USER MOD reduce.3.24.130724 H: found=0, std=0, add=519, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 520 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 98 SER OG : rot 180:sc= 0.0997 USER MOD Set 1.2: A 150 TYR OH : rot -166:sc= -1.51! USER MOD Single : A 93 SER OG : rot -33:sc= 0.136 USER MOD Single : A 103 MET CE :methyl 145:sc= 0 (180deg=-0.969) USER MOD Single : A 106 LYS NZ :NH3+ -155:sc= -0.0481 (180deg=-0.332) USER MOD Single : A 107 ASN :FLIP amide:sc= -0.942 F(o=-1.8,f=-0.94) 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 180:sc= 0 (180deg=0) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.072) USER MOD Single : A 124 THR OG1 : rot -79:sc= 0.863 USER MOD Single : A 127 THR OG1 : rot 94:sc= 0.304 USER MOD Single : A 129 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl -154:sc= 0 (180deg=-0.274) USER MOD Single : A 138 LYS NZ :NH3+ -151:sc= -0.735 (180deg=-2.68!) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN :FLIP amide:sc= -6.04! C(o=-9.4!,f=-6!) USER MOD Single : A 144 ASN :FLIP amide:sc= -1.34 F(o=-2!,f=-1.3) USER MOD Single : A 157 MET CE :methyl 159:sc= 0 (180deg=-0.0407) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 93 55.208 5.008 16.481 1.00 0.00 N ATOM 31 CA SER A 93 56.207 4.204 17.181 1.00 0.00 C ATOM 32 C SER A 93 56.356 2.840 16.514 1.00 0.00 C ATOM 33 O SER A 93 55.481 2.397 15.770 1.00 0.00 O ATOM 34 CB SER A 93 55.807 4.003 18.643 1.00 0.00 C ATOM 35 OG SER A 93 54.521 3.402 18.700 1.00 0.00 O ATOM 0 HA SER A 93 57.157 4.737 17.136 1.00 0.00 H new ATOM 0 HB2 SER A 93 56.538 3.372 19.149 1.00 0.00 H new ATOM 0 HB3 SER A 93 55.797 4.960 19.164 1.00 0.00 H new ATOM 0 HG SER A 93 53.982 3.710 17.942 1.00 0.00 H new ATOM 41 N GLU A 94 57.477 2.179 16.789 1.00 0.00 N ATOM 42 CA GLU A 94 57.737 0.863 16.211 1.00 0.00 C ATOM 43 C GLU A 94 56.484 -0.004 16.273 1.00 0.00 C ATOM 44 O GLU A 94 56.253 -0.851 15.411 1.00 0.00 O ATOM 45 CB GLU A 94 58.865 0.160 16.969 1.00 0.00 C ATOM 46 CG GLU A 94 60.163 0.264 16.167 1.00 0.00 C ATOM 47 CD GLU A 94 61.280 -0.459 16.912 1.00 0.00 C ATOM 48 OE1 GLU A 94 61.096 -1.622 17.233 1.00 0.00 O ATOM 49 OE2 GLU A 94 62.304 0.160 17.151 1.00 0.00 O ATOM 0 H GLU A 94 58.214 2.528 17.402 1.00 0.00 H new ATOM 0 HA GLU A 94 58.030 1.005 15.171 1.00 0.00 H new ATOM 0 HB2 GLU A 94 58.995 0.614 17.951 1.00 0.00 H new ATOM 0 HB3 GLU A 94 58.610 -0.887 17.133 1.00 0.00 H new ATOM 0 HG2 GLU A 94 60.028 -0.174 15.178 1.00 0.00 H new ATOM 0 HG3 GLU A 94 60.428 1.311 16.019 1.00 0.00 H new ATOM 56 N GLU A 95 55.679 0.216 17.309 1.00 0.00 N ATOM 57 CA GLU A 95 54.450 -0.553 17.484 1.00 0.00 C ATOM 58 C GLU A 95 53.530 -0.377 16.279 1.00 0.00 C ATOM 59 O GLU A 95 53.079 -1.351 15.677 1.00 0.00 O ATOM 60 CB GLU A 95 53.712 -0.103 18.746 1.00 0.00 C ATOM 61 CG GLU A 95 53.046 -1.312 19.405 1.00 0.00 C ATOM 62 CD GLU A 95 52.063 -0.835 20.469 1.00 0.00 C ATOM 63 OE1 GLU A 95 52.387 0.115 21.163 1.00 0.00 O ATOM 64 OE2 GLU A 95 51.001 -1.426 20.574 1.00 0.00 O ATOM 0 H GLU A 95 55.853 0.913 18.033 1.00 0.00 H new ATOM 0 HA GLU A 95 54.724 -1.604 17.579 1.00 0.00 H new ATOM 0 HB2 GLU A 95 54.409 0.365 19.441 1.00 0.00 H new ATOM 0 HB3 GLU A 95 52.962 0.647 18.494 1.00 0.00 H new ATOM 0 HG2 GLU A 95 52.526 -1.907 18.655 1.00 0.00 H new ATOM 0 HG3 GLU A 95 53.801 -1.956 19.855 1.00 0.00 H new ATOM 71 N GLU A 96 53.257 0.879 15.937 1.00 0.00 N ATOM 72 CA GLU A 96 52.387 1.177 14.802 1.00 0.00 C ATOM 73 C GLU A 96 53.057 0.767 13.495 1.00 0.00 C ATOM 74 O GLU A 96 52.402 0.299 12.564 1.00 0.00 O ATOM 75 CB GLU A 96 52.064 2.672 14.749 1.00 0.00 C ATOM 76 CG GLU A 96 51.654 3.156 16.142 1.00 0.00 C ATOM 77 CD GLU A 96 50.137 3.299 16.206 1.00 0.00 C ATOM 78 OE1 GLU A 96 49.560 3.726 15.220 1.00 0.00 O ATOM 79 OE2 GLU A 96 49.576 2.978 17.241 1.00 0.00 O ATOM 0 H GLU A 96 53.621 1.699 16.423 1.00 0.00 H new ATOM 0 HA GLU A 96 51.464 0.612 14.931 1.00 0.00 H new ATOM 0 HB2 GLU A 96 52.933 3.230 14.400 1.00 0.00 H new ATOM 0 HB3 GLU A 96 51.259 2.856 14.037 1.00 0.00 H new ATOM 0 HG2 GLU A 96 51.995 2.450 16.899 1.00 0.00 H new ATOM 0 HG3 GLU A 96 52.129 4.112 16.361 1.00 0.00 H new ATOM 86 N LEU A 97 54.373 0.950 13.436 1.00 0.00 N ATOM 87 CA LEU A 97 55.128 0.596 12.237 1.00 0.00 C ATOM 88 C LEU A 97 54.591 -0.696 11.631 1.00 0.00 C ATOM 89 O LEU A 97 54.421 -0.804 10.416 1.00 0.00 O ATOM 90 CB LEU A 97 56.610 0.412 12.572 1.00 0.00 C ATOM 91 CG LEU A 97 57.420 1.544 11.938 1.00 0.00 C ATOM 92 CD1 LEU A 97 58.912 1.282 12.148 1.00 0.00 C ATOM 93 CD2 LEU A 97 57.120 1.607 10.438 1.00 0.00 C ATOM 0 H LEU A 97 54.934 1.337 14.195 1.00 0.00 H new ATOM 0 HA LEU A 97 55.017 1.408 11.518 1.00 0.00 H new ATOM 0 HB2 LEU A 97 56.752 0.410 13.653 1.00 0.00 H new ATOM 0 HB3 LEU A 97 56.961 -0.552 12.202 1.00 0.00 H new ATOM 0 HG LEU A 97 57.148 2.491 12.404 1.00 0.00 H new ATOM 0 HD11 LEU A 97 59.490 2.088 11.696 1.00 0.00 H new ATOM 0 HD12 LEU A 97 59.127 1.236 13.216 1.00 0.00 H new ATOM 0 HD13 LEU A 97 59.184 0.335 11.682 1.00 0.00 H new ATOM 0 HD21 LEU A 97 57.697 2.413 9.985 1.00 0.00 H new ATOM 0 HD22 LEU A 97 57.393 0.660 9.972 1.00 0.00 H new ATOM 0 HD23 LEU A 97 56.057 1.792 10.287 1.00 0.00 H new ATOM 105 N SER A 98 54.325 -1.676 12.491 1.00 0.00 N ATOM 106 CA SER A 98 53.806 -2.961 12.029 1.00 0.00 C ATOM 107 C SER A 98 52.717 -2.746 10.983 1.00 0.00 C ATOM 108 O SER A 98 52.547 -3.552 10.067 1.00 0.00 O ATOM 109 CB SER A 98 53.228 -3.759 13.197 1.00 0.00 C ATOM 110 OG SER A 98 54.269 -4.074 14.112 1.00 0.00 O ATOM 0 H SER A 98 54.458 -1.607 13.500 1.00 0.00 H new ATOM 0 HA SER A 98 54.631 -3.519 11.587 1.00 0.00 H new ATOM 0 HB2 SER A 98 52.451 -3.182 13.698 1.00 0.00 H new ATOM 0 HB3 SER A 98 52.760 -4.673 12.832 1.00 0.00 H new ATOM 0 HG SER A 98 53.901 -4.585 14.863 1.00 0.00 H new ATOM 116 N ASP A 99 51.984 -1.646 11.129 1.00 0.00 N ATOM 117 CA ASP A 99 50.914 -1.327 10.188 1.00 0.00 C ATOM 118 C ASP A 99 51.499 -0.749 8.904 1.00 0.00 C ATOM 119 O ASP A 99 51.233 -1.239 7.808 1.00 0.00 O ATOM 120 CB ASP A 99 49.947 -0.310 10.797 1.00 0.00 C ATOM 121 CG ASP A 99 48.662 -1.016 11.214 1.00 0.00 C ATOM 122 OD1 ASP A 99 47.880 -1.347 10.338 1.00 0.00 O ATOM 123 OD2 ASP A 99 48.479 -1.217 12.403 1.00 0.00 O ATOM 0 H ASP A 99 52.108 -0.967 11.880 1.00 0.00 H new ATOM 0 HA ASP A 99 50.374 -2.247 9.965 1.00 0.00 H new ATOM 0 HB2 ASP A 99 50.406 0.172 11.660 1.00 0.00 H new ATOM 0 HB3 ASP A 99 49.725 0.475 10.074 1.00 0.00 H new ATOM 128 N LEU A 100 52.303 0.300 9.054 1.00 0.00 N ATOM 129 CA LEU A 100 52.925 0.939 7.899 1.00 0.00 C ATOM 130 C LEU A 100 53.445 -0.116 6.927 1.00 0.00 C ATOM 131 O LEU A 100 53.174 -0.061 5.727 1.00 0.00 O ATOM 132 CB LEU A 100 54.084 1.836 8.340 1.00 0.00 C ATOM 133 CG LEU A 100 53.748 3.293 8.019 1.00 0.00 C ATOM 134 CD1 LEU A 100 54.800 4.214 8.640 1.00 0.00 C ATOM 135 CD2 LEU A 100 53.735 3.488 6.501 1.00 0.00 C ATOM 0 H LEU A 100 52.537 0.721 9.953 1.00 0.00 H new ATOM 0 HA LEU A 100 52.171 1.549 7.402 1.00 0.00 H new ATOM 0 HB2 LEU A 100 54.263 1.719 9.409 1.00 0.00 H new ATOM 0 HB3 LEU A 100 55.001 1.542 7.830 1.00 0.00 H new ATOM 0 HG LEU A 100 52.768 3.537 8.429 1.00 0.00 H new ATOM 0 HD11 LEU A 100 54.557 5.251 8.409 1.00 0.00 H new ATOM 0 HD12 LEU A 100 54.812 4.076 9.721 1.00 0.00 H new ATOM 0 HD13 LEU A 100 55.782 3.972 8.233 1.00 0.00 H new ATOM 0 HD21 LEU A 100 53.496 4.526 6.270 1.00 0.00 H new ATOM 0 HD22 LEU A 100 54.716 3.242 6.094 1.00 0.00 H new ATOM 0 HD23 LEU A 100 52.984 2.835 6.057 1.00 0.00 H new ATOM 147 N PHE A 101 54.190 -1.084 7.458 1.00 0.00 N ATOM 148 CA PHE A 101 54.734 -2.153 6.624 1.00 0.00 C ATOM 149 C PHE A 101 53.612 -2.812 5.829 1.00 0.00 C ATOM 150 O PHE A 101 53.590 -2.757 4.600 1.00 0.00 O ATOM 151 