00 N ATOM 464 CA LYS A 118 -4.208 -10.405 1.775 1.00 0.00 C ATOM 465 C LYS A 118 -4.445 -9.625 0.488 1.00 0.00 C ATOM 466 O LYS A 118 -4.089 -10.078 -0.600 1.00 0.00 O ATOM 467 CB LYS A 118 -5.378 -11.350 2.039 1.00 0.00 C ATOM 468 CG LYS A 118 -5.559 -12.401 0.958 1.00 0.00 C ATOM 469 CD LYS A 118 -7.018 -12.788 0.797 1.00 0.00 C ATOM 470 CE LYS A 118 -7.829 -11.661 0.176 1.00 0.00 C ATOM 471 NZ LYS A 118 -7.778 -11.694 -1.312 1.00 0.00 N ATOM 0 H LYS A 118 -4.749 -9.553 3.611 1.00 0.00 H new ATOM 0 HA LYS A 118 -3.300 -10.997 1.663 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -5.225 -11.847 2.997 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -6.295 -10.766 2.125 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -5.176 -12.020 0.011 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -4.972 -13.285 1.207 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -7.092 -13.678 0.172 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -7.437 -13.045 1.770 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -8.865 -11.736 0.505 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -7.450 -10.703 0.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -8.343 -10.910 -1.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -6.792 -11.597 -1.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -8.163 -12.598 -1.653 1.00 0.00 H new ATOM 485 N ILE A 119 -5.041 -8.443 0.621 1.00 0.00 N ATOM 486 CA ILE A 119 -5.316 -7.592 -0.530 1.00 0.00 C ATOM 487 C ILE A 119 -4.041 -7.345 -1.332 1.00 0.00 C ATOM 488 O ILE A 119 -4.087 -7.150 -2.546 1.00 0.00 O ATOM 489 CB ILE A 119 -5.925 -6.243 -0.096 1.00 0.00 C ATOM 490 CG1 ILE A 119 -7.244 -6.475 0.642 1.00 0.00 C ATOM 491 CG2 ILE A 119 -6.141 -5.335 -1.300 1.00 0.00 C ATOM 492 CD1 ILE A 119 -7.486 -5.500 1.773 1.00 0.00 C ATOM 0 H ILE A 119 -5.342 -8.054 1.515 1.00 0.00 H new ATOM 0 HA ILE A 119 -6.040 -8.112 -1.157 1.00 0.00 H new ATOM 0 HB ILE A 119 -5.226 -5.750 0.579 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -8.066 -6.404 -0.070 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -7.254 -7.490 1.040 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -6.571 -4.389 -0.970 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -5.186 -5.148 -1.790 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -6.821 -5.817 -2.002 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -8.440 -5.726 2.250 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -6.684 -5.587 2.506 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -7.509 -4.484 1.379 1.00 0.00 H new ATOM 504 N MET A 120 -2.904 -7.369 -0.643 1.00 0.00 N ATOM 505 CA MET A 120 -1.616 -7.163 -1.293 1.00 0.00 C ATOM 506 C MET A 120 -1.279 -8.367 -2.162 1.00 0.00 C ATOM 507 O MET A 120 -0.695 -8.232 -3.237 1.00 0.00 O ATOM 508 CB MET A 120 -0.511 -6.946 -0.253 1.00 0.00 C ATOM 509 CG MET A 120 -0.961 -6.165 0.974 1.00 0.00 C ATOM 510 SD MET A 120 0.012 -4.671 1.248 1.00 0.00 S ATOM 511 CE MET A 120 -0.889 -3.927 2.605 1.00 0.00 C ATOM 0 H MET A 120 -2.849 -7.529 0.363 1.00 0.00 H new ATOM 0 HA MET A 120 -1.682 -6.272 -1.917 1.00 0.00 H new ATOM 0 HB2 MET A 120 -0.131 -7.916 0.066 1.00 0.00 H new ATOM 0 HB3 MET A 120 0.318 -6.418 -0.724 1.00 0.00 H new ATOM 0 HG2 MET A 120 -2.011 -5.894 0.861 1.00 0.00 H new ATOM 0 HG3 MET A 120 -0.890 -6.806 1.853 1.00 0.00 H new ATOM 0 HE1 MET A 120 -1.145 -2.898 2.351 1.00 0.00 H new ATOM 0 HE2 MET A 120 -1.802 -4.493 2.789 1.00 0.00 H new ATOM 0 HE3 MET A 120 -0.269 -3.936 3.502 1.00 0.00 H new ATOM 521 N LEU A 121 -1.662 -9.546 -1.683 1.00 0.00 N ATOM 522 CA LEU A 121 -1.416 -10.788 -2.406 1.00 0.00 C ATOM 523 C LEU A 121 -2.086 -10.757 -3.776 1.00 0.00 C ATOM 524 O LEU A 121 -1.571 -11.316 -4.744 1.00 0.00 O ATOM 525 CB LEU A 121 -1.938 -11.978 -1.598 1.00 0.00 C ATOM 526 CG LEU A 121 -1.096 -13.250 -1.694 1.00 0.00 C ATOM 527 CD1 LEU A 121 -1.027 -13.741 -3.133 1.00 0.00 C ATOM 528 CD2 LEU A 121 0.301 -13.006 -1.141 1.00 0.00 C ATOM 0 H LEU A 121 -2.146 -9.667 -0.793 1.00 0.00 H new ATOM 0 HA LEU A 121 -0.341 -10.895 -2.549 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -2.005 -11.684 -0.551 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.951 -12.206 -1.930 1.00 0.00 H new ATOM 0 HG LEU A 121 -1.573 -14.025 -1.093 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -0.423 -14.647 -3.180 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -2.033 -13.956 -3.493 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.575 -12.971 -3.759 1.00 0.00 H new ATOM 0 HD21 LEU A 121 0.887 -13.922 -1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.786 -12.216 -1.714 1.00 0.00 H new ATOM 0 HD23 LEU A 121 0.231 -12.705 -0.096 1.00 0.00 H new ATOM 540 N GLN A 122 -3.238 -10.097 -3.852 1.00 0.00 N ATOM 541 CA GLN A 122 -3.978 -9.990 -5.106 1.00 0.00 C ATOM 542 C GLN A 122 -3.075 -9.485 -6.229 1.00 0.00 C ATOM 543 O GLN A 122 -3.308 -9.769 -7.403 1.00 0.00 O ATOM 544 CB GLN A 122 -5.178 -9.055 -4.936 1.00 0.00 C ATOM 545 CG GLN A 122 -6.518 -9.772 -4.977 1.00 0.00 C ATOM 546 CD GLN A 122 -7.693 -8.815 -4.929 1.00 0.00 C ATOM 547 OE1 GLN A 122 -8.165 -8.342 -5.963 1.00 0.00 O ATOM 548 NE2 GLN A 122 -8.170 -8.524 -3.725 1.00 0.00 N ATOM 0 H GLN A 122 -3.679 -9.628 -3.061 1.00 0.00 H new ATOM 0 HA GLN A 122 -4.338 -10.983 -5.374 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -5.086 -8.528 -3.986 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -5.155 -8.301 -5.722 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -6.578 -10.370 -5.886 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -6.582 -10.463 -4.136 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -7.747 -8.940 -2.895 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -8.959 -7.885 -3.630 1.00 0.00 H new ATOM 557 N ALA A 123 -2.042 -8.736 -5.855 1.00 0.00 N ATOM 558 CA ALA A 