USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 693 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 150 HIS : no HD1:sc= -0.018 X(o=-0.034,f=-0.0091) USER MOD Set 1.2: A 151 SER OG : rot 180:sc= -0.0156 USER MOD Set 2.1: A 130 HIS :FLIP no HD1:sc= -0.145 F(o=-0.92,f=0.3) USER MOD Set 2.2: A 131 THR OG1 : rot 67:sc= 0.44 USER MOD Single : A 59 MET CE :methyl 156:sc= -0.143 (180deg=-1.25) USER MOD Single : A 69 CYS SG : rot 180:sc= -0.037 USER MOD Single : A 70 TYR OH : rot 179:sc= 1.19 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 149:sc= 0.00179 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0174) USER MOD Single : A 83 GLN : amide:sc= 0.322 K(o=0.32,f=-2) USER MOD Single : A 88 ASN : amide:sc=-3.22e-05 K(o=-3.2e-05,f=-1.3) USER MOD Single : A 89 LYS NZ :NH3+ -113:sc=0.000683 (180deg=-0.257) USER MOD Single : A 91 HIS :FLIP no HD1:sc= -0.369 F(o=-1.2,f=-0.37) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 42:sc= 0.36 USER MOD Single : A 96 SER OG : rot 180:sc=-0.00723 USER MOD Single : A 99 THR OG1 : rot -81:sc= 1.21 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 105 LYS NZ :NH3+ 175:sc= 1.3 (180deg=1.23) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.425 USER MOD Single : A 107 SER OG : rot 74:sc= 1.12 USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 165:sc= 0 USER MOD Single : A 118 GLN : amide:sc= -0.026 X(o=-0.026,f=-0.026) USER MOD Single : A 119 TYR OH : rot -42:sc= 0.00546 USER MOD Single : A 122 GLN : amide:sc= -0.524 X(o=-0.52,f=-0.49) USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 MET CE :methyl 143:sc= -0.33 (180deg=-2.5!) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 CYS SG : rot 180:sc= -0.557 USER MOD Single : A 143 GLN : amide:sc= 0.0589 K(o=0.059,f=-2.9!) USER MOD Single : A 145 GLN :FLIP amide:sc=-0.00281 F(o=-3!,f=-0.0028) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 59 -2.442 14.158 1.909 1.00 0.00 N ATOM 2 CA MET A 59 -2.621 12.758 2.255 1.00 0.00 C ATOM 3 C MET A 59 -1.276 12.051 2.396 1.00 0.00 C ATOM 4 O MET A 59 -0.217 12.656 2.250 1.00 0.00 O ATOM 5 CB MET A 59 -3.553 12.084 1.247 1.00 0.00 C ATOM 6 CG MET A 59 -2.986 11.964 -0.176 1.00 0.00 C ATOM 7 SD MET A 59 -2.191 10.387 -0.578 1.00 0.00 S ATOM 8 CE MET A 59 -3.638 9.301 -0.493 1.00 0.00 C ATOM 0 HA MET A 59 -3.100 12.686 3.231 1.00 0.00 H new ATOM 0 HB2 MET A 59 -3.798 11.086 1.611 1.00 0.00 H new ATOM 0 HB3 MET A 59 -4.486 12.645 1.205 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.797 12.132 -0.885 1.00 0.00 H new ATOM 0 HG3 MET A 59 -2.261 12.764 -0.326 1.00 0.00 H new ATOM 0 HE1 MET A 59 -3.463 8.413 -1.100 1.00 0.00 H new ATOM 0 HE2 MET A 59 -3.810 9.005 0.542 1.00 0.00 H new ATOM 0 HE3 MET A 59 -4.513 9.831 -0.869 1.00 0.00 H new ATOM 18 N ALA A 60 -1.351 10.762 2.711 1.00 0.00 N ATOM 19 CA ALA A 60 -0.225 9.932 3.114 1.00 0.00 C ATOM 20 C ALA A 60 -0.322 8.498 2.600 1.00 0.00 C ATOM 21 O ALA A 60 0.334 7.601 3.127 1.00 0.00 O ATOM 22 CB ALA A 60 -0.180 9.968 4.641 1.00 0.00 C ATOM 0 H ALA A 60 -2.232 10.249 2.691 1.00 0.00 H new ATOM 0 HA ALA A 60 0.692 10.325 2.676 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.651 9.358 4.995 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -0.044 10.996 4.977 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -1.115 9.576 5.042 1.00 0.00 H new ATOM 28 N GLY A 61 -1.185 8.221 1.626 1.00 0.00 N ATOM 29 CA GLY A 61 -1.442 6.897 1.065 1.00 0.00 C ATOM 30 C GLY A 61 -2.310 6.047 1.996 1.00 0.00 C ATOM 31 O GLY A 61 -3.226 5.346 1.566 1.00 0.00 O ATOM 0 H GLY A 61 -1.750 8.947 1.186 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -1.937 7.001 0.100 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -0.495 6.388 0.885 1.00 0.00 H new ATOM 35 N GLY A 62 -2.041 6.167 3.290 1.00 0.00 N ATOM 36 CA GLY A 62 -2.444 5.304 4.370 1.00 0.00 C ATOM 37 C GLY A 62 -1.303 5.140 5.352 1.00 0.00 C ATOM 38 O GLY A 62 -1.595 4.857 6.510 1.00 0.00 O ATOM 0 H GLY A 62 -1.481 6.948 3.632 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.314 5.723 4.876 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -2.741 4.331 3.978 1.00 0.00 H new ATOM 42 N ALA A 63 -0.050 5.332 4.916 1.00 0.00 N ATOM 43 CA ALA A 63 1.194 4.924 5.593 1.00 0.00 C ATOM 44 C ALA A 63 2.404 4.945 4.641 1.00 0.00 C ATOM 45 O ALA A 63 3.390 4.248 4.865 1.00 0.00 O ATOM 46 CB ALA A 63 1.030 3.524 6.210 1.00 0.00 C ATOM 0 H ALA A 63 0.136 5.803 4.031 1.00 0.00 H new ATOM 0 HA ALA A 63 1.387 5.648 6.384 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.956 3.235 6.707 1.00 0.00 H new ATOM 0 HB2 ALA A 63 0.218 3.540 6.937 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.800 2.805 5.424 1.00 0.00 H new ATOM 52 N TRP A 64 2.322 5.664 3.525 1.00 0.00 N ATOM 53 CA TRP A 64 3.383 5.711 2.537 1.00 0.00 C ATOM 54 C TRP A 64 3.250 7.008 1.749 1.00 0.00 C ATOM 55 O TRP A 64 4.035 7.928 1.958 1.00 0.00 O ATOM 56 CB TRP A 64 3.365 4.447 1.652 1.00 0.00 C ATOM 57 CG TRP A 64 2.022 3.879 1.281 1.00 0.00 C ATOM 58 CD1 TRP A 64 1.324 2.982 2.013 1.00 0.00 C ATOM 59 CD2 TRP A 64 1.205 4.140 0.100 1.00 0.00 C ATOM 60 NE1 TRP A 64 0.113 2.726 1.404 1.00 0.00 N ATOM 61 CE2 TRP A 64 -0.039 3.465 0.253 1.00 0.00 C ATOM 62 CE3 TRP A 64 1.373 4.910 -1.069 1.00 0.00 C ATOM 63 CZ2 TRP A 64 -1.094 3.620 -0.657 1.00 0.00 C ATOM 64 CZ3 TRP A 64 0.320 5.083 -1.986 1.00 0.00 C ATOM 65 CH2 TRP A 64 -0.925 4.466 -1.767 1.00 0.00 C ATOM 0 H TRP A 64 1.510 6.232 3.284 1.00 0.00 H new ATOM 0 HA TRP A 64 4.361 5.711 3.019 1.00 0.00 H new ATOM 0 HB2 TRP A 64 3.901 4.674 0.730 1.00 0.00 H new ATOM 0 HB3 TRP A 64 3.929 3.669 2.165 1.00 0.00 H new ATOM 0 HD1 TRP A 64 1.663 2.534 2.935 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -0.582 2.071 1.762 1.00 0.00 H new ATOM 0 HE3 TRP A 64 2.328 5.376 -1.264 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -2.026 3.095 -0.507 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 0.469 5.694 -2.864 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -1.746 4.641 -2.447 1.00 0.00 H new ATOM 76 N GLY A 65 2.246 7.089 0.871 1.00 0.00 N ATOM 77 CA GLY A 65 1.954 8.214 -0.009 1.00 0.00 C ATOM 78 C GLY A 65 3.208 8.645 -0.756 1.00 0.00 C ATOM 79 O GLY A 65 3.623 7.957 -1.689 1.00 0.00 O ATOM 0 H GLY A 65 1.580 6.326 0.752 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.177 7.935 -0.721 1.00 0.00 H new ATOM 0 HA3 GLY A 65 1.566 9.049 0.575 1.00 0.00 H new ATOM 83 N ARG A 66 3.853 9.713 -0.275 1.00 0.00 N ATOM 84 CA ARG A 66 5.134 10.240 -0.741 1.00 0.00 C ATOM 85 C ARG A 66 6.136 9.148 -1.078 1.00 0.00 C ATOM 86 O ARG A 66 6.833 9.285 -2.081 1.00 0.00 O ATOM 87 CB ARG A 66 5.791 11.141 0.319 1.00 0.00 C ATOM 88 CG ARG A 66 4.941 12.288 0.878 1.00 0.00 C ATOM 89 CD ARG A 66 4.304 11.946 2.234 1.00 0.00 C ATOM 90 NE ARG A 66 3.990 13.164 2.997 1.00 0.00 N ATOM 91 CZ ARG A 66 4.081 13.327 4.321 1.00 0.00 C ATOM 92 NH1 ARG A 66 4.254 12.284 5.126 1.00 0.00 N ATOM 93 NH2 ARG A 66 4.024 14.539 4.860 1.00 0.00 N ATOM 0 H ARG A 66 3.470 10.262 0.494 1.00 0.00 H new ATOM 0 HA ARG A 66 4.894 10.805 -1.641 1.00 0.00 