USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 524 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 97 ASN : amide:sc= -5.63! C(o=-7.6!,f=-22!) USER MOD Set 1.2: A 101 SER OG : rot 180:sc= -0.0378 USER MOD Set 1.3: A 135 GLN :FLIP amide:sc= -1.91 F(o=-10!,f=-7.6) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.0408 USER MOD Single : A 81 SER OG : rot 180:sc= -0.251 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HE2:sc= -1.63 X(o=-1.6,f=-1.9!) USER MOD Single : A 109 MET CE :methyl -129:sc= -0.0384 (180deg=-1.36) USER MOD Single : A 110 THR OG1 : rot 87:sc= 0.955 USER MOD Single : A 111 ASN : amide:sc= -0.08 K(o=-0.08,f=-0.91) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -177:sc= -0.753 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN :FLIP amide:sc=-0.000445 F(o=-0.95,f=-0.00045) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -2.74! C(o=-2.7!,f=-9.4!) USER MOD Single : A 144 MET CE :methyl 175:sc= 0 (180deg=-0.038) USER MOD Single : A 145 MET CE :methyl -113:sc= -0.0416 (180deg=-0.1) USER MOD Single : A 146 THR OG1 : rot -61:sc= 0.15 USER MOD Single : A 148 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0428) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 78 7.765 23.761 -2.979 1.00 0.00 N ATOM 2 CA ASP A 78 7.171 22.834 -3.985 1.00 0.00 C ATOM 3 C ASP A 78 8.227 21.838 -4.453 1.00 0.00 C ATOM 4 O ASP A 78 9.084 22.169 -5.273 1.00 0.00 O ATOM 5 CB ASP A 78 6.658 23.644 -5.177 1.00 0.00 C ATOM 6 CG ASP A 78 5.969 22.720 -6.175 1.00 0.00 C ATOM 7 OD1 ASP A 78 4.951 22.149 -5.819 1.00 0.00 O ATOM 8 OD2 ASP A 78 6.470 22.594 -7.280 1.00 0.00 O ATOM 0 HA ASP A 78 6.343 22.288 -3.534 1.00 0.00 H new ATOM 0 HB2 ASP A 78 5.961 24.409 -4.835 1.00 0.00 H new ATOM 0 HB3 ASP A 78 7.487 24.162 -5.660 1.00 0.00 H new ATOM 15 N THR A 79 8.165 20.613 -3.933 1.00 0.00 N ATOM 16 CA THR A 79 9.125 19.576 -4.314 1.00 0.00 C ATOM 17 C THR A 79 8.504 18.188 -4.148 1.00 0.00 C ATOM 18 O THR A 79 7.563 18.010 -3.374 1.00 0.00 O ATOM 19 CB THR A 79 10.385 19.683 -3.449 1.00 0.00 C ATOM 20 OG1 THR A 79 11.264 18.608 -3.759 1.00 0.00 O ATOM 21 CG2 THR A 79 10.005 19.621 -1.969 1.00 0.00 C ATOM 0 H THR A 79 7.466 20.315 -3.252 1.00 0.00 H new ATOM 0 HA THR A 79 9.393 19.721 -5.360 1.00 0.00 H new ATOM 0 HB THR A 79 10.881 20.632 -3.652 1.00 0.00 H new ATOM 0 HG1 THR A 79 12.071 18.676 -3.208 1.00 0.00 H new ATOM 0 HG21 THR A 79 10.905 19.698 -1.359 1.00 0.00 H new ATOM 0 HG22 THR A 79 9.334 20.446 -1.731 1.00 0.00 H new ATOM 0 HG23 THR A 79 9.505 18.675 -1.761 1.00 0.00 H new ATOM 29 N ASP A 80 9.036 17.210 -4.875 1.00 0.00 N ATOM 30 CA ASP A 80 8.524 15.845 -4.791 1.00 0.00 C ATOM 31 C ASP A 80 8.648 15.314 -3.364 1.00 0.00 C ATOM 32 O ASP A 80 7.646 15.103 -2.685 1.00 0.00 O ATOM 33 CB ASP A 80 9.299 14.935 -5.745 1.00 0.00 C ATOM 34 CG ASP A 80 8.986 15.302 -7.192 1.00 0.00 C ATOM 35 OD1 ASP A 80 8.004 15.994 -7.406 1.00 0.00 O ATOM 36 OD2 ASP A 80 9.729 14.883 -8.064 1.00 0.00 O ATOM 0 H ASP A 80 9.814 17.334 -5.523 1.00 0.00 H new ATOM 0 HA ASP A 80 7.472 15.854 -5.074 1.00 0.00 H new ATOM 0 HB2 ASP A 80 10.369 15.030 -5.561 1.00 0.00 H new ATOM 0 HB3 ASP A 80 9.035 13.894 -5.561 1.00 0.00 H new ATOM 41 N SER A 81 9.884 15.112 -2.913 1.00 0.00 N ATOM 42 CA SER A 81 10.132 14.615 -1.556 1.00 0.00 C ATOM 43 C SER A 81 9.061 13.611 -1.124 1.00 0.00 C ATOM 44 O SER A 81 8.581 12.812 -1.927 1.00 0.00 O ATOM 45 CB SER A 81 10.146 15.787 -0.576 1.00 0.00 C ATOM 46 OG SER A 81 8.830 16.304 -0.444 1.00 0.00 O ATOM 0 H SER A 81 10.727 15.283 -3.461 1.00 0.00 H new ATOM 0 HA SER A 81 11.098 14.110 -1.554 1.00 0.00 H new ATOM 0 HB2 SER A 81 10.520 15.460 0.394 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.821 16.565 -0.932 1.00 0.00 H new ATOM 0 HG SER A 81 8.835 17.055 0.185 1.00 0.00 H new ATOM 52 N GLU A 82 8.691 13.671 0.149 1.00 0.00 N ATOM 53 CA GLU A 82 7.676 12.778 0.694 1.00 0.00 C ATOM 54 C GLU A 82 6.348 12.965 -0.045 1.00 0.00 C ATOM 55 O GLU A 82 5.433 12.157 0.087 1.00 0.00 O ATOM 56 CB GLU A 82 7.494 13.078 2.191 1.00 0.00 C ATOM 57 CG GLU A 82 6.554 12.051 2.833 1.00 0.00 C ATOM 58 CD GLU A 82 6.465 12.296 4.339 1.00 0.00 C ATOM 59 OE1 GLU A 82 7.306 13.014 4.854 1.00 0.00 O ATOM 60 OE2 GLU A 82 5.556 11.761 4.952 1.00 0.00 O ATOM 0 H GLU A 82 9.079 14.330 0.824 1.00 0.00 H new ATOM 0 HA GLU A 82 7.998 11.745 0.564 1.00 0.00 H new ATOM 0 HB2 GLU A 82 8.462 13.058 2.692 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.089 14.082 2.320 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.563 12.123 2.385 1.00 0.00 H new ATOM 0 HG3 GLU A 82 6.918 11.042 2.641 1.00 0.00 H new ATOM 67 N GLU A 83 6.237 14.047 -0.811 1.00 0.00 N ATOM 68 CA GLU A 83 4.998 14.324 -1.533 1.00 0.00 C ATOM 69 C GLU A 83 4.711 13.245 -2.585 1.00 0.00 C ATOM 70 O GLU A 83 3.615 12.688 -2.622 1.00 0.00 O ATOM 71 CB GLU A 83 5.080 15.711 -2.198 1.00 0.00 C ATOM 72 CG GLU A 83 3.687 16.341 -2.274 1.00 0.00 C ATOM 73 CD GLU A 83 3.773 17.711 -2.935 1.00 0.00 C ATOM 74 OE1 GLU A 83 4.461 17.822 -3.935 1.00 0.00 O ATOM 75 OE2 GLU A 83 3.151 18.630 -2.427 1.00 0.00 O ATOM 0 H GLU A 83 6.976 14.736 -0.947 1.00 0.00 H new ATOM 0 HA GLU A 83 4.177 14.315 -0.817 1.00 0.00 H new ATOM 0 HB2 GLU A 83 5.749 16.357 -1.629 1.00 0.00 H new ATOM 0 HB3 GLU A 83 5.501 15.619 -3.199 1.00 0.00 H new ATOM 0 HG2 GLU A 83 3.017 15.695 -2.841 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.266 16.436 -1.273 1.00 0.00 H new ATOM 82 N GLU A 84 5.685 12.949 -3.446 1.00 0.00 N ATOM 83 CA GLU A 84 5.468 11.931 -4.476 1.00 0.00 C ATOM 84 C GLU A 84 4.904 10.672 -3.838 1.00 0.00 C ATOM 85 O GLU A 84 4.017 10.024 -4.396 1.00 0.00 O ATOM 86 CB GLU A 84 6.776 11.591 -5.202 1.00 0.00 C ATOM 87 CG GLU A 84 6.511 10.534 -6.284 1.00 0.00 C ATOM 88 CD GLU A 84 7.794 10.232 -7.052 1.00 0.00 C ATOM 89 OE1 GLU A 84 8.723 11.016 -6.949 1.00 0.00 O ATOM 90 OE2 GLU A 84 7.828 9.222 -7.736 1.00 0.00 O ATOM 0 H GLU A 84 6.607 13.385 -3.454 1.00 0.00 H new ATOM 0 HA GLU A 84 4.762 12.329 -5.205 1.00 0.00 H new ATOM 0 HB2 GLU A 84 7.196 12.490 -5.654 1.00 0.00 H new ATOM 0 HB3 GLU A 84 7.512 11.219 -4.489 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.130 9.622 -5.825 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.743 10.891 -6.971 1.00 0.00 H new ATOM 97 N ILE A 85 5.413 10.332 -2.665 1.00 0.00 N ATOM 98 CA ILE A 85 4.941 9.151 -1.964 1.00 0.00 C ATOM 99 C ILE A 85 3.463 9.320 -1.620 1.00 0.00 C ATOM 100 O ILE A 85 2.656 8.409 -1.810 1.00 0.00 O ATOM 101 CB ILE A 85 5.746 8.967 -0.675 1.00 0.00 C ATOM 102 CG1 ILE A 85 7.202 8.631 -1.019 1.00 0.00 C ATOM 103 CG2 ILE A 85 5.160 7.826 0.151 1.00 0.00 C ATOM 104 CD1 ILE A 85 8.072 8.678 0.246 1.00 0.00 C ATOM 0 H ILE A 85 6.146 10.852 -2.183 1.00 0.00 H new ATOM 0 HA ILE A 85 5.069 8.276 -2.601 1.00 0.00 H new ATOM 0 HB ILE A 85 5.703 9.893 -0.101 1.00 0.00 H new ATOM 0 HG12 ILE A 85 7.257 7.640 -1.470 1.00 0.00 H new ATOM 0 HG13 ILE A 85 7.581 9.339 -1.756 1.00 0.00 H new ATOM 0 HG21 ILE A 85 5.740 7.704 1.066 1.00 0.00 H new ATOM 0 HG22 ILE A 85 4.125 8.055 0.406 1.00 0.00 H new ATOM 0 HG23 ILE A 85 5.195 6.903 -0.427 1.00 0.00 H new ATOM 0 HD11 ILE A 85 9.103 8.437 -0.012 1.00 0.00 H new ATOM 0 HD12 ILE A 85 8.030 9.677 0.679 1.00 0.00 H new ATOM 0 HD13 ILE A 85 7.701 7.953 0.970 1.00 0.00 H new ATOM 116 N ARG A 86 3.117 10.502 -1.119 1.00 0.00 N ATOM 117 CA ARG A 86 1.738 10.788 -0.745 1.00 0.00 C ATOM 118 C ARG A 86 0.809 10.629 -1.952 1.00 0.00 C ATOM 119 O ARG A 86 -0.337 10.202 -1.816 1.00 0.00 O ATOM 120 CB ARG A 86 1.630 12.209 -0.176 1.00 0.00 C ATOM 121 CG ARG A 86 2.322 12.261 1.191 1.00 0.00 C ATOM 122 CD ARG A 86 2.308 13.696 1.732 1.00 0.00 C ATOM 123 NE ARG A 86 0.940 14.121 2.005 1.00 0.00 N ATOM 124 CZ ARG A 86 0.351 13.852 3.167 1.00 0.00 C ATOM 125 NH1 ARG A 86 1.011 13.229 4.107 1.00 0.00 N ATOM 126 NH2 ARG A 86 -0.886 14.216 3.368 1.00 0.00 N ATOM 0 H ARG A 86 3.768 11.272 -0.964 1.00 0.00 H new ATOM 0 HA ARG A 86 1.432 10.076 0.022 1.00 0.00 H new ATOM 0 HB2 ARG A 86 2.093 12.922 -0.858 1.00 0.00 H new ATOM 0 HB3 ARG A 86 0.583 12.495 -0.078 