123 -1.101 -8.191 -6.825 1.00 0.00 C ATOM 559 C ALA A 123 -0.151 -9.269 -7.340 1.00 0.00 C ATOM 560 O ALA A 123 0.410 -9.144 -8.429 1.00 0.00 O ATOM 561 CB ALA A 123 -0.316 -7.045 -6.207 1.00 0.00 C ATOM 0 H ALA A 123 -1.836 -8.493 -4.886 1.00 0.00 H new ATOM 0 HA ALA A 123 -1.671 -7.814 -7.674 1.00 0.00 H new ATOM 0 HB1 ALA A 123 0.384 -6.646 -6.941 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -1.004 -6.259 -5.896 1.00 0.00 H new ATOM 0 HB3 ALA A 123 0.236 -7.408 -5.340 1.00 0.00 H new ATOM 567 N THR A 124 0.026 -10.327 -6.554 1.00 0.00 N ATOM 568 CA THR A 124 0.910 -11.421 -6.936 1.00 0.00 C ATOM 569 C THR A 124 0.146 -12.485 -7.718 1.00 0.00 C ATOM 570 O THR A 124 0.610 -12.960 -8.755 1.00 0.00 O ATOM 571 CB THR A 124 1.556 -12.042 -5.695 1.00 0.00 C ATOM 572 OG1 THR A 124 0.832 -11.698 -4.527 1.00 0.00 O ATOM 573 CG2 THR A 124 2.990 -11.609 -5.487 1.00 0.00 C ATOM 0 H THR A 124 -0.431 -10.449 -5.650 1.00 0.00 H new ATOM 0 HA THR A 124 1.694 -11.018 -7.577 1.00 0.00 H new ATOM 0 HB THR A 124 1.539 -13.118 -5.869 1.00 0.00 H new ATOM 0 HG1 THR A 124 -0.121 -11.881 -4.667 1.00 0.00 H new ATOM 0 HG21 THR A 124 3.388 -12.085 -4.591 1.00 0.00 H new ATOM 0 HG22 THR A 124 3.588 -11.903 -6.350 1.00 0.00 H new ATOM 0 HG23 THR A 124 3.030 -10.526 -5.370 1.00 0.00 H new ATOM 581 N GLY A 125 -1.028 -12.850 -7.216 1.00 0.00 N ATOM 582 CA GLY A 125 -1.839 -13.851 -7.882 1.00 0.00 C ATOM 583 C GLY A 125 -1.571 -15.254 -7.373 1.00 0.00 C ATOM 584 O GLY A 125 -2.291 -15.755 -6.509 1.00 0.00 O ATOM 0 H GLY A 125 -1.432 -12.471 -6.360 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -2.893 -13.612 -7.740 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -1.646 -13.815 -8.954 1.00 0.00 H new ATOM 588 N GLU A 126 -0.535 -15.890 -7.910 1.00 0.00 N ATOM 589 CA GLU A 126 -0.178 -17.245 -7.506 1.00 0.00 C ATOM 590 C GLU A 126 1.336 -17.439 -7.524 1.00 0.00 C ATOM 591 O GLU A 126 1.965 -17.401 -8.582 1.00 0.00 O ATOM 592 CB GLU A 126 -0.851 -18.267 -8.426 1.00 0.00 C ATOM 593 CG GLU A 126 -1.792 -19.212 -7.698 1.00 0.00 C ATOM 594 CD GLU A 126 -1.138 -20.535 -7.353 1.00 0.00 C ATOM 595 OE1 GLU A 126 -0.860 -21.320 -8.284 1.00 0.00 O ATOM 596 OE2 GLU A 126 -0.905 -20.787 -6.152 1.00 0.00 O ATOM 0 H GLU A 126 0.072 -15.489 -8.625 1.00 0.00 H new ATOM 0 HA GLU A 126 -0.530 -17.399 -6.486 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -1.408 -17.737 -9.199 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -0.082 -18.851 -8.931 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -2.143 -18.735 -6.783 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -2.669 -19.395 -8.319 1.00 0.00 H new ATOM 603 N THR A 127 1.914 -17.648 -6.345 1.00 0.00 N ATOM 604 CA THR A 127 3.354 -17.851 -6.218 1.00 0.00 C ATOM 605 C THR A 127 3.758 -17.948 -4.750 1.00 0.00 C ATOM 606 O THR A 127 4.653 -18.712 -4.390 1.00 0.00 O ATOM 607 CB THR A 127 4.118 -16.708 -6.893 1.00 0.00 C ATOM 608 OG1 THR A 127 5.488 -16.740 -6.534 1.00 0.00 O ATOM 609 CG2 THR A 127 3.581 -15.338 -6.538 1.00 0.00 C ATOM 0 H THR A 127 1.406 -17.681 -5.461 1.00 0.00 H new ATOM 0 HA THR A 127 3.608 -18.788 -6.713 1.00 0.00 H new ATOM 0 HB THR A 127 3.987 -16.865 -7.964 1.00 0.00 H new ATOM 0 HG1 THR A 127 5.959 -16.003 -6.976 1.00 0.00 H new ATOM 0 HG21 THR A 127 4.167 -14.574 -7.049 1.00 0.00 H new ATOM 0 HG22 THR A 127 2.539 -15.264 -6.848 1.00 0.00 H new ATOM 0 HG23 THR A 127 3.650 -15.188 -5.461 1.00 0.00 H new ATOM 617 N ILE A 128 3.089 -17.167 -3.910 1.00 0.00 N ATOM 618 CA ILE A 128 3.371 -17.158 -2.478 1.00 0.00 C ATOM 619 C ILE A 128 2.102 -17.435 -1.673 1.00 0.00 C ATOM 620 O ILE A 128 1.853 -18.568 -1.263 1.00 0.00 O ATOM 621 CB ILE A 128 3.986 -15.813 -2.025 1.00 0.00 C ATOM 622 CG1 ILE A 128 3.601 -14.686 -2.990 1.00 0.00 C ATOM 623 CG2 ILE A 128 5.500 -15.930 -1.924 1.00 0.00 C ATOM 624 CD1 ILE A 128 3.680 -13.307 -2.374 1.00 0.00 C ATOM 0 H ILE A 128 2.345 -16.530 -4.196 1.00 0.00 H new ATOM 0 HA ILE A 128 4.097 -17.949 -2.291 1.00 0.00 H new ATOM 0 HB ILE A 128 3.588 -15.570 -1.040 1.00 0.00 H new ATOM 0 HG12 ILE A 128 4.257 -14.724 -3.860 1.00 0.00 H new ATOM 0 HG13 ILE A 128 2.586 -14.857 -3.348 1.00 0.00 H new ATOM 0 HG21 ILE A 128 5.918 -14.976 -1.604 1.00 0.00 H new ATOM 0 HG22 ILE A 128 5.758 -16.701 -1.198 1.00 0.00 H new ATOM 0 HG23 ILE A 128 5.910 -16.198 -2.898 1.00 0.00 H new ATOM 0 HD11 ILE A 128 3.394 -12.561 -3.115 1.00 0.00 H new ATOM 0 HD12 ILE A 128 3.003 -13.250 -1.521 1.00 0.00 H new ATOM 0 HD13 ILE A 128 4.700 -13.115 -2.041 1.00 0.00 H new ATOM 636 N THR A 129 1.299 -16.395 -1.460 1.00 0.00 N ATOM 637 CA THR A 129 0.049 -16.523 -0.715 1.00 0.00 C ATOM 638 C THR A 129 0.295 -16.998 0.715 1.00 0.00 C ATOM 639 O THR A 129 1.201 -17.789 0.973 1.00 0.00 O ATOM 640 CB THR A 129 -0.904 -17.489 -1.426 1.00 0.00 C ATOM 641 OG1 THR A 129 -0.586 -18.833 -1.112 1.00 0.00 O ATOM 642 CG2 THR A 129 -0.885 -17.355 -2.935 1.00 0.00 C ATOM 0 H THR A 129 1.493 -15.451 -1.794 1.00 0.00 H new ATOM 0 HA THR A 129 -0.408 -15.534 -0.672 1.00 0.00 H new ATOM 0 HB THR A 129 -1.898 -17.223 -1.067 1.00 0.00 H new ATOM 0 HG1 THR A 129 0.296 -19.054 -1.477 1.00 0.00 H new ATOM 0 HG21 THR A 129 -1.583 -18.069 -3.372 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.178 -16.343 -3.214 1.00 0.00 H new ATOM 0 HG23 THR A 129 0.120 -17.557 -3.306 1.00 0.00 H new ATOM 650 N GLU A 130 -0.530 -16.510 1.638 1.00 0.00 N ATOM 651 CA GLU A 130 -0.422 -16.880 3.046 1.00 0.00 C ATOM 652 C GLU A 130 0.914 -16.439 3.639 1.00 0.00 C ATOM 653 O GLU A 130 0.985 -15.438 4.351 1.00 0.00 O ATOM 654 CB GLU A 130 -0.599 -18.390 3.211 1.00 0.00 C ATOM 655 CG GLU A 130 -1.995 -18.875 2.856 1.00 0.00 C ATOM 656 CD GLU A 130 -2.656 -19.638 3.987 1.00 0.00 C ATOM 657 OE1 GLU A 130 -2.435 -20.863 4.086 1.00 0.00 O ATOM 658 OE2 GLU A 130 -3.395 -19.010 4.775 1.00 0.00 