H new ATOM 0 HB2 ARG A 66 6.102 10.512 1.153 1.00 0.00 H new ATOM 0 HB3 ARG A 66 6.696 11.569 -0.113 1.00 0.00 H new ATOM 0 HG2 ARG A 66 5.563 13.176 0.987 1.00 0.00 H new ATOM 0 HG3 ARG A 66 4.155 12.535 0.164 1.00 0.00 H new ATOM 0 HD2 ARG A 66 3.393 11.368 2.076 1.00 0.00 H new ATOM 0 HD3 ARG A 66 4.984 11.318 2.810 1.00 0.00 H new ATOM 0 HE ARG A 66 3.669 13.969 2.459 1.00 0.00 H new ATOM 0 HH11 ARG A 66 4.319 11.344 4.736 1.00 0.00 H new ATOM 0 HH12 ARG A 66 4.322 12.424 6.134 1.00 0.00 H new ATOM 0 HH21 ARG A 66 3.910 15.358 4.263 1.00 0.00 H new ATOM 0 HH22 ARG A 66 4.094 14.651 5.871 1.00 0.00 H new ATOM 107 N LEU A 67 6.228 8.083 -0.264 1.00 0.00 N ATOM 108 CA LEU A 67 7.186 6.996 -0.482 1.00 0.00 C ATOM 109 C LEU A 67 7.104 6.481 -1.916 1.00 0.00 C ATOM 110 O LEU A 67 8.141 6.284 -2.540 1.00 0.00 O ATOM 111 CB LEU A 67 7.007 5.827 0.501 1.00 0.00 C ATOM 112 CG LEU A 67 7.134 6.161 2.001 1.00 0.00 C ATOM 113 CD1 LEU A 67 7.200 4.857 2.803 1.00 0.00 C ATOM 114 CD2 LEU A 67 8.352 7.029 2.311 1.00 0.00 C ATOM 0 H LEU A 67 5.641 7.955 0.560 1.00 0.00 H new ATOM 0 HA LEU A 67 8.173 7.422 -0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.024 5.387 0.332 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.745 5.062 0.259 1.00 0.00 H new ATOM 0 HG LEU A 67 6.256 6.740 2.287 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.290 5.087 3.865 1.00 0.00 H new ATOM 0 HD12 LEU A 67 6.292 4.279 2.633 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.065 4.276 2.483 1.00 0.00 H new ATOM 0 HD21 LEU A 67 8.391 7.233 3.381 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.259 6.505 2.008 1.00 0.00 H new ATOM 0 HD23 LEU A 67 8.277 7.970 1.765 1.00 0.00 H new ATOM 126 N ALA A 68 5.897 6.325 -2.471 1.00 0.00 N ATOM 127 CA ALA A 68 5.716 5.801 -3.817 1.00 0.00 C ATOM 128 C ALA A 68 6.384 6.674 -4.890 1.00 0.00 C ATOM 129 O ALA A 68 6.717 6.136 -5.938 1.00 0.00 O ATOM 130 CB ALA A 68 4.225 5.596 -4.116 1.00 0.00 C ATOM 0 H ALA A 68 5.025 6.559 -1.997 1.00 0.00 H new ATOM 0 HA ALA A 68 6.218 4.834 -3.855 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.107 5.204 -5.126 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.804 4.889 -3.401 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.703 6.549 -4.034 1.00 0.00 H new ATOM 136 N CYS A 69 6.629 7.971 -4.645 1.00 0.00 N ATOM 137 CA CYS A 69 7.387 8.814 -5.568 1.00 0.00 C ATOM 138 C CYS A 69 8.846 8.344 -5.612 1.00 0.00 C ATOM 139 O CYS A 69 9.396 8.108 -6.687 1.00 0.00 O ATOM 140 CB CYS A 69 7.267 10.291 -5.161 1.00 0.00 C ATOM 141 SG CYS A 69 8.104 11.356 -6.373 1.00 0.00 S ATOM 0 H CYS A 69 6.308 8.457 -3.807 1.00 0.00 H new ATOM 0 HA CYS A 69 6.976 8.724 -6.573 1.00 0.00 H new ATOM 0 HB2 CYS A 69 6.216 10.570 -5.088 1.00 0.00 H new ATOM 0 HB3 CYS A 69 7.705 10.439 -4.174 1.00 0.00 H new ATOM 0 HG CYS A 69 7.989 12.599 -6.011 1.00 0.00 H new ATOM 147 N TYR A 70 9.473 8.172 -4.441 1.00 0.00 N ATOM 148 CA TYR A 70 10.828 7.636 -4.344 1.00 0.00 C ATOM 149 C TYR A 70 10.885 6.273 -5.045 1.00 0.00 C ATOM 150 O TYR A 70 11.820 5.997 -5.795 1.00 0.00 O ATOM 151 CB TYR A 70 11.277 7.490 -2.877 1.00 0.00 C ATOM 152 CG TYR A 70 11.369 8.751 -2.028 1.00 0.00 C ATOM 153 CD1 TYR A 70 10.209 9.327 -1.478 1.00 0.00 C ATOM 154 CD2 TYR A 70 12.625 9.294 -1.694 1.00 0.00 C ATOM 155 CE1 TYR A 70 10.291 10.432 -0.611 1.00 0.00 C ATOM 156 CE2 TYR A 70 12.717 10.397 -0.827 1.00 0.00 C ATOM 157 CZ TYR A 70 11.551 10.974 -0.271 1.00 0.00 C ATOM 158 OH TYR A 70 11.627 12.027 0.594 1.00 0.00 O ATOM 0 H TYR A 70 9.053 8.401 -3.540 1.00 0.00 H new ATOM 0 HA TYR A 70 11.508 8.335 -4.830 1.00 0.00 H new ATOM 0 HB2 TYR A 70 10.588 6.805 -2.384 1.00 0.00 H new ATOM 0 HB3 TYR A 70 12.257 7.013 -2.874 1.00 0.00 H new ATOM 0 HD1 TYR A 70 9.242 8.915 -1.725 1.00 0.00 H new ATOM 0 HD2 TYR A 70 13.524 8.860 -2.107 1.00 0.00 H new ATOM 0 HE1 TYR A 70 9.390 10.867 -0.205 1.00 0.00 H new ATOM 0 HE2 TYR A 70 13.686 10.807 -0.583 1.00 0.00 H new ATOM 0 HH TYR A 70 12.567 12.268 0.735 1.00 0.00 H new ATOM 168 N LEU A 71 9.872 5.428 -4.819 1.00 0.00 N ATOM 169 CA LEU A 71 9.787 4.083 -5.380 1.00 0.00 C ATOM 170 C LEU A 71 9.297 4.068 -6.844 1.00 0.00 C ATOM 171 O LEU A 71 8.995 2.989 -7.356 1.00 0.00 O ATOM 172 CB LEU A 71 8.922 3.162 -4.490 1.00 0.00 C ATOM 173 CG LEU A 71 9.262 3.108 -2.985 1.00 0.00 C ATOM 174 CD1 LEU A 71 8.335 2.121 -2.266 1.00 0.00 C ATOM 175 CD2 LEU A 71 10.714 2.734 -2.699 1.00 0.00 C ATOM 0 H LEU A 71 9.075 5.669 -4.229 1.00 0.00 H new ATOM 0 HA LEU A 71 10.804 3.691 -5.395 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.883 3.476 -4.590 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.989 2.149 -4.887 1.00 0.00 H new ATOM 0 HG LEU A 71 9.112 4.120 -2.608 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.586 2.093 -1.206 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.300 2.441 -2.386 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.459 1.127 -2.695 1.00 0.00 H new ATOM 0 HD21 LEU A 71 10.880 2.716 -1.622 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.925 1.749 -3.115 1.00 0.00 H new ATOM 0 HD23 LEU A 71 11.376 3.470 -3.155 1.00 0.00 H new ATOM 187 N GLU A 72 9.178 5.207 -7.538 1.00 0.00 N ATOM 188 CA GLU A 72 8.811 5.232 -8.962 1.00 0.00 C ATOM 189 C GLU A 72 9.818 5.971 -9.829 1.00 0.00 C ATOM 190 O GLU A 72 9.691 5.953 -11.052 1.00 0.00 O ATOM 191 CB GLU A 72 7.380 5.753 -9.174 1.00 0.00 C ATOM 192 CG GLU A 72 7.200 7.282 -9.164 1.00 0.00 C ATOM 193 CD GLU A 72 6.474 7.767 -10.416 1.00 0.00 C ATOM 194 OE1 GLU A 72 7.061 7.809 -11.521 1.00 0.00 O ATOM 195 OE2 GLU A 72 5.263 8.081 -10.318 1.00 0.00 O ATOM 0 H GLU A 72 9.332 6.131 -7.134 1.00 0.00 H new ATOM 0 HA GLU A 72 8.835 4.195 -9.296 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.016 5.372 -10.128 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.743 5.329 -8.397 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.638 7.578 -8.278 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.175 7.764 -9.098 1.00 0.00 H new ATOM 202 N PHE A 73 10.835 6.596 -9.232 1.00 0.00 N ATOM 203 CA PHE A 73 11.944 7.140 -10.008 1.00 0.00 C ATOM 204 C PHE A 73 12.578 6.008 -10.837 1.00 0.00 C ATOM 205 O PHE A 73 12.940 6.199 -12.002 1.00 0.00 O ATOM 206 CB PHE A 73 12.944 7.829 -9.056 1.00 0.00 C ATOM 207 CG PHE A 73 14.322 7.192 -9.016 1.00 0.00 C ATOM 208 CD1 PHE A 73 15.199 7.341 -10.106 1.00 0.00 C ATOM 209 CD2 PHE A 73 14.660 6.319 -7.970 1.00 0.00 C ATOM 210 CE1 PHE A 73 16.378 6.580 -10.177 1.00 0.00 C ATOM 211 CE2 PHE A 73 15.852 5.581 -8.026 1.00 0.00 C ATOM 212 CZ PHE A 73 16.705 5.699 -9.133 1.00 0.00 C ATOM 0 H PHE A 73 10.911 6.736 -8.224 1.00 0.00 H new ATOM 0 HA PHE A 73 11.600 7.900 -10.709 1.00 0.00 H new ATOM 0 HB2 PHE A 73 13.049 8.872 -9.354 1.00 0.00 H new ATOM 0 HB3 PHE A 73 12.527 7.826 -8.049 1.00 0.00 H new ATOM 0 HD1 PHE A 73 14.965 8.044 -10.892 1.00 0.00 H new ATOM 0 HD2 PHE A 73 14.001 6.215 -7.120 1.00 0.00 H new ATOM 0 HE1 PHE A 73 17.031 6.672 -11.032 1.00 0.00 H new ATOM 0 HE2 PHE A 73 16.114 4.919 -7.213 1.00 0.00 H new ATOM 0 HZ PHE