CB PHE A 101 55.432 -3.209 7.483 1.00 0.00 C ATOM 152 CG PHE A 101 56.273 -4.098 6.599 1.00 0.00 C ATOM 153 CD1 PHE A 101 55.657 -4.950 5.676 1.00 0.00 C ATOM 154 CD2 PHE A 101 57.670 -4.070 6.702 1.00 0.00 C ATOM 155 CE1 PHE A 101 56.436 -5.775 4.855 1.00 0.00 C ATOM 156 CE2 PHE A 101 58.449 -4.894 5.882 1.00 0.00 C ATOM 157 CZ PHE A 101 57.832 -5.747 4.959 1.00 0.00 C ATOM 0 H PHE A 101 54.428 -1.150 8.448 1.00 0.00 H new ATOM 0 HA PHE A 101 55.463 -1.716 5.941 1.00 0.00 H new ATOM 0 HB2 PHE A 101 56.058 -2.727 8.234 1.00 0.00 H new ATOM 0 HB3 PHE A 101 54.693 -3.805 8.019 1.00 0.00 H new ATOM 0 HD1 PHE A 101 54.580 -4.972 5.597 1.00 0.00 H new ATOM 0 HD2 PHE A 101 58.146 -3.412 7.414 1.00 0.00 H new ATOM 0 HE1 PHE A 101 55.960 -6.432 4.142 1.00 0.00 H new ATOM 0 HE2 PHE A 101 59.526 -4.872 5.961 1.00 0.00 H new ATOM 0 HZ PHE A 101 58.433 -6.384 4.327 1.00 0.00 H new ATOM 167 N ARG A 102 52.670 -3.423 6.545 1.00 0.00 N ATOM 168 CA ARG A 102 51.538 -4.073 5.889 1.00 0.00 C ATOM 169 C ARG A 102 50.820 -3.062 5.004 1.00 0.00 C ATOM 170 O ARG A 102 50.427 -3.362 3.877 1.00 0.00 O ATOM 171 CB ARG A 102 50.553 -4.623 6.924 1.00 0.00 C ATOM 172 CG ARG A 102 49.307 -5.159 6.213 1.00 0.00 C ATOM 173 CD ARG A 102 49.178 -6.662 6.469 1.00 0.00 C ATOM 174 NE ARG A 102 48.059 -6.938 7.367 1.00 0.00 N ATOM 175 CZ ARG A 102 46.808 -6.983 6.913 1.00 0.00 C ATOM 176 NH1 ARG A 102 46.565 -6.782 5.646 1.00 0.00 N ATOM 177 NH2 ARG A 102 45.825 -7.229 7.734 1.00 0.00 N ATOM 0 H ARG A 102 52.667 -3.482 7.563 1.00 0.00 H new ATOM 0 HA ARG A 102 51.913 -4.901 5.288 1.00 0.00 H new ATOM 0 HB2 ARG A 102 51.024 -5.418 7.503 1.00 0.00 H new ATOM 0 HB3 ARG A 102 50.274 -3.839 7.628 1.00 0.00 H new ATOM 0 HG2 ARG A 102 48.419 -4.641 6.574 1.00 0.00 H new ATOM 0 HG3 ARG A 102 49.376 -4.967 5.142 1.00 0.00 H new ATOM 0 HD2 ARG A 102 49.031 -7.186 5.524 1.00 0.00 H new ATOM 0 HD3 ARG A 102 50.102 -7.043 6.904 1.00 0.00 H new ATOM 0 HE ARG A 102 48.239 -7.099 8.358 1.00 0.00 H new ATOM 0 HH11 ARG A 102 47.334 -6.590 5.003 1.00 0.00 H new ATOM 0 HH12 ARG A 102 45.607 -6.817 5.299 1.00 0.00 H new ATOM 0 HH21 ARG A 102 46.015 -7.387 8.724 1.00 0.00 H new ATOM 0 HH22 ARG A 102 44.867 -7.263 7.386 1.00 0.00 H new ATOM 191 N MET A 103 50.670 -1.850 5.532 1.00 0.00 N ATOM 192 CA MET A 103 50.017 -0.775 4.793 1.00 0.00 C ATOM 193 C MET A 103 50.644 -0.646 3.413 1.00 0.00 C ATOM 194 O MET A 103 49.988 -0.267 2.443 1.00 0.00 O ATOM 195 CB MET A 103 50.184 0.549 5.540 1.00 0.00 C ATOM 196 CG MET A 103 49.131 1.549 5.064 1.00 0.00 C ATOM 197 SD MET A 103 49.738 2.409 3.592 1.00 0.00 S ATOM 198 CE MET A 103 50.548 3.783 4.447 1.00 0.00 C ATOM 0 H MET A 103 50.990 -1.589 6.465 1.00 0.00 H new ATOM 0 HA MET A 103 48.957 -1.009 4.697 1.00 0.00 H new ATOM 0 HB2 MET A 103 50.085 0.386 6.613 1.00 0.00 H new ATOM 0 HB3 MET A 103 51.183 0.950 5.369 1.00 0.00 H new ATOM 0 HG2 MET A 103 48.199 1.032 4.837 1.00 0.00 H new ATOM 0 HG3 MET A 103 48.913 2.268 5.854 1.00 0.00 H new ATOM 0 HE1 MET A 103 51.448 4.070 3.903 1.00 0.00 H new ATOM 0 HE2 MET A 103 49.867 4.633 4.497 1.00 0.00 H new ATOM 0 HE3 MET A 103 50.818 3.475 5.457 1.00 0.00 H new ATOM 208 N PHE A 104 51.931 -0.968 3.345 1.00 0.00 N ATOM 209 CA PHE A 104 52.668 -0.894 2.088 1.00 0.00 C ATOM 210 C PHE A 104 52.512 -2.193 1.304 1.00 0.00 C ATOM 211 O PHE A 104 52.282 -2.182 0.094 1.00 0.00 O ATOM 212 CB PHE A 104 54.154 -0.649 2.357 1.00 0.00 C ATOM 213 CG PHE A 104 54.743 0.168 1.233 1.00 0.00 C ATOM 214 CD1 PHE A 104 54.602 -0.261 -0.092 1.00 0.00 C ATOM 215 CD2 PHE A 104 55.431 1.354 1.515 1.00 0.00 C ATOM 216 CE1 PHE A 104 55.148 0.495 -1.135 1.00 0.00 C ATOM 217 CE2 PHE A 104 55.978 2.110 0.472 1.00 0.00 C ATOM 218 CZ PHE A 104 55.836 1.681 -0.854 1.00 0.00 C ATOM 0 H PHE A 104 52.484 -1.282 4.142 1.00 0.00 H new ATOM 0 HA PHE A 104 52.263 -0.067 1.505 1.00 0.00 H new ATOM 0 HB2 PHE A 104 54.281 -0.127 3.305 1.00 0.00 H new ATOM 0 HB3 PHE A 104 54.680 -1.600 2.444 1.00 0.00 H new ATOM 0 HD1 PHE A 104 54.071 -1.176 -0.309 1.00 0.00 H new ATOM 0 HD2 PHE A 104 55.540 1.686 2.537 1.00 0.00 H new ATOM 0 HE1 PHE A 104 55.039 0.163 -2.157 1.00 0.00 H new ATOM 0 HE2 PHE A 104 56.510 3.024 0.689 1.00 0.00 H new ATOM 0 HZ PHE A 104 56.257 2.265 -1.659 1.00 0.00 H new ATOM 228 N ASP A 105 52.642 -3.314 2.007 1.00 0.00 N ATOM 229 CA ASP A 105 52.518 -4.621 1.370 1.00 0.00 C ATOM 230 C ASP A 105 51.051 -4.978 1.157 1.00 0.00 C ATOM 231 O ASP A 105 50.265 -5.025 2.103 1.00 0.00 O ATOM 232 CB ASP A 105 53.170 -5.701 2.233 1.00 0.00 C ATOM 233 CG ASP A 105 53.149 -7.027 1.483 1.00 0.00 C ATOM 234 OD1 ASP A 105 53.456 -7.022 0.303 1.00 0.00 O ATOM 235 OD2 ASP A 105 52.824 -8.028 2.100 1.00 0.00 O ATOM 0 H ASP A 105 52.831 -3.345 3.009 1.00 0.00 H new ATOM 0 HA ASP A 105 53.023 -4.571 0.405 1.00 0.00 H new ATOM 0 HB2 ASP A 105 54.196 -5.421 2.472 1.00 0.00 H new ATOM 0 HB3 ASP A 105 52.638 -5.797 3.179 1.00 0.00 H new ATOM 240 N LYS A 106 50.692 -5.231 -0.099 1.00 0.00 N ATOM 241 CA LYS A 106 49.314 -5.586 -0.430 1.00 0.00 C ATOM 242 C LYS A 106 49.264 -6.938 -1.137 1.00 0.00 C ATOM 243 O LYS A 106 48.315 -7.240 -1.860 1.00 0.00 O ATOM 244 CB LYS A 106 48.690 -4.526 -1.341 1.00 0.00 C ATOM 245 CG LYS A 106 49.321 -3.162 -1.053 1.00 0.00 C ATOM 246 CD LYS A 106 50.352 -2.838 -2.137 1.00 0.00 C ATOM 247 CE LYS A 106 49.691 -2.926 -3.513 1.00 0.00 C ATOM 248 NZ LYS A 106 50.177 -1.808 -4.371 1.00 0.00 N ATOM 0 H LYS A 106 51.327 -5.198 -0.896 1.00 0.00 H new ATOM 0 HA LYS A 106 48.751 -5.642 0.502 1.00 0.00 H new ATOM 0 HB2 LYS A 106 48.843 -4.795 -2.386 1.00 0.00 H new ATOM 0 HB3 LYS A 106 47.613 -4.481 -1.178 1.00 0.00 H new ATOM 0 HG2 LYS A 106 48.551 -2.391 -1.027 1.00 0.00 H new ATOM 0 HG3 LYS A 106 49.798 -3.170 -0.073 1.00 0.00 H new ATOM 0 HD2 LYS A 106 50.758 -1.839 -1.980 1.00 0.00 H new ATOM 0 HD3 LYS A 106 51.188 -3.535 -2.078 1.00 0.00 H new ATOM 0 HE2 LYS A 106 49.923 -3.884 -3.979 1.00 0.00 H new ATOM 0 HE3 LYS A 106 48.607 -2.876 -3.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 49.469 -1.600 -5.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 50.329 -0.962 -3.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 51.073 -2.082 -4.823 1.00 0.00 H new ATOM 262 N ASN A 107 50.295 -7.749 -0.917 1.00 0.00 N ATOM 263 CA ASN A 107 50.358 -9.071 -1.537 1.00 0.00 C ATOM 264 C ASN A 107 50.382 -10.164 -0.470 1.00 0.00 C ATOM 265 O ASN A 107 50.579 -11.341 -0.772 1.00 0.00 O ATOM 266 CB ASN A 107 51.609 -9.195 -2.410 1.00 0.00 C ATOM 267 CG ASN A 107 51.705 -10.612 -2.965 1.00 0.00 C ATOM 268 OD1 ASN A 107 52.746 -11.343 -2.674 1.00 0.00 O flip ATOM 269 ND2 ASN A 107 50.814 -11.068 -3.682 1.00 0.00 N flip ATOM 0 H ASN A 107 51.090 -7.519 -0.321 1.00 0.00 H new ATOM 0 HA ASN A 107 49.470 -9.192 -2.158 1.00 0.00 H new ATOM 0 HB2 ASN A 107 51.567 -8.475 -3.227 1.00 0.00 H new ATOM 0 HB3 ASN A 107 52.498 -8.962 -1.825 1.00 0.00 H new ATOM 0 HD21 ASN A 107 50.000 -10.497 -3.910 1.00 0.00 H new ATOM 0 HD22 ASN A 107 50.890 -12.017 -4.048 1.00 0.00 H new ATOM 276 N ALA A 108 50.176 -9.761 0.782 1.00 0.00 N ATOM 277 CA ALA A 108 50.171 -10.714 1.888 1.00 0.00 C ATOM 278 C ALA A 108 51.395 -11.624 1.823 1.00 0.00 C ATOM 279 O ALA A 108 51.280 -12.847 1.902 1.00 0.00 O ATOM 280 CB ALA A 108 48.908 -11.576 1.844 1.00 0.00 C ATOM 0 H ALA A 108 50.012 -8.792 1.054 1.00 0.00 H new ATOM 0 HA ALA A 108 50.194 -10.146 2.818 1.00 0.00 H new ATOM 0 HB1 ALA A 108 48.920 -12.281 2.675 1.00 0.00 H new ATOM 0 HB2 ALA A 108 48.028 -10.937 1.923 1.00 0.00 H new ATOM 0 HB3 ALA A 108 48.875 -12.125 0.903 1.00 0.00 H new ATOM 286 N ASP A 109 52.568 -11.014 1.681 1.00 0.00 N ATOM 287 CA ASP A 109 53.811 -11.780 1.611 1.00 0.00 C ATOM 288 C ASP A 109 54.756 -11.364 2.734 1.00 0.00 C ATOM 289 O ASP A 109 55.532 -12.173 3.243 1.00 0.00 O ATOM 290 CB ASP A 109 54.507 -11.562 0.265 1.00 0.00 C ATOM 291 CG ASP A 109 54.731 -10.072 0.042 1.00 0.00 C ATOM 292 OD1 ASP A 109 53.891 -9.298 0.467 1.00 0.00 O ATOM 293 OD2 ASP A 109 55.740 -9.726 -0.550 1.00 0.00 O ATOM 0 H ASP A 109 52.685 -10.003 1.613 1.00 0.00 H new ATOM 0 HA ASP A 109 53.560 -12.835 1.718 1.00 0.00 H new ATOM 0 HB2 ASP A 109 55.460 -12.090 0.247 1.00 0.00 H new ATOM 0 HB3 ASP A 109 53.899 -11.974 -0.541 1.00 0.00 H new ATOM 298 N GLY A 110 54.679 -10.093 3.117 1.00 0.00 N ATOM 299 CA GLY A 110 55.529 -9.575 4.186 1.00 0.00 C ATOM 300 C GLY A 110 56.829 -9.007 3.624 1.00 0.00 C ATOM 301 O GLY A 110 57.846 -8.948 4.315 1.00 0.00 O ATOM 0 H GLY A 110 54.044 -9.408 2.708 1.00 0.00 H new ATOM 0 HA2 GLY A 110 54.996 -8.799 4.735 1.00 0.00 H new ATOM 0 HA3 GLY A 110 55.753 -10.371 4.896 1.00 0.00 H new ATOM 305 N TYR A 111 56.785 -8.588 2.363 1.00 0.00 N ATOM 306 CA TYR A 111 57.970 -8.026 1.719 1.00 0.00 C ATOM 307 C TYR A 111 57.573 -7.131 0.550 1.00 0.00 C ATOM 308 O TYR A 111 56.985 -7.589 -0.430 1.00 0.00 O ATOM 309 CB TYR A 111 58.880 -9.142 1.204 1.00 0.00 C ATOM 310 CG TYR A 111 59.361 -9.975 2.368 1.00 0.00 C ATOM 311 CD1 TYR A 111 60.423 -9.523 3.161 1.00 0.00 C ATOM 312 CD2 TYR A 111 58.743 -11.198 2.657 1.00 0.00 C ATOM 313 CE1 TYR A 111 60.868 -10.295 4.241 1.00 0.00 C ATOM 314 CE2 TYR A 111 59.189 -11.970 3.737 1.00 0.00 C ATOM 315 CZ TYR A 111 60.251 -11.518 4.529 1.00 0.00 C ATOM 316 OH TYR A 111 60.691 -12.278 5.594 1.00 0.00 O ATOM 0 H TYR A 111 55.954 -8.625 1.772 1.00 0.00 H new ATOM 0 HA TYR A 111 58.504 -7.434 2.462 1.00 0.00 H new ATOM 0 HB2 TYR A 111 58.340 -9.768 0.494 1.00 0.00 H new ATOM 0 HB3 TYR A 111 59.730 -8.716 0.671 1.00 0.00 H new ATOM 0 HD1 TYR A 111 60.899 -8.579 2.940 1.00 0.00 H new ATOM 0 HD2 TYR A 111 57.922 -11.546 2.047 1.00 0.00 H new ATOM 0 HE1 TYR A 111 61.688 -9.947 4.852 1.00 0.00 H new ATOM 0 HE2 TYR A 111 58.714 -12.914 3.959 1.00 0.00 H new ATOM 0 HH TYR A 111 60.155 -13.096 5.656 1.00 0.00 H new ATOM 326 N ILE A 112 57.905 -5.847 0.663 1.00 0.00 N ATOM 327 CA ILE A 112 57.582 -4.894 -0.395 1.00 0.00 C ATOM 328 C ILE A 112 58.464 -5.141 -1.613 1.00 0.00 C ATOM 329 O ILE A 112 59.691 -5.092 -1.530 1.00 0.00 O ATOM 330 CB ILE A 112 57.793 -3.456 0.087 1.00 0.00 C ATOM 331 CG1 ILE A 112 57.205 -3.281 1.495 1.00 0.00 C ATOM 332 CG2 ILE A 112 57.104 -2.488 -0.877 1.00 0.00 C ATOM 333 CD1 ILE A 112 55.852 -3.993 1.590 1.00 0.00 C ATOM 0 H ILE A 112 58.391 -5.447 1.465 1.00 0.00 H new ATOM 0 HA ILE A 112 56.535 -5.033 -0.663 1.00 0.00 H new ATOM 0 HB ILE A 112 58.862 -3.244 0.118 1.00 0.00 H new ATOM 0 HG12 ILE A 112 57.892 -3.687 2.238 1.00 0.00 H new ATOM 0 HG13 ILE A 112 57.084 -2.221 1.718 1.00 0.00 H new ATOM 0 HG21 ILE A 112 57.254 -1.464 -0.534 1.00 0.00 H new ATOM 0 HG22 ILE A 112 57.530 -2.603 -1.874 1.00 0.00 H new ATOM 0 HG23 ILE A 112 56.037 -2.706 -0.911 1.00 0.00 H new ATOM 0 HD11 ILE A 112 55.442 -3.864 2.592 1.00 0.00 H new ATOM 0 HD12 ILE A 112 55.165 -3.567 0.859 1.00 0.00 H new ATOM 0 HD13 ILE A 112 55.985 -5.056 1.387 1.00 0.00 H new ATOM 345 N ASP A 113 57.824 -5.408 -2.747 1.00 0.00 N ATOM 346 CA ASP A 113 58.560 -5.661 -3.983 1.00 0.00 C ATOM 347 C ASP A 113 58.246 -4.585 -5.015 1.00 0.00 C ATOM 348 O ASP A 113 57.116 -4.104 -5.108 1.00 0.00 O ATOM 349 CB ASP A 113 58.190 -7.030 -4.557 1.00 0.00 C ATOM 350 CG ASP A 113 56.682 -7.099 -4.778 1.00 0.00 C ATOM 351 OD1 ASP A 113 56.212 -6.479 -5.718 1.00 0.00 O ATOM 352 OD2 ASP A 113 56.020 -7.770 -4.003 1.00 0.00 O ATOM 0 H ASP A 113 56.809 -5.455 -2.837 1.00 0.00 H new ATOM 0 HA ASP A 113 59.625 -5.644 -3.752 1.00 0.00 H new ATOM 0 HB2 ASP A 113 58.714 -7.195 -5.498 1.00 0.00 H new ATOM 0 HB3 ASP A 113 58.505 -7.819 -3.874 1.00 0.00 H new ATOM 357 N LEU A 114 59.259 -4.210 -5.789 1.00 0.00 N ATOM 358 CA LEU A 114 59.085 -3.188 -6.811 1.00 0.00 C ATOM 359 C LEU A 114 57.743 -3.359 -7.514 1.00 0.00 C ATOM 360 O LEU A 114 57.008 -2.394 -7.725 1.00 0.00 O ATOM 361 CB LEU A 114 60.205 -3.282 -7.847 1.00 0.00 C ATOM 362 CG LEU A 114 61.512 -2.779 -7.235 1.00 0.00 C ATOM 363 CD1 LEU A 114 62.557 -3.895 -7.273 1.00 0.00 C ATOM 364 CD2 LEU A 114 62.019 -1.578 -8.037 1.00 0.00 C ATOM 0 H LEU A 114 60.201 -4.596 -5.728 1.00 0.00 H new ATOM 0 HA LEU A 114 59.116 -2.213 -6.325 1.00 0.00 H new ATOM 0 HB2 LEU A 114 60.321 -4.313 -8.180 1.00 0.00 H new ATOM 0 HB3 LEU A 114 59.952 -2.690 -8.726 1.00 0.00 H new ATOM 0 HG LEU A 114 61.338 -2.480 -6.201 1.00 0.00 H new ATOM 0 HD11 LEU A 114 63.489 -3.536 -6.836 1.00 0.00 H new ATOM 0 HD12 LEU A 114 62.196 -4.751 -6.703 1.00 0.00 H new ATOM 0 HD13 LEU A 114 62.732 -4.194 -8.306 1.00 0.00 H new ATOM 0 HD21 LEU A 114 62.951 -1.218 -7.602 1.00 0.00 H new ATOM 0 HD22 LEU A 114 62.193 -1.878 -9.070 1.00 0.00 H new ATOM 0 HD23 LEU A 114 61.275 -0.782 -8.010 1.00 0.00 H new ATOM 376 N GLU A 115 57.433 -4.601 -7.873 1.00 0.00 N ATOM 377 CA GLU A 115 56.176 -4.895 -8.553 1.00 0.00 C ATOM 378 C GLU A 115 55.018 -4.187 -7.857 1.00 0.00 C ATOM 379 O GLU A 115 54.042 -3.789 -8.492 1.00 0.00 O ATOM 380 CB GLU A 115 55.909 -6.401 -8.557 1.00 0.00 C ATOM 381 CG GLU A 115 55.899 -6.914 -9.997 1.00 0.00 C ATOM 382 CD GLU A 115 54.537 -6.642 -10.626 1.00 0.00 C ATOM 383 OE1 GLU A 115 53.773 -5.897 -10.035 1.00 0.00 O ATOM 384 OE2 GLU A 115 54.278 -7.181 -11.689 1.00 0.00 O ATOM 0 H GLU A 115 58.028 -5.413 -7.707 1.00 0.00 H new ATOM 0 HA GLU A 115 56.257 -4.539 -9.580 1.00 0.00 H new ATOM 0 HB2 GLU A 115 56.676 -6.918 -7.981 1.00 0.00 H new ATOM 0 HB3 GLU A 115 54.953 -6.613 -8.078 1.00 0.00 H new ATOM 0 HG2 GLU A 115 56.682 -6.423 -10.574 1.00 0.00 H new ATOM 0 HG3 GLU A 115 56.112 -7.983 -10.015 1.00 0.00 H new ATOM 391 N GLU A 116 55.140 -4.034 -6.542 1.00 0.00 N ATOM 392 CA GLU A 116 54.100 -3.371 -5.762 1.00 0.00 C ATOM 393 C GLU A 116 54.483 -1.922 -5.491 1.00 0.00 C ATOM 394 O GLU A 116 53.665 -1.011 -5.626 1.00 0.00 O ATOM 395 CB GLU A 116 53.891 -4.086 -4.427 1.00 0.00 C ATOM 396 CG GLU A 116 53.314 -5.480 -4.679 1.00 0.00 C ATOM 397 CD GLU A 116 53.734 -6.415 -3.551 1.00 0.00 C ATOM 398 OE1 GLU A 116 54.375 -5.945 -2.625 1.00 0.00 O ATOM 399 OE2 GLU A 116 53.408 -7.588 -3.628 1.00 0.00 O ATOM 0 H GLU A 116 55.940 -4.357 -5.998 1.00 0.00 H new ATOM 0 HA GLU A 116 53.176 -3.404 -6.339 1.00 0.00 H new ATOM 0 HB2 GLU A 116 54.838 -4.164 -3.892 1.00 0.00 H new ATOM 0 HB3 GLU A 116 53.215 -3.510 -3.796 1.00 0.00 H new ATOM 0 HG2 GLU A 116 52.227 -5.430 -4.739 1.00 0.00 H new ATOM 0 HG3 GLU A 116 53.668 -5.864 -5.635 1.00 0.00 H new ATOM 406 N LEU A 117 55.739 -1.719 -5.106 1.00 0.00 N ATOM 407 CA LEU A 117 56.228 -0.376 -4.815 1.00 0.00 C ATOM 408 C LEU A 117 55.820 0.589 -5.924 1.00 0.00 C ATOM 409 O LEU A 117 55.141 1.586 -5.678 1.00 0.00 O ATOM 410 CB LEU A 117 57.751 -0.375 -4.682 1.00 0.00 C ATOM 411 CG LEU A 117 58.135 0.021 -3.255 1.00 0.00 C ATOM 412 CD1 LEU A 117 59.188 -0.949 -2.715 1.00 0.00 C ATOM 413 CD2 LEU A 117 58.706 1.440 -3.260 1.00 0.00 C ATOM 0 H LEU A 117 56.431 -2.459 -4.989 1.00 0.00 H new ATOM 0 HA LEU A 117 55.786 -0.053 -3.872 1.00 0.00 H new ATOM 0 HB2 LEU A 117 58.148 -1.362 -4.917 1.00 0.00 H new ATOM 0 HB3 LEU A 117 58.189 0.323 -5.395 1.00 0.00 H new ATOM 0 HG LEU A 117 57.251 -0.017 -2.619 1.00 0.00 H new ATOM 0 HD11 LEU A 117 59.459 -0.663 -1.699 1.00 0.00 H new ATOM 0 HD12 LEU A 117 58.783 -1.961 -2.712 1.00 0.00 H new ATOM 0 HD13 LEU A 117 60.074 -0.915 -3.349 1.00 0.00 H new ATOM 0 HD21 LEU A 117 58.981 1.725 -2.244 1.00 0.00 H new ATOM 0 HD22 LEU A 117 59.589 1.475 -3.898 1.00 0.00 H new ATOM 0 HD23 LEU A 117 57.956 2.133 -3.641 1.00 0.00 H new ATOM 425 N LYS A 118 56.235 0.281 -7.150 1.00 0.00 N ATOM 426 CA LYS A 118 55.897 1.132 -8.288 1.00 0.00 C ATOM 427 C LYS A 118 54.391 1.354 -8.345 1.00 0.00 C ATOM 428 O LYS A 118 53.920 2.470 -8.563 1.00 0.00 O ATOM 429 CB LYS A 118 56.359 0.490 -9.598 1.00 0.00 C ATOM 430 CG LYS A 118 57.863 0.711 -9.772 1.00 0.00 C ATOM 431 CD LYS A 118 58.615 -0.568 -9.399 1.00 0.00 C ATOM 432 CE LYS A 118 58.265 -1.677 -10.393 1.00 0.00 C ATOM 433 NZ LYS A 118 59.333 -1.771 -11.428 1.00 0.00 N ATOM 0 H LYS A 118 56.797 -0.538 -7.380 1.00 0.00 H new ATOM 0 HA LYS A 118 56.405 2.088 -8.160 1.00 0.00 H new ATOM 0 HB2 LYS A 118 56.136 -0.577 -9.591 1.00 0.00 H new ATOM 0 HB3 LYS A 118 55.817 0.923 -10.439 1.00 0.00 H new ATOM 0 HG2 LYS A 118 58.084 0.987 -10.803 1.00 0.00 H new ATOM 0 HG3 LYS A 118 58.195 1.537 -9.143 1.00 0.00 H new ATOM 0 HD2 LYS A 118 59.690 -0.385 -9.406 1.00 0.00 H new ATOM 0 HD3 LYS A 118 58.350 -0.876 -8.387 1.00 0.00 H new ATOM 0 HE2 LYS A 118 58.164 -2.629 -9.872 1.00 0.00 H new ATOM 0 HE3 LYS A 118 57.304 -1.468 -10.