O ATOM 0 H GLU A 130 -1.284 -15.854 1.434 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.215 -16.365 3.588 1.00 0.00 H new ATOM 0 HB2 GLU A 130 0.128 -18.905 2.582 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.378 -18.664 4.243 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -2.615 -18.019 2.590 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -1.940 -19.515 1.975 1.00 0.00 H new ATOM 665 N ASP A 131 1.971 -17.193 3.348 1.00 0.00 N ATOM 666 CA ASP A 131 3.302 -16.876 3.859 1.00 0.00 C ATOM 667 C ASP A 131 3.634 -15.401 3.653 1.00 0.00 C ATOM 668 O ASP A 131 4.072 -14.719 4.579 1.00 0.00 O ATOM 669 CB ASP A 131 4.355 -17.748 3.173 1.00 0.00 C ATOM 670 CG ASP A 131 4.453 -19.130 3.789 1.00 0.00 C ATOM 671 OD1 ASP A 131 3.723 -20.036 3.334 1.00 0.00 O ATOM 672 OD2 ASP A 131 5.258 -19.306 4.727 1.00 0.00 O ATOM 0 H ASP A 131 1.932 -18.027 2.762 1.00 0.00 H new ATOM 0 HA ASP A 131 3.308 -17.082 4.929 1.00 0.00 H new ATOM 0 HB2 ASP A 131 4.112 -17.842 2.115 1.00 0.00 H new ATOM 0 HB3 ASP A 131 5.326 -17.256 3.235 1.00 0.00 H new ATOM 677 N ASP A 132 3.418 -14.914 2.436 1.00 0.00 N ATOM 678 CA ASP A 132 3.690 -13.518 2.116 1.00 0.00 C ATOM 679 C ASP A 132 2.749 -12.592 2.880 1.00 0.00 C ATOM 680 O ASP A 132 3.082 -11.438 3.148 1.00 0.00 O ATOM 681 CB ASP A 132 3.549 -13.277 0.612 1.00 0.00 C ATOM 682 CG ASP A 132 3.901 -11.855 0.220 1.00 0.00 C ATOM 683 OD1 ASP A 132 5.101 -11.576 0.015 1.00 0.00 O ATOM 684 OD2 ASP A 132 2.976 -11.022 0.116 1.00 0.00 O ATOM 0 H ASP A 132 3.056 -15.464 1.657 1.00 0.00 H new ATOM 0 HA ASP A 132 4.714 -13.297 2.417 1.00 0.00 H new ATOM 0 HB2 ASP A 132 4.195 -13.970 0.073 1.00 0.00 H new ATOM 0 HB3 ASP A 132 2.525 -13.493 0.306 1.00 0.00 H new ATOM 689 N ILE A 133 1.575 -13.107 3.234 1.00 0.00 N ATOM 690 CA ILE A 133 0.593 -12.324 3.971 1.00 0.00 C ATOM 691 C ILE A 133 1.157 -11.880 5.316 1.00 0.00 C ATOM 692 O ILE A 133 1.137 -10.696 5.651 1.00 0.00 O ATOM 693 CB ILE A 133 -0.703 -13.122 4.223 1.00 0.00 C ATOM 694 CG1 ILE A 133 -1.203 -13.779 2.931 1.00 0.00 C ATOM 695 CG2 ILE A 133 -1.769 -12.213 4.816 1.00 0.00 C ATOM 696 CD1 ILE A 133 -1.712 -12.797 1.897 1.00 0.00 C ATOM 0 H ILE A 133 1.283 -14.061 3.022 1.00 0.00 H new ATOM 0 HA ILE A 133 0.360 -11.454 3.357 1.00 0.00 H new ATOM 0 HB ILE A 133 -0.487 -13.917 4.937 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -0.392 -14.362 2.495 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -2.002 -14.478 3.177 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -2.680 -12.786 4.990 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -1.412 -11.802 5.761 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -1.980 -11.399 4.123 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -2.047 -13.340 1.013 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -2.545 -12.230 2.312 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -0.910 -12.112 1.620 1.00 0.00 H new ATOM 708 N GLU A 134 1.655 -12.844 6.082 1.00 0.00 N ATOM 709 CA GLU A 134 2.225 -12.567 7.395 1.00 0.00 C ATOM 710 C GLU A 134 3.607 -11.930 7.275 1.00 0.00 C ATOM 711 O GLU A 134 4.070 -11.257 8.195 1.00 0.00 O ATOM 712 CB GLU A 134 2.318 -13.859 8.211 1.00 0.00 C ATOM 713 CG GLU A 134 1.103 -14.114 9.088 1.00 0.00 C ATOM 714 CD GLU A 134 1.321 -15.250 10.068 1.00 0.00 C ATOM 715 OE1 GLU A 134 1.472 -16.404 9.615 1.00 0.00 O ATOM 716 OE2 GLU A 134 1.341 -14.986 11.289 1.00 0.00 O ATOM 0 H GLU A 134 1.675 -13.828 5.815 1.00 0.00 H new ATOM 0 HA GLU A 134 1.568 -11.862 7.905 1.00 0.00 H new ATOM 0 HB2 GLU A 134 2.447 -14.700 7.530 1.00 0.00 H new ATOM 0 HB3 GLU A 134 3.207 -13.818 8.840 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.860 -13.205 9.639 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.245 -14.343 8.456 1.00 0.00 H new ATOM 723 N GLU A 135 4.265 -12.153 6.142 1.00 0.00 N ATOM 724 CA GLU A 135 5.597 -11.604 5.916 1.00 0.00 C ATOM 725 C GLU A 135 5.533 -10.123 5.563 1.00 0.00 C ATOM 726 O GLU A 135 6.339 -9.329 6.050 1.00 0.00 O ATOM 727 CB GLU A 135 6.312 -12.379 4.806 1.00 0.00 C ATOM 728 CG GLU A 135 7.619 -13.012 5.253 1.00 0.00 C ATOM 729 CD GLU A 135 8.715 -12.884 4.213 1.00 0.00 C ATOM 730 OE1 GLU A 135 8.521 -13.381 3.083 1.00 0.00 O ATOM 731 OE2 GLU A 135 9.766 -12.288 4.527 1.00 0.00 O ATOM 0 H GLU A 135 3.899 -12.708 5.368 1.00 0.00 H new ATOM 0 HA GLU A 135 6.162 -11.707 6.843 1.00 0.00 H new ATOM 0 HB2 GLU A 135 5.648 -13.159 4.433 1.00 0.00 H new ATOM 0 HB3 GLU A 135 6.510 -11.705 3.973 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.947 -12.543 6.181 1.00 0.00 H new ATOM 0 HG3 GLU A 135 7.452 -14.067 5.471 1.00 0.00 H new ATOM 738 N LEU A 136 4.577 -9.748 4.719 1.00 0.00 N ATOM 739 CA LEU A 136 4.435 -8.354 4.322 1.00 0.00 C ATOM 740 C LEU A 136 3.852 -7.533 5.466 1.00 0.00 C ATOM 741 O LEU A 136 4.216 -6.374 5.663 1.00 0.00 O ATOM 742 CB LEU A 136 3.553 -8.227 3.074 1.00 0.00 C ATOM 743 CG LEU A 136 3.094 -6.802 2.728 1.00 0.00 C ATOM 744 CD1 LEU A 136 4.216 -5.794 2.944 1.00 0.00 C ATOM 745 CD2 LEU A 136 2.594 -6.739 1.292 1.00 0.00 C ATOM 0 H LEU A 136 3.897 -10.383 4.301 1.00 0.00 H new ATOM 0 HA LEU A 136 5.425 -7.968 4.081 1.00 0.00 H new ATOM 0 HB2 LEU A 136 4.100 -8.630 2.222 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.670 -8.851 3.210 1.00 0.00 H new ATOM 0 HG LEU A 136 2.274 -6.542 3.397 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.861 -4.795 2.691 1.00 0.00 H new ATOM 0 HD12 LEU A 136 4.528 -5.815 3.988 1.00 0.00 H new ATOM 0 HD13 LEU A 136 5.063 -6.050 2.308 1.00 0.00 H new ATOM 0 HD21 LEU A 136 2.273 -5.723 1.063 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.397 -7.027 0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 136 1.753 -7.422 1.169 1.00 0.00 H new ATOM 757 N MET A 137 2.949 -8.148 6.221 1.00 0.00 N ATOM 758 CA MET A 137 2.315 -7.486 