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.815 11.595 1.890 1.00 0.00 H new ATOM 0 HG3 ARG A 86 3.349 11.907 1.101 1.00 0.00 H new ATOM 0 HD2 ARG A 86 2.903 13.754 2.644 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.768 14.369 1.008 1.00 0.00 H new ATOM 0 HE ARG A 86 0.424 14.635 1.291 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.979 12.948 3.950 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.558 13.023 4.998 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.399 14.706 2.635 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.340 14.011 4.258 1.00 0.00 H new ATOM 140 N GLU A 87 1.319 10.944 -3.137 1.00 0.00 N ATOM 141 CA GLU A 87 0.522 10.808 -4.353 1.00 0.00 C ATOM 142 C GLU A 87 0.391 9.336 -4.735 1.00 0.00 C ATOM 143 O GLU A 87 -0.699 8.766 -4.687 1.00 0.00 O ATOM 144 CB GLU A 87 1.182 11.581 -5.496 1.00 0.00 C ATOM 145 CG GLU A 87 1.108 13.079 -5.200 1.00 0.00 C ATOM 146 CD GLU A 87 1.866 13.863 -6.265 1.00 0.00 C ATOM 147 OE1 GLU A 87 2.400 13.237 -7.166 1.00 0.00 O ATOM 148 OE2 GLU A 87 1.902 15.078 -6.163 1.00 0.00 O ATOM 0 H GLU A 87 2.267 11.291 -3.283 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.472 11.216 -4.169 1.00 0.00 H new ATOM 0 HB2 GLU A 87 2.221 11.271 -5.608 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.680 11.359 -6.438 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.067 13.401 -5.173 1.00 0.00 H new ATOM 0 HG3 GLU A 87 1.531 13.284 -4.217 1.00 0.00 H new ATOM 155 N ALA A 88 1.512 8.741 -5.135 1.00 0.00 N ATOM 156 CA ALA A 88 1.534 7.333 -5.556 1.00 0.00 C ATOM 157 C ALA A 88 0.548 6.508 -4.724 1.00 0.00 C ATOM 158 O ALA A 88 -0.238 5.723 -5.262 1.00 0.00 O ATOM 159 CB ALA A 88 2.942 6.753 -5.403 1.00 0.00 C ATOM 0 H ALA A 88 2.418 9.207 -5.178 1.00 0.00 H new ATOM 0 HA ALA A 88 1.239 7.288 -6.604 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.942 5.710 -5.719 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.638 7.319 -6.022 1.00 0.00 H new ATOM 0 HB3 ALA A 88 3.250 6.816 -4.359 1.00 0.00 H new ATOM 165 N PHE A 89 0.586 6.696 -3.409 1.00 0.00 N ATOM 166 CA PHE A 89 -0.313 5.972 -2.524 1.00 0.00 C ATOM 167 C PHE A 89 -1.767 6.424 -2.725 1.00 0.00 C ATOM 168 O PHE A 89 -2.682 5.602 -2.696 1.00 0.00 O ATOM 169 CB PHE A 89 0.129 6.162 -1.066 1.00 0.00 C ATOM 170 CG PHE A 89 1.169 5.110 -0.725 1.00 0.00 C ATOM 171 CD1 PHE A 89 0.800 3.759 -0.680 1.00 0.00 C ATOM 172 CD2 PHE A 89 2.496 5.477 -0.487 1.00 0.00 C ATOM 173 CE1 PHE A 89 1.759 2.780 -0.396 1.00 0.00 C ATOM 174 CE2 PHE A 89 3.455 4.497 -0.210 1.00 0.00 C ATOM 175 CZ PHE A 89 3.085 3.152 -0.162 1.00 0.00 C ATOM 0 H PHE A 89 1.224 7.338 -2.938 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.266 4.911 -2.768 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.543 7.160 -0.925 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.728 6.075 -0.398 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.225 3.473 -0.865 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.782 6.518 -0.517 1.00 0.00 H new ATOM 0 HE1 PHE A 89 1.474 1.739 -0.358 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.482 4.781 -0.033 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.826 2.397 0.057 1.00 0.00 H new ATOM 185 N ARG A 90 -1.987 7.724 -2.923 1.00 0.00 N ATOM 186 CA ARG A 90 -3.350 8.215 -3.126 1.00 0.00 C ATOM 187 C ARG A 90 -3.976 7.594 -4.380 1.00 0.00 C ATOM 188 O ARG A 90 -5.120 7.138 -4.352 1.00 0.00 O ATOM 189 CB ARG A 90 -3.338 9.744 -3.268 1.00 0.00 C ATOM 190 CG ARG A 90 -3.183 10.409 -1.889 1.00 0.00 C ATOM 191 CD ARG A 90 -4.543 10.517 -1.191 1.00 0.00 C ATOM 192 NE ARG A 90 -4.435 11.383 -0.025 1.00 0.00 N ATOM 193 CZ ARG A 90 -3.774 10.996 1.057 1.00 0.00 C ATOM 194 NH1 ARG A 90 -3.178 9.835 1.081 1.00 0.00 N ATOM 195 NH2 ARG A 90 -3.715 11.780 2.097 1.00 0.00 N ATOM 0 H ARG A 90 -1.260 8.440 -2.947 1.00 0.00 H new ATOM 0 HA ARG A 90 -3.946 7.929 -2.260 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.519 10.049 -3.920 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -4.262 10.079 -3.739 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -2.496 9.828 -1.273 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -2.746 11.401 -2.004 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -5.286 10.915 -1.883 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.886 9.527 -0.889 1.00 0.00 H new ATOM 0 HE ARG A 90 -4.875 12.303 -0.041 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -3.220 9.223 0.266 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -2.670 9.540 1.915 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -4.177 12.689 2.077 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -3.207 11.484 2.931 1.00 0.00 H new ATOM 209 N VAL A 91 -3.226 7.585 -5.474 1.00 0.00 N ATOM 210 CA VAL A 91 -3.727 7.022 -6.728 1.00 0.00 C ATOM 211 C VAL A 91 -3.890 5.507 -6.620 1.00 0.00 C ATOM 212 O VAL A 91 -4.723 4.915 -7.307 1.00 0.00 O ATOM 213 CB VAL A 91 -2.774 7.354 -7.877 1.00 0.00 C ATOM 214 CG1 VAL A 91 -2.777 8.862 -8.141 1.00 0.00 C ATOM 215 CG2 VAL A 91 -1.363 6.915 -7.501 1.00 0.00 C ATOM 0 H VAL A 91 -2.277 7.956 -5.523 1.00 0.00 H new ATOM 0 HA VAL A 91 -4.703 7.465 -6.928 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.101 6.831 -8.776 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -2.096 9.089 -8.961 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.784 9.183 -8.407 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.453 9.389 -7.244 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -0.679 7.149 -8.317 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.046 7.441 -6.600 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.353 5.841 -7.317 1.00 0.00 H new ATOM 225 N PHE A 92 -3.085 4.886 -5.761 1.00 0.00 N ATOM 226 CA PHE A 92 -3.150 3.434 -5.588 1.00 0.00 C ATOM 227 C PHE A 92 -4.575 3.009 -5.247 1.00 0.00 C ATOM 228 O PHE A 92 -5.129 2.105 -5.875 1.00 0.00 O ATOM 229 CB PHE A 92 -2.186 2.994 -4.459 1.00 0.00 C ATOM 230 CG PHE A 92 -1.001 2.246 -5.028 1.00 0.00 C ATOM 231 CD1 PHE A 92 -0.290 2.778 -6.110 1.00 0.00 C ATOM 232 CD2 PHE A 92 -0.617 1.019 -4.473 1.00 0.00 C ATOM 233 CE1 PHE A 92 0.802 2.081 -6.638 1.00 0.00 C ATOM 234 CE2 PHE A 92 0.472 0.324 -5.000 1.00 0.00 C ATOM 235 CZ PHE A 92 1.184 0.854 -6.082 1.00 0.00 C ATOM 0 H PHE A 92 -2.389 5.355 -5.181 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.852 2.954 -6.520 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -1.840 3.869 -3.908 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -2.716 2.359 -3.749 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -0.584 3.726 -6.537 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -1.164 0.610 -3.636 1.00 0.00 H new ATOM 0 HE1 PHE A 92 1.350 2.489 -7.474 1.00 0.00 H new ATOM 0 HE2 PHE A 92 0.766 -0.623 -4.573 1.00 0.00 H new ATOM 0 HZ PHE A 92 2.028 0.317 -6.488 1.00 0.00 H new ATOM 245 N ASP A 93 -5.163 3.663 -4.257 1.00 0.00 N ATOM 246 CA ASP A 93 -6.518 3.328 -3.864 1.00 0.00 C ATOM 247 C ASP A 93 -7.444 3.460 -5.067 1.00 0.00 C ATOM 248 O ASP A 93 -8.044 4.512 -5.285 1.00 0.00 O ATOM 249 CB ASP A 93 -6.987 4.258 -2.741 1.00 0.00 C ATOM 250 CG ASP A 93 -8.219 3.681 -2.057 1.00 0.00 C ATOM 251 OD1 ASP A 93 -8.453 2.491 -2.193 1.00 0.00 O ATOM 252 OD2 ASP A 93 -8.909 4.442 -1.404 1.00 0.00 O ATOM 0 H ASP A 93 -4.731 4.415 -3.721 1.00 0.00 H new ATOM 0 HA ASP A 93 -6.541 2.301 -3.500 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.187 4.392 -2.012 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.216 5.243 -3.147 1.00 0.00 H new ATOM 257 N LYS A 94 -7.543 2.388 -5.852 1.00 0.00 N ATOM 258 CA LYS A 94 -8.394 2.414 -7.041 1.00 0.00 C ATOM 259 C LYS A 94 -9.801 2.853 -6.665 1.00 0.00 C ATOM 260 O LYS A 94 -10.350 3.786 -7.253 1.00 0.00 O ATOM 261 CB LYS A 94 -8.435 1.021 -7.681 1.00 0.00 C ATOM 262 CG LYS A 94 -7.152 0.774 -8.485 1.00 0.00 C ATOM 263 CD LYS A 94 -7.109 -0.694 -8.947 1.00 0.00 C ATOM 264 CE LYS A 94 -6.245 -0.836 -10.209 1.00 0.00 C ATOM 265 NZ LYS A 94 -7.104 -0.646 -11.413 1.00 0.00 N ATOM 0 H LYS A 94 -7.055 1.507 -5.691 1.00 0.00 H new ATOM 0 HA LYS A 94 -7.982 3.125 -7.758 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -8.542 0.260 -6.908 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.304 0.937 -8.333 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -7.118 1.439 -9.348 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -6.278 1.000 -7.874 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -6.706 -1.320 -8.151 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -8.120 -1.047 -9.150 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.442 -0.099 -10.200 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.775 -1.819 -10.