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 59.096 -2.525 -12.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 59.408 -0.865 -11.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 60.241 -1.989 -10.971 1.00 0.00 H new ATOM 447 N ILE A 119 53.640 0.276 -8.136 1.00 0.00 N ATOM 448 CA ILE A 119 52.184 0.363 -8.155 1.00 0.00 C ATOM 449 C ILE A 119 51.710 1.370 -7.112 1.00 0.00 C ATOM 450 O ILE A 119 50.628 1.943 -7.226 1.00 0.00 O ATOM 451 CB ILE A 119 51.561 -1.004 -7.859 1.00 0.00 C ATOM 452 CG1 ILE A 119 51.760 -1.926 -9.065 1.00 0.00 C ATOM 453 CG2 ILE A 119 50.064 -0.840 -7.590 1.00 0.00 C ATOM 454 CD1 ILE A 119 51.238 -3.324 -8.730 1.00 0.00 C ATOM 0 H ILE A 119 54.010 -0.657 -7.954 1.00 0.00 H new ATOM 0 HA ILE A 119 51.871 0.689 -9.147 1.00 0.00 H new ATOM 0 HB ILE A 119 52.042 -1.437 -6.982 1.00 0.00 H new ATOM 0 HG12 ILE A 119 51.233 -1.527 -9.932 1.00 0.00 H new ATOM 0 HG13 ILE A 119 52.816 -1.974 -9.329 1.00 0.00 H new ATOM 0 HG21 ILE A 119 49.623 -1.814 -7.380 1.00 0.00 H new ATOM 0 HG22 ILE A 119 49.918 -0.183 -6.732 1.00 0.00 H new ATOM 0 HG23 ILE A 119 49.582 -0.405 -8.466 1.00 0.00 H new ATOM 0 HD11 ILE A 119 51.380 -3.981 -9.588 1.00 0.00 H new ATOM 0 HD12 ILE A 119 51.785 -3.721 -7.875 1.00 0.00 H new ATOM 0 HD13 ILE A 119 50.177 -3.268 -8.487 1.00 0.00 H new ATOM 466 N MET A 120 52.541 1.579 -6.093 1.00 0.00 N ATOM 467 CA MET A 120 52.208 2.523 -5.031 1.00 0.00 C ATOM 468 C MET A 120 52.395 3.955 -5.521 1.00 0.00 C ATOM 469 O MET A 120 51.596 4.841 -5.218 1.00 0.00 O ATOM 470 CB MET A 120 53.101 2.292 -3.810 1.00 0.00 C ATOM 471 CG MET A 120 52.628 3.177 -2.655 1.00 0.00 C ATOM 472 SD MET A 120 51.691 2.177 -1.472 1.00 0.00 S ATOM 473 CE MET A 120 51.988 3.211 -0.017 1.00 0.00 C ATOM 0 H MET A 120 53.441 1.112 -5.981 1.00 0.00 H new ATOM 0 HA MET A 120 51.166 2.366 -4.751 1.00 0.00 H new ATOM 0 HB2 MET A 120 53.068 1.243 -3.515 1.00 0.00 H new ATOM 0 HB3 MET A 120 54.138 2.521 -4.056 1.00 0.00 H new ATOM 0 HG2 MET A 120 53.484 3.637 -2.161 1.00 0.00 H new ATOM 0 HG3 MET A 120 52.006 3.988 -3.035 1.00 0.00 H new ATOM 0 HE1 MET A 120 51.491 2.773 0.848 1.00 0.00 H new ATOM 0 HE2 MET A 120 53.060 3.272 0.173 1.00 0.00 H new ATOM 0 HE3 MET A 120 51.593 4.211 -0.195 1.00 0.00 H new ATOM 483 N LEU A 121 53.461 4.167 -6.288 1.00 0.00 N ATOM 484 CA LEU A 121 53.751 5.493 -6.826 1.00 0.00 C ATOM 485 C LEU A 121 52.716 5.870 -7.881 1.00 0.00 C ATOM 486 O LEU A 121 52.174 6.975 -7.876 1.00 0.00 O ATOM 487 CB LEU A 121 55.142 5.518 -7.464 1.00 0.00 C ATOM 488 CG LEU A 121 56.166 4.923 -6.496 1.00 0.00 C ATOM 489 CD1 LEU A 121 57.568 5.056 -7.094 1.00 0.00 C ATOM 490 CD2 LEU A 121 56.110 5.674 -5.162 1.00 0.00 C ATOM 0 H LEU A 121 54.133 3.445 -6.549 1.00 0.00 H new ATOM 0 HA LEU A 121 53.716 6.209 -6.005 1.00 0.00 H new ATOM 0 HB2 LEU A 121 55.136 4.951 -8.395 1.00 0.00 H new ATOM 0 HB3 LEU A 121 55.418 6.542 -7.716 1.00 0.00 H new ATOM 0 HG LEU A 121 55.937 3.870 -6.329 1.00 0.00 H new ATOM 0 HD11 LEU A 121 58.299 4.632 -6.405 1.00 0.00 H new ATOM 0 HD12 LEU A 121 57.611 4.521 -8.043 1.00 0.00 H new ATOM 0 HD13 LEU A 121 57.794 6.109 -7.260 1.00 0.00 H new ATOM 0 HD21 LEU A 121 56.840 5.248 -4.474 1.00 0.00 H new ATOM 0 HD22 LEU A 121 56.338 6.727 -5.327 1.00 0.00 H new ATOM 0 HD23 LEU A 121 55.112 5.582 -4.734 1.00 0.00 H new ATOM 502 N GLN A 122 52.452 4.934 -8.787 1.00 0.00 N ATOM 503 CA GLN A 122 51.482 5.166 -9.855 1.00 0.00 C ATOM 504 C GLN A 122 50.082 5.360 -9.280 1.00 0.00 C ATOM 505 O GLN A 122 49.170 5.810 -9.973 1.00 0.00 O ATOM 506 CB GLN A 122 51.462 3.980 -10.822 1.00 0.00 C ATOM 507 CG GLN A 122 52.410 4.257 -11.990 1.00 0.00 C ATOM 508 CD GLN A 122 53.648 3.377 -11.861 1.00 0.00 C ATOM 509 OE1 GLN A 122 54.554 3.679 -11.083 1.00 0.00 O ATOM 510 NE2 GLN A 122 53.743 2.294 -12.583 1.00 0.00 N ATOM 0 H GLN A 122 52.892 4.014 -8.805 1.00 0.00 H new ATOM 0 HA GLN A 122 51.781 6.069 -10.388 1.00 0.00 H new ATOM 0 HB2 GLN A 122 51.763 3.070 -10.304 1.00 0.00 H new ATOM 0 HB3 GLN A 122 50.450 3.816 -11.192 1.00 0.00 H new ATOM 0 HG2 GLN A 122 51.906 4.058 -12.936 1.00 0.00 H new ATOM 0 HG3 GLN A 122 52.697 5.308 -11.997 1.00 0.00 H new ATOM 0 HE21 GLN A 122 52.993 2.043 -13.227 1.00 0.00 H new ATOM 0 HE22 GLN A 122 54.567 1.698 -12.503 1.00 0.00 H new ATOM 519 N ALA A 123 49.921 5.015 -8.005 1.00 0.00 N ATOM 520 CA ALA A 123 48.623 5.156 -7.350 1.00 0.00 C ATOM 521 C ALA A 123 48.548 6.477 -6.592 1.00 0.00 C ATOM 522 O ALA A 123 47.465 7.014 -6.358 1.00 0.00 O ATOM 523 CB ALA A 123 48.387 4.005 -6.371 1.00 0.00 C ATOM 0 H ALA A 123 50.661 4.641 -7.412 1.00 0.00 H new ATOM 0 HA ALA A 123 47.854 5.137 -8.123 1.00 0.00 H new ATOM 0 HB1 ALA A 123 47.415 4.127 -5.893 1.00 0.00 H new ATOM 0 HB2 ALA A 123 48.409 3.058 -6.910 1.00 0.00 H new ATOM 0 HB3 ALA A 123 49.168 4.008 -5.611 1.00 0.00 H new ATOM 529 N THR A 124 49.712 6.995 -6.210 1.00 0.00 N ATOM 530 CA THR A 124 49.767 8.258 -5.478 1.00 0.00 C ATOM 531 C THR A 124 49.932 9.427 -6.442 1.00 0.00 C ATOM 532 O THR A 124 50.860 10.227 -6.319 1.00 0.00 O ATOM 533 CB THR A 124 50.937 8.257 -4.492 1.00 0.00 C ATOM 534 OG1 THR A 124 51.879 7.266 -4.877 1.00 0.00 O ATOM 535 CG2 THR A 124 50.420 7.953 -3.085 1.00 0.00 C ATOM 0 H THR A 124 50.620 6.567 -6.392 1.00 0.00 H new ATOM 0 HA THR A 124 48.831 8.368 -4.930 1.00 0.00 H new ATOM 0 HB THR A 124 51.417 9.236 -4.497 1.00 0.00 H new ATOM 0 HG1 THR A 124 51.562 6.384 -4.590 1.00 0.00 H new ATOM 0 HG21 THR A 124 51.254 7.952 -2.383 1.00 0.00 H new ATOM 0 HG22 THR A 124 49.698 8.715 -2.790 1.00 0.00 H new ATOM 0 HG23 THR A 124 49.939 6.975 -3.078 1.00 0.00 H new ATOM 543 N GLY A 125 49.020 9.516 -7.406 1.00 0.00 N ATOM 544 CA GLY A 125 49.072 10.591 -8.391 1.00 0.00 C ATOM 545 C GLY A 125 50.049 10.254 -9.514 1.00 0.00 C ATOM 546 O GLY A 125 50.205 11.017 -10.468 1.00 0.00 O ATOM 0 H GLY A 125 48.244 8.864 -7.526 1.00 0.00 H new ATOM 0 HA2 GLY A 125 48.078 10.758 -8.806 1.00 0.00 H new ATOM 0 HA3 GLY A 125 49.375 11.519 -7.906 1.00 0.00 H new ATOM 550 N GLU A 126 50.706 9.102 -9.392 1.00 0.00 N ATOM 551 CA GLU A 126 51.666 8.672 -10.406 1.00 0.00 C ATOM 552 C GLU A 126 52.471 9.866 -10.916 1.00 0.00 C ATOM 553 O GLU A 126 52.669 10.848 -10.200 1.00 0.00 O ATOM 554 CB GLU A 126 50.939 8.010 -11.578 1.00 0.00 C ATOM 555 CG GLU A 126 50.143 9.066 -12.348 1.00 0.00 C ATOM 556 CD GLU A 126 49.434 8.411 -13.528 1.00 0.00 C ATOM 557 OE1 GLU A 126 49.988 7.476 -14.082 1.00 0.00 O ATOM 558 OE2 GLU A 126 48.347 8.854 -13.860 1.00 0.00 O ATOM 0 H GLU A 126 50.593 8.456 -8.611 1.00 0.00 H new ATOM 0 HA GLU A 126 52.345 7.951 -9.951 1.00 0.00 H new ATOM 0 HB2 GLU A 126 51.658 7.527 -12.240 1.00 0.00 H new ATOM 0 HB3 GLU A 