7.355 1.00 0.00 C ATOM 759 C MET A 137 3.363 -6.853 8.264 1.00 0.00 C ATOM 760 O MET A 137 3.128 -5.804 8.864 1.00 0.00 O ATOM 761 CB MET A 137 1.470 -8.485 8.149 1.00 0.00 C ATOM 762 CG MET A 137 0.313 -7.844 8.897 1.00 0.00 C ATOM 763 SD MET A 137 0.722 -7.459 10.611 1.00 0.00 S ATOM 764 CE MET A 137 -0.420 -6.118 10.939 1.00 0.00 C ATOM 0 H MET A 137 2.639 -9.107 6.068 1.00 0.00 H new ATOM 0 HA MET A 137 1.666 -6.699 6.971 1.00 0.00 H new ATOM 0 HB2 MET A 137 1.077 -9.239 7.467 1.00 0.00 H new ATOM 0 HB3 MET A 137 2.110 -9.003 8.863 1.00 0.00 H new ATOM 0 HG2 MET A 137 0.016 -6.929 8.384 1.00 0.00 H new ATOM 0 HG3 MET A 137 -0.546 -8.515 8.874 1.00 0.00 H new ATOM 0 HE1 MET A 137 0.124 -5.174 10.962 1.00 0.00 H new ATOM 0 HE2 MET A 137 -1.175 -6.083 10.153 1.00 0.00 H new ATOM 0 HE3 MET A 137 -0.905 -6.281 11.901 1.00 0.00 H new ATOM 774 N LYS A 138 4.523 -7.496 8.356 1.00 0.00 N ATOM 775 CA LYS A 138 5.610 -6.993 9.185 1.00 0.00 C ATOM 776 C LYS A 138 6.089 -5.632 8.683 1.00 0.00 C ATOM 777 O LYS A 138 6.648 -4.841 9.442 1.00 0.00 O ATOM 778 CB LYS A 138 6.774 -7.988 9.197 1.00 0.00 C ATOM 779 CG LYS A 138 7.263 -8.335 10.593 1.00 0.00 C ATOM 780 CD LYS A 138 7.916 -9.707 10.630 1.00 0.00 C ATOM 781 CE LYS A 138 9.344 -9.657 10.110 1.00 0.00 C ATOM 782 NZ LYS A 138 10.317 -9.333 11.188 1.00 0.00 N ATOM 0 H LYS A 138 4.733 -8.366 7.867 1.00 0.00 H new ATOM 0 HA LYS A 138 5.236 -6.874 10.202 1.00 0.00 H new ATOM 0 HB2 LYS A 138 6.464 -8.903 8.692 1.00 0.00 H new ATOM 0 HB3 LYS A 138 7.603 -7.572 8.624 1.00 0.00 H new ATOM 0 HG2 LYS A 138 7.977 -7.582 10.927 1.00 0.00 H new ATOM 0 HG3 LYS A 138 6.425 -8.311 11.290 1.00 0.00 H new ATOM 0 HD2 LYS A 138 7.913 -10.086 11.652 1.00 0.00 H new ATOM 0 HD3 LYS A 138 7.333 -10.405 10.030 1.00 0.00 H new ATOM 0 HE2 LYS A 138 9.602 -10.618 9.665 1.00 0.00 H new ATOM 0 HE3 LYS A 138 9.416 -8.910 9.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 11.278 -9.309 10.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 10.087 -8.404 11.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 10.267 -10.059 11.931 1.00 0.00 H new ATOM 796 N ASP A 139 5.864 -5.367 7.398 1.00 0.00 N ATOM 797 CA ASP A 139 6.271 -4.103 6.795 1.00 0.00 C ATOM 798 C ASP A 139 5.226 -3.019 7.042 1.00 0.00 C ATOM 799 O ASP A 139 5.563 -1.884 7.378 1.00 0.00 O ATOM 800 CB ASP A 139 6.497 -4.281 5.292 1.00 0.00 C ATOM 801 CG ASP A 139 7.969 -4.347 4.933 1.00 0.00 C ATOM 802 OD1 ASP A 139 8.746 -3.525 5.462 1.00 0.00 O ATOM 803 OD2 ASP A 139 8.344 -5.220 4.123 1.00 0.00 O ATOM 0 H ASP A 139 5.402 -6.011 6.756 1.00 0.00 H new ATOM 0 HA ASP A 139 7.206 -3.791 7.261 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.003 -5.194 4.959 1.00 0.00 H new ATOM 0 HB3 ASP A 139 6.032 -3.453 4.757 1.00 0.00 H new ATOM 808 N GLY A 140 3.955 -3.377 6.875 1.00 0.00 N ATOM 809 CA GLY A 140 2.881 -2.421 7.086 1.00 0.00 C ATOM 810 C GLY A 140 2.955 -1.760 8.448 1.00 0.00 C ATOM 811 O GLY A 140 3.046 -0.537 8.548 1.00 0.00 O ATOM 0 H GLY A 140 3.650 -4.310 6.598 1.00 0.00 H new ATOM 0 HA2 GLY A 140 2.922 -1.656 6.311 1.00 0.00 H new ATOM 0 HA3 GLY A 140 1.922 -2.928 6.983 1.00 0.00 H new ATOM 815 N ASP A 141 2.919 -2.571 9.498 1.00 0.00 N ATOM 816 CA ASP A 141 2.984 -2.061 10.861 1.00 0.00 C ATOM 817 C ASP A 141 4.428 -1.771 11.265 1.00 0.00 C ATOM 818 O ASP A 141 4.851 -0.615 11.304 1.00 0.00 O ATOM 819 CB ASP A 141 2.354 -3.064 11.830 1.00 0.00 C ATOM 820 CG ASP A 141 2.460 -2.622 13.277 1.00 0.00 C ATOM 821 OD1 ASP A 141 2.305 -1.410 13.539 1.00 0.00 O ATOM 822 OD2 ASP A 141 2.698 -3.487 14.146 1.00 0.00 O ATOM 0 H ASP A 141 2.845 -3.586 9.431 1.00 0.00 H new ATOM 0 HA ASP A 141 2.424 -1.127 10.904 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.304 -3.202 11.572 1.00 0.00 H new ATOM 0 HB3 ASP A 141 2.841 -4.032 11.713 1.00 0.00 H new ATOM 827 N LYS A 142 5.179 -2.825 11.563 1.00 0.00 N ATOM 828 CA LYS A 142 6.574 -2.680 11.963 1.00 0.00 C ATOM 829 C LYS A 142 6.695 -1.840 13.231 1.00 0.00 C ATOM 830 O LYS A 142 7.703 -1.168 13.448 1.00 0.00 O ATOM 831 CB LYS A 142 7.385 -2.039 10.835 1.00 0.00 C ATOM 832 CG LYS A 142 8.888 -2.173 11.014 1.00 0.00 C ATOM 833 CD LYS A 142 9.598 -2.313 9.677 1.00 0.00 C ATOM 834 CE LYS A 142 9.439 -1.062 8.829 1.00 0.00 C ATOM 835 NZ LYS A 142 9.873 -1.285 7.422 1.00 0.00 N ATOM 0 H LYS A 142 4.846 -3.789 11.535 1.00 0.00 H new ATOM 0 HA LYS A 142 6.971 -3.674 12.169 1.00 0.00 H new ATOM 0 HB2 LYS A 142 7.098 -2.496 9.888 1.00 0.00 H new ATOM 0 HB3 LYS A 142 7.128 -0.982 10.770 1.00 0.00 H new ATOM 0 HG2 LYS A 142 9.272 -1.300 11.541 1.00 0.00 H new ATOM 0 HG3 LYS A 142 9.105 -3.042 11.635 1.00 0.00 H new ATOM 0 HD2 LYS A 142 10.657 -2.508 9.845 1.00 0.00 H new ATOM 0 HD3 LYS A 142 9.197 -3.172 9.139 1.00 0.00 H new ATOM 0 HE2 LYS A 142 8.396 -0.746 8.841 1.00 0.00 H new ATOM 0 HE3 LYS A 142 10.023 -0.252 9.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 9.686 -0.429 6.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 10.891 -1.496 7.