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -6.525 -0.741 -12.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -7.855 -1.366 -11.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -7.533 0.301 -11.388 1.00 0.00 H new ATOM 279 N ASP A 95 -10.379 2.176 -5.683 1.00 0.00 N ATOM 280 CA ASP A 95 -11.720 2.499 -5.226 1.00 0.00 C ATOM 281 C ASP A 95 -11.714 3.801 -4.431 1.00 0.00 C ATOM 282 O ASP A 95 -12.663 4.094 -3.704 1.00 0.00 O ATOM 283 CB ASP A 95 -12.246 1.359 -4.353 1.00 0.00 C ATOM 284 CG ASP A 95 -13.709 1.598 -4.001 1.00 0.00 C ATOM 285 OD1 ASP A 95 -14.519 1.606 -4.910 1.00 0.00 O ATOM 286 OD2 ASP A 95 -13.995 1.769 -2.827 1.00 0.00 O ATOM 0 H ASP A 95 -9.939 1.400 -5.188 1.00 0.00 H new ATOM 0 HA ASP A 95 -12.369 2.626 -6.092 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -12.141 0.410 -4.879 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -11.652 1.285 -3.442 1.00 0.00 H new ATOM 291 N GLY A 96 -10.639 4.580 -4.600 1.00 0.00 N ATOM 292 CA GLY A 96 -10.485 5.873 -3.922 1.00 0.00 C ATOM 293 C GLY A 96 -11.268 5.937 -2.611 1.00 0.00 C ATOM 294 O GLY A 96 -11.916 6.939 -2.317 1.00 0.00 O ATOM 0 H GLY A 96 -9.856 4.334 -5.206 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -9.429 6.052 -3.721 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -10.823 6.670 -4.584 1.00 0.00 H new ATOM 298 N ASN A 97 -11.221 4.854 -1.837 1.00 0.00 N ATOM 299 CA ASN A 97 -11.948 4.804 -0.576 1.00 0.00 C ATOM 300 C ASN A 97 -11.290 5.702 0.474 1.00 0.00 C ATOM 301 O ASN A 97 -11.852 5.928 1.545 1.00 0.00 O ATOM 302 CB ASN A 97 -12.044 3.354 -0.072 1.00 0.00 C ATOM 303 CG ASN A 97 -10.738 2.892 0.573 1.00 0.00 C ATOM 304 OD1 ASN A 97 -9.755 3.627 0.607 1.00 0.00 O ATOM 305 ND2 ASN A 97 -10.675 1.699 1.095 1.00 0.00 N ATOM 0 H ASN A 97 -10.693 4.010 -2.060 1.00 0.00 H new ATOM 0 HA ASN A 97 -12.957 5.178 -0.748 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -12.856 3.273 0.651 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.292 2.695 -0.904 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -9.810 1.378 1.531 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -11.490 1.087 1.068 1.00 0.00 H new ATOM 312 N GLY A 98 -10.101 6.226 0.157 1.00 0.00 N ATOM 313 CA GLY A 98 -9.382 7.113 1.082 1.00 0.00 C ATOM 314 C GLY A 98 -8.427 6.334 1.979 1.00 0.00 C ATOM 315 O GLY A 98 -7.979 6.835 3.011 1.00 0.00 O ATOM 0 H GLY A 98 -9.618 6.054 -0.725 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -8.823 7.856 0.514 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -10.099 7.656 1.698 1.00 0.00 H new ATOM 319 N TYR A 99 -8.119 5.114 1.573 1.00 0.00 N ATOM 320 CA TYR A 99 -7.209 4.264 2.332 1.00 0.00 C ATOM 321 C TYR A 99 -6.630 3.184 1.424 1.00 0.00 C ATOM 322 O TYR A 99 -6.828 3.224 0.209 1.00 0.00 O ATOM 323 CB TYR A 99 -7.935 3.634 3.518 1.00 0.00 C ATOM 324 CG TYR A 99 -8.287 4.712 4.519 1.00 0.00 C ATOM 325 CD1 TYR A 99 -7.345 5.111 5.478 1.00 0.00 C ATOM 326 CD2 TYR A 99 -9.549 5.317 4.489 1.00 0.00 C ATOM 327 CE1 TYR A 99 -7.665 6.110 6.402 1.00 0.00 C ATOM 328 CE2 TYR A 99 -9.869 6.319 5.412 1.00 0.00 C ATOM 329 CZ TYR A 99 -8.926 6.715 6.370 1.00 0.00 C ATOM 330 OH TYR A 99 -9.241 7.704 7.280 1.00 0.00 O ATOM 0 H TYR A 99 -8.484 4.687 0.722 1.00 0.00 H new ATOM 0 HA TYR A 99 -6.392 4.874 2.717 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -8.839 3.128 3.179 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -7.303 2.879 3.986 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -6.371 4.646 5.503 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -10.277 5.010 3.752 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.939 6.415 7.141 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -10.842 6.787 5.386 1.00 0.00 H new ATOM 0 HH TYR A 99 -10.155 8.018 7.118 1.00 0.00 H new ATOM 340 N ILE A 100 -5.902 2.225 2.008 1.00 0.00 N ATOM 341 CA ILE A 100 -5.289 1.146 1.210 1.00 0.00 C ATOM 342 C ILE A 100 -5.741 -0.238 1.676 1.00 0.00 C ATOM 343 O ILE A 100 -5.473 -0.639 2.813 1.00 0.00 O ATOM 344 CB ILE A 100 -3.768 1.240 1.327 1.00 0.00 C ATOM 345 CG1 ILE A 100 -3.267 2.589 0.776 1.00 0.00 C ATOM 346 CG2 ILE A 100 -3.113 0.101 0.552 1.00 0.00 C ATOM 347 CD1 ILE A 100 -3.645 2.753 -0.699 1.00 0.00 C ATOM 0 H ILE A 100 -5.723 2.169 3.011 1.00 0.00 H new ATOM 0 HA ILE A 100 -5.608 1.272 0.175 1.00 0.00 H new ATOM 0 HB ILE A 100 -3.499 1.165 2.381 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.695 3.405 1.358 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.184 2.652 0.887 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -2.029 0.176 0.641 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -3.445 -0.854 0.959 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -3.396 0.166 -0.499 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.280 3.713 -1.064 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.195 1.949 -1.281 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.729 2.714 -0.803 1.00 0.00 H new ATOM 359 N SER A 101 -6.413 -0.975 0.774 1.00 0.00 N ATOM 360 CA SER A 101 -6.888 -2.330 1.071 1.00 0.00 C ATOM 361 C SER A 101 -5.947 -3.355 0.445 1.00 0.00 C ATOM 362 O SER A 101 -5.192 -3.032 -0.465 1.00 0.00 O ATOM 363 CB SER A 101 -8.293 -2.536 0.504 1.00 0.00 C ATOM 364 OG SER A 101 -8.756 -3.833 0.856 1.00 0.00 O ATOM 0 H SER A 101 -6.638 -0.651 -0.167 1.00 0.00 H new ATOM 0 HA SER A 101 -6.912 -2.459 2.153 1.00 0.00 H new ATOM 0 HB2 SER A 101 -8.970 -1.777 0.895 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.280 -2.424 -0.580 1.00 0.00 H new ATOM 0 HG SER A 101 -9.657 -3.968 0.495 1.00 0.00 H new ATOM 370 N ALA A 102 -5.993 -4.582 0.949 1.00 0.00 N ATOM 371 CA ALA A 102 -5.125 -5.646 0.445 1.00 0.00 C ATOM 372 C ALA A 102 -5.457 -6.043 -0.988 1.00 0.00 C ATOM 373 O ALA A 102 -4.559 -6.364 -1.769 1.00 0.00 O ATOM 374 CB ALA A 102 -5.240 -6.878 1.344 1.00 0.00 C ATOM 0 H ALA A 102 -6.618 -4.867 1.703 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.107 -5.257 0.454 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.592 -7.667 0.964 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -4.938 -6.618 2.359 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -6.272 -7.228 1.351 1.00 0.00 H new ATOM 380 N ALA A 103 -6.736 -6.047 -1.330 1.00 0.00 N ATOM 381 CA ALA A 103 -7.151 -6.439 -2.663 1.00 0.00 C ATOM 382 C ALA A 103 -6.554 -5.521 -3.724 1.00 0.00 C ATOM 383 O ALA A 103 -6.216 -5.962 -4.824 1.00 0.00 O ATOM 384 CB ALA A 103 -8.679 -6.401 -2.742 1.00 0.00 C ATOM 0 H ALA A 103 -7.499 -5.785 -0.706 1.00 0.00 H new ATOM 0 HA ALA A 103 -6.790 -7.449 -2.856 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -8.999 -6.695 -3.742 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -9.098 -7.091 -2.010 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.029 -5.391 -2.531 1.00 0.00 H new ATOM 390 N GLU A 104 -6.436 -4.243 -3.401 1.00 0.00 N ATOM 391 CA GLU A 104 -5.894 -3.280 -4.340 1.00 0.00 C ATOM 392 C GLU A 104 -4.420 -3.542 -4.608 1.00 0.00 C ATOM 393 O GLU A 104 -3.940 -3.340 -5.713 1.00 0.00 O ATOM 394 CB GLU A 104 -6.049 -1.874 -3.763 1.00 0.00 C ATOM 395 CG GLU A 104 -7.522 -1.607 -3.482 1.00 0.00 C ATOM 396 CD GLU A 104 -7.681 -0.290 -2.734 1.00 0.00 C ATOM 397 OE1 GLU A 104 -6.669 0.286 -2.371 1.00 0.00 O ATOM 398 OE2 GLU A 104 -8.812 0.115 -2.518 1.00 0.00 O ATOM 0 H GLU A 104 -6.708 -3.852 -2.499 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.440 -3.373 -5.279 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -5.468 -1.779 -2.845 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -5.661 -1.135 -4.464 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.078 -1.572 -4.419 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -7.941 -2.422 -2.892 1.00 0.00 H new ATOM 405 N LEU A 105 -3.691 -3.979 -3.595 1.00 0.00 N ATOM 406 CA LEU A 105 -2.269 -4.221 -3.786 1.00 0.00 C ATOM 407 C LEU A 105 -2.023 -5.373 -4.747 1.00 0.00 C ATOM 408 O LEU A 105 -1.275 -5.233 -5.703 1.00 0.00 O ATOM 409 CB LEU A 105 -1.613 -4.544 -2.451 1.00 0.00 C ATOM 410 CG LEU A 105 -2.039 -3.524 -1.401 1.00 0.00 C ATOM 411 CD1 LEU A 105 -1.238 -3.765 -0.121 1.00 0.00 C ATOM 412 CD2 LEU A 105 -1.783 -2.107 -1.917 1.00 0.00 C ATOM 0 H LEU A 105 -4.045 -4.169 -2.658 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.836 -3.315 -4.210 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.895 -5.547 -2.131 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -0.528 -4.537 -2.558 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.104 -3.633 -1.194 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.536 -3.040 0.636 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -1.432 -4.773 0.245 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.174 -3.654 -0.331 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -2.090 -1.384 -1.161 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.721 -1.983 -2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -2.356 -1.943 -2.830 1.00 0.00 H new ATOM 424 N ARG A 106 -2.636 -6.515 -4.490 1.00 0.00 N ATOM 425 CA ARG A 106 -2.425 -7.666 -5.352 1.00 0.00 C ATOM 426 C ARG A 106 -2.886 -7.388 -6.776 1.00 0.00 C ATOM 427 O ARG A 106 -2.188 -7.729 -7.734 1.00 0.00 O ATOM 428 CB ARG A 106 -3.150 -8.889 -4.776 1.00 0.00 C ATOM 429 CG ARG A 106 -4.653 -8.611 -4.688 1.00 0.00 C ATOM 430 CD ARG A 106 -5.348 -9.749 -3.941 1.00 0.00 C ATOM 431 NE ARG A 106 -6.792 -9.559 -3.985 1.00 0.00 N ATOM 432 CZ ARG A 106 -7.598 -10.196 -3.143 1.00 0.00 C ATOM 433 NH1 ARG A 106 -7.101 -10.995 -2.233 1.00 0.00 N ATOM 434 NH2 ARG A 106 -8.889 -10.017 -3.219 1.00 0.00 N ATOM 0 H ARG A 106 -3.272 -6.670 -3.708 1.00 0.00 H new ATOM 0 HA ARG A 106 -1.355 -7.872 -5.391 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.969 -9.760 -5.406 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -2.756 -9.123 -3.787 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -4.828 -7.666 -4.173 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -5.073 -8.511 -5.689 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -5.084 -10.706 -4.391 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -5.007 -9.778 -2.906 1.00 0.00 H new ATOM 0 HE ARG A 106 -7.192 -8.924 -4.676 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -6.092 -11.130 -2.169 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -7.723 -11.483 -1.588 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -9.276 -9.389 -3.924 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -9.510 -10.505 -2.574 1.00 0.00 H new ATOM 448 N HIS A 107 -4.056 -6.782 -6.925 1.00 0.00 N ATOM 449 CA HIS A 107 -4.575 -6.488 -8.253 1.00 0.00 C ATOM 450 C HIS A 107 -3.726 -5.432 -8.955 1.00 0.00 C ATOM 451 O HIS A 107 -3.350 -5.592 -10.115 1.00 0.00 O ATOM 452 CB HIS A 107 -6.014 -5.984 -8.136 1.00 0.00 C ATOM 453 CG HIS A 107 -6.899 -7.099 -7.659 1.00 0.00 C ATOM 454 ND1 HIS A 107 -7.875 -6.906 -6.693 1.00 0.00 N ATOM 455 CD2 HIS A 107 -6.975 -8.425 -8.007 1.00 0.00 C ATOM 456 CE1 HIS A 107 -8.490 -8.088 -6.496 1.00 0.00 C ATOM 457 NE2 HIS A 107 -7.980 -9.046 -7.273 1.00 0.00 N ATOM 0 H HIS A 107 -4.656 -6.488 -6.155 1.00 0.00 H new ATOM 0 HA HIS A 107 -4.544 -7.404 -8.844 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -6.061 -5.146 -7.441 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -6.362 -5.618 -9.102 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -8.088 -6.029 -6.218 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -6.349 -8.912 -8.740 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -9.297 -8.242 -5.795 1.00 0.00 H new ATOM 466 N VAL A 108 -3.437 -4.351 -8.243 1.00 0.00 N ATOM 467 CA VAL A 108 -2.646 -3.268 -8.813 1.00 0.00 C ATOM 468 C VAL A 108 -1.224 -3.741 -9.102 1.00 0.00 C ATOM 469 O VAL A 108 -0.690 -3.479 -10.174 1.00 0.00 O ATOM 470 CB VAL A 108 -2.632 -2.073 -7.854 1.00 0.00 C ATOM 471 CG1 VAL A 108 -1.821 -0.938 -8.472 1.00 0.00 C ATOM 472 CG2 VAL A 108 -4.074 -1.592 -7.598 1.00 0.00 C ATOM 0 H VAL A 108 -3.735 -4.201 -7.279 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.099 -2.957 -9.755 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.181 -2.375 -6.909 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -1.810 -0.087 -7.792 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -0.800 -1.275 -8.649 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -2.274 -0.640 -9.418 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.058 -0.742 -6.916 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.530 -1.292 -8.541 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.655 -2.402 -7.156 1.00 0.00 H new ATOM 482 N MET A 109 -0.612 -4.428 -8.139 1.00 0.00 N ATOM 483 CA MET A 109 0.757 -4.911 -8.321 1.00 0.00 C ATOM 484 C MET A 109 0.828 -5.762 -9.583 1.00 0.00 C ATOM 485 O MET A 109 1.718 -5.584 -10.417 1.00 0.00 O ATOM 486 CB MET A 109 1.175 -5.750 -7.108 1.00 0.00 C ATOM 487 CG MET A 109 1.509 -4.830 -5.928 1.00 0.00 C ATOM 488 SD MET A 109 3.051 -3.941 -6.255 1.00 0.00 S ATOM 489 CE MET A 109 4.198 -5.251 -5.752 1.00 0.00 C ATOM 0 H MET A 109 -1.033 -4.660 -7.239 1.00 0.00 H new ATOM 0 HA MET A 109 1.433 -4.061 -8.417 1.00 0.00 H new ATOM 0 HB2 MET A 109 0.371 -6.432 -6.832 1.00 0.00 H new ATOM 0 HB3 MET A 109 2.041 -6.363 -7.359 1.00 0.00 H new ATOM 0 HG2 MET A 109 0.697 -4.120 -5.768 1.00 0.00 H new ATOM 0 HG3 MET A 109 1.604 -5.417 -5.014 1.00 0.00 H new ATOM 0 HE1 MET A 109 4.924 -4.848 -5.046 1.00 0.00 H new ATOM 0 HE2 MET A 109 3.642 -6.059 -5.278 1.00 0.00 H new ATOM 0 HE3 MET A 109 4.719 -5.635 -6.629 1.00 0.00 H new ATOM 499 N THR A 110 -0.137 -6.661 -9.735 1.00 0.00 N ATOM 500 CA THR A 110 -0.198 -7.507 -10.918 1.00 0.00 C ATOM 501 C THR A 110 -0.416 -6.646 -12.158 1.00 0.00 C ATOM 502 O THR A 110 0.210 -6.860 -13.195 1.00 0.00 O ATOM 503 CB THR A 110 -1.334 -8.522 -10.777 1.00 0.00 C ATOM 504 OG1 THR A 110 -1.061 -9.379 -9.677 1.00 0.00 O ATOM 505 CG2 THR A 110 -1.448 -9.347 -12.057 1.00 0.00 C ATOM 0 H THR A 110 -0.883 -6.822 -9.058 1.00 0.00 H new ATOM 0 HA THR A 110 0.744 -8.046 -11.021 1.00 0.00 H new ATOM 0 HB THR A 110 -2.274 -7.997 -10.606 1.00 0.00 H new ATOM 0 HG1 THR A 110 -1.405 -8.974 -8.854 1.00 0.00 H new ATOM 0 HG21 THR A 110 -2.258 -10.069 -11.954 1.00 0.00 H new ATOM 0 HG22 THR A 110 -1.656 -8.686 -12.898 1.00 0.00 H new ATOM 0 HG23 THR A 110 -0.511 -9.875 -12.234 1.00 0.00 H new ATOM 513 N ASN A 111 -1.310 -5.668 -12.035 1.00 0.00 N ATOM 514 CA ASN A 111 -1.614 -4.766 -13.141 1.00 0.00 C ATOM 515 C ASN A 111 -0.376 -3.973 -13.534 1.00 0.00 C ATOM 516 O ASN A 111 -0.109 -3.764 -14.718 1.00 0.00 O ATOM 517 CB ASN A 111 -2.721 -3.798 -12.729 1.00 0.00 C ATOM 518 CG ASN A 111 -3.246 -3.051 -13.951 1.00 0.00 C ATOM 519 OD1 ASN A 111 -2.562 -2.181 -14.490 1.00 0.00 O ATOM 520 ND2 ASN A 111 -4.427 -3.342 -14.423 1.00 0.00 N ATOM 0 H ASN A 111 -1.836 -5.481 -11.181 1.00 0.00 H new ATOM 0 HA ASN A 111 -1.943 -5.361 -13.993 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -3.534 -4.345 -12.251 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -2.339 -3.088 -11.995 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -4.785 -2.848 -15.240 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -4.992 -4.063 -13.975 1.00 0.00 H new ATOM 527 N LEU A 112 0.379 -3.539 -12.534 1.00 0.00 N ATOM 528 CA LEU A 112 1.586 -2.776 -12.780 1.00 0.00 C ATOM 529 C LEU A 112 2.571 -3.614 -13.582 1.00 0.00 C ATOM 530 O LEU A 112 3.263 -3.100 -14.461 1.00 0.00 O ATOM 531 CB LEU A 112 2.222 -2.373 -11.446 1.00 0.00 C ATOM 532 CG LEU A 112 1.465 -1.183 -10.829 1.00 0.00 C ATOM 533 CD1 LEU A 112 1.894 -1.029 -9.365 1.00 0.00 C ATOM 534 CD2 LEU A 112 1.786 0.121 -11.594 1.00 0.00 C ATOM 0 H LEU A 112 0.174 -3.704 -11.548 1.00 0.00 H new ATOM 0 HA