126 50.270 7.231 -11.212 1.00 0.00 H new ATOM 0 HG2 GLU A 126 49.414 9.539 -11.689 1.00 0.00 H new ATOM 0 HG3 GLU A 126 50.810 9.852 -12.702 1.00 0.00 H new ATOM 565 N THR A 127 52.935 9.772 -12.162 1.00 0.00 N ATOM 566 CA THR A 127 53.719 10.850 -12.756 1.00 0.00 C ATOM 567 C THR A 127 55.133 10.854 -12.184 1.00 0.00 C ATOM 568 O THR A 127 55.742 11.908 -12.002 1.00 0.00 O ATOM 569 CB THR A 127 53.061 12.202 -12.478 1.00 0.00 C ATOM 570 OG1 THR A 127 51.674 12.122 -12.777 1.00 0.00 O ATOM 571 CG2 THR A 127 53.712 13.279 -13.347 1.00 0.00 C ATOM 0 H THR A 127 52.783 8.969 -12.772 1.00 0.00 H new ATOM 0 HA THR A 127 53.764 10.685 -13.832 1.00 0.00 H new ATOM 0 HB THR A 127 53.192 12.460 -11.427 1.00 0.00 H new ATOM 0 HG1 THR A 127 51.175 11.906 -11.961 1.00 0.00 H new ATOM 0 HG21 THR A 127 53.241 14.242 -13.147 1.00 0.00 H new ATOM 0 HG22 THR A 127 54.775 13.340 -13.115 1.00 0.00 H new ATOM 0 HG23 THR A 127 53.584 13.024 -14.399 1.00 0.00 H new ATOM 579 N ILE A 128 55.646 9.659 -11.902 1.00 0.00 N ATOM 580 CA ILE A 128 56.991 9.526 -11.348 1.00 0.00 C ATOM 581 C ILE A 128 57.857 8.655 -12.255 1.00 0.00 C ATOM 582 O ILE A 128 57.361 7.757 -12.935 1.00 0.00 O ATOM 583 CB ILE A 128 56.936 8.893 -9.956 1.00 0.00 C ATOM 584 CG1 ILE A 128 56.030 9.730 -9.049 1.00 0.00 C ATOM 585 CG2 ILE A 128 58.344 8.842 -9.360 1.00 0.00 C ATOM 586 CD1 ILE A 128 55.084 8.806 -8.281 1.00 0.00 C ATOM 0 H ILE A 128 55.156 8.776 -12.046 1.00 0.00 H new ATOM 0 HA ILE A 128 57.426 10.523 -11.277 1.00 0.00 H new ATOM 0 HB ILE A 128 56.538 7.881 -10.035 1.00 0.00 H new ATOM 0 HG12 ILE A 128 56.633 10.312 -8.352 1.00 0.00 H new ATOM 0 HG13 ILE A 128 55.457 10.441 -9.645 1.00 0.00 H new ATOM 0 HG21 ILE A 128 58.303 8.391 -8.369 1.00 0.00 H new ATOM 0 HG22 ILE A 128 58.990 8.245 -10.004 1.00 0.00 H new ATOM 0 HG23 ILE A 128 58.743 9.853 -9.282 1.00 0.00 H new ATOM 0 HD11 ILE A 128 54.439 9.401 -7.635 1.00 0.00 H new ATOM 0 HD12 ILE A 128 54.472 8.244 -8.987 1.00 0.00 H new ATOM 0 HD13 ILE A 128 55.666 8.113 -7.673 1.00 0.00 H new ATOM 598 N THR A 129 59.160 8.931 -12.258 1.00 0.00 N ATOM 599 CA THR A 129 60.090 8.167 -13.085 1.00 0.00 C ATOM 600 C THR A 129 60.785 7.093 -12.253 1.00 0.00 C ATOM 601 O THR A 129 60.448 6.874 -11.089 1.00 0.00 O ATOM 602 CB THR A 129 61.150 9.089 -13.692 1.00 0.00 C ATOM 603 OG1 THR A 129 60.700 10.435 -13.622 1.00 0.00 O ATOM 604 CG2 THR A 129 61.390 8.705 -15.152 1.00 0.00 C ATOM 0 H THR A 129 59.592 9.670 -11.703 1.00 0.00 H new ATOM 0 HA THR A 129 59.518 7.695 -13.884 1.00 0.00 H new ATOM 0 HB THR A 129 62.082 8.987 -13.135 1.00 0.00 H new ATOM 0 HG1 THR A 129 61.378 11.027 -14.009 1.00 0.00 H new ATOM 0 HG21 THR A 129 62.145 9.363 -15.582 1.00 0.00 H new ATOM 0 HG22 THR A 129 61.736 7.673 -15.205 1.00 0.00 H new ATOM 0 HG23 THR A 129 60.460 8.805 -15.712 1.00 0.00 H new ATOM 612 N GLU A 130 61.761 6.425 -12.864 1.00 0.00 N ATOM 613 CA GLU A 130 62.502 5.372 -12.173 1.00 0.00 C ATOM 614 C GLU A 130 63.448 5.976 -11.140 1.00 0.00 C ATOM 615 O GLU A 130 63.711 5.381 -10.094 1.00 0.00 O ATOM 616 CB GLU A 130 63.318 4.548 -13.172 1.00 0.00 C ATOM 617 CG GLU A 130 63.114 3.057 -12.897 1.00 0.00 C ATOM 618 CD GLU A 130 64.267 2.265 -13.504 1.00 0.00 C ATOM 619 OE1 GLU A 130 65.199 2.888 -13.985 1.00 0.00 O ATOM 620 OE2 GLU A 130 64.201 1.047 -13.480 1.00 0.00 O ATOM 0 H GLU A 130 62.055 6.591 -13.826 1.00 0.00 H new ATOM 0 HA GLU A 130 61.780 4.726 -11.672 1.00 0.00 H new ATOM 0 HB2 GLU A 130 63.011 4.785 -14.191 1.00 0.00 H new ATOM 0 HB3 GLU A 130 64.375 4.802 -13.090 1.00 0.00 H new ATOM 0 HG2 GLU A 130 63.062 2.878 -11.823 1.00 0.00 H new ATOM 0 HG3 GLU A 130 62.167 2.724 -13.322 1.00 0.00 H new ATOM 627 N ASP A 131 63.956 7.165 -11.447 1.00 0.00 N ATOM 628 CA ASP A 131 64.877 7.847 -10.542 1.00 0.00 C ATOM 629 C ASP A 131 64.313 7.879 -9.125 1.00 0.00 C ATOM 630 O ASP A 131 65.057 7.956 -8.147 1.00 0.00 O ATOM 631 CB ASP A 131 65.124 9.282 -11.012 1.00 0.00 C ATOM 632 CG ASP A 131 65.557 9.271 -12.474 1.00 0.00 C ATOM 633 OD1 ASP A 131 66.728 9.037 -12.723 1.00 0.00 O ATOM 634 OD2 ASP A 131 64.711 9.496 -13.324 1.00 0.00 O ATOM 0 H ASP A 131 63.749 7.673 -12.307 1.00 0.00 H new ATOM 0 HA ASP A 131 65.817 7.296 -10.544 1.00 0.00 H new ATOM 0 HB2 ASP A 131 64.217 9.876 -10.895 1.00 0.00 H new ATOM 0 HB3 ASP A 131 65.893 9.750 -10.397 1.00 0.00 H new ATOM 639 N ASP A 132 62.987 7.823 -9.026 1.00 0.00 N ATOM 640 CA ASP A 132 62.329 7.850 -7.722 1.00 0.00 C ATOM 641 C ASP A 132 62.111 6.434 -7.198 1.00 0.00 C ATOM 642 O ASP A 132 61.956 6.219 -5.996 1.00 0.00 O ATOM 643 CB ASP A 132 60.976 8.558 -7.821 1.00 0.00 C ATOM 644 CG ASP A 132 61.106 9.979 -7.283 1.00 0.00 C ATOM 645 OD1 ASP A 132 61.093 10.137 -6.074 1.00 0.00 O ATOM 646 OD2 ASP A 132 61.215 10.889 -8.089 1.00 0.00 O ATOM 0 H ASP A 132 62.353 7.759 -9.823 1.00 0.00 H new ATOM 0 HA ASP A 132 62.976 8.393 -7.033 1.00 0.00 H new ATOM 0 HB2 ASP A 132 60.640 8.579 -8.858 1.00 0.00 H new ATOM 0 HB3 ASP A 132 60.224 8.010 -7.253 1.00 0.00 H new ATOM 651 N ILE A 133 62.098 5.469 -8.113 1.00 0.00 N ATOM 652 CA ILE A 133 61.896 4.074 -7.729 1.00 0.00 C ATOM 653 C ILE A 133 63.223 3.425 -7.350 1.00 0.00 C ATOM 654 O ILE A 133 63.299 2.641 -6.403 1.00 0.00 O ATOM 655 CB ILE A 133 61.270 3.281 -8.878 1.00 0.00 C ATOM 656 CG1 ILE A 133 60.098 4.070 -9.467 1.00 0.00 C ATOM 657 CG2 ILE A 133 60.765 1.937 -8.352 1.00 0.00 C ATOM 658 CD1 ILE A 133 59.506 3.297 -10.647 1.00 0.00 C ATOM 0 H ILE A 133 62.223 5.623 -9.114 1.00 0.00 H new ATOM 0 HA ILE A 133 61.224 4.062 -6.871 1.00 0.00 H new ATOM 0 HB ILE A 133 62.019 3.112 -9.652 1.00 0.00 H new ATOM 0 HG12 ILE A 133 59.335 4.232 -8.705 1.00 0.00 H new ATOM 0 HG13 ILE A 133 60.436 5.053 -9.795 1.00 0.00 H new ATOM 0 HG21 ILE A 133 60.319 1.371 -9.170 1.00 0.00 H new ATOM 0 HG22 ILE A 133 61.599 1.374 -7.933 1.00 0.00 H new ATOM 0 HG23 ILE A 133 60.017 2.107 -7.578 1.00 0.00 H new ATOM 0 HD11 ILE A 133 58.671 3.858 -11.067 1.00 0.00 H new ATOM 0 HD12 ILE A 133 60.271 3.157 -11.411 1.00 0.00 H new ATOM 0 HD13 ILE A 133 59.154 2.324 -10.305 1.00 0.00 H new ATOM 670 N GLU A 134 64.268 3.756 -8.104 1.00 0.00 N ATOM 671 CA GLU A 134 65.591 3.195 -7.843 1.00 0.00 C ATOM 672 C GLU A 134 66.189 3.791 -6.573 1.00 0.00 C ATOM 673 O GLU A 134 66.424 3.086 -5.591 1.00 0.00 O ATOM 674 CB GLU A 134 66.532 3.471 -9.017 1.00 0.00 C ATOM 675 CG GLU A 134 66.771 2.173 -9.792 1.00 0.00 C ATOM 676 CD GLU A 134 67.187 2.501 -11.222 1.00 0.00 C ATOM 677 OE1 GLU A 134 66.900 3.601 -11.664 1.00 0.00 O ATOM 678 OE2 GLU A 134 67.786 1.647 -11.854 1.00 0.00 O ATOM 0 H GLU A 134 64.226 4.402 -8.892 1.00 0.00 H new ATOM 0 HA GLU A 134 65.477 2.119 -7.715 1.00 0.00 H new ATOM 0 HB2 GLU A 134 66.100 4.226 -9.674 1.00 0.00 H new ATOM 0 HB3 GLU A 134 67.479 3.870 -8.653 1.00 0.00 H new ATOM 0 HG2 GLU A 134 67.546 1.583 -9.303 1.00 0.00 H new ATOM 0 HG3 GLU A 134 65.865 1.568 -9.796 1.00 0.00 H new ATOM 685 N GLU A 135 66.432 5.099 -6.599 1.00 0.00 N ATOM 686 CA GLU A 135 67.004 5.776 -5.437 1.00 0.00 C ATOM 687 C GLU A 135 66.197 5.449 -4.186 1.00 0.00 C ATOM 688 O GLU A 135 66.733 5.387 -3.079 1.00 0.00 O ATOM 689 CB GLU A 135 67.008 7.293 -5.645 1.00 0.00 C ATOM 690 CG GLU A 135 68.095 7.925 -4.773 1.00 0.00 C ATOM 691 CD GLU A 135 67.446 8.736 -3.657 1.00 0.00 C ATOM 692 OE1 GLU A 135 66.294 8.475 -3.355 1.00 0.00 O ATOM 693 OE2 GLU A 135 68.111 9.607 -3.121 1.00 0.00 O ATOM 0 H GLU A 135 66.245 5.704 -7.399 1.00 0.00 H new ATOM 0 HA GLU A 135 68.029 5.427 -5.314 1.00 0.00 H new ATOM 0 HB2 GLU A 135 67.187 7.526 -6.694 1.00 0.00 H new ATOM 0 HB3 GLU A 135 66.034 7.709 -5.388 1.00 0.00 H new ATOM 0 HG2 GLU A 135 68.733 7.149 -4.349 1.00 0.00 H new ATOM 0 HG3 GLU A 135 68.734 