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 9.346 -2.086 7.019 1.00 0.00 H new ATOM 849 N ASN A 143 5.662 -1.884 14.067 1.00 0.00 N ATOM 850 CA ASN A 143 5.654 -1.127 15.315 1.00 0.00 C ATOM 851 C ASN A 143 5.597 -2.056 16.528 1.00 0.00 C ATOM 852 O ASN A 143 5.594 -1.597 17.670 1.00 0.00 O ATOM 853 CB ASN A 143 4.467 -0.161 15.340 1.00 0.00 C ATOM 854 CG ASN A 143 4.882 1.258 15.676 1.00 0.00 C ATOM 855 OD1 ASN A 143 6.067 1.594 15.651 1.00 0.00 O ATOM 856 ND2 ASN A 143 3.906 2.101 15.994 1.00 0.00 N ATOM 0 H ASN A 143 4.820 -2.436 13.903 1.00 0.00 H new ATOM 0 HA ASN A 143 6.582 -0.558 15.367 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.973 -0.172 14.368 1.00 0.00 H new ATOM 0 HB3 ASN A 143 3.737 -0.506 16.072 1.00 0.00 H new ATOM 0 HD21 ASN A 143 4.125 3.069 16.230 1.00 0.00 H new ATOM 0 HD22 ASN A 143 2.938 1.780 16.002 1.00 0.00 H new ATOM 863 N ASN A 144 5.553 -3.364 16.277 1.00 0.00 N ATOM 864 CA ASN A 144 5.497 -4.349 17.353 1.00 0.00 C ATOM 865 C ASN A 144 4.185 -4.249 18.125 1.00 0.00 C ATOM 866 O ASN A 144 4.114 -4.618 19.297 1.00 0.00 O ATOM 867 CB ASN A 144 6.679 -4.164 18.308 1.00 0.00 C ATOM 868 CG ASN A 144 7.198 -5.482 18.848 1.00 0.00 C ATOM 869 OD1 ASN A 144 8.416 -5.842 18.461 1.00 0.00 O flip ATOM 870 ND2 ASN A 144 6.512 -6.170 19.605 1.00 0.00 N flip ATOM 0 H ASN A 144 5.555 -3.764 15.339 1.00 0.00 H new ATOM 0 HA ASN A 144 5.554 -5.339 16.901 1.00 0.00 H new ATOM 0 HB2 ASN A 144 7.484 -3.645 17.788 1.00 0.00 H new ATOM 0 HB3 ASN A 144 6.375 -3.528 19.140 1.00 0.00 H new ATOM 0 HD21 ASN A 144 5.581 -5.855 19.877 1.00 0.00 H new ATOM 0 HD22 ASN A 144 6.875 -7.055 19.960 1.00 0.00 H new ATOM 877 N ASP A 145 3.146 -3.751 17.460 1.00 0.00 N ATOM 878 CA ASP A 145 1.836 -3.607 18.086 1.00 0.00 C ATOM 879 C ASP A 145 0.764 -4.325 17.271 1.00 0.00 C ATOM 880 O ASP A 145 -0.142 -4.945 17.829 1.00 0.00 O ATOM 881 CB ASP A 145 1.476 -2.128 18.238 1.00 0.00 C ATOM 882 CG ASP A 145 1.451 -1.399 16.909 1.00 0.00 C ATOM 883 OD1 ASP A 145 2.037 -1.918 15.937 1.00 0.00 O ATOM 884 OD2 ASP A 145 0.847 -0.308 16.841 1.00 0.00 O ATOM 0 H ASP A 145 3.186 -3.441 16.489 1.00 0.00 H new ATOM 0 HA ASP A 145 1.882 -4.062 19.075 1.00 0.00 H new ATOM 0 HB2 ASP A 145 0.500 -2.042 18.715 1.00 0.00 H new ATOM 0 HB3 ASP A 145 2.197 -1.648 18.899 1.00 0.00 H new ATOM 889 N GLY A 146 0.872 -4.238 15.948 1.00 0.00 N ATOM 890 CA GLY A 146 -0.093 -4.886 15.080 1.00 0.00 C ATOM 891 C GLY A 146 -1.205 -3.952 14.646 1.00 0.00 C ATOM 892 O GLY A 146 -2.384 -4.293 14.741 1.00 0.00 O ATOM 0 H GLY A 146 1.611 -3.730 15.462 1.00 0.00 H new ATOM 0 HA2 GLY A 146 0.418 -5.271 14.198 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -0.524 -5.743 15.598 1.00 0.00 H new ATOM 896 N ARG A 147 -0.829 -2.770 14.168 1.00 0.00 N ATOM 897 CA ARG A 147 -1.805 -1.784 13.717 1.00 0.00 C ATOM 898 C ARG A 147 -1.164 -0.773 12.771 1.00 0.00 C ATOM 899 O ARG A 147 -0.325 0.030 13.180 1.00 0.00 O ATOM 900 CB ARG A 147 -2.419 -1.059 14.918 1.00 0.00 C ATOM 901 CG ARG A 147 -3.740 -1.653 15.376 1.00 0.00 C ATOM 902 CD ARG A 147 -4.343 -0.853 16.519 1.00 0.00 C ATOM 903 NE ARG A 147 -3.666 -1.115 17.787 1.00 0.00 N ATOM 904 CZ ARG A 147 -3.808 -2.239 18.485 1.00 0.00 C ATOM 905 NH1 ARG A 147 -4.599 -3.208 18.042 1.00 0.00 N ATOM 906 NH2 ARG A 147 -3.155 -2.396 19.629 1.00 0.00 N ATOM 0 H ARG A 147 0.143 -2.472 14.083 1.00 0.00 H new ATOM 0 HA ARG A 147 -2.592 -2.310 13.176 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -1.712 -1.084 15.747 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -2.571 -0.011 14.660 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -4.439 -1.678 14.540 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -3.586 -2.684 15.694 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -4.282 0.211 16.289 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -5.401 -1.099 16.615 1.00 0.00 H new ATOM 0 HE ARG A 147 -3.048 -0.394 18.159 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -5.102 -3.093 17.162 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -4.704 -4.067 18.581 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -2.544 -1.655 19.973 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -3.264 -3.257 20.164 1.00 0.00 H new ATOM 920 N ILE A 148 -1.566 -0.816 11.505 1.00 0.00 N ATOM 921 CA ILE A 148 -1.036 0.096 10.501 1.00 0.00 C ATOM 922 C ILE A 148 -2.140 1.007 9.971 1.00 0.00 C ATOM 923 O ILE A 148 -3.113 0.536 9.383 1.00 0.00 O ATOM 924 CB ILE A 148 -0.385 -0.685 9.339 1.00 0.00 C ATOM 925 CG1 ILE A 148 0.419 0.249 8.434 1.00 0.00 C ATOM 926 CG2 ILE A 148 -1.430 -1.438 8.537 1.00 0.00 C ATOM 927 CD1 ILE A 148 -0.432 1.218 7.645 1.00 0.00 C ATOM 0 H ILE A 148 -2.259 -1.475 11.150 1.00 0.00 H new ATOM 0 HA ILE A 148 -0.270 0.712 10.973 1.00 0.00 H new ATOM 0 HB ILE A 148 0.301 -1.413 9.771 1.00 0.00 H new ATOM 0 HG12 ILE A 148 1.124 0.813 9.045 1.00 0.00 H new ATOM 0 HG13 ILE A 148 1.008 -0.351 7.740 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -0.945 -1.979 7.725 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -1.947 -2.145 9.186 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -2.150 -0.732 8.123 1.00 0.00 H new ATOM 0 HD11 ILE A 148 0.210 1.846 7.027 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -1.119 0.663 7.007 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -1.001 1.845 8.331 1.00 0.00 H new ATOM 939 N ASP A 149 -1.991 2.311 10.193 1.00 0.00 N ATOM 940 CA ASP A 149 -2.992 3.272 9.745 1.00 0.00 C ATOM 941 C ASP A 149 -2.365 4.606 9.343 1.00 0.00 C ATOM 942 O ASP A 149 -1.782 5.305 10.171 1.00 0.00 O ATOM 943 CB ASP A 149 -4.025 3.505 10.848 1.00 0.00 C ATOM 944 CG ASP A 149 -3.381 3.793 12.191 1.00 0.00 C ATOM 945 OD1 ASP A 149 -2.661 2.911 12.705 1.00 0.00 O ATOM 946 OD2 ASP A 149 -3.596 4.900 12.728 1.00 0.00 O ATOM 0 H ASP A 149 -1.193 2.723 10.677 1.00 0.00 H new ATOM 0 HA ASP A 149 -3.477 2.850 8.864 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -4.668 4.340 10.570 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -4.664 2.626 10.935 1.00 0.00 H new ATOM 951 N TYR A 150 -2.517 4.956 8.069 1.00 0.00 N ATOM 952 CA TYR A 150 -1.999 6.214 7.534 1.00 0.00 C ATOM 953 C TYR A 150 -0.504 6.395 7.809 1.00 0.00 C ATOM 954 O TYR A 150 0.327 6.132 6.939 1.00 0.00 O ATOM 955 CB TYR A 150 -2.788 7.395 8.112 1.00 0.00 C ATOM 956 CG TYR A 150 -3.572 8.166 7.075 1.00 0.00 C ATOM 957 CD1 TYR A 150 -3.048 8.397 5.810 1.00 0.00 C ATOM 958 CD2 TYR A 150 -4.835 8.667 7.364 1.00 0.00 C ATOM 959 CE1 TYR A 150 -3.760 9.103 4.861 1.00 0.00 C ATOM 960 CE2 TYR A 150 -5.555 9.374 6.420 1.00 0.00 C ATOM 961 CZ TYR A 150 -5.013 9.590 5.170 1.00 0.00 C ATOM 962 OH TYR