LEU A 112 1.333 -1.879 -13.346 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.206 -3.218 -10.758 1.00 0.00 H new ATOM 0 HB3 LEU A 112 3.268 -2.107 -11.600 1.00 0.00 H new ATOM 0 HG LEU A 112 0.393 -1.370 -10.894 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.364 -0.188 -8.917 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.656 -1.941 -8.818 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.968 -0.848 -9.318 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.242 0.951 -11.143 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.857 0.319 -11.543 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.486 0.014 -12.637 1.00 0.00 H new ATOM 546 N GLY A 113 2.633 -4.913 -13.275 1.00 0.00 N ATOM 547 CA GLY A 113 3.542 -5.826 -13.974 1.00 0.00 C ATOM 548 C GLY A 113 4.569 -6.417 -13.011 1.00 0.00 C ATOM 549 O GLY A 113 5.332 -7.313 -13.376 1.00 0.00 O ATOM 0 H GLY A 113 2.067 -5.355 -12.550 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.970 -6.629 -14.440 1.00 0.00 H new ATOM 0 HA3 GLY A 113 4.054 -5.293 -14.775 1.00 0.00 H new ATOM 553 N GLU A 114 4.588 -5.910 -11.781 1.00 0.00 N ATOM 554 CA GLU A 114 5.529 -6.397 -10.776 1.00 0.00 C ATOM 555 C GLU A 114 4.975 -7.636 -10.070 1.00 0.00 C ATOM 556 O GLU A 114 3.953 -7.571 -9.388 1.00 0.00 O ATOM 557 CB GLU A 114 5.809 -5.287 -9.760 1.00 0.00 C ATOM 558 CG GLU A 114 6.881 -5.751 -8.773 1.00 0.00 C ATOM 559 CD GLU A 114 7.300 -4.589 -7.877 1.00 0.00 C ATOM 560 OE1 GLU A 114 6.423 -3.882 -7.406 1.00 0.00 O ATOM 561 OE2 GLU A 114 8.491 -4.419 -7.682 1.00 0.00 O ATOM 0 H GLU A 114 3.968 -5.168 -11.458 1.00 0.00 H new ATOM 0 HA GLU A 114 6.459 -6.678 -11.270 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.140 -4.385 -10.274 1.00 0.00 H new ATOM 0 HB3 GLU A 114 4.894 -5.031 -9.225 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.498 -6.570 -8.165 1.00 0.00 H new ATOM 0 HG3 GLU A 114 7.746 -6.134 -9.315 1.00 0.00 H new ATOM 568 N LYS A 115 5.656 -8.766 -10.257 1.00 0.00 N ATOM 569 CA LYS A 115 5.226 -10.026 -9.655 1.00 0.00 C ATOM 570 C LYS A 115 5.191 -9.927 -8.132 1.00 0.00 C ATOM 571 O LYS A 115 6.061 -9.311 -7.517 1.00 0.00 O ATOM 572 CB LYS A 115 6.166 -11.153 -10.089 1.00 0.00 C ATOM 573 CG LYS A 115 7.564 -10.915 -9.512 1.00 0.00 C ATOM 574 CD LYS A 115 8.515 -11.994 -10.026 1.00 0.00 C ATOM 575 CE LYS A 115 9.906 -11.762 -9.435 1.00 0.00 C ATOM 576 NZ LYS A 115 10.829 -12.828 -9.911 1.00 0.00 N ATOM 0 H LYS A 115 6.505 -8.834 -10.819 1.00 0.00 H new ATOM 0 HA LYS A 115 4.215 -10.244 -10.000 1.00 0.00 H new ATOM 0 HB2 LYS A 115 5.780 -12.113 -9.746 1.00 0.00 H new ATOM 0 HB3 LYS A 115 6.215 -11.199 -11.177 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.926 -9.928 -9.801 1.00 0.00 H new ATOM 0 HG3 LYS A 115 7.528 -10.935 -8.423 1.00 0.00 H new ATOM 0 HD2 LYS A 115 8.148 -12.982 -9.747 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.560 -11.967 -11.115 1.00 0.00 H new ATOM 0 HE2 LYS A 115 10.280 -10.782 -9.732 1.00 0.00 H new ATOM 0 HE3 LYS A 115 9.856 -11.768 -8.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.776 -12.672 -9.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 10.473 -13.757 -9.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.884 -12.801 -10.949 1.00 0.00 H new ATOM 590 N LEU A 116 4.183 -10.542 -7.522 1.00 0.00 N ATOM 591 CA LEU A 116 4.045 -10.528 -6.072 1.00 0.00 C ATOM 592 C LEU A 116 3.271 -11.758 -5.594 1.00 0.00 C ATOM 593 O LEU A 116 2.580 -12.411 -6.377 1.00 0.00 O ATOM 594 CB LEU A 116 3.322 -9.240 -5.625 1.00 0.00 C ATOM 595 CG LEU A 116 1.839 -9.225 -6.083 1.00 0.00 C ATOM 596 CD1 LEU A 116 1.711 -9.603 -7.570 1.00 0.00 C ATOM 597 CD2 LEU A 116 0.974 -10.186 -5.229 1.00 0.00 C ATOM 0 H LEU A 116 3.450 -11.056 -8.010 1.00 0.00 H new ATOM 0 HA LEU A 116 5.040 -10.552 -5.627 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.368 -9.155 -4.539 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.838 -8.372 -6.035 1.00 0.00 H new ATOM 0 HG LEU A 116 1.474 -8.207 -5.944 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.661 -9.584 -7.861 1.00 0.00 H new ATOM 0 HD12 LEU A 116 2.269 -8.889 -8.176 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.113 -10.604 -7.727 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -0.059 -10.151 -5.576 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.356 -11.202 -5.326 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.016 -9.881 -4.183 1.00 0.00 H new ATOM 609 N THR A 117 3.358 -12.062 -4.301 1.00 0.00 N ATOM 610 CA THR A 117 2.619 -13.197 -3.734 1.00 0.00 C ATOM 611 C THR A 117 1.408 -12.683 -2.948 1.00 0.00 C ATOM 612 O THR A 117 1.547 -11.854 -2.047 1.00 0.00 O ATOM 613 CB THR A 117 3.526 -14.007 -2.805 1.00 0.00 C ATOM 614 OG1 THR A 117 4.259 -13.121 -1.973 1.00 0.00 O ATOM 615 CG2 THR A 117 4.498 -14.848 -3.633 1.00 0.00 C ATOM 0 H THR A 117 3.926 -11.547 -3.629 1.00 0.00 H new ATOM 0 HA THR A 117 2.280 -13.839 -4.547 1.00 0.00 H new ATOM 0 HB THR A 117 2.914 -14.667 -2.190 1.00 0.00 H new ATOM 0 HG1 THR A 117 4.874 -13.635 -1.409 1.00 0.00 H new ATOM 0 HG21 THR A 117 5.141 -15.422 -2.966 1.00 0.00 H new ATOM 0 HG22 THR A 117 3.936 -15.530 -4.272 1.00 0.00 H new ATOM 0 HG23 THR A 117 5.110 -14.192 -4.252 1.00 0.00 H new ATOM 623 N ASP A 118 0.221 -13.168 -3.301 1.00 0.00 N ATOM 624 CA ASP A 118 -1.004 -12.735 -2.633 1.00 0.00 C ATOM 625 C ASP A 118 -0.913 -12.985 -1.134 1.00 0.00 C ATOM 626 O ASP A 118 -1.357 -12.172 -0.325 1.00 0.00 O ATOM 627 CB ASP A 118 -2.201 -13.499 -3.195 1.00 0.00 C ATOM 628 CG ASP A 118 -3.499 -12.834 -2.750 1.00 0.00 C ATOM 629 OD1 ASP A 118 -3.473 -12.148 -1.741 1.00 0.00 O ATOM 630 OD2 ASP A 118 -4.499 -13.020 -3.424 1.00 0.00 O ATOM 0 H ASP A 118 0.081 -13.856 -4.041 1.00 0.00 H new ATOM 0 HA ASP A 118 -1.131 -11.667 -2.810 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -2.149 -13.523 -4.284 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -2.176 -14.533 -2.852 1.00 0.00 H new ATOM 635 N GLU A 119 -0.345 -14.120 -0.770 1.00 0.00 N ATOM 636 CA GLU A 119 -0.215 -14.477 0.632 1.00 0.00 C ATOM 637 C GLU A 119 0.611 -13.426 1.376 1.00 0.00 C ATOM 638 O GLU A 119 0.347 -13.117 2.545 1.00 0.00 O ATOM 639 CB GLU A 119 0.459 -15.844 0.739 1.00 0.00 C ATOM 640 CG GLU A 119 -0.324 -16.856 -0.101 1.00 0.00 C ATOM 641 CD GLU A 119 0.250 -18.256 0.093 1.00 0.00 C ATOM 642 OE1 GLU A 119 1.093 -18.415 0.959 1.00 0.00 O ATOM 643 OE2 GLU A 119 -0.160 -19.150 -0.632 1.00 0.00 O ATOM 0 H GLU A 119 0.032 -14.808 -1.422 1.00 0.00 H new ATOM 0 HA GLU A 119 -1.205 -14.519 1.086 1.00 0.00 H new ATOM 0 HB2 GLU A 119 1.490 -15.783 0.390 1.00 0.00 H new ATOM 0 HB3 GLU A 119 0.493 -16.166 1.780 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.375 -16.843 0.187 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -0.278 -16.579 -1.154 1.00 0.00 H new ATOM 650 N GLU A 120 1.580 -12.841 0.678 1.00 0.00 N ATOM 651 CA GLU A 120 2.403 -11.795 1.272 1.00 0.00 C ATOM 652 C GLU A 120 1.599 -10.504 1.363 1.00 0.00 C ATOM 653 O GLU A 120 1.654 -9.799 2.367 1.00 0.00 O ATOM 654 CB GLU A 120 3.662 -11.568 0.432 1.00 0.00 C ATOM 655 CG GLU A 120 4.599 -10.585 1.146 1.00 0.00 C ATOM 656 CD GLU A 120 5.209 -11.244 2.380 1.00 0.00 C ATOM 657 OE1 GLU A 120 5.006 -12.435 2.554 1.00 0.00 O ATOM 658 OE2 GLU A 120 5.870 -10.549 3.132 1.00 0.00 O ATOM 0 H GLU A 120 1.812 -13.071 -0.288 1.00 0.00 H new ATOM 0 HA GLU A 120 2.704 -12.105 2.273 1.00 0.00 H new ATOM 0 HB2 GLU A 120 4.174 -12.516 0.266 1.00 0.00 H new ATOM 0 HB3 GLU A 120 3.390 -11.177 -0.548 1.00 0.00 H new ATOM 0 HG2 GLU A 120 5.389 -10.265 0.467 1.00 0.00 H new ATOM 0 HG3 GLU A 120 4.048 -9.691 1.437 1.00 0.00 H new ATOM 665 N VAL A 121 0.841 -10.216 0.309 1.00 0.00 N ATOM 666 CA VAL A 121 0.013 -9.017 0.284 1.00 0.00 C ATOM 667 C VAL A 121 -0.871 -8.991 1.524 1.00 0.00 C ATOM 668 O VAL A 121 -0.728 -8.132 2.391 1.00 0.00 O ATOM 669 CB VAL A 121 -0.857 -9.012 -0.984 1.00 0.00 C ATOM 670 CG1 VAL A 121 -1.967 -7.969 -0.858 1.00 0.00 C ATOM 671 CG2 VAL A 121 0.017 -8.689 -2.199 1.00 0.00 C ATOM 0 H VAL A 121 0.784 -10.791 -0.531 1.00 0.00 H new ATOM 0 HA VAL A 121 0.650 -8.133 