A 73 17.611 5.114 -9.183 1.00 0.00 H new ATOM 222 N LEU A 74 12.700 4.839 -10.203 1.00 0.00 N ATOM 223 CA LEU A 74 13.237 3.607 -10.744 1.00 0.00 C ATOM 224 C LEU A 74 12.113 2.721 -11.274 1.00 0.00 C ATOM 225 O LEU A 74 10.926 2.902 -10.975 1.00 0.00 O ATOM 226 CB LEU A 74 14.116 2.881 -9.696 1.00 0.00 C ATOM 227 CG LEU A 74 13.688 2.929 -8.213 1.00 0.00 C ATOM 228 CD1 LEU A 74 12.318 2.337 -7.899 1.00 0.00 C ATOM 229 CD2 LEU A 74 14.725 2.210 -7.347 1.00 0.00 C ATOM 0 H LEU A 74 12.404 4.731 -9.233 1.00 0.00 H new ATOM 0 HA LEU A 74 13.885 3.846 -11.588 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.182 1.833 -9.988 1.00 0.00 H new ATOM 0 HB3 LEU A 74 15.122 3.295 -9.764 1.00 0.00 H new ATOM 0 HG LEU A 74 13.620 3.993 -7.987 1.00 0.00 H new ATOM 0 HD11 LEU A 74 12.120 2.424 -6.831 1.00 0.00 H new ATOM 0 HD12 LEU A 74 11.552 2.878 -8.455 1.00 0.00 H new ATOM 0 HD13 LEU A 74 12.301 1.286 -8.187 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.416 2.248 -6.302 1.00 0.00 H new ATOM 0 HD22 LEU A 74 14.806 1.170 -7.664 1.00 0.00 H new ATOM 0 HD23 LEU A 74 15.693 2.699 -7.457 1.00 0.00 H new ATOM 241 N LYS A 75 12.511 1.715 -12.044 1.00 0.00 N ATOM 242 CA LYS A 75 11.649 0.678 -12.608 1.00 0.00 C ATOM 243 C LYS A 75 12.227 -0.682 -12.250 1.00 0.00 C ATOM 244 O LYS A 75 13.167 -0.740 -11.467 1.00 0.00 O ATOM 245 CB LYS A 75 11.500 0.925 -14.118 1.00 0.00 C ATOM 246 CG LYS A 75 10.274 1.806 -14.386 1.00 0.00 C ATOM 247 CD LYS A 75 10.152 2.080 -15.884 1.00 0.00 C ATOM 248 CE LYS A 75 8.695 2.325 -16.267 1.00 0.00 C ATOM 249 NZ LYS A 75 8.535 2.418 -17.729 1.00 0.00 N ATOM 0 H LYS A 75 13.489 1.593 -12.306 1.00 0.00 H new ATOM 0 HA LYS A 75 10.642 0.706 -12.192 1.00 0.00 H new ATOM 0 HB2 LYS A 75 12.397 1.408 -14.506 1.00 0.00 H new ATOM 0 HB3 LYS A 75 11.397 -0.025 -14.642 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.373 1.312 -14.023 1.00 0.00 H new ATOM 0 HG3 LYS A 75 10.364 2.746 -13.841 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.755 2.948 -16.151 1.00 0.00 H new ATOM 0 HD3 LYS A 75 10.545 1.234 -16.447 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.074 1.516 -15.882 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.344 3.246 -15.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 7.535 2.585 -17.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 9.109 3.205 -18.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 8.848 1.530 -18.170 1.00 0.00 H new ATOM 263 N LYS A 76 11.689 -1.775 -12.809 1.00 0.00 N ATOM 264 CA LYS A 76 12.057 -3.181 -12.538 1.00 0.00 C ATOM 265 C LYS A 76 13.571 -3.420 -12.560 1.00 0.00 C ATOM 266 O LYS A 76 14.048 -4.388 -11.980 1.00 0.00 O ATOM 267 CB LYS A 76 11.400 -4.112 -13.579 1.00 0.00 C ATOM 268 CG LYS A 76 9.907 -4.423 -13.413 1.00 0.00 C ATOM 269 CD LYS A 76 9.034 -3.171 -13.390 1.00 0.00 C ATOM 270 CE LYS A 76 7.553 -3.516 -13.538 1.00 0.00 C ATOM 271 NZ LYS A 76 6.732 -2.293 -13.478 1.00 0.00 N ATOM 0 H LYS A 76 10.944 -1.703 -13.501 1.00 0.00 H new ATOM 0 HA LYS A 76 11.696 -3.402 -11.533 1.00 0.00 H new ATOM 0 HB2 LYS A 76 11.543 -3.668 -14.564 1.00 0.00 H new ATOM 0 HB3 LYS A 76 11.943 -5.057 -13.574 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.584 -5.069 -14.229 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.758 -4.979 -12.488 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.191 -2.634 -12.455 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.335 -2.502 -14.196 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.385 -4.028 -14.485 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.252 -4.203 -12.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.882 -2.416 -14.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.450 -2.112 -12.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.284 -1.487 -13.834 1.00 0.00 H new ATOM 285 N GLU A 77 14.294 -2.549 -13.256 1.00 0.00 N ATOM 286 CA GLU A 77 15.728 -2.322 -13.227 1.00 0.00 C ATOM 287 C GLU A 77 16.258 -2.448 -11.796 1.00 0.00 C ATOM 288 O GLU A 77 16.999 -3.389 -11.530 1.00 0.00 O ATOM 289 CB GLU A 77 15.995 -0.940 -13.866 1.00 0.00 C ATOM 290 CG GLU A 77 15.344 -0.869 -15.258 1.00 0.00 C ATOM 291 CD GLU A 77 15.642 0.401 -16.042 1.00 0.00 C ATOM 292 OE1 GLU A 77 16.753 0.521 -16.601 1.00 0.00 O ATOM 293 OE2 GLU A 77 14.692 1.195 -16.242 1.00 0.00 O ATOM 0 H GLU A 77 13.840 -1.923 -13.921 1.00 0.00 H new ATOM 0 HA GLU A 77 16.266 -3.075 -13.803 1.00 0.00 H new ATOM 0 HB2 GLU A 77 15.595 -0.152 -13.228 1.00 0.00 H new ATOM 0 HB3 GLU A 77 17.068 -0.770 -13.948 1.00 0.00 H new ATOM 0 HG2 GLU A 77 15.678 -1.726 -15.843 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.264 -0.962 -15.143 1.00 0.00 H new ATOM 300 N GLU A 78 15.829 -1.564 -10.889 1.00 0.00 N ATOM 301 CA GLU A 78 16.371 -1.401 -9.544 1.00 0.00 C ATOM 302 C GLU A 78 15.267 -1.542 -8.490 1.00 0.00 C ATOM 303 O GLU A 78 15.528 -1.896 -7.347 1.00 0.00 O ATOM 304 CB GLU A 78 17.044 -0.020 -9.440 1.00 0.00 C ATOM 305 CG GLU A 78 18.081 0.224 -10.543 1.00 0.00 C ATOM 306 CD GLU A 78 18.865 1.520 -10.351 1.00 0.00 C ATOM 307 OE1 GLU A 78 18.242 2.602 -10.495 1.00 0.00 O ATOM 308 OE2 GLU A 78 20.102 1.459 -10.134 1.00 0.00 O ATOM 0 H GLU A 78 15.064 -0.918 -11.084 1.00 0.00 H new ATOM 0 HA GLU A 78 17.108 -2.182 -9.356 1.00 0.00 H new ATOM 0 HB2 GLU A 78 16.280 0.756 -9.489 1.00 0.00 H new ATOM 0 HB3 GLU A 78 17.528 0.070 -8.467 1.00 0.00 H new ATOM 0 HG2 GLU A 78 18.777 -0.614 -10.571 1.00 0.00 H new ATOM 0 HG3 GLU A 78 17.576 0.251 -11.509 1.00 0.00 H new ATOM 315 N LEU A 79 14.004 -1.328 -8.875 1.00 0.00 N ATOM 316 CA LEU A 79 12.827 -1.568 -8.046 1.00 0.00 C ATOM 317 C LEU A 79 12.779 -3.018 -7.587 1.00 0.00 C ATOM 318 O LEU A 79 12.451 -3.304 -6.433 1.00 0.00 O ATOM 319 CB LEU A 79 11.562 -1.269 -8.864 1.00 0.00 C ATOM 320 CG LEU A 79 10.244 -1.479 -8.103 1.00 0.00 C ATOM 321 CD1 LEU A 79 10.138 -0.687 -6.796 1.00 0.00 C ATOM 322 CD2 LEU A 79 9.116 -1.072 -9.046 1.00 0.00 C ATOM 0 H LEU A 79 13.770 -0.972 -9.802 1.00 0.00 H new ATOM 0 HA LEU A 79 12.880 -0.919 -7.172 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.605 -0.237 -9.211 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.560 -1.904 -9.750 1.00 0.00 H new ATOM 0 HG LEU A 79 10.188 -2.526 -7.807 1.00 0.00 H new ATOM 0 HD11 LEU A 79 9.178 -0.893 -6.323 1.00 0.00 H new ATOM 0 HD12 LEU A 79 10.944 -0.983 -6.125 1.00 0.00 H new ATOM 0 HD13 LEU A 79 10.216 0.379 -7.009 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.157 -1.205 -8.545 1.00 0.00 H new ATOM 0 HD22 LEU A 79 9.236 -0.026 -9.327 1.00 0.00 H new ATOM 0 HD23 LEU A 79 9.148 -1.694 -9.941 1.00 0.00 H new ATOM 334 N LYS A 80 13.067 -3.937 -8.512 1.00 0.00 N ATOM 335 CA LYS A 80 13.075 -5.350 -8.190 1.00 0.00 C ATOM 336 C LYS A 80 14.163 -5.618 -7.168 1.00 0.00 C ATOM 337 O LYS A 80 13.844 -6.175 -6.117 1.00 0.00 O ATOM 338 CB LYS A 80 13.214 -6.226 -9.442 1.00 0.00 C ATOM 339 CG LYS A 80 13.154 -7.719 -9.103 1.00 0.00 C ATOM 340 CD LYS A 80 11.761 -8.172 -8.663 1.00 0.00 C ATOM 341 CE LYS A 80 11.851 -9.504 -7.934 1.00 0.00 C ATOM 342 NZ LYS A 80 12.280 -10.583 -8.837 1.00 0.00 N ATOM 0 H LYS A 80 13.295 -3.721 -9.482 1.00 0.00 H new ATOM 0 HA LYS A 80 12.114 -5.622 -7.754 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.419 -5.981 -10.147 1.00 0.00 H new ATOM 0 HB3 LYS A 80 14.159 -6.004 -9.938 1.00 0.00 H new ATOM 0 HG2 LYS A 80 13.461 -8.297 -9.975 1.00 0.00 H new ATOM 0 HG3 LYS A 80 13.869 -7.936 -8.309 1.00 0.00 H new ATOM 0 HD2 LYS A 80 11.315 -7.421 -8.011 1.00 0.00 H new ATOM 0 HD3 LYS A 80 11.110 -8.267 -9.532 1.00 0.00 H new ATOM 0 HE2 LYS A 80 12.554 -9.420 -7.105 1.00 0.00 H new ATOM 0 HE3 LYS A 80 10.880 -9.752 -7.