A 150 -5.727 10.295 4.229 1.00 0.00 O ATOM 0 H TYR A 150 -3.000 4.379 7.380 1.00 0.00 H new ATOM 0 HA TYR A 150 -2.125 6.181 6.452 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -3.475 7.024 8.873 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -2.096 8.074 8.611 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -2.067 8.018 5.564 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -5.261 8.501 8.342 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -3.338 9.273 3.882 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -6.537 9.755 6.659 1.00 0.00 H new ATOM 0 HH TYR A 150 -6.589 10.565 4.608 1.00 0.00 H new ATOM 972 N ASP A 151 -0.174 6.866 9.013 1.00 0.00 N ATOM 973 CA ASP A 151 1.216 7.112 9.407 1.00 0.00 C ATOM 974 C ASP A 151 2.174 6.080 8.817 1.00 0.00 C ATOM 975 O ASP A 151 3.071 6.424 8.047 1.00 0.00 O ATOM 976 CB ASP A 151 1.336 7.116 10.932 1.00 0.00 C ATOM 977 CG ASP A 151 2.319 8.157 11.432 1.00 0.00 C ATOM 978 OD1 ASP A 151 2.399 9.241 10.816 1.00 0.00 O ATOM 979 OD2 ASP A 151 3.007 7.889 12.438 1.00 0.00 O ATOM 0 H ASP A 151 -0.856 7.087 9.738 1.00 0.00 H new ATOM 0 HA ASP A 151 1.497 8.088 9.011 1.00 0.00 H new ATOM 0 HB2 ASP A 151 0.356 7.305 11.370 1.00 0.00 H new ATOM 0 HB3 ASP A 151 1.652 6.129 11.271 1.00 0.00 H new ATOM 984 N GLU A 152 1.984 4.821 9.186 1.00 0.00 N ATOM 985 CA GLU A 152 2.839 3.749 8.693 1.00 0.00 C ATOM 986 C GLU A 152 2.502 3.398 7.245 1.00 0.00 C ATOM 987 O GLU A 152 3.370 2.966 6.486 1.00 0.00 O ATOM 988 CB GLU A 152 2.704 2.515 9.583 1.00 0.00 C ATOM 989 CG GLU A 152 3.640 2.522 10.780 1.00 0.00 C ATOM 990 CD GLU A 152 2.970 2.026 12.047 1.00 0.00 C ATOM 991 OE1 GLU A 152 2.077 2.731 12.562 1.00 0.00 O ATOM 992 OE2 GLU A 152 3.339 0.933 12.525 1.00 0.00 O ATOM 0 H GLU A 152 1.248 4.517 9.823 1.00 0.00 H new ATOM 0 HA GLU A 152 3.871 4.097 8.724 1.00 0.00 H new ATOM 0 HB2 GLU A 152 1.676 2.444 9.937 1.00 0.00 H new ATOM 0 HB3 GLU A 152 2.898 1.624 8.986 1.00 0.00 H new ATOM 0 HG2 GLU A 152 4.506 1.897 10.563 1.00 0.00 H new ATOM 0 HG3 GLU A 152 4.010 3.535 10.941 1.00 0.00 H new ATOM 999 N PHE A 153 1.240 3.587 6.863 1.00 0.00 N ATOM 1000 CA PHE A 153 0.803 3.290 5.502 1.00 0.00 C ATOM 1001 C PHE A 153 1.619 4.080 4.485 1.00 0.00 C ATOM 1002 O PHE A 153 2.139 3.520 3.521 1.00 0.00 O ATOM 1003 CB PHE A 153 -0.688 3.607 5.337 1.00 0.00 C ATOM 1004 CG PHE A 153 -1.146 3.633 3.903 1.00 0.00 C ATOM 1005 CD1 PHE A 153 -0.674 2.700 2.995 1.00 0.00 C ATOM 1006 CD2 PHE A 153 -2.046 4.590 3.466 1.00 0.00 C ATOM 1007 CE1 PHE A 153 -1.090 2.721 1.678 1.00 0.00 C ATOM 1008 CE2 PHE A 153 -2.466 4.616 2.150 1.00 0.00 C ATOM 1009 CZ PHE A 153 -1.988 3.681 1.255 1.00 0.00 C ATOM 0 H PHE A 153 0.506 3.943 7.475 1.00 0.00 H new ATOM 0 HA PHE A 153 0.961 2.227 5.322 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -1.271 2.864 5.882 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -0.897 4.574 5.794 1.00 0.00 H new ATOM 0 HD1 PHE A 153 0.028 1.947 3.321 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -2.424 5.325 4.162 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -0.714 1.988 0.980 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -3.168 5.368 1.822 1.00 0.00 H new ATOM 0 HZ PHE A 153 -2.315 3.700 0.226 1.00 0.00 H new ATOM 1019 N LEU A 154 1.727 5.384 4.705 1.00 0.00 N ATOM 1020 CA LEU A 154 2.481 6.246 3.804 1.00 0.00 C ATOM 1021 C LEU A 154 3.916 5.746 3.642 1.00 0.00 C ATOM 1022 O LEU A 154 4.581 6.054 2.654 1.00 0.00 O ATOM 1023 CB LEU A 154 2.459 7.688 4.318 1.00 0.00 C ATOM 1024 CG LEU A 154 1.082 8.194 4.776 1.00 0.00 C ATOM 1025 CD1 LEU A 154 0.985 9.703 4.621 1.00 0.00 C ATOM 1026 CD2 LEU A 154 -0.035 7.510 3.997 1.00 0.00 C ATOM 0 H LEU A 154 1.303 5.867 5.497 1.00 0.00 H new ATOM 0 HA LEU A 154 2.009 6.219 2.822 1.00 0.00 H new ATOM 0 HB2 LEU A 154 3.156 7.771 5.152 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.827 8.344 3.529 1.00 0.00 H new ATOM 0 HG LEU A 154 0.967 7.945 5.831 1.00 0.00 H new ATOM 0 HD11 LEU A 154 0.002 10.040 4.951 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.755 10.181 5.227 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.128 9.971 3.574 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -1.000 7.885 4.339 1.00 0.00 H new ATOM 0 HD22 LEU A 154 0.080 7.722 2.934 1.00 0.00 H new ATOM 0 HD23 LEU A 154 0.014 6.433 4.160 1.00 0.00 H new ATOM 1038 N GLU A 155 4.380 4.958 4.610 1.00 0.00 N ATOM 1039 CA GLU A 155 5.726 4.399 4.562 1.00 0.00 C ATOM 1040 C GLU A 155 5.781 3.197 3.617 1.00 0.00 C ATOM 1041 O GLU A 155 6.859 2.693 3.302 1.00 0.00 O ATOM 1042 CB GLU A 155 6.177 3.982 5.963 1.00 0.00 C ATOM 1043 CG GLU A 155 7.668 3.703 6.064 1.00 0.00 C ATOM 1044 CD GLU A 155 8.353 4.557 7.113 1.00 0.00 C ATOM 1045 OE1 GLU A 155 8.365 4.152 8.294 1.00 0.00 O ATOM 1046 OE2 GLU A 155 8.879 5.632 6.753 1.00 0.00 O ATOM 0 H GLU A 155 3.843 4.693 5.436 1.00 0.00 H new ATOM 0 HA GLU A 155 6.401 5.168 4.185 1.00 0.00 H new ATOM 0 HB2 GLU A 155 5.914 4.769 6.670 1.00 0.00 H new ATOM 0 HB3 GLU A 155 5.628 3.089 6.262 1.00 0.00 H new ATOM 0 HG2 GLU A 155 7.821 2.650 6.302 1.00 0.00 H new ATOM 0 HG3 GLU A 155 8.134 3.882 5.095 1.00 0.00 H new ATOM 1053 N PHE A 156 4.612 2.744 3.165 1.00 0.00 N ATOM 1054 CA PHE A 156 4.524 1.607 2.254 1.00 0.00 C ATOM 1055 C PHE A 156 4.999 2.001 0.859 1.00 0.00 C ATOM 1056 O PHE A 156 5.795 1.297 0.238 1.00 0.00 O ATOM 1057 CB PHE A 156 3.080 1.101 2.189 1.00 0.00 C ATOM 1058 CG PHE A 156 2.952 -0.395 2.141 1.00 0.00 C ATOM 1059 CD1 PHE A 156 2.936 -1.066 0.929 1.00 0.00 C ATOM 1060 CD2 PHE A 156 2.836 -1.129 3.310 1.00 0.00 C ATOM 1061 CE1 PHE A 156 2.808 -2.440 0.884 1.00 0.00 C ATOM 1062 CE2 PHE A 156 2.705 -2.503 3.271 1.00 0.00 C ATOM 1063 CZ PHE A 156 2.691 -3.159 2.056 1.00 0.00 C ATOM 0 H PHE A 156 3.711 3.150 3.417 1.00 0.00 H new ATOM 0 HA PHE A 156 