8.567 -5.379 1.00 0.00 H new ATOM 700 N LEU A 136 64.898 5.245 -4.377 1.00 0.00 N ATOM 701 CA LEU A 136 64.008 4.931 -3.272 1.00 0.00 C ATOM 702 C LEU A 136 64.162 3.473 -2.847 1.00 0.00 C ATOM 703 O LEU A 136 64.071 3.144 -1.664 1.00 0.00 O ATOM 704 CB LEU A 136 62.564 5.183 -3.709 1.00 0.00 C ATOM 705 CG LEU A 136 61.585 4.787 -2.606 1.00 0.00 C ATOM 706 CD1 LEU A 136 61.376 3.272 -2.618 1.00 0.00 C ATOM 707 CD2 LEU A 136 62.122 5.222 -1.238 1.00 0.00 C ATOM 0 H LEU A 136 64.441 5.292 -5.288 1.00 0.00 H new ATOM 0 HA LEU A 136 64.263 5.566 -2.423 1.00 0.00 H new ATOM 0 HB2 LEU A 136 62.433 6.236 -3.956 1.00 0.00 H new ATOM 0 HB3 LEU A 136 62.349 4.614 -4.614 1.00 0.00 H new ATOM 0 HG LEU A 136 60.633 5.285 -2.787 1.00 0.00 H new ATOM 0 HD11 LEU A 136 60.677 2.995 -1.829 1.00 0.00 H new ATOM 0 HD12 LEU A 136 60.972 2.968 -3.584 1.00 0.00 H new ATOM 0 HD13 LEU A 136 62.330 2.772 -2.450 1.00 0.00 H new ATOM 0 HD21 LEU A 136 61.414 4.934 -0.461 1.00 0.00 H new ATOM 0 HD22 LEU A 136 63.081 4.738 -1.053 1.00 0.00 H new ATOM 0 HD23 LEU A 136 62.253 6.304 -1.226 1.00 0.00 H new ATOM 719 N MET A 137 64.386 2.602 -3.826 1.00 0.00 N ATOM 720 CA MET A 137 64.539 1.176 -3.545 1.00 0.00 C ATOM 721 C MET A 137 65.972 0.853 -3.128 1.00 0.00 C ATOM 722 O MET A 137 66.218 0.371 -2.023 1.00 0.00 O ATOM 723 CB MET A 137 64.179 0.350 -4.782 1.00 0.00 C ATOM 724 CG MET A 137 63.850 -1.084 -4.361 1.00 0.00 C ATOM 725 SD MET A 137 65.383 -1.966 -3.980 1.00 0.00 S ATOM 726 CE MET A 137 64.669 -3.625 -3.878 1.00 0.00 C ATOM 0 H MET A 137 64.465 2.853 -4.811 1.00 0.00 H new ATOM 0 HA MET A 137 63.865 0.923 -2.726 1.00 0.00 H new ATOM 0 HB2 MET A 137 63.325 0.795 -5.294 1.00 0.00 H new ATOM 0 HB3 MET A 137 65.010 0.352 -5.488 1.00 0.00 H new ATOM 0 HG2 MET A 137 63.195 -1.078 -3.490 1.00 0.00 H new ATOM 0 HG3 MET A 137 63.313 -1.595 -5.160 1.00 0.00 H new ATOM 0 HE1 MET A 137 65.285 -4.247 -3.228 1.00 0.00 H new ATOM 0 HE2 MET A 137 63.660 -3.562 -3.471 1.00 0.00 H new ATOM 0 HE3 MET A 137 64.632 -4.067 -4.874 1.00 0.00 H new ATOM 736 N LYS A 138 66.913 1.117 -4.030 1.00 0.00 N ATOM 737 CA LYS A 138 68.322 0.844 -3.753 1.00 0.00 C ATOM 738 C LYS A 138 68.702 1.306 -2.347 1.00 0.00 C ATOM 739 O LYS A 138 69.534 0.689 -1.682 1.00 0.00 O ATOM 740 CB LYS A 138 69.215 1.558 -4.771 1.00 0.00 C ATOM 741 CG LYS A 138 69.220 0.774 -6.085 1.00 0.00 C ATOM 742 CD LYS A 138 70.650 0.347 -6.421 1.00 0.00 C ATOM 743 CE LYS A 138 70.676 -1.151 -6.734 1.00 0.00 C ATOM 744 NZ LYS A 138 69.874 -1.886 -5.716 1.00 0.00 N ATOM 0 H LYS A 138 66.730 1.516 -4.951 1.00 0.00 H new ATOM 0 HA LYS A 138 68.471 -0.233 -3.827 1.00 0.00 H new ATOM 0 HB2 LYS A 138 68.852 2.571 -4.941 1.00 0.00 H new ATOM 0 HB3 LYS A 138 70.230 1.644 -4.383 1.00 0.00 H new ATOM 0 HG2 LYS A 138 68.578 -0.103 -6.000 1.00 0.00 H new ATOM 0 HG3 LYS A 138 68.815 1.389 -6.889 1.00 0.00 H new ATOM 0 HD2 LYS A 138 71.019 0.914 -7.276 1.00 0.00 H new ATOM 0 HD3 LYS A 138 71.312 0.566 -5.583 1.00 0.00 H new ATOM 0 HE2 LYS A 138 70.272 -1.332 -7.730 1.00 0.00 H new ATOM 0 HE3 LYS A 138 71.703 -1.515 -6.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 70.254 -2.847 -5.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 69.924 -1.384 -4.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 68.883 -1.940 -6.028 1.00 0.00 H new ATOM 758 N ASP A 139 68.089 2.401 -1.904 1.00 0.00 N ATOM 759 CA ASP A 139 68.379 2.937 -0.575 1.00 0.00 C ATOM 760 C ASP A 139 67.545 2.228 0.488 1.00 0.00 C ATOM 761 O ASP A 139 67.882 2.242 1.672 1.00 0.00 O ATOM 762 CB ASP A 139 68.080 4.436 -0.522 1.00 0.00 C ATOM 763 CG ASP A 139 68.712 5.036 0.729 1.00 0.00 C ATOM 764 OD1 ASP A 139 69.658 4.450 1.229 1.00 0.00 O ATOM 765 OD2 ASP A 139 68.242 6.072 1.169 1.00 0.00 O ATOM 0 H ASP A 139 67.398 2.929 -2.437 1.00 0.00 H new ATOM 0 HA ASP A 139 69.437 2.770 -0.375 1.00 0.00 H new ATOM 0 HB2 ASP A 139 68.472 4.928 -1.412 1.00 0.00 H new ATOM 0 HB3 ASP A 139 67.003 4.603 -0.514 1.00 0.00 H new ATOM 770 N GLY A 140 66.450 1.610 0.054 1.00 0.00 N ATOM 771 CA GLY A 140 65.574 0.899 0.982 1.00 0.00 C ATOM 772 C GLY A 140 65.951 -0.576 1.064 1.00 0.00 C ATOM 773 O GLY A 140 65.204 -1.394 1.601 1.00 0.00 O ATOM 0 H GLY A 140 66.150 1.586 -0.921 1.00 0.00 H new ATOM 0 HA2 GLY A 140 65.642 1.351 1.971 1.00 0.00 H new ATOM 0 HA3 GLY A 140 64.538 0.996 0.657 1.00 0.00 H new ATOM 777 N ASP A 141 67.122 -0.906 0.526 1.00 0.00 N ATOM 778 CA ASP A 141 67.594 -2.288 0.544 1.00 0.00 C ATOM 779 C ASP A 141 69.035 -2.352 1.040 1.00 0.00 C ATOM 780 O ASP A 141 69.943 -2.742 0.306 1.00 0.00 O ATOM 781 CB ASP A 141 67.523 -2.899 -0.857 1.00 0.00 C ATOM 782 CG ASP A 141 67.464 -4.419 -0.746 1.00 0.00 C ATOM 783 OD1 ASP A 141 67.044 -4.902 0.292 1.00 0.00 O ATOM 784 OD2 ASP A 141 67.839 -5.078 -1.702 1.00 0.00 O ATOM 0 H ASP A 141 67.755 -0.244 0.077 1.00 0.00 H new ATOM 0 HA ASP A 141 66.951 -2.853 1.218 1.00 0.00 H new ATOM 0 HB2 ASP A 141 66.644 -2.528 -1.383 1.00 0.00 H new ATOM 0 HB3 ASP A 141 68.394 -2.600 -1.441 1.00 0.00 H new ATOM 789 N LYS A 142 69.231 -1.964 2.296 1.00 0.00 N ATOM 790 CA LYS A 142 70.565 -1.980 2.889 1.00 0.00 C ATOM 791 C LYS A 142 71.034 -3.416 3.099 1.00 0.00 C ATOM 792 O LYS A 142 72.205 -3.739 2.902 1.00 0.00 O ATOM 793 CB LYS A 142 70.560 -1.257 4.238 1.00 0.00 C ATOM 794 CG LYS A 142 71.259 0.096 4.097 1.00 0.00 C ATOM 795 CD LYS A 142 72.555 0.088 4.911 1.00 0.00 C ATOM 796 CE LYS A 142 73.732 -0.232 3.989 1.00 0.00 C ATOM 797 NZ LYS A 142 74.991 0.298 4.584 1.00 0.00 N ATOM 0 H LYS A 142 68.492 -1.638 2.918 1.00 0.00 H new ATOM 0 HA LYS A 142 71.244 -1.469 2.206 1.00 0.00 H new ATOM 0 HB2 LYS A 142 69.536 -1.114 4.582 1.00 0.00 H new ATOM 0 HB3 LYS A 142 71.067 -1.863 4.989 1.00 0.00 H new ATOM 0 HG2 LYS A 142 71.477 0.297 3.048 1.00 0.00 H new ATOM 0 HG3 LYS A 142 70.603 0.894 4.445 1.00 0.00 H new ATOM 0 HD2 LYS A 142 72.705 1.057 5.387 1.00 0.00 H new ATOM 0 HD3 LYS A 142 72.492 -0.652 5.709 1.00 0.00 H new ATOM 0 HE2 LYS A 142 73.811 -1.309 3.845 1.00 0.00 H new ATOM 0 HE3 LYS A 142 73.568 0.210 3.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 75.791 0.080 3.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 74.913 1.329 4.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 75.149 -0.144 5.512 1.00 0.00 H new ATOM 811 N ASN A 143 70.101 -4.274 3.503 1.00 0.00 N ATOM 812 CA ASN A 143 70.422 -5.679 3.742 1.00 0.00 C ATOM 813 C ASN A 143 70.790 -6.375 2.434 1.00 0.00 C ATOM 814 O ASN A 143 71.431 -7.426 2.433 1.00 0.00 O ATOM 815 CB ASN A 143 69.228 -6.399 4.372 1.00 0.00 C ATOM 816 CG ASN A 143 68.589 -5.502 5.426 1.00 0.00 C ATOM 817 OD1 ASN A 143 67.296 -5.538 5.599 1.00 0.00 O flip ATOM 818 ND2 ASN A 143 69.280 -4.748 6.112 1.00 0.00 N flip ATOM 0 H ASN A 143 69.126 -4.025 3.671 1.00 0.00 H new ATOM 0 HA ASN A 143 71.272 -5.718 4.423 1.00 0.00 H new ATOM 0 HB2 ASN A 143 68.497 -6.653 3.604 1.00 0.00 H new ATOM 0 HB3 ASN A 143 69.553 -7.336 4.825 1.00 0.00 H new ATOM 0 HD21 ASN A 143 70.291 -4.719 5.978 1.00 0.00 H new ATOM 0 HD22 ASN A 143 68.842 -4.152 6.815 1.00 0.00 H new ATOM 825 N ASN A 144 70.377 -5.776 1.320 1.00 0.00 N ATOM 826 CA ASN A 144 70.669 -6.347 0.007 1.00 0.00 C ATOM 827 C ASN A 144 70.082 -7.751 -0.105 1.00 0.00 C ATOM 828 O ASN A 144 70.811 -8.737 -0.212 1.00 0.00 O ATOM 829 CB ASN A 144 72.181 -6.419 -0.222 1.00 0.00 C ATOM 830 CG ASN A 144 72.468 -7.217 -1.490 1.00 0.00 C ATOM 831 OD1 ASN A 144 72.959 -8.422 -1.390 1.00 0.00 O flip ATOM 832 ND2 ASN A 144 72.242 -6.734 -2.599 1.00 0.00 N flip ATOM 0 H ASN A 144 69.845 -4.906 1.298 1.00 0.00 H new ATOM 0 HA ASN A 144 70.218 -5.703 -0.748 1.00 0.00 H new ATOM 0 HB2 ASN A 144 72.594 -5.414 -0.311 1.00 0.00 H new ATOM 0 HB3 ASN A 144 72.667 -6.889 