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 12.217 -11.495 -8.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 11.664 -10.601 -9.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 13.263 -10.417 -9.134 1.00 0.00 H new ATOM 356 N GLU A 81 15.405 -5.221 -7.457 1.00 0.00 N ATOM 357 CA GLU A 81 16.514 -5.465 -6.550 1.00 0.00 C ATOM 358 C GLU A 81 16.214 -4.833 -5.189 1.00 0.00 C ATOM 359 O GLU A 81 16.360 -5.529 -4.193 1.00 0.00 O ATOM 360 CB GLU A 81 17.871 -5.114 -7.198 1.00 0.00 C ATOM 361 CG GLU A 81 18.830 -4.311 -6.312 1.00 0.00 C ATOM 362 CD GLU A 81 20.230 -4.123 -6.914 1.00 0.00 C ATOM 363 OE1 GLU A 81 20.601 -4.812 -7.890 1.00 0.00 O ATOM 364 OE2 GLU A 81 20.980 -3.241 -6.440 1.00 0.00 O ATOM 0 H GLU A 81 15.661 -4.730 -8.313 1.00 0.00 H new ATOM 0 HA GLU A 81 16.620 -6.531 -6.346 1.00 0.00 H new ATOM 0 HB2 GLU A 81 18.364 -6.040 -7.494 1.00 0.00 H new ATOM 0 HB3 GLU A 81 17.684 -4.547 -8.110 1.00 0.00 H new ATOM 0 HG2 GLU A 81 18.394 -3.331 -6.119 1.00 0.00 H new ATOM 0 HG3 GLU A 81 18.925 -4.813 -5.349 1.00 0.00 H new ATOM 371 N PHE A 82 15.663 -3.615 -5.116 1.00 0.00 N ATOM 372 CA PHE A 82 15.228 -3.011 -3.859 1.00 0.00 C ATOM 373 C PHE A 82 14.359 -3.979 -3.073 1.00 0.00 C ATOM 374 O PHE A 82 14.696 -4.356 -1.950 1.00 0.00 O ATOM 375 CB PHE A 82 14.464 -1.692 -4.101 1.00 0.00 C ATOM 376 CG PHE A 82 14.100 -0.902 -2.848 1.00 0.00 C ATOM 377 CD1 PHE A 82 13.013 -1.304 -2.047 1.00 0.00 C ATOM 378 CD2 PHE A 82 14.776 0.290 -2.521 1.00 0.00 C ATOM 379 CE1 PHE A 82 12.591 -0.521 -0.958 1.00 0.00 C ATOM 380 CE2 PHE A 82 14.388 1.041 -1.403 1.00 0.00 C ATOM 381 CZ PHE A 82 13.279 0.657 -0.644 1.00 0.00 C ATOM 0 H PHE A 82 15.508 -3.022 -5.932 1.00 0.00 H new ATOM 0 HA PHE A 82 16.122 -2.784 -3.278 1.00 0.00 H new ATOM 0 HB2 PHE A 82 15.069 -1.056 -4.747 1.00 0.00 H new ATOM 0 HB3 PHE A 82 13.547 -1.919 -4.645 1.00 0.00 H new ATOM 0 HD1 PHE A 82 12.497 -2.226 -2.272 1.00 0.00 H new ATOM 0 HD2 PHE A 82 15.598 0.627 -3.135 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.740 -0.827 -0.367 1.00 0.00 H new ATOM 0 HE2 PHE A 82 14.949 1.921 -1.126 1.00 0.00 H new ATOM 0 HZ PHE A 82 12.953 1.269 0.184 1.00 0.00 H new ATOM 391 N GLN A 83 13.216 -4.370 -3.640 1.00 0.00 N ATOM 392 CA GLN A 83 12.257 -5.146 -2.880 1.00 0.00 C ATOM 393 C GLN A 83 12.797 -6.538 -2.529 1.00 0.00 C ATOM 394 O GLN A 83 12.403 -7.086 -1.500 1.00 0.00 O ATOM 395 CB GLN A 83 10.893 -5.159 -3.580 1.00 0.00 C ATOM 396 CG GLN A 83 10.771 -6.018 -4.850 1.00 0.00 C ATOM 397 CD GLN A 83 9.310 -6.313 -5.179 1.00 0.00 C ATOM 398 OE1 GLN A 83 8.522 -6.608 -4.286 1.00 0.00 O ATOM 399 NE2 GLN A 83 8.906 -6.252 -6.436 1.00 0.00 N ATOM 0 H GLN A 83 12.943 -4.164 -4.601 1.00 0.00 H new ATOM 0 HA GLN A 83 12.098 -4.659 -1.918 1.00 0.00 H new ATOM 0 HB2 GLN A 83 10.147 -5.504 -2.864 1.00 0.00 H new ATOM 0 HB3 GLN A 83 10.635 -4.132 -3.839 1.00 0.00 H new ATOM 0 HG2 GLN A 83 11.238 -5.501 -5.688 1.00 0.00 H new ATOM 0 HG3 GLN A 83 11.312 -6.954 -4.712 1.00 0.00 H new ATOM 0 HE21 GLN A 83 9.567 -6.006 -7.173 1.00 0.00 H new ATOM 0 HE22 GLN A 83 7.933 -6.451 -6.669 1.00 0.00 H new ATOM 408 N LEU A 84 13.695 -7.091 -3.349 1.00 0.00 N ATOM 409 CA LEU A 84 14.366 -8.357 -3.190 1.00 0.00 C ATOM 410 C LEU A 84 15.371 -8.282 -2.036 1.00 0.00 C ATOM 411 O LEU A 84 15.251 -9.042 -1.074 1.00 0.00 O ATOM 412 CB LEU A 84 14.992 -8.662 -4.564 1.00 0.00 C ATOM 413 CG LEU A 84 15.434 -10.110 -4.718 1.00 0.00 C ATOM 414 CD1 LEU A 84 15.682 -10.403 -6.202 1.00 0.00 C ATOM 415 CD2 LEU A 84 16.693 -10.454 -3.915 1.00 0.00 C ATOM 0 H LEU A 84 13.985 -6.617 -4.204 1.00 0.00 H new ATOM 0 HA LEU A 84 13.698 -9.172 -2.911 1.00 0.00 H new ATOM 0 HB2 LEU A 84 14.269 -8.425 -5.345 1.00 0.00 H new ATOM 0 HB3 LEU A 84 15.851 -8.009 -4.717 1.00 0.00 H new ATOM 0 HG LEU A 84 14.631 -10.731 -4.321 1.00 0.00 H new ATOM 0 HD11 LEU A 84 15.999 -11.439 -6.320 1.00 0.00 H new ATOM 0 HD12 LEU A 84 14.763 -10.239 -6.764 1.00 0.00 H new ATOM 0 HD13 LEU A 84 16.461 -9.740 -6.579 1.00 0.00 H new ATOM 0 HD21 LEU A 84 16.950 -11.502 -4.072 1.00 0.00 H new ATOM 0 HD22 LEU A 84 17.519 -9.824 -4.246 1.00 0.00 H new ATOM 0 HD23 LEU A 84 16.507 -10.281 -2.855 1.00 0.00 H new ATOM 427 N LEU A 85 16.344 -7.369 -2.110 1.00 0.00 N ATOM 428 CA LEU A 85 17.394 -7.166 -1.116 1.00 0.00 C ATOM 429 C LEU A 85 16.775 -6.831 0.239 1.00 0.00 C ATOM 430 O LEU A 85 17.230 -7.340 1.266 1.00 0.00 O ATOM 431 CB LEU A 85 18.344 -6.022 -1.528 1.00 0.00 C ATOM 432 CG LEU A 85 19.199 -6.202 -2.799 1.00 0.00 C ATOM 433 CD1 LEU A 85 20.111 -4.977 -2.947 1.00 0.00 C ATOM 434 CD2 LEU A 85 20.053 -7.467 -2.828 1.00 0.00 C ATOM 0 H LEU A 85 16.422 -6.726 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 85 17.967 -8.091 -1.048 1.00 0.00 H new ATOM 0 HB2 LEU A 85 17.743 -5.121 -1.656 1.00 0.00 H new ATOM 0 HB3 LEU A 85 19.022 -5.837 -0.695 1.00 0.00 H new ATOM 0 HG LEU A 85 18.498 -6.303 -3.628 1.00 0.00 H new ATOM 0 HD11 LEU A 85 20.724 -5.086 -3.841 1.00 0.00 H new ATOM 0 HD12 LEU A 85 19.501 -4.078 -3.032 1.00 0.00 H new ATOM 0 HD13 LEU A 85 20.756 -4.896 -2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 85 20.617 -7.504 -3.760 1.00 0.00 H new ATOM 0 HD22 LEU A 85 20.744 -7.459 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 85 19.408 -8.343 -2.759 1.00 0.00 H new ATOM 446 N LEU A 86 15.739 -5.987 0.254 1.00 0.00 N ATOM 447 CA LEU A 86 14.998 -5.613 1.444 1.00 0.00 C ATOM 448 C LEU A 86 14.395 -6.872 2.054 1.00 0.00 C ATOM 449 O LEU A 86 14.667 -7.182 3.217 1.00 0.00 O ATOM 450 CB LEU A 86 13.944 -4.568 1.046 1.00 0.00 C ATOM 451 CG LEU A 86 13.220 -3.901 2.222 1.00 0.00 C ATOM 452 CD1 LEU A 86 12.549 -2.612 1.741 1.00 0.00 C ATOM 453 CD2 LEU A 86 12.169 -4.811 2.861 1.00 0.00 C ATOM 0 H LEU A 86 15.389 -5.536 -0.591 1.00 0.00 H new ATOM 0 HA LEU A 86 15.637 -5.161 2.203 1.00 0.00 H new ATOM 0 HB2 LEU A 86 14.428 -3.794 0.450 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.203 -5.046 0.406 1.00 0.00 H new ATOM 0 HG LEU A 86 13.970 -3.686 2.983 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.034 -2.137 2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.305 -1.933 1.347 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.829 -2.847 0.957 1.00 0.00 H new ATOM 0 HD21 LEU A 86 11.689 -4.287 3.688 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.419 -5.080 2.117 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.649 -5.715 3.235 1.00 0.00 H new ATOM 465 N ALA A 87 13.593 -7.601 1.269 