0.277 1.00 0.00 H new ATOM 0 HB VAL A 121 -1.310 -9.995 -1.109 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.576 -7.975 -1.762 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -2.593 -8.206 0.003 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -1.525 -6.982 -0.725 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -0.598 -8.685 -3.099 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.474 -7.708 -2.068 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.798 -9.443 -2.296 1.00 0.00 H new ATOM 681 N ASP A 122 -1.782 -9.949 1.598 1.00 0.00 N ATOM 682 CA ASP A 122 -2.688 -10.039 2.732 1.00 0.00 C ATOM 683 C ASP A 122 -1.903 -9.900 4.031 1.00 0.00 C ATOM 684 O ASP A 122 -2.320 -9.186 4.943 1.00 0.00 O ATOM 685 CB ASP A 122 -3.417 -11.386 2.696 1.00 0.00 C ATOM 686 CG ASP A 122 -4.617 -11.366 3.633 1.00 0.00 C ATOM 687 OD1 ASP A 122 -5.305 -10.360 3.661 1.00 0.00 O ATOM 688 OD2 ASP A 122 -4.834 -12.362 4.307 1.00 0.00 O ATOM 0 H ASP A 122 -1.913 -10.672 0.890 1.00 0.00 H new ATOM 0 HA ASP A 122 -3.422 -9.235 2.678 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -3.745 -11.602 1.679 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -2.734 -12.184 2.987 1.00 0.00 H new ATOM 693 N GLU A 123 -0.755 -10.573 4.108 1.00 0.00 N ATOM 694 CA GLU A 123 0.075 -10.488 5.302 1.00 0.00 C ATOM 695 C GLU A 123 0.678 -9.082 5.444 1.00 0.00 C ATOM 696 O GLU A 123 0.859 -8.584 6.556 1.00 0.00 O ATOM 697 CB GLU A 123 1.197 -11.529 5.241 1.00 0.00 C ATOM 698 CG GLU A 123 2.023 -11.464 6.528 1.00 0.00 C ATOM 699 CD GLU A 123 3.068 -12.574 6.541 1.00 0.00 C ATOM 700 OE1 GLU A 123 3.257 -13.195 5.508 1.00 0.00 O ATOM 701 OE2 GLU A 123 3.661 -12.789 7.584 1.00 0.00 O ATOM 0 H GLU A 123 -0.386 -11.172 3.370 1.00 0.00 H new ATOM 0 HA GLU A 123 -0.553 -10.688 6.170 1.00 0.00 H new ATOM 0 HB2 GLU A 123 0.776 -12.527 5.116 1.00 0.00 H new ATOM 0 HB3 GLU A 123 1.835 -11.342 4.377 1.00 0.00 H new ATOM 0 HG2 GLU A 123 2.512 -10.493 6.606 1.00 0.00 H new ATOM 0 HG3 GLU A 123 1.368 -11.561 7.394 1.00 0.00 H new ATOM 708 N MET A 124 1.003 -8.463 4.308 1.00 0.00 N ATOM 709 CA MET A 124 1.607 -7.126 4.301 1.00 0.00 C ATOM 710 C MET A 124 0.799 -6.140 5.145 1.00 0.00 C ATOM 711 O MET A 124 1.281 -5.649 6.165 1.00 0.00 O ATOM 712 CB MET A 124 1.701 -6.606 2.865 1.00 0.00 C ATOM 713 CG MET A 124 2.608 -5.377 2.817 1.00 0.00 C ATOM 714 SD MET A 124 2.647 -4.730 1.126 1.00 0.00 S ATOM 715 CE MET A 124 4.244 -3.888 1.231 1.00 0.00 C ATOM 0 H MET A 124 0.859 -8.864 3.381 1.00 0.00 H new ATOM 0 HA MET A 124 2.604 -7.209 4.734 1.00 0.00 H new ATOM 0 HB2 MET A 124 2.094 -7.385 2.212 1.00 0.00 H new ATOM 0 HB3 MET A 124 0.708 -6.351 2.495 1.00 0.00 H new ATOM 0 HG2 MET A 124 2.242 -4.613 3.503 1.00 0.00 H new ATOM 0 HG3 MET A 124 3.615 -5.640 3.141 1.00 0.00 H new ATOM 0 HE1 MET A 124 4.468 -3.412 0.276 1.00 0.00 H new ATOM 0 HE2 MET A 124 4.205 -3.131 2.014 1.00 0.00 H new ATOM 0 HE3 MET A 124 5.023 -4.613 1.466 1.00 0.00 H new ATOM 725 N ILE A 125 -0.423 -5.838 4.709 1.00 0.00 N ATOM 726 CA ILE A 125 -1.271 -4.892 5.428 1.00 0.00 C ATOM 727 C ILE A 125 -1.474 -5.362 6.859 1.00 0.00 C ATOM 728 O ILE A 125 -1.459 -4.562 7.792 1.00 0.00 O ATOM 729 CB ILE A 125 -2.636 -4.780 4.713 1.00 0.00 C ATOM 730 CG1 ILE A 125 -2.445 -4.059 3.363 1.00 0.00 C ATOM 731 CG2 ILE A 125 -3.665 -4.004 5.565 1.00 0.00 C ATOM 732 CD1 ILE A 125 -3.807 -3.646 2.788 1.00 0.00 C ATOM 0 H ILE A 125 -0.845 -6.232 3.868 1.00 0.00 H new ATOM 0 HA ILE A 125 -0.789 -3.914 5.443 1.00 0.00 H new ATOM 0 HB ILE A 125 -3.020 -5.788 4.557 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -1.816 -3.179 3.498 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -1.929 -4.715 2.662 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -4.612 -3.946 5.028 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -3.816 -4.520 6.513 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -3.294 -2.997 5.755 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -3.661 -3.138 1.835 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -4.422 -4.533 2.636 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -4.307 -2.973 3.485 1.00 0.00 H new ATOM 744 N ARG A 126 -1.690 -6.650 7.025 1.00 0.00 N ATOM 745 CA ARG A 126 -1.921 -7.202 8.348 1.00 0.00 C ATOM 746 C ARG A 126 -0.783 -6.835 9.297 1.00 0.00 C ATOM 747 O ARG A 126 -1.026 -6.456 10.443 1.00 0.00 O ATOM 748 CB ARG A 126 -2.039 -8.724 8.245 1.00 0.00 C ATOM 749 CG ARG A 126 -3.349 -9.103 7.529 1.00 0.00 C ATOM 750 CD ARG A 126 -4.500 -9.163 8.539 1.00 0.00 C ATOM 751 NE ARG A 126 -4.203 -10.144 9.570 1.00 0.00 N ATOM 752 CZ ARG A 126 -4.384 -11.439 9.351 1.00 0.00 C ATOM 753 NH1 ARG A 126 -4.834 -11.847 8.196 1.00 0.00 N ATOM 754 NH2 ARG A 126 -4.106 -12.304 10.289 1.00 0.00 N ATOM 0 H ARG A 126 -1.711 -7.332 6.267 1.00 0.00 H new ATOM 0 HA ARG A 126 -2.845 -6.784 8.747 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -1.186 -9.127 7.698 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -2.018 -9.167 9.241 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -3.573 -8.372 6.753 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -3.237 -10.068 7.035 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -4.651 -8.182 8.990 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -5.428 -9.426 8.031 1.00 0.00 H new ATOM 0 HE ARG A 126 -3.850 -9.832 10.475 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -5.046 -11.170 7.463 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -4.974 -12.843 8.026 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -3.750 -11.983 11.189 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -4.245 -13.300 10.121 1.00 0.00 H new ATOM 768 N GLU A 127 0.459 -6.937 8.824 1.00 0.00 N ATOM 769 CA GLU A 127 1.607 -6.598 9.662 1.00 0.00 C ATOM 770 C GLU A 127 1.860 -5.096 9.642 1.00 0.00 C ATOM 771 O GLU A 127 2.253 -4.512 10.653 1.00 0.00 O ATOM 772 CB GLU A 127 2.859 -7.345 9.185 1.00 0.00 C ATOM 773 CG GLU A 127 2.665 -8.854 9.373 1.00 0.00 C ATOM 774 CD GLU A 127 2.567 -9.193 10.859 1.00 0.00 C ATOM 775 OE1 GLU A 127 3.004 -8.384 11.661 1.00 0.00 O ATOM 776 OE2 GLU A 127 2.055 -10.256 11.171 1.00 0.00 O ATOM 0 H GLU A 127 0.693 -7.246 7.881 1.00 0.00 H new ATOM 0 HA GLU A 127 1.383 -6.902 10.684 1.00 0.00 H new ATOM 0 HB2 GLU A 127 3.050 -7.121 8.135 1.00 0.00 H new ATOM 0 HB3 GLU A 127 3.731 -7.008 9.746 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.761 -9.179 8.858 1.00 0.00 H new ATOM 0 HG3 GLU A 127 3.499 -9.394 8.924 1.00 0.00 H new ATOM 783 N ALA A 128 1.631 -4.475 8.492 1.00 0.00 N ATOM 784 CA ALA A 128 1.838 -3.038 8.371 1.00 0.00 C ATOM 785 C ALA A 128 0.797 -2.290 9.196 1.00 0.00 C ATOM 786 O ALA A 128 1.133 -1.467 10.048 1.00 0.00 O ATOM 787 CB ALA A 128 1.732 -2.617 6.902 1.00 0.00 C ATOM 0 H ALA A 128 1.307 -4.935 7.642 1.00 0.00 H new ATOM 0 HA ALA A 128 2.833 -2.792 8.743 1.00 0.00 H new ATOM 0 HB1 ALA A 128 1.888 -1.541 6.820 1.00 0.00 H new ATOM 0 HB2 ALA A 128 2.490 -3.139 6.318 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.743 -2.870 6.521 1.00 0.00 H new ATOM 793 N ASP A 129 -0.468 -2.579 8.925 1.00 0.00 N ATOM 794 CA ASP A 129 -1.559 -1.925 9.630 1.00 0.00 C ATOM 795 C ASP A 129 -1.333 -1.985 11.133 1.00 0.00 C ATOM 796 O ASP A 129 -0.948 -3.021 11.676 1.00 0.00 O ATOM 797 CB ASP A 129 -2.888 -2.595 9.272 1.00 0.00 C ATOM 798 CG ASP A 129 -4.047 -1.805 9.867 1.00 0.00 C ATOM 799 OD1 ASP A 129 -3.867 -1.242 10.933 1.00 0.00 O ATOM 800 OD2 ASP A 129 -5.101 -1.780 9.252 1.00 0.00 O ATOM 0 H ASP A 129 -0.763 -3.260 8.225 1.00 0.00 H new ATOM 0 HA ASP A 129 -1.594 -0.879 9.326 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -2.995 -2.653 8.189 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -2.902 -3.618 9.649 1.00 0.00 H new ATOM 805 N ILE A 130 -1.572 -0.858 11.800 1.00 0.00 N ATOM 806 CA ILE A 130 -1.387 -0.772 13.253 1.00 0.00 C ATOM 807 C ILE A 130 -2.730 -0.778 13.969 1.00 0.00 C ATOM 808 O ILE A 130 -2.824 -1.171 15.132 1.00 0.00 O ATOM 809 CB ILE A 130 -0.633 0.509 13.609 1.00 0.00 C ATOM 810 CG1 ILE A 130 0.694 0.527 12.844 1.00 0.00 C ATOM 811 CG2 ILE A 130 -0.364 