0.633 1.00 0.00 H new ATOM 0 HD21 ASN A 144 71.858 -5.792 -2.676 1.00 0.00 H new ATOM 0 HD22 ASN A 144 72.438 -7.276 -3.441 1.00 0.00 H new ATOM 839 N ASP A 145 68.755 -7.829 -0.079 1.00 0.00 N ATOM 840 CA ASP A 145 68.076 -9.119 -0.179 1.00 0.00 C ATOM 841 C ASP A 145 67.225 -9.178 -1.443 1.00 0.00 C ATOM 842 O ASP A 145 66.956 -10.253 -1.978 1.00 0.00 O ATOM 843 CB ASP A 145 67.177 -9.347 1.037 1.00 0.00 C ATOM 844 CG ASP A 145 67.866 -10.297 2.010 1.00 0.00 C ATOM 845 OD1 ASP A 145 67.941 -11.475 1.703 1.00 0.00 O ATOM 846 OD2 ASP A 145 68.309 -9.832 3.047 1.00 0.00 O ATOM 0 H ASP A 145 68.133 -7.025 0.009 1.00 0.00 H new ATOM 0 HA ASP A 145 68.838 -9.897 -0.218 1.00 0.00 H new ATOM 0 HB2 ASP A 145 66.965 -8.397 1.528 1.00 0.00 H new ATOM 0 HB3 ASP A 145 66.220 -9.764 0.722 1.00 0.00 H new ATOM 851 N GLY A 146 66.801 -8.008 -1.911 1.00 0.00 N ATOM 852 CA GLY A 146 65.975 -7.934 -3.113 1.00 0.00 C ATOM 853 C GLY A 146 64.519 -7.669 -2.748 1.00 0.00 C ATOM 854 O GLY A 146 63.616 -7.849 -3.564 1.00 0.00 O ATOM 0 H GLY A 146 67.012 -7.107 -1.482 1.00 0.00 H new ATOM 0 HA2 GLY A 146 66.342 -7.141 -3.765 1.00 0.00 H new ATOM 0 HA3 GLY A 146 66.052 -8.867 -3.671 1.00 0.00 H new ATOM 858 N ARG A 147 64.303 -7.240 -1.507 1.00 0.00 N ATOM 859 CA ARG A 147 62.952 -6.952 -1.034 1.00 0.00 C ATOM 860 C ARG A 147 62.998 -6.024 0.176 1.00 0.00 C ATOM 861 O ARG A 147 64.050 -5.485 0.523 1.00 0.00 O ATOM 862 CB ARG A 147 62.235 -8.246 -0.643 1.00 0.00 C ATOM 863 CG ARG A 147 63.062 -8.991 0.407 1.00 0.00 C ATOM 864 CD ARG A 147 62.398 -10.332 0.725 1.00 0.00 C ATOM 865 NE ARG A 147 63.300 -11.440 0.420 1.00 0.00 N ATOM 866 CZ ARG A 147 64.342 -11.710 1.202 1.00 0.00 C ATOM 867 NH1 ARG A 147 64.570 -10.984 2.261 1.00 0.00 N ATOM 868 NH2 ARG A 147 65.137 -12.704 0.909 1.00 0.00 N ATOM 0 H ARG A 147 65.038 -7.085 -0.817 1.00 0.00 H new ATOM 0 HA ARG A 147 62.408 -6.466 -1.844 1.00 0.00 H new ATOM 0 HB2 ARG A 147 61.245 -8.020 -0.248 1.00 0.00 H new ATOM 0 HB3 ARG A 147 62.092 -8.875 -1.522 1.00 0.00 H new ATOM 0 HG2 ARG A 147 64.075 -9.153 0.039 1.00 0.00 H new ATOM 0 HG3 ARG A 147 63.145 -8.391 1.313 1.00 0.00 H new ATOM 0 HD2 ARG A 147 62.118 -10.364 1.778 1.00 0.00 H new ATOM 0 HD3 ARG A 147 61.479 -10.435 0.147 1.00 0.00 H new ATOM 0 HE ARG A 147 63.128 -12.015 -0.405 1.00 0.00 H new ATOM 0 HH11 ARG A 147 63.949 -10.208 2.491 1.00 0.00 H new ATOM 0 HH12 ARG A 147 65.369 -11.192 2.860 1.00 0.00 H new ATOM 0 HH21 ARG A 147 64.959 -13.273 0.081 1.00 0.00 H new ATOM 0 HH22 ARG A 147 65.936 -12.912 1.508 1.00 0.00 H new ATOM 882 N ILE A 148 61.845 -5.845 0.814 1.00 0.00 N ATOM 883 CA ILE A 148 61.761 -4.981 1.988 1.00 0.00 C ATOM 884 C ILE A 148 61.359 -5.794 3.215 1.00 0.00 C ATOM 885 O ILE A 148 60.314 -6.445 3.231 1.00 0.00 O ATOM 886 CB ILE A 148 60.733 -3.871 1.764 1.00 0.00 C ATOM 887 CG1 ILE A 148 61.223 -2.940 0.652 1.00 0.00 C ATOM 888 CG2 ILE A 148 60.554 -3.071 3.056 1.00 0.00 C ATOM 889 CD1 ILE A 148 62.411 -2.120 1.158 1.00 0.00 C ATOM 0 H ILE A 148 60.964 -6.281 0.542 1.00 0.00 H new ATOM 0 HA ILE A 148 62.742 -4.535 2.152 1.00 0.00 H new ATOM 0 HB ILE A 148 59.779 -4.313 1.476 1.00 0.00 H new ATOM 0 HG12 ILE A 148 61.516 -3.522 -0.222 1.00 0.00 H new ATOM 0 HG13 ILE A 148 60.417 -2.277 0.338 1.00 0.00 H new ATOM 0 HG21 ILE A 148 59.821 -2.280 2.896 1.00 0.00 H new ATOM 0 HG22 ILE A 148 60.206 -3.733 3.849 1.00 0.00 H new ATOM 0 HG23 ILE A 148 61.507 -2.629 3.345 1.00 0.00 H new ATOM 0 HD11 ILE A 148 62.759 -1.457 0.366 1.00 0.00 H new ATOM 0 HD12 ILE A 148 62.103 -1.526 2.019 1.00 0.00 H new ATOM 0 HD13 ILE A 148 63.218 -2.791 1.451 1.00 0.00 H new ATOM 901 N ASP A 149 62.205 -5.753 4.241 1.00 0.00 N ATOM 902 CA ASP A 149 61.932 -6.493 5.471 1.00 0.00 C ATOM 903 C ASP A 149 61.754 -5.535 6.645 1.00 0.00 C ATOM 904 O ASP A 149 61.932 -4.325 6.511 1.00 0.00 O ATOM 905 CB ASP A 149 63.083 -7.452 5.783 1.00 0.00 C ATOM 906 CG ASP A 149 64.377 -6.660 5.936 1.00 0.00 C ATOM 907 OD1 ASP A 149 64.366 -5.480 5.624 1.00 0.00 O ATOM 908 OD2 ASP A 149 65.359 -7.244 6.362 1.00 0.00 O ATOM 0 H ASP A 149 63.076 -5.222 4.247 1.00 0.00 H new ATOM 0 HA ASP A 149 61.013 -7.060 5.324 1.00 0.00 H new ATOM 0 HB2 ASP A 149 62.872 -8.005 6.698 1.00 0.00 H new ATOM 0 HB3 ASP A 149 63.186 -8.186 4.984 1.00 0.00 H new ATOM 913 N TYR A 150 61.399 -6.095 7.798 1.00 0.00 N ATOM 914 CA TYR A 150 61.196 -5.286 8.997 1.00 0.00 C ATOM 915 C TYR A 150 62.448 -4.475 9.314 1.00 0.00 C ATOM 916 O TYR A 150 62.370 -3.310 9.704 1.00 0.00 O ATOM 917 CB TYR A 150 60.865 -6.178 10.195 1.00 0.00 C ATOM 918 CG TYR A 150 59.413 -6.003 10.569 1.00 0.00 C ATOM 919 CD1 TYR A 150 58.435 -5.938 9.569 1.00 0.00 C ATOM 920 CD2 TYR A 150 59.045 -5.905 11.916 1.00 0.00 C ATOM 921 CE1 TYR A 150 57.089 -5.775 9.917 1.00 0.00 C ATOM 922 CE2 TYR A 150 57.699 -5.743 12.264 1.00 0.00 C ATOM 923 CZ TYR A 150 56.720 -5.678 11.264 1.00 0.00 C ATOM 924 OH TYR A 150 55.393 -5.518 11.606 1.00 0.00 O ATOM 0 H TYR A 150 61.247 -7.095 7.928 1.00 0.00 H new ATOM 0 HA TYR A 150 60.364 -4.609 8.807 1.00 0.00 H new ATOM 0 HB2 TYR A 150 61.065 -7.221 9.951 1.00 0.00 H new ATOM 0 HB3 TYR A 150 61.503 -5.920 11.041 1.00 0.00 H new ATOM 0 HD1 TYR A 150 58.719 -6.014 8.530 1.00 0.00 H new ATOM 0 HD2 TYR A 150 59.800 -5.954 12.687 1.00 0.00 H new ATOM 0 HE1 TYR A 150 56.335 -5.724 9.146 1.00 0.00 H new ATOM 0 HE2 TYR A 150 57.415 -5.668 13.303 1.00 0.00 H new ATOM 0 HH TYR A 150 55.328 -5.247 12.545 1.00 0.00 H new ATOM 934 N ASP A 151 63.607 -5.106 9.142 1.00 0.00 N ATOM 935 CA ASP A 151 64.874 -4.434 9.413 1.00 0.00 C ATOM 936 C ASP A 151 64.967 -3.136 8.617 1.00 0.00 C ATOM 937 O ASP A 151 64.911 -2.041 9.178 1.00 0.00 O ATOM 938 CB ASP A 151 66.053 -5.336 9.038 1.00 0.00 C ATOM 939 CG ASP A 151 67.342 -4.751 9.604 1.00 0.00 C ATOM 940 OD1 ASP A 151 67.408 -4.569 10.809 1.00 0.00 O ATOM 941 OD2 ASP A 151 68.244 -4.494 8.825 1.00 0.00 O ATOM 0 H ASP A 151 63.695 -6.070 8.820 1.00 0.00 H new ATOM 0 HA ASP A 151 64.916 -4.212 10.479 1.00 0.00 H new ATOM 0 HB2 ASP A 151 65.895 -6.341 9.430 1.00 0.00 H new ATOM 0 HB3 ASP A 151 66.127 -5.424 7.954 1.00 0.00 H new ATOM 946 N GLU A 152 65.105 -3.270 7.301 1.00 0.00 N ATOM 947 CA GLU A 152 65.199 -2.101 6.433 1.00 0.00 C ATOM 948 C GLU A 152 64.005 -1.181 6.661 1.00 0.00 C ATOM 949 O GLU A 152 64.157 0.023 6.868 1.00 0.00 O ATOM 950 CB GLU A 152 65.225 -2.528 4.965 1.00 0.00 C ATOM 951 CG GLU A 152 66.650 -2.922 4.569 1.00 0.00 C ATOM 952 CD GLU A 152 66.599 -4.002 3.495 1.00 0.00 C ATOM 953 OE1 GLU A 152 65.518 -4.257 2.990 1.00 0.00 O ATOM 954 OE2 GLU A 152 67.642 -4.559 3.192 1.00 0.00 O ATOM 0 H GLU A 152 65.154 -4.166 6.817 1.00 0.00 H new ATOM 0 HA GLU A 152 66.121 -1.571 6.672 1.00 0.00 H new ATOM 0 HB2 GLU A 152 64.548 -3.368 4.808 1.00 0.00 H new ATOM 0 HB3 GLU A 152 64.873 -1.713 4.333 1.00 0.00 H new ATOM 0 HG2 GLU A 152 67.190 -2.051 4.198 1.00 0.00 H new ATOM 0 HG3 GLU A 152 67.193 -3.286 5.441 1.00 0.00 H new ATOM 961 N PHE A 153 62.812 -1.768 6.623 1.00 0.00 N ATOM 962 CA PHE A 153 61.586 -1.003 6.828 1.00 0.00 C ATOM 963 C PHE A 153 61.662 -0.217 8.133 1.00 0.00 C ATOM 964 O PHE A 153 61.570 1.011 8.144 1.00 0.00 O ATOM 965 CB PHE A 153 60.379 -1.943 6.884 1.00 0.00 C ATOM 966 CG PHE A 153 59.110 -1.157 6.658 1.00 0.00 C ATOM 967 CD1 PHE A 153 58.689 -0.867 5.354 1.00 0.00 C ATOM 968 CD2 PHE A 153 58.352 -0.720 7.751 1.00 0.00 C ATOM 969 CE1 PHE A 153 57.511 -0.140 5.144 1.00 0.00 C ATOM 970 CE2 PHE A 153 57.174 0.006 7.541 1.00 0.00 C ATOM 971 CZ PHE A 153 56.754 0.296 6.238 1.00 0.00 C ATOM 0 H PHE A 153 62.668 -2.764 6.453 1.00 0.00 H new ATOM 0 HA PHE A 153 61.473 -0.311 5.993 1.00 0.00 H new ATOM 0 HB2 PHE A 153 60.476 -2.721 6.126 1.00 0.00 H new