1.00 0.00 N ATOM 466 CA ALA A 87 12.903 -8.801 1.718 1.00 0.00 C ATOM 467 C ALA A 87 13.881 -9.853 2.241 1.00 0.00 C ATOM 468 O ALA A 87 13.557 -10.547 3.204 1.00 0.00 O ATOM 469 CB ALA A 87 12.055 -9.380 0.580 1.00 0.00 C ATOM 0 H ALA A 87 13.407 -7.366 0.294 1.00 0.00 H new ATOM 0 HA ALA A 87 12.250 -8.520 2.544 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.543 -10.278 0.928 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.318 -8.642 0.264 1.00 0.00 H new ATOM 0 HB3 ALA A 87 12.700 -9.633 -0.262 1.00 0.00 H new ATOM 475 N ASN A 88 15.066 -9.959 1.632 1.00 0.00 N ATOM 476 CA ASN A 88 16.124 -10.851 2.080 1.00 0.00 C ATOM 477 C ASN A 88 16.568 -10.462 3.492 1.00 0.00 C ATOM 478 O ASN A 88 16.516 -11.279 4.416 1.00 0.00 O ATOM 479 CB ASN A 88 17.305 -10.830 1.088 1.00 0.00 C ATOM 480 CG ASN A 88 18.222 -12.036 1.259 1.00 0.00 C ATOM 481 OD1 ASN A 88 18.119 -12.801 2.211 1.00 0.00 O ATOM 482 ND2 ASN A 88 19.118 -12.262 0.320 1.00 0.00 N ATOM 0 H ASN A 88 15.314 -9.418 0.804 1.00 0.00 H new ATOM 0 HA ASN A 88 15.743 -11.872 2.113 1.00 0.00 H new ATOM 0 HB2 ASN A 88 16.920 -10.810 0.068 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.880 -9.915 1.230 1.00 0.00 H new ATOM 0 HD21 ASN A 88 19.729 -13.076 0.384 1.00 0.00 H new ATOM 0 HD22 ASN A 88 19.200 -11.623 -0.471 1.00 0.00 H new ATOM 489 N LYS A 89 17.001 -9.204 3.663 1.00 0.00 N ATOM 490 CA LYS A 89 17.581 -8.701 4.898 1.00 0.00 C ATOM 491 C LYS A 89 16.600 -8.765 6.049 1.00 0.00 C ATOM 492 O LYS A 89 16.945 -9.368 7.061 1.00 0.00 O ATOM 493 CB LYS A 89 18.118 -7.271 4.687 1.00 0.00 C ATOM 494 CG LYS A 89 19.633 -7.227 4.889 1.00 0.00 C ATOM 495 CD LYS A 89 20.050 -6.768 6.288 1.00 0.00 C ATOM 496 CE LYS A 89 19.547 -7.623 7.459 1.00 0.00 C ATOM 497 NZ LYS A 89 20.075 -9.002 7.470 1.00 0.00 N ATOM 0 H LYS A 89 16.953 -8.501 2.926 1.00 0.00 H new ATOM 0 HA LYS A 89 18.417 -9.346 5.168 1.00 0.00 H new ATOM 0 HB2 LYS A 89 17.870 -6.929 3.682 1.00 0.00 H new ATOM 0 HB3 LYS A 89 17.633 -6.588 5.385 1.00 0.00 H new ATOM 0 HG2 LYS A 89 20.045 -8.219 4.703 1.00 0.00 H new ATOM 0 HG3 LYS A 89 20.071 -6.556 4.150 1.00 0.00 H new ATOM 0 HD2 LYS A 89 21.139 -6.738 6.328 1.00 0.00 H new ATOM 0 HD3 LYS A 89 19.697 -5.747 6.433 1.00 0.00 H new ATOM 0 HE2 LYS A 89 19.819 -7.134 8.395 1.00 0.00 H new ATOM 0 HE3 LYS A 89 18.458 -7.663 7.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 19.300 -9.672 7.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 20.797 -9.103 6.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 20.500 -9.203 8.397 1.00 0.00 H new ATOM 511 N ALA A 90 15.461 -8.093 5.890 1.00 0.00 N ATOM 512 CA ALA A 90 14.245 -8.026 6.714 1.00 0.00 C ATOM 513 C ALA A 90 14.365 -7.766 8.229 1.00 0.00 C ATOM 514 O ALA A 90 13.355 -7.426 8.850 1.00 0.00 O ATOM 515 CB ALA A 90 13.410 -9.271 6.421 1.00 0.00 C ATOM 0 H ALA A 90 15.351 -7.500 5.067 1.00 0.00 H new ATOM 0 HA ALA A 90 13.765 -7.098 6.405 1.00 0.00 H new ATOM 0 HB1 ALA A 90 12.500 -9.248 7.020 1.00 0.00 H new ATOM 0 HB2 ALA A 90 13.148 -9.293 5.363 1.00 0.00 H new ATOM 0 HB3 ALA A 90 13.986 -10.162 6.670 1.00 0.00 H new ATOM 521 N HIS A 91 15.563 -7.829 8.808 1.00 0.00 N ATOM 522 CA HIS A 91 15.895 -8.410 10.107 1.00 0.00 C ATOM 523 C HIS A 91 15.760 -9.938 10.034 1.00 0.00 C ATOM 524 O HIS A 91 14.964 -10.478 9.263 1.00 0.00 O ATOM 525 CB HIS A 91 15.125 -7.796 11.302 1.00 0.00 C ATOM 526 CG HIS A 91 14.161 -8.748 11.972 1.00 0.00 C ATOM 527 ND1 HIS A 91 13.128 -9.404 11.353 1.00 0.00 N flip ATOM 528 CD2 HIS A 91 14.317 -9.303 13.227 1.00 0.00 C flip ATOM 529 CE1 HIS A 91 12.656 -10.369 12.247 1.00 0.00 C flip ATOM 530 NE2 HIS A 91 13.400 -10.271 13.357 1.00 0.00 N flip ATOM 0 H HIS A 91 16.388 -7.446 8.346 1.00 0.00 H new ATOM 0 HA HIS A 91 16.933 -8.153 10.318 1.00 0.00 H new ATOM 0 HB2 HIS A 91 15.845 -7.445 12.042 1.00 0.00 H new ATOM 0 HB3 HIS A 91 14.573 -6.923 10.954 1.00 0.00 H new ATOM 0 HD2 HIS A 91 15.046 -9.010 13.969 1.00 0.00 H new ATOM 0 HE1 HIS A 91 11.846 -11.062 12.076 1.00 0.00 H new ATOM 0 HE2 HIS A 91 13.284 -10.853 14.187 1.00 0.00 H new ATOM 538 N SER A 92 16.490 -10.627 10.909 1.00 0.00 N ATOM 539 CA SER A 92 16.266 -12.020 11.253 1.00 0.00 C ATOM 540 C SER A 92 17.159 -12.327 12.446 1.00 0.00 C ATOM 541 O SER A 92 18.280 -11.801 12.539 1.00 0.00 O ATOM 542 CB SER A 92 16.642 -12.928 10.082 1.00 0.00 C ATOM 543 OG SER A 92 16.244 -14.263 10.312 1.00 0.00 O ATOM 0 H SER A 92 17.276 -10.214 11.411 1.00 0.00 H new ATOM 0 HA SER A 92 15.215 -12.194 11.486 1.00 0.00 H new ATOM 0 HB2 SER A 92 16.173 -12.560 9.170 1.00 0.00 H new ATOM 0 HB3 SER A 92 17.720 -12.891 9.923 1.00 0.00 H new ATOM 0 HG SER A 92 16.497 -14.817 9.544 1.00 0.00 H new ATOM 549 N ARG A 93 16.675 -13.195 13.328 1.00 0.00 N ATOM 550 CA ARG A 93 17.410 -13.726 14.461 1.00 0.00 C ATOM 551 C ARG A 93 18.081 -15.018 13.994 1.00 0.00 C ATOM 552 O ARG A 93 17.411 -15.851 13.379 1.00 0.00 O ATOM 553 CB ARG A 93 16.399 -13.979 15.600 1.00 0.00 C ATOM 554 CG ARG A 93 17.005 -13.849 17.003 1.00 0.00 C ATOM 555 CD ARG A 93 15.976 -14.294 18.060 1.00 0.00 C ATOM 556 NE ARG A 93 16.277 -13.774 19.406 1.00 0.00 N ATOM 557 CZ ARG A 93 17.318 -14.095 20.181 1.00 0.00 C ATOM 558 NH1 ARG A 93 18.192 -15.029 19.819 1.00 0.00 N ATOM 559 NH2 ARG A 93 17.479 -13.454 21.329 1.00 0.00 N ATOM 0 H ARG A 93 15.724 -13.559 13.267 1.00 0.00 H new ATOM 0 HA ARG A 93 18.176 -13.044 14.830 1.00 0.00 H new ATOM 0 HB2 ARG A 93 15.573 -13.274 15.504 1.00 0.00 H new ATOM 0 HB3 ARG A 93 15.980 -14.979 15.486 1.00 0.00 H new ATOM 0 HG2 ARG A 93 17.905 -14.460 17.078 1.00 0.00 H new ATOM 0 HG3 ARG A 93 17.304 -12.817 17.186 1.00 0.00 H new ATOM 0 HD2 ARG A 93 14.984 -13.957 17.759 1.00 0.00 H new ATOM 0 HD3 ARG A 93 15.946 -15.383 18.095 1.00 0.00 H new ATOM 0 HE ARG A 93 15.619 -13.095 19.788 1.00 0.00 H new ATOM 0 HH11 ARG A 93 18.077 -15.519 18.932 1.00 0.00 H new ATOM 0 HH12 ARG A 93 18.978 -15.256 20.428 1.00 0.00 H new ATOM 0 HH21 ARG A 93 16.815 -12.731 21.607 1.00 0.00 H new ATOM 0 HH22 ARG A 93 18.267 -13.684 21.935 1.00 0.00 H new ATOM 573 N SER A 94 19.370 -15.201 14.277 1.00 0.00 N ATOM 574 CA SER A 94 20.156 -16.325 13.775 1.00 0.00 C ATOM 575 C SER A 94 20.132 -16.406 12.236 1.00 0.00 C ATOM 576 O SER A 94 19.720 -15.466 11.551 1.00 0.00 O ATOM 577 CB SER A 94 19.723 -17.614 14.500 1.00 0.00 C ATOM 578 OG SER A 94 20.041 -17.516 15.878 1.00 0.00 O ATOM 0 H SER A 94 19.904 -14.564 14.869 1.00 0.00 H new ATOM 0 HA SER A 94 21.210 -16.174 14.008 1.00 0.00 H new ATOM 0 HB2 SER A 94 18.652 -17.771 14.374 1.00 0.00 H new ATOM 0 HB3 SER A 94 20.225 -18.476 14.061 1.00 0.00 H new ATOM 0 HG SER A 94 19.763 -18.336 16.337 1.00 0.00 H new ATOM 584 N SER A 95 20.683 -17.487 11.681 1.00 0.00 N ATOM 585 CA SER A 95 20.921 -17.688 10.259 1.00 0.00 C ATOM 586 C SER A 95 19.921 -18.714 9.732 1.00 0.00 C ATOM 587 O SER A 95 20.010 -19.886 10.108 1.00 0.00 O ATOM 588 CB SER A 95 22.369 -18.168 10.076 1.00 0.00 C ATOM 589 OG SER A 95 22.654 -19.246 10.964 1.00 0.00 O ATOM 0 H SER A 95 20.989 -18.282 12.242 1.00 0.00 H new ATOM 0 