0.534 15.123 1.00 0.00 C ATOM 812 CD1 ILE A 130 1.487 1.790 13.196 1.00 0.00 C ATOM 0 H ILE A 130 -1.893 0.006 11.363 1.00 0.00 H new ATOM 0 HA ILE A 130 -0.811 -1.640 13.574 1.00 0.00 H new ATOM 0 HB ILE A 130 -1.224 1.383 13.337 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.278 -0.359 13.092 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.505 0.494 11.771 1.00 0.00 H new ATOM 0 HG21 ILE A 130 0.174 1.446 15.382 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.311 0.506 15.661 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.237 -0.332 15.400 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.429 1.793 12.647 1.00 0.00 H new ATOM 0 HD12 ILE A 130 0.906 2.672 12.925 1.00 0.00 H new ATOM 0 HD13 ILE A 130 1.691 1.805 14.267 1.00 0.00 H new ATOM 824 N ASP A 131 -3.763 -0.337 13.271 1.00 0.00 N ATOM 825 CA ASP A 131 -5.108 -0.289 13.850 1.00 0.00 C ATOM 826 C ASP A 131 -5.834 -1.615 13.647 1.00 0.00 C ATOM 827 O ASP A 131 -6.802 -1.917 14.346 1.00 0.00 O ATOM 828 CB ASP A 131 -5.913 0.838 13.201 1.00 0.00 C ATOM 829 CG ASP A 131 -5.344 2.190 13.619 1.00 0.00 C ATOM 830 OD1 ASP A 131 -4.626 2.230 14.606 1.00 0.00 O ATOM 831 OD2 ASP A 131 -5.634 3.165 12.948 1.00 0.00 O ATOM 0 H ASP A 131 -3.704 -0.007 12.308 1.00 0.00 H new ATOM 0 HA ASP A 131 -5.013 -0.103 14.920 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -5.882 0.740 12.116 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -6.959 0.767 13.498 1.00 0.00 H new ATOM 836 N GLY A 132 -5.364 -2.402 12.686 1.00 0.00 N ATOM 837 CA GLY A 132 -5.983 -3.692 12.404 1.00 0.00 C ATOM 838 C GLY A 132 -7.396 -3.507 11.857 1.00 0.00 C ATOM 839 O GLY A 132 -8.297 -4.290 12.156 1.00 0.00 O ATOM 0 H GLY A 132 -4.565 -2.173 12.095 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -5.378 -4.241 11.682 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -6.016 -4.291 13.314 1.00 0.00 H new ATOM 843 N ASP A 133 -7.585 -2.453 11.060 1.00 0.00 N ATOM 844 CA ASP A 133 -8.898 -2.154 10.476 1.00 0.00 C ATOM 845 C ASP A 133 -8.935 -2.530 8.995 1.00 0.00 C ATOM 846 O ASP A 133 -9.532 -1.823 8.181 1.00 0.00 O ATOM 847 CB ASP A 133 -9.195 -0.660 10.627 1.00 0.00 C ATOM 848 CG ASP A 133 -8.109 0.160 9.940 1.00 0.00 C ATOM 849 OD1 ASP A 133 -7.010 -0.350 9.797 1.00 0.00 O ATOM 850 OD2 ASP A 133 -8.393 1.284 9.562 1.00 0.00 O ATOM 0 H ASP A 133 -6.850 -1.794 10.804 1.00 0.00 H new ATOM 0 HA ASP A 133 -9.651 -2.740 11.002 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -10.167 -0.428 10.192 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -9.248 -0.396 11.683 1.00 0.00 H new ATOM 855 N GLY A 134 -8.306 -3.652 8.652 1.00 0.00 N ATOM 856 CA GLY A 134 -8.279 -4.123 7.267 1.00 0.00 C ATOM 857 C GLY A 134 -7.795 -3.041 6.308 1.00 0.00 C ATOM 858 O GLY A 134 -7.732 -3.255 5.097 1.00 0.00 O ATOM 0 H GLY A 134 -7.809 -4.251 9.311 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -7.627 -4.993 7.192 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -9.278 -4.447 6.974 1.00 0.00 H new ATOM 862 N GLN A 135 -7.462 -1.874 6.848 1.00 0.00 N ATOM 863 CA GLN A 135 -6.995 -0.760 6.031 1.00 0.00 C ATOM 864 C GLN A 135 -5.751 -0.155 6.655 1.00 0.00 C ATOM 865 O GLN A 135 -5.694 0.042 7.866 1.00 0.00 O ATOM 866 CB GLN A 135 -8.093 0.304 5.943 1.00 0.00 C ATOM 867 CG GLN A 135 -9.338 -0.290 5.276 1.00 0.00 C ATOM 868 CD GLN A 135 -9.011 -0.743 3.856 1.00 0.00 C ATOM 869 OE1 GLN A 135 -9.189 -1.994 3.527 1.00 0.00 O flip ATOM 870 NE2 GLN A 135 -8.576 0.061 3.030 1.00 0.00 N flip ATOM 0 H GLN A 135 -7.507 -1.675 7.847 1.00 0.00 H new ATOM 0 HA GLN A 135 -6.757 -1.121 5.030 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -8.341 0.667 6.940 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -7.737 1.161 5.372 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -9.704 -1.135 5.860 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -10.136 0.452 5.254 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -8.439 1.037 3.292 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -8.353 -0.250 2.084 1.00 0.00 H new ATOM 879 N VAL A 136 -4.751 0.135 5.824 1.00 0.00 N ATOM 880 CA VAL A 136 -3.501 0.719 6.320 1.00 0.00 C ATOM 881 C VAL A 136 -3.318 2.120 5.754 1.00 0.00 C ATOM 882 O VAL A 136 -3.570 2.367 4.565 1.00 0.00 O ATOM 883 CB VAL A 136 -2.319 -0.174 5.932 1.00 0.00 C ATOM 884 CG1 VAL A 136 -2.243 -0.288 4.420 1.00 0.00 C ATOM 885 CG2 VAL A 136 -1.017 0.427 6.447 1.00 0.00 C ATOM 0 H VAL A 136 -4.778 -0.021 4.816 1.00 0.00 H new ATOM 0 HA VAL A 136 -3.546 0.788 7.407 1.00 0.00 H new ATOM 0 HB VAL A 136 -2.464 -1.160 6.374 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -1.401 -0.924 4.145 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -3.167 -0.725 4.041 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -2.106 0.703 3.987 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.183 -0.216 6.166 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -0.876 1.416 6.012 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -1.060 0.511 7.533 1.00 0.00 H new ATOM 895 N ASN A 137 -2.905 3.039 6.626 1.00 0.00 N ATOM 896 CA ASN A 137 -2.710 4.424 6.221 1.00 0.00 C ATOM 897 C ASN A 137 -1.574 4.521 5.213 1.00 0.00 C ATOM 898 O ASN A 137 -1.224 3.532 4.568 1.00 0.00 O ATOM 899 CB ASN A 137 -2.408 5.296 7.438 1.00 0.00 C ATOM 900 CG ASN A 137 -3.555 5.203 8.440 1.00 0.00 C ATOM 901 OD1 ASN A 137 -4.766 4.960 8.012 1.00 0.00 O flip ATOM 902 ND2 ASN A 137 -3.345 5.354 9.643 1.00 0.00 N flip ATOM 0 H ASN A 137 -2.702 2.849 7.607 1.00 0.00 H new ATOM 0 HA ASN A 137 -3.627 4.782 5.754 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -1.478 4.973 7.906 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -2.267 6.332 7.128 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -2.400 5.544 9.976 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -4.116 5.290 10.307 1.00 0.00 H new ATOM 909 N TYR A 138 -1.009 5.714 5.064 1.00 0.00 N ATOM 910 CA TYR A 138 0.076 5.920 4.110 1.00 0.00 C ATOM 911 C TYR A 138 1.433 5.566 4.721 1.00 0.00 C ATOM 912 O TYR A 138 2.152 4.731 4.182 1.00 0.00 O ATOM 913 CB TYR A 138 0.075 7.384 3.648 1.00 0.00 C ATOM 914 CG TYR A 138 -1.357 7.870 3.539 1.00 0.00 C ATOM 915 CD1 TYR A 138 -2.287 7.151 2.777 1.00 0.00 C ATOM 916 CD2 TYR A 138 -1.755 9.033 4.211 1.00 0.00 C ATOM 917 CE1 TYR A 138 -3.616 7.597 2.687 1.00 0.00 C ATOM 918 CE2 TYR A 138 -3.080 9.478 4.122 1.00 0.00 C ATOM 919 CZ TYR A 138 -4.011 8.760 3.362 1.00 0.00 C ATOM 920 OH TYR A 138 -5.317 9.200 3.275 1.00 0.00 O ATOM 0 H TYR A 138 -1.281 6.547 5.586 1.00 0.00 H new ATOM 0 HA TYR A 138 -0.086 5.261 3.257 1.00 0.00 H new ATOM 0 HB2 TYR A 138 0.629 8.002 4.355 1.00 0.00 H new ATOM 0 HB3 TYR A 138 0.577 7.474 2.685 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -1.982 6.254 2.259 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -1.039 9.588 4.799 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -4.333 7.044 2.098 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -3.384 10.376 4.640 1.00 0.00 H new ATOM 0 HH TYR A 138 -5.422 10.019 3.803 1.00 0.00 H new ATOM 930 N GLU A 139 1.769 6.189 5.852 1.00 0.00 N ATOM 931 CA GLU A 139 3.049 5.914 6.511 1.00 0.00 C ATOM 932 C GLU A 139 3.174 4.427 6.797 1.00 0.00 C ATOM 933 O GLU A 139 4.026 3.752 6.203 1.00 0.00 O ATOM 934 CB GLU A 139 3.169 6.722 7.798 1.00 0.00 C ATOM 935 CG GLU A 139 3.298 8.203 7.434 1.00 0.00 C ATOM 936 CD GLU A 139 3.358 9.056 8.696 1.00 0.00 C ATOM 937 OE1 GLU A 139 3.307 8.486 9.773 1.00 0.00 O ATOM 938 OE2 GLU A 139 3.457 10.264 8.565 1.00 0.00 O ATOM 0 H GLU A 139 1.184 6.877 6.326 1.00 0.00 H new ATOM 0 HA GLU A 139 3.861 6.211 5.847 1.00 0.00 H new ATOM 0 HB2 GLU A 139 2.294 6.562 8.428 1.00 0.00 H new ATOM 0 HB3 GLU A 139 4.038 6.396 8.370 1.00 0.00 H new ATOM 0 HG2 GLU A 139 4.197 8.361 6.838 1.00 0.00 H new ATOM 0 HG3 GLU A 139 2.450 8.509 6.821 1.00 0.00 H new ATOM 945 N GLU A 140 2.329 3.940 7.716 1.00 0.00 N ATOM 946 CA GLU A 140 2.313 2.518 8.097 1.00 0.00 C ATOM 947 C GLU A 140 2.701 1.649 6.892 1.00 0.00 C ATOM 948 O GLU A 140 3.252 0.559 7.040 1.00 0.00 O ATOM 949 CB GLU A 140 0.905 2.125 8.538 