ATOM 0 HB3 PHE A 153 60.341 -2.444 7.851 1.00 0.00 H new ATOM 0 HD1 PHE A 153 59.273 -1.204 4.510 1.00 0.00 H new ATOM 0 HD2 PHE A 153 58.676 -0.943 8.757 1.00 0.00 H new ATOM 0 HE1 PHE A 153 57.186 0.084 4.139 1.00 0.00 H new ATOM 0 HE2 PHE A 153 56.589 0.342 8.384 1.00 0.00 H new ATOM 0 HZ PHE A 153 55.845 0.857 6.076 1.00 0.00 H new ATOM 981 N LEU A 154 61.829 -0.943 9.234 1.00 0.00 N ATOM 982 CA LEU A 154 61.914 -0.315 10.550 1.00 0.00 C ATOM 983 C LEU A 154 62.825 0.908 10.507 1.00 0.00 C ATOM 984 O LEU A 154 62.495 1.964 11.046 1.00 0.00 O ATOM 985 CB LEU A 154 62.460 -1.308 11.578 1.00 0.00 C ATOM 986 CG LEU A 154 61.315 -2.168 12.112 1.00 0.00 C ATOM 987 CD1 LEU A 154 61.852 -3.542 12.513 1.00 0.00 C ATOM 988 CD2 LEU A 154 60.695 -1.486 13.333 1.00 0.00 C ATOM 0 H LEU A 154 61.908 -1.960 9.243 1.00 0.00 H new ATOM 0 HA LEU A 154 60.910 -0.004 10.838 1.00 0.00 H new ATOM 0 HB2 LEU A 154 63.221 -1.940 11.121 1.00 0.00 H new ATOM 0 HB3 LEU A 154 62.940 -0.773 12.397 1.00 0.00 H new ATOM 0 HG LEU A 154 60.558 -2.288 11.337 1.00 0.00 H new ATOM 0 HD11 LEU A 154 61.035 -4.155 12.894 1.00 0.00 H new ATOM 0 HD12 LEU A 154 62.295 -4.027 11.643 1.00 0.00 H new ATOM 0 HD13 LEU A 154 62.609 -3.425 13.288 1.00 0.00 H new ATOM 0 HD21 LEU A 154 59.878 -2.098 13.716 1.00 0.00 H new ATOM 0 HD22 LEU A 154 61.453 -1.367 14.107 1.00 0.00 H new ATOM 0 HD23 LEU A 154 60.312 -0.506 13.047 1.00 0.00 H new ATOM 1000 N GLU A 155 63.979 0.751 9.865 1.00 0.00 N ATOM 1001 CA GLU A 155 64.937 1.848 9.763 1.00 0.00 C ATOM 1002 C GLU A 155 64.463 2.887 8.749 1.00 0.00 C ATOM 1003 O GLU A 155 64.128 4.016 9.107 1.00 0.00 O ATOM 1004 CB GLU A 155 66.309 1.323 9.332 1.00 0.00 C ATOM 1005 CG GLU A 155 67.344 2.445 9.445 1.00 0.00 C ATOM 1006 CD GLU A 155 68.566 2.099 8.602 1.00 0.00 C ATOM 1007 OE1 GLU A 155 68.439 1.255 7.731 1.00 0.00 O ATOM 1008 OE2 GLU A 155 69.610 2.684 8.838 1.00 0.00 O ATOM 0 H GLU A 155 64.272 -0.115 9.412 1.00 0.00 H new ATOM 0 HA GLU A 155 65.016 2.313 10.746 1.00 0.00 H new ATOM 0 HB2 GLU A 155 66.601 0.480 9.959 1.00 0.00 H new ATOM 0 HB3 GLU A 155 66.264 0.957 8.306 1.00 0.00 H new ATOM 0 HG2 GLU A 155 66.912 3.387 9.108 1.00 0.00 H new ATOM 0 HG3 GLU A 155 67.635 2.582 10.487 1.00 0.00 H new ATOM 1015 N PHE A 156 64.447 2.493 7.479 1.00 0.00 N ATOM 1016 CA PHE A 156 64.020 3.399 6.415 1.00 0.00 C ATOM 1017 C PHE A 156 62.700 4.074 6.776 1.00 0.00 C ATOM 1018 O PHE A 156 62.650 5.279 7.019 1.00 0.00 O ATOM 1019 CB PHE A 156 63.846 2.638 5.099 1.00 0.00 C ATOM 1020 CG PHE A 156 63.737 3.624 3.960 1.00 0.00 C ATOM 1021 CD1 PHE A 156 62.518 4.261 3.700 1.00 0.00 C ATOM 1022 CD2 PHE A 156 64.855 3.901 3.164 1.00 0.00 C ATOM 1023 CE1 PHE A 156 62.417 5.176 2.645 1.00 0.00 C ATOM 1024 CE2 PHE A 156 64.755 4.816 2.110 1.00 0.00 C ATOM 1025 CZ PHE A 156 63.536 5.453 1.849 1.00 0.00 C ATOM 0 H PHE A 156 64.721 1.563 7.163 1.00 0.00 H new ATOM 0 HA PHE A 156 64.793 4.159 6.297 1.00 0.00 H new ATOM 0 HB2 PHE A 156 64.693 1.971 4.937 1.00 0.00 H new ATOM 0 HB3 PHE A 156 62.953 2.015 5.142 1.00 0.00 H new ATOM 0 HD1 PHE A 156 61.655 4.047 4.313 1.00 0.00 H new ATOM 0 HD2 PHE A 156 65.795 3.408 3.364 1.00 0.00 H new ATOM 0 HE1 PHE A 156 61.477 5.668 2.445 1.00 0.00 H new ATOM 0 HE2 PHE A 156 65.618 5.031 1.498 1.00 0.00 H new ATOM 0 HZ PHE A 156 63.458 6.158 1.034 1.00 0.00 H new ATOM 1035 N MET A 157 61.631 3.283 6.801 1.00 0.00 N ATOM 1036 CA MET A 157 60.310 3.815 7.127 1.00 0.00 C ATOM 1037 C MET A 157 60.065 3.767 8.631 1.00 0.00 C ATOM 1038 O MET A 157 59.237 2.994 9.115 1.00 0.00 O ATOM 1039 CB MET A 157 59.219 3.009 6.421 1.00 0.00 C ATOM 1040 CG MET A 157 57.846 3.471 6.912 1.00 0.00 C ATOM 1041 SD MET A 157 56.618 3.204 5.610 1.00 0.00 S ATOM 1042 CE MET A 157 56.917 4.739 4.700 1.00 0.00 C ATOM 0 H MET A 157 61.651 2.283 6.602 1.00 0.00 H new ATOM 0 HA MET A 157 60.276 4.851 6.788 1.00 0.00 H new ATOM 0 HB2 MET A 157 59.295 3.142 5.342 1.00 0.00 H new ATOM 0 HB3 MET A 157 59.350 1.946 6.622 1.00 0.00 H new ATOM 0 HG2 MET A 157 57.565 2.921 7.810 1.00 0.00 H new ATOM 0 HG3 MET A 157 57.881 4.526 7.183 1.00 0.00 H new ATOM 0 HE1 MET A 157 56.555 4.632 3.677 1.00 0.00 H new ATOM 0 HE2 MET A 157 56.390 5.559 5.187 1.00 0.00 H new ATOM 0 HE3 MET A 157 57.986 4.952 4.686 1.00 0.00 H new ATOM 1052 N LYS A 158 60.791 4.604 9.366 1.00 0.00 N ATOM 1053 CA LYS A 158 60.640 4.650 10.818 1.00 0.00 C ATOM 1054 C LYS A 158 59.315 5.303 11.195 1.00 0.00 C ATOM 1055 O LYS A 158 59.283 6.345 11.848 1.00 0.00 O ATOM 1056 CB LYS A 158 61.781 5.445 11.452 1.00 0.00 C ATOM 1057 CG LYS A 158 62.093 4.867 12.833 1.00 0.00 C ATOM 1058 CD LYS A 158 63.400 4.076 12.771 1.00 0.00 C ATOM 1059 CE LYS A 158 64.517 4.888 13.426 1.00 0.00 C ATOM 1060 NZ LYS A 158 65.347 3.991 14.279 1.00 0.00 N ATOM 0 H LYS A 158 61.481 5.252 8.987 1.00 0.00 H new ATOM 0 HA LYS A 158 60.661 3.625 11.189 1.00 0.00 H new ATOM 0 HB2 LYS A 158 62.667 5.401 10.818 1.00 0.00 H new ATOM 0 HB3 LYS A 158 61.503 6.495 11.539 1.00 0.00 H new ATOM 0 HG2 LYS A 158 62.176 5.670 13.565 1.00 0.00 H new ATOM 0 HG3 LYS A 158 61.279 4.220 13.161 1.00 0.00 H new ATOM 0 HD2 LYS A 158 63.284 3.120 13.281 1.00 0.00 H new ATOM 0 HD3 LYS A 158 63.656 3.855 11.735 1.00 0.00 H new ATOM 0 HE2 LYS A 158 65.137 5.357 12.662 1.00 0.00 H new ATOM 0 HE3 LYS A 158 64.092 5.691 14.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 66.108 4.542 14.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 64.751 3.564 15.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 65.763 3.240 13.692 1.00 0.00 H new ATOM 1074 N GLY A 159 58.219 4.677 10.774 1.00 0.00 N ATOM 1075 CA GLY A 159 56.891 5.206 11.071 1.00 0.00 C ATOM 1076 C GLY A 159 56.753 6.635 10.558 1.00 0.00 C ATOM 1077 O GLY A 159 56.590 7.576 11.334 1.00 0.00 O ATOM 0 H GLY A 159 58.223 3.813 10.232 1.00 0.00 H new ATOM 0 HA2 GLY A 159 56.131 4.574 10.611 1.00 0.00 H new ATOM 0 HA3 GLY A 159 56.717 5.182 12.147 1.00 0.00 H new ATOM 1081 N VAL A 160 56.819 6.784 9.237 1.00 0.00 N ATOM 1082 CA VAL A 160 56.702 8.104 8.623 1.00 0.00 C ATOM 1083 C VAL A 160 55.236 8.449 8.380 1.00 0.00 C ATOM 1084 O VAL A 160 54.613 7.957 7.438 1.00 0.00 O ATOM 1085 CB VAL A 160 57.453 8.143 7.290 1.00 0.00 C ATOM 1086 CG1 VAL A 160 57.470 9.576 6.754 1.00 0.00 C ATOM 1087 CG2 VAL A 160 58.891 7.664 7.502 1.00 0.00 C ATOM 0 H VAL A 160 56.951 6.017 8.578 1.00 0.00 H new ATOM 0 HA VAL A 160 57.138 8.834 9.305 1.00 0.00 H new ATOM 0 HB VAL A 160 56.953 7.492 6.573 1.00 0.00 H new ATOM 0 HG11 VAL A 160 58.005 9.603 5.805 1.00 0.00 H new ATOM 0 HG12 VAL A 160 56.447 9.920 6.604 1.00 0.00 H new ATOM 0 HG13 VAL A 160 57.970 10.227 7.471 1.00 0.00 H new ATOM 0 HG21 VAL A 160 59.427 7.691 6.553 1.00 0.00 H new ATOM 0 HG22 VAL A 160 59.390 8.316 8.219 1.00 0.00 H new ATOM 0 HG23 VAL A 160 58.882 6.643 7.884 1.00 0.00 H new ATOM 1097 N GLU A 161 54.693 9.303 9.243 1.00 0.00 N ATOM 1098 CA GLU A 161 53.297 9.715 9.120 1.00 0.00 C ATOM 1099 C GLU A 161 52.366 8.550 9.445 1.00 0.00 C ATOM 1100 O GLU A 161 52.503 7.515 8.815 1.00 0.00 O ATOM 1101 CB GLU A 161 53.004 10.203 7.701 1.00 0.00 C ATOM 1102 CG GLU A 161 51.729 11.049 7.706 1.00 0.00 C ATOM 1103 CD GLU A 161 52.092 12.520 7.541 1.00 0.00 C ATOM 1104 OE1 GLU A 161 53.247 12.852 7.755 1.00 0.00 O ATOM 1105 OE2 GLU A 161 51.212 13.294 7.202 1.00 0.00 O ATOM 1106 OXT GLU A 161 51.530 8.712 10.319 1.00 0.00 O ATOM 0 H GLU A 161 55.192 9.720 10.028 1.00 0.00 H new ATOM 0 HA GLU A 161 53.125 10.527 9.826 1.00 0.00 H new ATOM 0 HB2 GLU A 161 53.842 10.791 7.327 1.00 0.00 H new ATOM 0 HB3 GLU A 161 52.886 9.353 7.029 1.00 0.00 H new ATOM 0 HG2 GLU A 161 51.068 10.734 6.898 1.00 0.00 H new ATOM 0 HG3 GLU A 161 51.185 10.900 8.639 1.00 0.00 H new