5.167 0.811 2.629 1.00 0.00 H new ATOM 0 HB2 PHE A 156 2.537 1.473 3.058 1.00 0.00 H new ATOM 0 HB3 PHE A 156 2.598 1.524 1.307 1.00 0.00 H new ATOM 0 HD1 PHE A 156 3.025 -0.508 0.009 1.00 0.00 H new ATOM 0 HD2 PHE A 156 2.848 -0.621 4.263 1.00 0.00 H new ATOM 0 HE1 PHE A 156 2.799 -2.951 -0.067 1.00 0.00 H new ATOM 0 HE2 PHE A 156 2.614 -3.064 4.189 1.00 0.00 H new ATOM 0 HZ PHE A 156 2.589 -4.234 2.023 1.00 0.00 H new ATOM 1073 N MET A 157 4.498 3.133 0.375 1.00 0.00 N ATOM 1074 CA MET A 157 4.861 3.632 -0.947 1.00 0.00 C ATOM 1075 C MET A 157 6.356 3.931 -1.035 1.00 0.00 C ATOM 1076 O MET A 157 6.939 3.902 -2.119 1.00 0.00 O ATOM 1077 CB MET A 157 4.057 4.893 -1.275 1.00 0.00 C ATOM 1078 CG MET A 157 4.399 6.082 -0.390 1.00 0.00 C ATOM 1079 SD MET A 157 4.672 7.596 -1.331 1.00 0.00 S ATOM 1080 CE MET A 157 3.274 7.555 -2.450 1.00 0.00 C ATOM 0 H MET A 157 3.838 3.724 0.880 1.00 0.00 H new ATOM 0 HA MET A 157 4.626 2.855 -1.674 1.00 0.00 H new ATOM 0 HB2 MET A 157 4.231 5.164 -2.316 1.00 0.00 H new ATOM 0 HB3 MET A 157 2.994 4.672 -1.177 1.00 0.00 H new ATOM 0 HG2 MET A 157 3.590 6.243 0.323 1.00 0.00 H new ATOM 0 HG3 MET A 157 5.294 5.853 0.189 1.00 0.00 H new ATOM 0 HE1 MET A 157 2.958 8.574 -2.674 1.00 0.00 H new ATOM 0 HE2 MET A 157 3.562 7.053 -3.374 1.00 0.00 H new ATOM 0 HE3 MET A 157 2.451 7.014 -1.984 1.00 0.00 H new ATOM 1090 N LYS A 158 6.973 4.221 0.109 1.00 0.00 N ATOM 1091 CA LYS A 158 8.401 4.527 0.152 1.00 0.00 C ATOM 1092 C LYS A 158 9.208 3.485 -0.617 1.00 0.00 C ATOM 1093 O LYS A 158 10.166 3.818 -1.314 1.00 0.00 O ATOM 1094 CB LYS A 158 8.886 4.601 1.601 1.00 0.00 C ATOM 1095 CG LYS A 158 8.983 6.021 2.133 1.00 0.00 C ATOM 1096 CD LYS A 158 10.154 6.180 3.090 1.00 0.00 C ATOM 1097 CE LYS A 158 11.340 6.850 2.415 1.00 0.00 C ATOM 1098 NZ LYS A 158 12.409 5.871 2.071 1.00 0.00 N ATOM 0 H LYS A 158 6.508 4.250 1.016 1.00 0.00 H new ATOM 0 HA LYS A 158 8.552 5.496 -0.323 1.00 0.00 H new ATOM 0 HB2 LYS A 158 8.207 4.030 2.233 1.00 0.00 H new ATOM 0 HB3 LYS A 158 9.864 4.126 1.674 1.00 0.00 H new ATOM 0 HG2 LYS A 158 9.096 6.715 1.300 1.00 0.00 H new ATOM 0 HG3 LYS A 158 8.056 6.283 2.644 1.00 0.00 H new ATOM 0 HD2 LYS A 158 9.843 6.771 3.952 1.00 0.00 H new ATOM 0 HD3 LYS A 158 10.453 5.202 3.466 1.00 0.00 H new ATOM 0 HE2 LYS A 158 11.005 7.355 1.509 1.00 0.00 H new ATOM 0 HE3 LYS A 158 11.748 7.616 3.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 13.200 6.367 1.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 12.747 5.407 2.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 12.027 5.154 1.422 1.00 0.00 H new ATOM 1112 N GLY A 159 8.809 2.223 -0.490 1.00 0.00 N ATOM 1113 CA GLY A 159 9.502 1.156 -1.185 1.00 0.00 C ATOM 1114 C GLY A 159 9.470 1.337 -2.689 1.00 0.00 C ATOM 1115 O GLY A 159 10.364 0.873 -3.397 1.00 0.00 O ATOM 0 H GLY A 159 8.019 1.922 0.081 1.00 0.00 H new ATOM 0 HA2 GLY A 159 10.538 1.117 -0.847 1.00 0.00 H new ATOM 0 HA3 GLY A 159 9.047 0.200 -0.926 1.00 0.00 H new ATOM 1119 N VAL A 160 8.437 2.018 -3.178 1.00 0.00 N ATOM 1120 CA VAL A 160 8.287 2.267 -4.604 1.00 0.00 C ATOM 1121 C VAL A 160 9.511 2.980 -5.170 1.00 0.00 C ATOM 1122 O VAL A 160 9.858 2.806 -6.338 1.00 0.00 O ATOM 1123 CB VAL A 160 7.033 3.116 -4.887 1.00 0.00 C ATOM 1124 CG1 VAL A 160 6.825 3.286 -6.383 1.00 0.00 C ATOM 1125 CG2 VAL A 160 5.806 2.492 -4.236 1.00 0.00 C ATOM 0 H VAL A 160 7.690 2.408 -2.603 1.00 0.00 H new ATOM 0 HA VAL A 160 8.182 1.297 -5.090 1.00 0.00 H new ATOM 0 HB VAL A 160 7.183 4.104 -4.453 1.00 0.00 H new ATOM 0 HG11 VAL A 160 5.934 3.889 -6.560 1.00 0.00 H new ATOM 0 HG12 VAL A 160 7.692 3.784 -6.817 1.00 0.00 H new ATOM 0 HG13 VAL A 160 6.699 2.307 -6.846 1.00 0.00 H new ATOM 0 HG21 VAL A 160 4.930 3.106 -4.447 1.00 0.00 H new ATOM 0 HG22 VAL A 160 5.652 1.490 -4.636 1.00 0.00 H new ATOM 0 HG23 VAL A 160 5.956 2.433 -3.158 1.00 0.00 H new ATOM 1135 N GLU A 161 10.163 3.782 -4.334 1.00 0.00 N ATOM 1136 CA GLU A 161 11.349 4.520 -4.751 1.00 0.00 C ATOM 1137 C GLU A 161 12.572 3.610 -4.785 1.00 0.00 C ATOM 1138 O GLU A 161 13.394 3.760 -5.713 1.00 0.00 O ATOM 1139 CB GLU A 161 11.600 5.698 -3.807 1.00 0.00 C ATOM 1140 CG GLU A 161 10.394 6.606 -3.632 1.00 0.00 C ATOM 1141 CD GLU A 161 10.742 7.912 -2.944 1.00 0.00 C ATOM 1142 OE1 GLU A 161 11.237 8.830 -3.630 1.00 0.00 O ATOM 1143 OE2 GLU A 161 10.520 8.016 -1.720 1.00 0.00 O ATOM 1144 OXT GLU A 161 12.699 2.757 -3.882 1.00 0.00 O ATOM 0 H GLU A 161 9.890 3.937 -3.364 1.00 0.00 H new ATOM 0 HA GLU A 161 11.175 4.901 -5.757 1.00 0.00 H new ATOM 0 HB2 GLU A 161 11.899 5.314 -2.832 1.00 0.00 H new ATOM 0 HB3 GLU A 161 12.435 6.286 -4.188 1.00 0.00 H new ATOM 0 HG2 GLU A 161 9.959 6.819 -4.609 1.00 0.00 H new ATOM 0 HG3 GLU A 161 9.633 6.085 -3.051 1.00 0.00 H new ATOM 1226 N PHE B 132 5.255 -6.471 -6.145 1.00 0.00 N ATOM 1227 CA PHE B 132 3.888 -6.461 -6.648 1.00 0.00 C ATOM 1228 C PHE B 132 3.140 -5.185 -6.225 1.00 0.00 C ATOM 1229 O PHE B 132 3.461 -4.096 -6.701 1.00 0.00 O ATOM 1230 CB PHE B 132 3.151 -7.732 -6.199 1.00 0.00 C ATOM 1231 CG PHE B 132 3.696 -8.356 -4.943 1.00 0.00 C ATOM 1232 CD1 PHE B 132 4.760 -9.242 -5.001 1.00 0.00 C ATOM 1233 CD2 PHE B 132 3.136 -8.070 -3.710 1.00 0.00 C ATOM 1234 CE1 PHE B 132 5.257 -9.828 -3.852 1.00 0.00 C ATOM 1235 CE2 PHE B 132 3.626 -8.655 -2.558 1.00 0.00 C ATOM 1236 CZ PHE B 132 4.688 -9.535 -2.629 1.00 0.00 C ATOM 0 HA PHE B 132 3.921 -6.455 -7.737 1.00 0.00 H new ATOM 0 HB2 PHE B 132 2.099 -7.492 -6.044 1.00 0.00 H new ATOM 0 HB3 PHE B 132 3.195 -8.466 -7.003 1.00 0.00 H new ATOM 0 HD1 PHE B 132 5.206 -9.478 -5.956 1.00 0.00 H new ATOM 0 HD2 PHE B 132 2.306 -7.381 -3.648 1.00 0.00 H new ATOM 0 HE1 PHE B 132 6.089 -10.514 -3.911 1.00 0.00 H new ATOM 0 HE2 PHE B 132 3.179 -8.424 -1.602 1.00 0.00 H new ATOM 0 HZ PHE B 132 5.072 -9.993 -1.730 1.00 0.00 H new