1.00 0.00 C ATOM 950 CG GLU A 140 0.548 2.809 9.858 1.00 0.00 C ATOM 951 CD GLU A 140 -0.903 2.519 10.218 1.00 0.00 C ATOM 952 OE1 GLU A 140 -1.531 1.764 9.492 1.00 0.00 O ATOM 953 OE2 GLU A 140 -1.363 3.051 11.214 1.00 0.00 O ATOM 0 H GLU A 140 1.645 4.511 8.212 1.00 0.00 H new ATOM 0 HA GLU A 140 3.023 2.364 8.910 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.185 2.406 7.769 1.00 0.00 H new ATOM 0 HB3 GLU A 140 0.842 1.043 8.653 1.00 0.00 H new ATOM 0 HG2 GLU A 140 1.206 2.454 10.651 1.00 0.00 H new ATOM 0 HG3 GLU A 140 0.702 3.885 9.773 1.00 0.00 H new ATOM 960 N PHE A 141 2.430 2.177 5.693 1.00 0.00 N ATOM 961 CA PHE A 141 2.777 1.499 4.451 1.00 0.00 C ATOM 962 C PHE A 141 4.177 1.908 3.998 1.00 0.00 C ATOM 963 O PHE A 141 5.029 1.054 3.734 1.00 0.00 O ATOM 964 CB PHE A 141 1.765 1.875 3.356 1.00 0.00 C ATOM 965 CG PHE A 141 1.711 0.805 2.277 1.00 0.00 C ATOM 966 CD1 PHE A 141 2.866 0.444 1.565 1.00 0.00 C ATOM 967 CD2 PHE A 141 0.501 0.176 1.988 1.00 0.00 C ATOM 968 CE1 PHE A 141 2.800 -0.538 0.576 1.00 0.00 C ATOM 969 CE2 PHE A 141 0.438 -0.802 1.003 1.00 0.00 C ATOM 970 CZ PHE A 141 1.586 -1.163 0.295 1.00 0.00 C ATOM 0 H PHE A 141 1.969 3.077 5.562 1.00 0.00 H new ATOM 0 HA PHE A 141 2.755 0.423 4.623 1.00 0.00 H new ATOM 0 HB2 PHE A 141 0.776 2.003 3.797 1.00 0.00 H new ATOM 0 HB3 PHE A 141 2.042 2.831 2.912 1.00 0.00 H new ATOM 0 HD1 PHE A 141 3.807 0.927 1.783 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -0.391 0.450 2.532 1.00 0.00 H new ATOM 0 HE1 PHE A 141 3.689 -0.814 0.028 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -0.503 -1.285 0.784 1.00 0.00 H new ATOM 0 HZ PHE A 141 1.534 -1.925 -0.469 1.00 0.00 H new ATOM 980 N VAL A 142 4.397 3.225 3.875 1.00 0.00 N ATOM 981 CA VAL A 142 5.686 3.742 3.411 1.00 0.00 C ATOM 982 C VAL A 142 6.828 2.912 3.971 1.00 0.00 C ATOM 983 O VAL A 142 7.589 2.313 3.220 1.00 0.00 O ATOM 984 CB VAL A 142 5.868 5.214 3.817 1.00 0.00 C ATOM 985 CG1 VAL A 142 7.281 5.677 3.453 1.00 0.00 C ATOM 986 CG2 VAL A 142 4.852 6.095 3.074 1.00 0.00 C ATOM 0 H VAL A 142 3.705 3.943 4.089 1.00 0.00 H new ATOM 0 HA VAL A 142 5.697 3.676 2.323 1.00 0.00 H new ATOM 0 HB VAL A 142 5.712 5.303 4.892 1.00 0.00 H new ATOM 0 HG11 VAL A 142 7.408 6.720 3.742 1.00 0.00 H new ATOM 0 HG12 VAL A 142 8.012 5.064 3.980 1.00 0.00 H new ATOM 0 HG13 VAL A 142 7.431 5.577 2.378 1.00 0.00 H new ATOM 0 HG21 VAL A 142 4.989 7.136 3.368 1.00 0.00 H new ATOM 0 HG22 VAL A 142 5.005 5.999 1.999 1.00 0.00 H new ATOM 0 HG23 VAL A 142 3.841 5.777 3.327 1.00 0.00 H new ATOM 996 N GLN A 143 6.958 2.890 5.291 1.00 0.00 N ATOM 997 CA GLN A 143 8.045 2.132 5.916 1.00 0.00 C ATOM 998 C GLN A 143 8.241 0.788 5.214 1.00 0.00 C ATOM 999 O GLN A 143 9.274 0.555 4.586 1.00 0.00 O ATOM 1000 CB GLN A 143 7.732 1.905 7.403 1.00 0.00 C ATOM 1001 CG GLN A 143 8.051 3.178 8.194 1.00 0.00 C ATOM 1002 CD GLN A 143 7.161 4.322 7.715 1.00 0.00 C ATOM 1003 OE1 GLN A 143 5.972 4.122 7.473 1.00 0.00 O ATOM 1004 NE2 GLN A 143 7.672 5.514 7.557 1.00 0.00 N ATOM 0 H GLN A 143 6.341 3.376 5.942 1.00 0.00 H new ATOM 0 HA GLN A 143 8.967 2.706 5.823 1.00 0.00 H new ATOM 0 HB2 GLN A 143 6.682 1.640 7.528 1.00 0.00 H new ATOM 0 HB3 GLN A 143 8.319 1.070 7.786 1.00 0.00 H new ATOM 0 HG2 GLN A 143 7.894 3.004 9.259 1.00 0.00 H new ATOM 0 HG3 GLN A 143 9.100 3.443 8.066 1.00 0.00 H new ATOM 0 HE21 GLN A 143 8.659 5.677 7.759 1.00 0.00 H new ATOM 0 HE22 GLN A 143 7.084 6.282 7.232 1.00 0.00 H new ATOM 1013 N MET A 144 7.252 -0.090 5.327 1.00 0.00 N ATOM 1014 CA MET A 144 7.342 -1.411 4.711 1.00 0.00 C ATOM 1015 C MET A 144 7.970 -1.329 3.318 1.00 0.00 C ATOM 1016 O MET A 144 8.847 -2.124 2.998 1.00 0.00 O ATOM 1017 CB MET A 144 5.945 -2.030 4.606 1.00 0.00 C ATOM 1018 CG MET A 144 5.279 -2.037 5.984 1.00 0.00 C ATOM 1019 SD MET A 144 6.204 -3.115 7.107 1.00 0.00 S ATOM 1020 CE MET A 144 5.194 -4.604 6.896 1.00 0.00 C ATOM 0 H MET A 144 6.385 0.085 5.835 1.00 0.00 H new ATOM 0 HA MET A 144 7.977 -2.036 5.339 1.00 0.00 H new ATOM 0 HB2 MET A 144 5.338 -1.463 3.901 1.00 0.00 H new ATOM 0 HB3 MET A 144 6.015 -3.047 4.220 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.242 -1.024 6.385 1.00 0.00 H new ATOM 0 HG3 MET A 144 4.249 -2.384 5.899 1.00 0.00 H new ATOM 0 HE1 MET A 144 5.647 -5.431 7.442 1.00 0.00 H new ATOM 0 HE2 MET A 144 4.191 -4.421 7.281 1.00 0.00 H new ATOM 0 HE3 MET A 144 5.135 -4.857 5.837 1.00 0.00 H new ATOM 1030 N MET A 145 7.509 -0.378 2.499 1.00 0.00 N ATOM 1031 CA MET A 145 8.034 -0.213 1.134 1.00 0.00 C ATOM 1032 C MET A 145 9.569 -0.315 1.096 1.00 0.00 C ATOM 1033 O MET A 145 10.138 -1.387 1.294 1.00 0.00 O ATOM 1034 CB MET A 145 7.587 1.151 0.575 1.00 0.00 C ATOM 1035 CG MET A 145 7.811 1.210 -0.948 1.00 0.00 C ATOM 1036 SD MET A 145 8.192 2.914 -1.442 1.00 0.00 S ATOM 1037 CE MET A 145 6.504 3.565 -1.394 1.00 0.00 C ATOM 0 H MET A 145 6.778 0.287 2.753 1.00 0.00 H new ATOM 0 HA MET A 145 7.634 -1.019 0.519 1.00 0.00 H new ATOM 0 HB2 MET A 145 6.533 1.315 0.800 1.00 0.00 H new ATOM 0 HB3 MET A 145 8.145 1.951 1.062 1.00 0.00 H new ATOM 0 HG2 MET A 145 8.629 0.547 -1.231 1.00 0.00 H new ATOM 0 HG3 MET A 145 6.921 0.860 -1.470 1.00 0.00 H new ATOM 0 HE1 MET A 145 6.183 3.820 -2.404 1.00 0.00 H new ATOM 0 HE2 MET A 145 5.835 2.811 -0.980 1.00 0.00 H new ATOM 0 HE3 MET A 145 6.476 4.457 -0.769 1.00 0.00 H new ATOM 1047 N THR A 146 10.238 0.803 0.816 1.00 0.00 N ATOM 1048 CA THR A 146 11.700 0.825 0.741 1.00 0.00 C ATOM 1049 C THR A 146 12.256 1.994 1.545 1.00 0.00 C ATOM 1050 O THR A 146 13.377 2.444 1.310 1.00 0.00 O ATOM 1051 CB THR A 146 12.146 0.933 -0.718 1.00 0.00 C ATOM 1052 OG1 THR A 146 11.522 2.058 -1.320 1.00 0.00 O ATOM 1053 CG2 THR A 146 11.752 -0.340 -1.468 1.00 0.00 C ATOM 0 H THR A 146 9.793 1.703 0.638 1.00 0.00 H new ATOM 0 HA THR A 146 12.086 -0.103 1.164 1.00 0.00 H new ATOM 0 HB THR A 146 13.228 1.055 -0.761 1.00 0.00 H new ATOM 0 HG1 THR A 146 10.549 1.939 -1.305 1.00 0.00 H new ATOM 0 HG21 THR A 146 12.070 -0.263 -2.508 1.00 0.00 H new ATOM 0 HG22 THR A 146 12.235 -1.200 -1.004 1.00 0.00 H new ATOM 0 HG23 THR A 146 10.670 -0.466 -1.428 1.00 0.00 H new ATOM 1061 N ALA A 147 11.465 2.475 2.505 1.00 0.00 N ATOM 1062 CA ALA A 147 11.882 3.592 3.355 1.00 0.00 C ATOM 1063 C ALA A 147 12.384 3.073 4.701 1.00 0.00 C ATOM 1064 O ALA A 147 11.638 3.031 5.680 1.00 0.00 O ATOM 1065 CB ALA A 147 10.702 4.545 3.572 1.00 0.00 C ATOM 0 H ALA A 147 10.535 2.111 2.713 1.00 0.00 H new ATOM 0 HA ALA A 147 12.692 4.128 2.861 1.00 0.00 H new ATOM 0 HB1 ALA A 147 11.016 5.375 4.205 1.00 0.00 H new ATOM 0 HB2 ALA A 147 10.364 4.930 2.610 1.00 0.00 H new ATOM 0 HB3 ALA A 147 9.885 4.009 4.056 1.00 0.00 H new ATOM 1071 N LYS A 148 13.651 2.673 4.742 1.00 0.00 N ATOM 1072 CA LYS A 148 14.239 2.153 5.973 1.00 0.00 C ATOM 1073 C LYS A 148 13.355 1.057 6.560 1.00 0.00 C ATOM 1074 O LYS A 148 12.717 1.312 7.569 1.00 0.00 O ATOM 1075 CB LYS A 148 14.392 3.283 7.000 1.00 0.00 C ATOM 1076 CG LYS A 148 15.300 4.398 6.452 1.00 0.00 C ATOM 1077 CD LYS A 148 16.774 3.977 6.534 1.00 0.00 C ATOM 1078 CE LYS A 148 17.669 5.160 6.153 1.00 0.00 C ATOM 1079 NZ LYS A 148 17.773 6.093 7.310 1.00 0.00 N ATOM 1080 OXT LYS A 148 13.331 -0.023 5.991 1.00 0.00 O ATOM 0 H LYS A 148 14.286 2.698 3.944 1.00 0.00 H new ATOM 0 HA LYS A 148 15.219 1.738 5.739 1.00 0.00 H new ATOM 0 HB2 LYS A 148 13.412 3.693 7.245 1.00 0.00 H new ATOM 0 HB3 LYS A 148 14.812 2.886 7.924 1.00 0.00 H new ATOM 0 HG2 LYS A 148 15.035 4.616 5.418 1.00 0.00 H new ATOM 0 HG3 LYS A 148 15.145 5.315 7.021 1.00 0.00 H new ATOM 0 HD2 LYS A 148 17.010 3.639 7.543 1.00 0.00 H new ATOM 0 HD3 LYS A 148 16.960 3.137 5.865 1.00 0.00 H new ATOM 0 HE2 LYS A 148 18.659 4.804 5.868 1.00 0.00 H new ATOM 0 HE3 LYS A 148 17.256 5.680 5.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 18.496 6.814 7.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 16.855 6.557 7.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 18.040 5.561 8.162 1.00 0.00 H new TER 1094 LYS A 148 HETATM 1095 CA CA A 201 -8.246 1.014 0.232 1.00 0.00 CA HETATM 1096 CA CA A 202 -4.365 1.091 9.864 1.00 0.00 CA