HA SER A 95 20.786 -16.763 9.699 1.00 0.00 H new ATOM 0 HB2 SER A 95 22.525 -18.487 9.045 1.00 0.00 H new ATOM 0 HB3 SER A 95 23.058 -17.344 10.262 1.00 0.00 H new ATOM 0 HG SER A 95 21.889 -19.857 10.993 1.00 0.00 H new ATOM 595 N SER A 96 18.960 -18.315 8.902 1.00 0.00 N ATOM 596 CA SER A 96 17.983 -19.217 8.313 1.00 0.00 C ATOM 597 C SER A 96 17.623 -18.715 6.915 1.00 0.00 C ATOM 598 O SER A 96 17.124 -17.602 6.765 1.00 0.00 O ATOM 599 CB SER A 96 16.754 -19.300 9.228 1.00 0.00 C ATOM 600 OG SER A 96 17.137 -19.759 10.515 1.00 0.00 O ATOM 0 H SER A 96 18.840 -17.343 8.618 1.00 0.00 H new ATOM 0 HA SER A 96 18.393 -20.222 8.216 1.00 0.00 H new ATOM 0 HB2 SER A 96 16.283 -18.320 9.308 1.00 0.00 H new ATOM 0 HB3 SER A 96 16.015 -19.975 8.797 1.00 0.00 H new ATOM 0 HG SER A 96 16.347 -19.808 11.093 1.00 0.00 H new ATOM 606 N GLY A 97 17.890 -19.532 5.890 1.00 0.00 N ATOM 607 CA GLY A 97 17.291 -19.336 4.572 1.00 0.00 C ATOM 608 C GLY A 97 15.788 -19.624 4.623 1.00 0.00 C ATOM 609 O GLY A 97 15.030 -18.970 3.910 1.00 0.00 O ATOM 0 H GLY A 97 18.517 -20.334 5.951 1.00 0.00 H new ATOM 0 HA2 GLY A 97 17.461 -18.313 4.236 1.00 0.00 H new ATOM 0 HA3 GLY A 97 17.770 -19.993 3.846 1.00 0.00 H new ATOM 613 N GLU A 98 15.386 -20.537 5.523 1.00 0.00 N ATOM 614 CA GLU A 98 14.015 -20.926 5.820 1.00 0.00 C ATOM 615 C GLU A 98 13.275 -21.345 4.546 1.00 0.00 C ATOM 616 O GLU A 98 13.903 -21.685 3.540 1.00 0.00 O ATOM 617 CB GLU A 98 13.397 -19.808 6.682 1.00 0.00 C ATOM 618 CG GLU A 98 12.602 -20.298 7.908 1.00 0.00 C ATOM 619 CD GLU A 98 11.090 -20.170 7.730 1.00 0.00 C ATOM 620 OE1 GLU A 98 10.539 -20.978 6.951 1.00 0.00 O ATOM 621 OE2 GLU A 98 10.502 -19.245 8.339 1.00 0.00 O ATOM 0 H GLU A 98 16.059 -21.050 6.093 1.00 0.00 H new ATOM 0 HA GLU A 98 13.942 -21.833 6.421 1.00 0.00 H new ATOM 0 HB2 GLU A 98 14.196 -19.150 7.024 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.737 -19.209 6.055 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.852 -21.341 8.103 1.00 0.00 H new ATOM 0 HG3 GLU A 98 12.909 -19.727 8.785 1.00 0.00 H new ATOM 628 N THR A 99 11.956 -21.470 4.600 1.00 0.00 N ATOM 629 CA THR A 99 11.165 -21.674 3.409 1.00 0.00 C ATOM 630 C THR A 99 11.341 -20.446 2.496 1.00 0.00 C ATOM 631 O THR A 99 11.265 -19.311 2.985 1.00 0.00 O ATOM 632 CB THR A 99 9.707 -21.921 3.833 1.00 0.00 C ATOM 633 OG1 THR A 99 9.186 -20.976 4.757 1.00 0.00 O ATOM 634 CG2 THR A 99 9.526 -23.324 4.424 1.00 0.00 C ATOM 0 H THR A 99 11.415 -21.432 5.464 1.00 0.00 H new ATOM 0 HA THR A 99 11.486 -22.547 2.840 1.00 0.00 H new ATOM 0 HB THR A 99 9.143 -21.812 2.907 1.00 0.00 H new ATOM 0 HG1 THR A 99 9.485 -21.204 5.662 1.00 0.00 H new ATOM 0 HG21 THR A 99 8.485 -23.465 4.713 1.00 0.00 H new ATOM 0 HG22 THR A 99 9.800 -24.071 3.679 1.00 0.00 H new ATOM 0 HG23 THR A 99 10.164 -23.435 5.301 1.00 0.00 H new ATOM 642 N PRO A 100 11.568 -20.616 1.182 1.00 0.00 N ATOM 643 CA PRO A 100 11.703 -19.476 0.291 1.00 0.00 C ATOM 644 C PRO A 100 10.330 -18.841 0.062 1.00 0.00 C ATOM 645 O PRO A 100 9.305 -19.519 0.108 1.00 0.00 O ATOM 646 CB PRO A 100 12.289 -20.052 -1.001 1.00 0.00 C ATOM 647 CG PRO A 100 11.764 -21.488 -1.017 1.00 0.00 C ATOM 648 CD PRO A 100 11.734 -21.868 0.463 1.00 0.00 C ATOM 0 HA PRO A 100 12.343 -18.690 0.692 1.00 0.00 H new ATOM 0 HB2 PRO A 100 11.958 -19.493 -1.877 1.00 0.00 H new ATOM 0 HB3 PRO A 100 13.379 -20.022 -0.997 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.774 -21.549 -1.468 1.00 0.00 H new ATOM 0 HG3 PRO A 100 12.416 -22.148 -1.589 1.00 0.00 H new ATOM 0 HD2 PRO A 100 10.914 -22.554 0.675 1.00 0.00 H new ATOM 0 HD3 PRO A 100 12.655 -22.371 0.758 1.00 0.00 H new ATOM 656 N ALA A 101 10.326 -17.551 -0.263 1.00 0.00 N ATOM 657 CA ALA A 101 9.149 -16.783 -0.645 1.00 0.00 C ATOM 658 C ALA A 101 9.633 -15.664 -1.561 1.00 0.00 C ATOM 659 O ALA A 101 10.727 -15.128 -1.336 1.00 0.00 O ATOM 660 CB ALA A 101 8.494 -16.199 0.614 1.00 0.00 C ATOM 0 H ALA A 101 11.179 -16.991 -0.267 1.00 0.00 H new ATOM 0 HA ALA A 101 8.411 -17.403 -1.154 1.00 0.00 H new ATOM 0 HB1 ALA A 101 7.612 -15.623 0.332 1.00 0.00 H new ATOM 0 HB2 ALA A 101 8.200 -17.010 1.281 1.00 0.00 H new ATOM 0 HB3 ALA A 101 9.204 -15.549 1.125 1.00 0.00 H new ATOM 666 N GLN A 102 8.864 -15.292 -2.582 1.00 0.00 N ATOM 667 CA GLN A 102 9.192 -14.214 -3.506 1.00 0.00 C ATOM 668 C GLN A 102 8.011 -13.235 -3.599 1.00 0.00 C ATOM 669 O GLN A 102 6.867 -13.617 -3.321 1.00 0.00 O ATOM 670 CB GLN A 102 9.571 -14.791 -4.881 1.00 0.00 C ATOM 671 CG GLN A 102 10.865 -15.615 -4.826 1.00 0.00 C ATOM 672 CD GLN A 102 11.405 -16.006 -6.203 1.00 0.00 C ATOM 673 OE1 GLN A 102 10.663 -16.228 -7.158 1.00 0.00 O ATOM 674 NE2 GLN A 102 12.718 -16.083 -6.341 1.00 0.00 N ATOM 0 H GLN A 102 7.974 -15.744 -2.793 1.00 0.00 H new ATOM 0 HA GLN A 102 10.056 -13.662 -3.136 1.00 0.00 H new ATOM 0 HB2 GLN A 102 8.758 -15.418 -5.247 1.00 0.00 H new ATOM 0 HB3 GLN A 102 9.691 -13.976 -5.595 1.00 0.00 H new ATOM 0 HG2 GLN A 102 11.627 -15.043 -4.296 1.00 0.00 H new ATOM 0 HG3 GLN A 102 10.684 -16.520 -4.246 1.00 0.00 H new ATOM 0 HE21 GLN A 102 13.326 -15.897 -5.544 1.00 0.00 H new ATOM 0 HE22 GLN A 102 13.122 -16.328 -7.245 1.00 0.00 H new ATOM 683 N PRO A 103 8.272 -11.961 -3.941 1.00 0.00 N ATOM 684 CA PRO A 103 7.255 -10.924 -3.903 1.00 0.00 C ATOM 685 C PRO A 103 6.419 -10.825 -5.177 1.00 0.00 C ATOM 686 O PRO A 103 6.902 -10.564 -6.282 1.00 0.00 O ATOM 687 CB PRO A 103 8.015 -9.643 -3.657 1.00 0.00 C ATOM 688 CG PRO A 103 9.366 -9.877 -4.332 1.00 0.00 C ATOM 689 CD PRO A 103 9.596 -11.363 -4.065 1.00 0.00 C ATOM 0 HA PRO A 103 6.524 -11.147 -3.126 1.00 0.00 H new ATOM 0 HB2 PRO A 103 7.498 -8.784 -4.086 1.00 0.00 H new ATOM 0 HB3 PRO A 103 8.130 -9.446 -2.591 1.00 0.00 H new ATOM 0 HG2 PRO A 103 9.334 -9.653 -5.398 1.00 0.00 H new ATOM 0 HG3 PRO A 103 10.152 -9.258 -3.900 1.00 0.00 H new ATOM 0 HD2 PRO A 103 10.157 -11.823 -4.879 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.177 -11.510 -3.155 1.00 0.00 H new ATOM 697 N GLU A 104 5.119 -10.925 -4.959 1.00 0.00 N ATOM 698 CA GLU A 104 4.045 -11.081 -5.940 1.00 0.00 C ATOM 699 C GLU A 104 3.544 -9.778 -6.580 1.00 0.00 C ATOM 700 O GLU A 104 2.475 -9.760 -7.184 1.00 0.00 O ATOM 701 CB GLU A 104 2.913 -11.899 -5.277 1.00 0.00 C ATOM 702 CG GLU A 104 2.454 -11.378 -3.897 1.00 0.00 C ATOM 703 CD GLU A 104 1.036 -10.828 -3.887 1.00 0.00 C ATOM 704 OE1 GLU A 104 0.088 -11.597 -3.595 1.00 0.00 O ATOM 705 OE2 GLU A 104 0.886 -9.593 -3.998 1.00 0.00 O ATOM 0 H GLU A 104 4.750 -10.897 -4.009 1.00 0.00 H new ATOM 0 HA GLU A 104 4.452 -11.616 -6.798 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.054 -11.912 -5.948 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.247 -12.931 -5.166 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.524 -12.189 -3.172 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.139 -10.596 -3.568 1.00 0.00 H new ATOM 712 N LYS A 105 4.313 -8.695 -6.489 1.00 0.00 N ATOM 713 CA LYS A 105 3.952 -7.366 -7.005 1.00 0.00 C ATOM 714 C LYS A 105 5.161 -6.706 -7.678 1.00 0.00 C ATOM 715 O LYS A 105 6.289 -7.172 -7.470 1.00 0.00 O ATOM 716 CB LYS A 105 3.315 -6.507 -5.891 1.00 0.00 C ATOM 717 CG LYS A 105 4.201 -6.257 -4.655 1.00 0.00 C ATOM 718 CD LYS A 105 4.162 -7.342 -3.561 1.00 0.00 C ATOM 719 CE LYS A 105 3.165 -7.072 -2.426 1.00 0.00 C ATOM 720 NZ LYS A 105 1.747 -7.317 -2.766 1.00 0.00 N ATOM 0 H LYS A 105 5.230 -8.713 -6.043 1.00 0.00 H new ATOM 0 HA LYS A 105 3.192 -7.468 -7.779 1.00 0.00 H new ATOM 0 HB2 LYS A 105 3.034 -5.543 -6.316 1.00 0.00 H new ATOM 0 HB3 LYS A 105 2.395 -6.992 -5.564 1.00 0.00 H new ATOM 0 HG2 LYS A 105 5.232 -6.144 -4.989 1.00 0.00 H new ATOM 0 HG3 LYS A 105 3.905 -5.308 -4.208 1.00 0.00 H new ATOM 0 HD2 LYS A 105 3.915 -8.297 -4.024 1.00 0.00 H new ATOM 0 HD3 LYS A 105 5.160 -7.444 -3.134 1.00 0.00 H new ATOM 0 HE2 LYS A 105 3.431 -7.696 -1.573 1.00 0.00 H new ATOM 0 HE3 LYS A 105 3.272 -6.035 -2.