ATOM 1246 N ASP B 133 2.143 -5.312 -5.346 1.00 0.00 N ATOM 1247 CA ASP B 133 1.371 -4.157 -4.894 1.00 0.00 C ATOM 1248 C ASP B 133 2.209 -3.237 -4.008 1.00 0.00 C ATOM 1249 O ASP B 133 1.791 -2.125 -3.685 1.00 0.00 O ATOM 1250 CB ASP B 133 0.124 -4.618 -4.135 1.00 0.00 C ATOM 1251 CG ASP B 133 -1.155 -4.068 -4.736 1.00 0.00 C ATOM 1252 OD1 ASP B 133 -1.128 -2.931 -5.251 1.00 0.00 O ATOM 1253 OD2 ASP B 133 -2.184 -4.775 -4.692 1.00 0.00 O ATOM 0 H ASP B 133 1.854 -6.200 -4.936 1.00 0.00 H new ATOM 0 HA ASP B 133 1.069 -3.593 -5.777 1.00 0.00 H new ATOM 0 HB2 ASP B 133 0.084 -5.707 -4.136 1.00 0.00 H new ATOM 0 HB3 ASP B 133 0.198 -4.303 -3.094 1.00 0.00 H new ATOM 1258 N LEU B 134 3.391 -3.702 -3.621 1.00 0.00 N ATOM 1259 CA LEU B 134 4.279 -2.916 -2.776 1.00 0.00 C ATOM 1260 C LEU B 134 4.737 -1.662 -3.509 1.00 0.00 C ATOM 1261 O LEU B 134 4.806 -0.578 -2.930 1.00 0.00 O ATOM 1262 CB LEU B 134 5.494 -3.749 -2.363 1.00 0.00 C ATOM 1263 CG LEU B 134 5.212 -4.877 -1.368 1.00 0.00 C ATOM 1264 CD1 LEU B 134 4.126 -5.803 -1.896 1.00 0.00 C ATOM 1265 CD2 LEU B 134 6.483 -5.662 -1.083 1.00 0.00 C ATOM 0 H LEU B 134 3.756 -4.619 -3.879 1.00 0.00 H new ATOM 0 HA LEU B 134 3.731 -2.621 -1.881 1.00 0.00 H new ATOM 0 HB2 LEU B 134 5.938 -4.182 -3.260 1.00 0.00 H new ATOM 0 HB3 LEU B 134 6.239 -3.082 -1.928 1.00 0.00 H new ATOM 0 HG LEU B 134 4.860 -4.432 -0.438 1.00 0.00 H new ATOM 0 HD11 LEU B 134 3.942 -6.597 -1.173 1.00 0.00 H new ATOM 0 HD12 LEU B 134 3.209 -5.236 -2.053 1.00 0.00 H new ATOM 0 HD13 LEU B 134 4.448 -6.240 -2.841 1.00 0.00 H new ATOM 0 HD21 LEU B 134 6.266 -6.461 -0.374 1.00 0.00 H new ATOM 0 HD22 LEU B 134 6.860 -6.093 -2.010 1.00 0.00 H new ATOM 0 HD23 LEU B 134 7.235 -4.996 -0.660 1.00 0.00 H new ATOM 1277 N ARG B 135 5.046 -1.823 -4.790 1.00 0.00 N ATOM 1278 CA ARG B 135 5.497 -0.713 -5.617 1.00 0.00 C ATOM 1279 C ARG B 135 4.393 -0.265 -6.568 1.00 0.00 C ATOM 1280 O ARG B 135 4.187 0.931 -6.777 1.00 0.00 O ATOM 1281 CB ARG B 135 6.736 -1.122 -6.416 1.00 0.00 C ATOM 1282 CG ARG B 135 7.161 -0.091 -7.446 1.00 0.00 C ATOM 1283 CD ARG B 135 8.613 -0.275 -7.856 1.00 0.00 C ATOM 1284 NE ARG B 135 9.154 0.918 -8.501 1.00 0.00 N ATOM 1285 CZ ARG B 135 10.343 0.963 -9.099 1.00 0.00 C ATOM 1286 NH1 ARG B 135 11.116 -0.115 -9.136 1.00 0.00 N ATOM 1287 NH2 ARG B 135 10.759 2.089 -9.662 1.00 0.00 N ATOM 0 H ARG B 135 4.992 -2.716 -5.279 1.00 0.00 H new ATOM 0 HA ARG B 135 5.751 0.121 -4.962 1.00 0.00 H new ATOM 0 HB2 ARG B 135 7.562 -1.296 -5.726 1.00 0.00 H new ATOM 0 HB3 ARG B 135 6.537 -2.067 -6.921 1.00 0.00 H new ATOM 0 HG2 ARG B 135 6.521 -0.169 -8.325 1.00 0.00 H new ATOM 0 HG3 ARG B 135 7.022 0.910 -7.038 1.00 0.00 H new ATOM 0 HD2 ARG B 135 9.211 -0.514 -6.976 1.00 0.00 H new ATOM 0 HD3 ARG B 135 8.693 -1.123 -8.536 1.00 0.00 H new ATOM 0 HE ARG B 135 8.588 1.767 -8.493 1.00 0.00 H new ATOM 0 HH11 ARG B 135 10.800 -0.984 -8.705 1.00 0.00 H new ATOM 0 HH12 ARG B 135 12.026 -0.075 -9.595 1.00 0.00 H new ATOM 0 HH21 ARG B 135 10.168 2.920 -9.637 1.00 0.00 H new ATOM 0 HH22 ARG B 135 11.670 2.124 -10.120 1.00 0.00 H new ATOM 1301 N GLY B 136 3.690 -1.231 -7.147 1.00 0.00 N ATOM 1302 CA GLY B 136 2.621 -0.912 -8.071 1.00 0.00 C ATOM 1303 C GLY B 136 1.450 -0.232 -7.389 1.00 0.00 C ATOM 1304 O GLY B 136 1.283 -0.343 -6.174 1.00 0.00 O ATOM 0 H GLY B 136 3.842 -2.228 -6.993 1.00 0.00 H new ATOM 0 HA2 GLY B 136 3.006 -0.263 -8.858 1.00 0.00 H new ATOM 0 HA3 GLY B 136 2.276 -1.827 -8.553 1.00 0.00 H new ATOM 1308 N LYS B 137 0.639 0.475 -8.169 1.00 0.00 N ATOM 1309 CA LYS B 137 -0.521 1.177 -7.630 1.00 0.00 C ATOM 1310 C LYS B 137 -0.101 2.174 -6.554 1.00 0.00 C ATOM 1311 O LYS B 137 -0.868 2.476 -5.639 1.00 0.00 O ATOM 1312 CB LYS B 137 -1.524 0.177 -7.051 1.00 0.00 C ATOM 1313 CG LYS B 137 -1.892 -0.941 -8.013 1.00 0.00 C ATOM 1314 CD LYS B 137 -3.265 -0.719 -8.627 1.00 0.00 C ATOM 1315 CE LYS B 137 -4.368 -0.842 -7.588 1.00 0.00 C ATOM 1316 NZ LYS B 137 -5.574 -1.523 -8.134 1.00 0.00 N ATOM 0 H LYS B 137 0.763 0.577 -9.176 1.00 0.00 H new ATOM 0 HA LYS B 137 -0.994 1.726 -8.444 1.00 0.00 H new ATOM 0 HB2 LYS B 137 -1.107 -0.259 -6.143 1.00 0.00 H new ATOM 0 HB3 LYS B 137 -2.430 0.710 -6.762 1.00 0.00 H new ATOM 0 HG2 LYS B 137 -1.144 -1.003 -8.804 1.00 0.00 H new ATOM 0 HG3 LYS B 137 -1.878 -1.895 -7.486 1.00 0.00 H new ATOM 0 HD2 LYS B 137 -3.304 0.269 -9.085 1.00 0.00 H new ATOM 0 HD3 LYS B 137 -3.431 -1.446 -9.422 1.00 0.00 H new ATOM 0 HE2 LYS B 137 -3.996 -1.398 -6.728 1.00 0.00 H new ATOM 0 HE3 LYS B 137 -4.642 0.151 -7.231 1.00 0.00 H new ATOM 0 HZ1 LYS B 137 -6.302 -1.586 -7.394 1.00 0.00 H new ATOM 0 HZ2 LYS B 137 -5.945 -0.979 -8.939 1.00 0.00 H new ATOM 0 HZ3 LYS B 137 -5.319 -2.480 -8.451 1.00 0.00 H new ATOM 1330 N PHE B 138 1.122 2.682 -6.670 1.00 0.00 N ATOM 1331 CA PHE B 138 1.646 3.645 -5.708 1.00 0.00 C ATOM 1332 C PHE B 138 2.311 4.819 -6.421 1.00 0.00 C ATOM 1333 O PHE B 138 2.094 5.977 -6.065 1.00 0.00 O ATOM 1334 CB PHE B 138 2.646 2.965 -4.771 1.00 0.00 C ATOM 1335 CG PHE B 138 2.016 2.401 -3.529 1.00 0.00 C ATOM 1336 CD1 PHE B 138 1.512 3.239 -2.549 1.00 0.00 C ATOM 1337 CD2 PHE B 138 1.930 1.030 -3.344 1.00 0.00 C ATOM 1338 CE1 PHE B 138 0.932 2.722 -1.406 1.00 0.00 C ATOM 1339 CE2 PHE B 138 1.351 0.507 -2.203 1.00 0.00 C ATOM 1340 CZ PHE B 138 0.852 1.354 -1.233 1.00 0.00 C ATOM 0 H PHE B 138 1.769 2.442 -7.421 1.00 0.00 H new ATOM 0 HA PHE B 138 0.812 4.028 -5.120 1.00 0.00 H new ATOM 0 HB2 PHE B 138 3.149 2.162 -5.310 1.00 0.00 H new ATOM 0 HB3 PHE B 138 3.412 3.686 -4.485 1.00 0.00 H new ATOM 0 HD1 PHE B 138 1.573 4.309 -2.679 1.00 0.00 H new ATOM 0 HD2 PHE B 138 2.319 0.363 -4.099 1.00 0.00 H new ATOM 0 HE1 PHE B 138 0.542 3.387 -0.649 1.00 0.00 H new ATOM 0 HE2 PHE B 138 1.289 -0.563 -2.070 1.00 0.00 H new ATOM 0 HZ PHE B 138 0.400 0.947 -0.340 1.00 0.00 H new