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 1.160 -7.190 -1.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 1.445 -6.645 -3.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 1.638 -8.289 -3.120 1.00 0.00 H new ATOM 734 N THR A 106 4.966 -5.650 -8.483 1.00 0.00 N ATOM 735 CA THR A 106 6.018 -5.191 -9.399 1.00 0.00 C ATOM 736 C THR A 106 6.101 -3.672 -9.623 1.00 0.00 C ATOM 737 O THR A 106 6.917 -3.205 -10.429 1.00 0.00 O ATOM 738 CB THR A 106 5.938 -6.045 -10.687 1.00 0.00 C ATOM 739 OG1 THR A 106 7.202 -6.077 -11.322 1.00 0.00 O ATOM 740 CG2 THR A 106 4.843 -5.584 -11.655 1.00 0.00 C ATOM 0 H THR A 106 4.104 -5.106 -8.518 1.00 0.00 H new ATOM 0 HA THR A 106 6.983 -5.358 -8.920 1.00 0.00 H new ATOM 0 HB THR A 106 5.658 -7.054 -10.385 1.00 0.00 H new ATOM 0 HG1 THR A 106 7.146 -6.620 -12.136 1.00 0.00 H new ATOM 0 HG21 THR A 106 4.842 -6.226 -12.536 1.00 0.00 H new ATOM 0 HG22 THR A 106 3.873 -5.644 -11.162 1.00 0.00 H new ATOM 0 HG23 THR A 106 5.034 -4.554 -11.957 1.00 0.00 H new ATOM 748 N SER A 107 5.319 -2.881 -8.892 1.00 0.00 N ATOM 749 CA SER A 107 5.381 -1.429 -8.907 1.00 0.00 C ATOM 750 C SER A 107 5.677 -0.912 -7.494 1.00 0.00 C ATOM 751 O SER A 107 5.407 -1.599 -6.506 1.00 0.00 O ATOM 752 CB SER A 107 4.067 -0.860 -9.458 1.00 0.00 C ATOM 753 OG SER A 107 3.467 -1.721 -10.418 1.00 0.00 O ATOM 0 H SER A 107 4.608 -3.246 -8.258 1.00 0.00 H new ATOM 0 HA SER A 107 6.187 -1.097 -9.561 1.00 0.00 H new ATOM 0 HB2 SER A 107 3.371 -0.696 -8.635 1.00 0.00 H new ATOM 0 HB3 SER A 107 4.257 0.112 -9.913 1.00 0.00 H new ATOM 0 HG SER A 107 3.077 -2.497 -9.963 1.00 0.00 H new ATOM 759 N GLY A 108 6.223 0.295 -7.368 1.00 0.00 N ATOM 760 CA GLY A 108 6.642 0.879 -6.099 1.00 0.00 C ATOM 761 C GLY A 108 5.461 1.242 -5.215 1.00 0.00 C ATOM 762 O GLY A 108 5.486 0.969 -4.014 1.00 0.00 O ATOM 0 H GLY A 108 6.390 0.908 -8.166 1.00 0.00 H new ATOM 0 HA2 GLY A 108 7.285 0.174 -5.572 1.00 0.00 H new ATOM 0 HA3 GLY A 108 7.237 1.772 -6.291 1.00 0.00 H new ATOM 766 N MET A 109 4.396 1.819 -5.783 1.00 0.00 N ATOM 767 CA MET A 109 3.203 2.104 -4.990 1.00 0.00 C ATOM 768 C MET A 109 2.557 0.823 -4.449 1.00 0.00 C ATOM 769 O MET A 109 1.799 0.895 -3.481 1.00 0.00 O ATOM 770 CB MET A 109 2.179 2.951 -5.761 1.00 0.00 C ATOM 771 CG MET A 109 1.426 2.193 -6.857 1.00 0.00 C ATOM 772 SD MET A 109 2.294 1.977 -8.428 1.00 0.00 S ATOM 773 CE MET A 109 1.814 3.544 -9.210 1.00 0.00 C ATOM 0 H MET A 109 4.338 2.091 -6.764 1.00 0.00 H new ATOM 0 HA MET A 109 3.537 2.695 -4.137 1.00 0.00 H new ATOM 0 HB2 MET A 109 1.455 3.356 -5.054 1.00 0.00 H new ATOM 0 HB3 MET A 109 2.694 3.800 -6.212 1.00 0.00 H new ATOM 0 HG2 MET A 109 1.165 1.207 -6.473 1.00 0.00 H new ATOM 0 HG3 MET A 109 0.490 2.717 -7.053 1.00 0.00 H new ATOM 0 HE1 MET A 109 2.256 3.605 -10.205 1.00 0.00 H new ATOM 0 HE2 MET A 109 0.728 3.592 -9.292 1.00 0.00 H new ATOM 0 HE3 MET A 109 2.169 4.377 -8.604 1.00 0.00 H new ATOM 783 N GLU A 110 2.814 -0.346 -5.047 1.00 0.00 N ATOM 784 CA GLU A 110 2.286 -1.589 -4.558 1.00 0.00 C ATOM 785 C GLU A 110 3.034 -1.995 -3.293 1.00 0.00 C ATOM 786 O GLU A 110 2.424 -2.142 -2.232 1.00 0.00 O ATOM 787 CB GLU A 110 2.405 -2.674 -5.623 1.00 0.00 C ATOM 788 CG GLU A 110 1.596 -2.416 -6.895 1.00 0.00 C ATOM 789 CD GLU A 110 1.750 -3.611 -7.836 1.00 0.00 C ATOM 790 OE1 GLU A 110 2.732 -3.651 -8.614 1.00 0.00 O ATOM 791 OE2 GLU A 110 0.929 -4.546 -7.719 1.00 0.00 O ATOM 0 H GLU A 110 3.394 -0.439 -5.881 1.00 0.00 H new ATOM 0 HA GLU A 110 1.229 -1.462 -4.322 1.00 0.00 H new ATOM 0 HB2 GLU A 110 3.455 -2.784 -5.893 1.00 0.00 H new ATOM 0 HB3 GLU A 110 2.085 -3.623 -5.192 1.00 0.00 H new ATOM 0 HG2 GLU A 110 0.545 -2.265 -6.648 1.00 0.00 H new ATOM 0 HG3 GLU A 110 1.943 -1.505 -7.383 1.00 0.00 H new ATOM 798 N VAL A 111 4.360 -2.151 -3.395 1.00 0.00 N ATOM 799 CA VAL A 111 5.211 -2.582 -2.311 1.00 0.00 C ATOM 800 C VAL A 111 5.112 -1.651 -1.101 1.00 0.00 C ATOM 801 O VAL A 111 5.251 -2.099 0.029 1.00 0.00 O ATOM 802 CB VAL A 111 6.645 -2.745 -2.821 1.00 0.00 C ATOM 803 CG1 VAL A 111 6.790 -4.021 -3.651 1.00 0.00 C ATOM 804 CG2 VAL A 111 7.215 -1.579 -3.583 1.00 0.00 C ATOM 0 H VAL A 111 4.870 -1.973 -4.260 1.00 0.00 H new ATOM 0 HA VAL A 111 4.868 -3.554 -1.955 1.00 0.00 H new ATOM 0 HB VAL A 111 7.236 -2.805 -1.907 1.00 0.00 H new ATOM 0 HG11 VAL A 111 7.818 -4.112 -4.001 1.00 0.00 H new ATOM 0 HG12 VAL A 111 6.538 -4.885 -3.037 1.00 0.00 H new ATOM 0 HG13 VAL A 111 6.118 -3.976 -4.508 1.00 0.00 H new ATOM 0 HG21 VAL A 111 8.234 -1.810 -3.893 1.00 0.00 H new ATOM 0 HG22 VAL A 111 6.603 -1.386 -4.464 1.00 0.00 H new ATOM 0 HG23 VAL A 111 7.222 -0.695 -2.945 1.00 0.00 H new ATOM 814 N ALA A 112 4.772 -0.387 -1.320 1.00 0.00 N ATOM 815 CA ALA A 112 4.467 0.573 -0.277 1.00 0.00 C ATOM 816 C ALA A 112 3.516 0.014 0.797 1.00 0.00 C ATOM 817 O ALA A 112 3.894 -0.058 1.967 1.00 0.00 O ATOM 818 CB ALA A 112 3.921 1.829 -0.955 1.00 0.00 C ATOM 0 H ALA A 112 4.700 0.006 -2.258 1.00 0.00 H new ATOM 0 HA ALA A 112 5.375 0.814 0.276 1.00 0.00 H new ATOM 0 HB1 ALA A 112 3.680 2.575 -0.198 1.00 0.00 H new ATOM 0 HB2 ALA A 112 4.672 2.231 -1.635 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.021 1.578 -1.516 1.00 0.00 H new ATOM 824 N SER A 113 2.308 -0.425 0.428 1.00 0.00 N ATOM 825 CA SER A 113 1.388 -1.041 1.389 1.00 0.00 C ATOM 826 C SER A 113 1.928 -2.377 1.925 1.00 0.00 C ATOM 827 O SER A 113 1.605 -2.737 3.059 1.00 0.00 O ATOM 828 CB SER A 113 0.003 -1.252 0.754 1.00 0.00 C ATOM 829 OG SER A 113 -0.959 -0.338 1.248 1.00 0.00 O ATOM 0 H SER A 113 1.946 -0.366 -0.524 1.00 0.00 H new ATOM 0 HA SER A 113 1.296 -0.355 2.231 1.00 0.00 H new ATOM 0 HB2 SER A 113 0.081 -1.144 -0.328 1.00 0.00 H new ATOM 0 HB3 SER A 113 -0.333 -2.270 0.949 1.00 0.00 H new ATOM 0 HG SER A 113 -1.823 -0.507 0.817 1.00 0.00 H new ATOM 835 N TYR A 114 2.759 -3.093 1.159 1.00 0.00 N ATOM 836 CA TYR A 114 3.310 -4.387 1.578 1.00 0.00 C ATOM 837 C TYR A 114 4.239 -4.169 2.759 1.00 0.00 C ATOM 838 O TYR A 114 4.140 -4.848 3.774 1.00 0.00 O ATOM 839 CB TYR A 114 4.039 -5.104 0.425 1.00 0.00 C ATOM 840 CG TYR A 114 5.443 -5.632 0.716 1.00 0.00 C ATOM 841 CD1 TYR A 114 5.595 -6.797 1.493 1.00 0.00 C ATOM 842 CD2 TYR A 114 6.596 -4.944 0.275 1.00 0.00 C ATOM 843 CE1 TYR A 114 6.877 -7.260 1.848 1.00 0.00 C ATOM 844 CE2 TYR A 114 7.876 -5.419 0.607 1.00 0.00 C ATOM 845 CZ TYR A 114 8.028 -6.564 1.417 1.00 0.00 C ATOM 846 OH TYR A 114 9.279 -6.997 1.743 1.00 0.00 O ATOM 0 H TYR A 114 3.068 -2.793 0.234 1.00 0.00 H new ATOM 0 HA TYR A 114 2.487 -5.037 1.875 1.00 0.00 H new ATOM 0 HB2 TYR A 114 3.421 -5.942 0.103 1.00 0.00 H new ATOM 0 HB3 TYR A 114 4.104 -4.414 -0.416 1.00 0.00 H new ATOM 0 HD1 TYR A 114 4.721 -7.340 1.820 1.00 0.00 H new ATOM 0 HD2 TYR A 114 6.493 -4.049 -0.320 1.00 0.00 H new ATOM 0 HE1 TYR A 114 6.980 -8.150 2.451 1.00 0.00 H new ATOM 0 HE2 TYR A 114 8.751 -4.903 0.239 1.00 0.00 H new ATOM 0 HH TYR A 114 9.939 -6.549 1.174 1.00 0.00 H new ATOM 856 N LEU A 115 5.146 -3.209 2.628 1.00 0.00 N ATOM 857 CA LEU A 115 6.150 -2.895 3.618 1.00 0.00 C ATOM 858 C LEU A 115 5.473 -2.495 4.928 1.00 0.00 C ATOM 859 O LEU A 115 5.893 -2.927 6.002 1.00 0.00 O ATOM 860 CB LEU A 115 7.037 -1.780 3.038 1.00 0.00 C ATOM 861 CG LEU A 115 8.153 -2.229 2.091 1.00 0.00 C ATOM 862 CD1 LEU A 115 8.908 -1.003 1.560 1.00 0.00 C ATOM 863 CD2 LEU A 115 9.144 -3.166 2.786 1.00 0.00 C ATOM 0 H LEU A 115 5.199 -2.613 1.802 1.00 0.00 H new ATOM 0 HA LEU A 115 6.778 -3.756 3.847 1.00 0.00 H new ATOM 0 HB2 LEU A 115 6.398 -1.076 2.505 1.00 0.00 H new ATOM 0 HB3 LEU A 115 7.489 -1.236 3.867 1.00 0.00 H new ATOM 0 HG LEU A 115 7.688 -2.773 1.268 1.00 0.00 H new ATOM 0 HD11 LEU A 115 9.701 -1.328 0.887 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.217 -0.355 1.021 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.343 -0.454 2.395 1.00 0.00 H new ATOM 0 HD21 LEU A 115 9.921 -3.462 2.081 1.00 0.00 H new ATOM 0 HD22 LEU A 115 9.599 -2.651 3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 115 8.619 -4.053 3.141 1.00 0.00 H new ATOM 875 N VAL A 116 4.393 -1.719 4.856 1.00 0.00 N ATOM 876 CA VAL A 116 3.585 -1.376 6.020 1.00 0.00 C ATOM 877 C VAL A 116 2.904 -2.643 6.570 1.00 0.00 C ATOM 878 O VAL A 116 2.889 -2.846 7.786 1.00 0.00 O ATOM 879 CB VAL A 116 2.600 -0.257 5.625 1.00 0.00 C ATOM 880 CG1 VAL A 116 1.693 0.184 6.784 1.00 0.00 C ATOM 881 CG2 VAL A 116 3.362 0.988 5.139 1.00 0.00 C ATOM 0 H VAL A 116 4.054 -1.310 3.985 1.00 0.00 H new ATOM 0 HA VAL A 116 4.199 -0.988 6.833 1.00 0.00 H new ATOM 0 HB VAL A 116 1.981 -0.679 4.834 1.00 0.00 H new ATOM 0 HG11 VAL A 116 1.023 0.973 6.442 1.00 0.00 H new ATOM 0 HG12 VAL A 116 1.105 -0.666 7.130 1.00 0.00 H new ATOM 0 HG13 VAL A 116 2.306 0.558 7.604 1.00 0.00 H new ATOM 0 HG21 VAL A 116 2.650 1.766 4.865 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.009 1.353 5.937 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.967 0.728 4.271 1.00 0.00 H new ATOM 891 N ALA A 117 2.379 -3.523 5.710 1.00 0.00 N ATOM 892 CA ALA A 117 1.765 -4.784 6.113 1.00 0.00 C ATOM 893 C ALA A 117 2.757 -5.709 6.814 1.00 0.00 C ATOM 894 O ALA A 117 2.348 -6.466 7.694 1.00 0.00 O ATOM 895 CB ALA A 117 1.181 -5.515 4.905 1.00 0.00 C ATOM 0 H ALA A 117 2.371 -3.373 4.701 1.00 0.00 H new ATOM 0 HA ALA A 117 0.970 -4.530 6.814 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.729 -6.452 5.230 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.422 -4.890 4.434 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.975 -5.725 4.188 1.00 0.00 H new ATOM 901 N GLN A 118 4.045 -5.648 6.471 1.00 0.00 N ATOM 902 CA GLN A 118 5.083 -6.291 7.249 1.00 0.00 C ATOM 903 C GLN A 118 5.157 -5.577 8.605 1.00 0.00 C ATOM 904 O GLN A 118 4.732 -6.137 9.616 1.00 0.00 O ATOM 905 CB GLN A 118 6.424 -6.270 6.499 1.00 0.00 C ATOM 906 CG GLN A 118 6.476 -6.926 5.113 1.00 0.00 C ATOM 907 CD GLN A 118 5.966 -8.364 5.057 1.00 0.00 C ATOM 908 OE1 GLN A 118 6.733 -9.316 5.187 1.00 0.00 O ATOM 909 NE2 GLN A 118 4.679 -8.555 4.823 1.00 0.00 N ATOM 0 H GLN A 118 4.388 -5.152 5.648 1.00 0.00 H new ATOM 0 HA GLN A 118 4.850 -7.344 7.410 1.00 0.00 H new ATOM 0 HB2 GLN A 118 6.731 -5.230 6.389 1.00 0.00 H new ATOM 0 HB3 GLN A 118 7.168 -6.757 7.129 1.00 0.00 H new ATOM 0 HG2 GLN A 118 5.890 -6.322 4.420 1.00 0.00 H new ATOM 0 HG3 GLN A 118 7.507 -6.908 4.758 1.00 0.00 H new ATOM 0 HE21 GLN A 118 4.056 -7.755 4.718 1.00 0.00 H new ATOM 0 HE22 GLN A 118 4.309 -9.503 4.748 1.00 0.00 H new ATOM 918 N TYR A 119 5.613 -4.320 8.633 1.00 0.00 N ATOM 919 CA TYR A 119 6.324 -3.783 9.805 1.00 0.00 C ATOM 920 C TYR A 119 5.623 -2.637 10.541 1.00 0.00 C ATOM 921 O TYR A 119 6.126 -2.185 11.576 1.00 0.00 O ATOM 922 CB TYR A 119 7.702 -3.275 9.367 1.00 0.00 C ATOM 923 CG TYR A 119 8.584 -4.275 8.649 1.00 0.00 C ATOM 924 CD1 TYR A 119 9.190 -5.312 9.383 1.00 0.00 C ATOM 925 CD2 TYR A 119 8.846 -4.133 7.271 1.00 0.00 C ATOM 926 CE1 TYR A 119 10.028 -6.229 8.731 1.00 0.00 C ATOM 927 CE2 TYR A 119 9.642 -5.081 6.604 1.00 0.00 C ATOM 928 CZ TYR A 119 10.228 -6.140 7.336 1.00 0.00 C ATOM 929 OH TYR A 119 10.985 -7.074 6.702 1.00 0.00 O ATOM 0 H TYR A 119 5.505 -3.657 7.865 1.00 0.00 H new ATOM 0 HA TYR A 119 6.372 -4.616 10.506 1.00 0.00 H new ATOM 0 HB2 TYR A 119 7.559 -2.414 8.715 1.00 0.00 H new ATOM 0 HB3 TYR A 119 8.234 -2.921 10.250 1.00 0.00 H new ATOM 0 HD1 TYR A 119 9.011 -5.401 10.444 1.00 0.00 H new ATOM 0 HD2 TYR A 119 8.435 -3.295 6.727 1.00 0.00 H new ATOM 0 HE1 TYR A 119 10.521 -7.005 9.297 1.00 0.00 H new ATOM 0 HE2 TYR A 119 9.805 -5.001 5.539 1.00 0.00 H new ATOM 0 HH TYR A 119 11.776 -7.277 7.244 1.00 0.00 H new ATOM 939 N GLY A 120 4.525 -2.115 9.995 1.00 0.00 N ATOM 940 CA GLY A 120 4.108 -0.751 10.219 1.00 0.00 C ATOM 941 C GLY A 120 5.033 0.169 9.424 1.00 0.00 C ATOM 942 O GLY A 120 5.987 -0.273 8.779 1.00 0.00 O ATOM 0 H GLY A 120 3.902 -2.640 9.381 1.00 0.00 H new ATOM 0 HA2 GLY A 120 3.073 -0.614 9.904 1.00 0.00 H new ATOM 0 HA3 GLY A 120 4.153 -0.509 11.281 1.00 0.00 H new ATOM 946 N GLU A 121 4.752 1.466 9.477 1.00 0.00 N ATOM 947 CA GLU A 121 5.540 2.493 8.789 1.00 0.00 C ATOM 948 C GLU A 121 7.026 2.442 9.147 1.00 0.00 C ATOM 949 O GLU A 121 7.845 2.905 8.355 1.00 0.00 O ATOM 950 CB GLU A 121 5.047 3.905 9.122 1.00 0.00 C ATOM 951 CG GLU A 121 3.810 4.335 8.339 1.00 0.00 C ATOM 952 CD GLU A 121 3.678 5.859 8.364 1.00 0.00 C ATOM 953 OE1 GLU A 121 3.726 6.455 9.466 1.00 0.00 O ATOM 954 OE2 GLU A 121 3.586 6.482 7.282 1.00 0.00 O ATOM 0 H GLU A 121 3.963 1.842 10.003 1.00 0.00 H new ATOM 0 HA GLU A 121 5.411 2.277 7.729 1.00 0.00 H new ATOM 0 HB2 GLU A 121 4.826 3.959 10.188 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.851 4.614 8.927 1.00 0.00 H new ATOM 0 HG2 GLU A 121 3.882 3.985 7.309 1.00 0.00 H new ATOM 0 HG3 GLU A 121 2.919 3.878 8.770 1.00 0.00 H new ATOM 961 N GLN A 122 7.376 1.945 10.338 1.00 0.00 N ATOM 962 CA GLN A 122 8.717 2.016 10.893 1.00 0.00 C ATOM 963 C GLN A 122 9.743 1.415 9.950 1.00 0.00 C ATOM 964 O GLN A 122 10.422 2.150 9.237 1.00 0.00 O ATOM 965 CB GLN A 122 8.760 1.370 12.287 1.00 0.00 C ATOM 966 CG GLN A 122 8.593 2.425 13.376 1.00 0.00 C ATOM 967 CD GLN A 122 9.748 3.414 13.367 1.00 0.00 C ATOM 968 OE1 GLN A 122 10.883 3.033 13.649 1.00 0.00 O ATOM 969 NE2 GLN A 122 9.483 4.654 12.991 1.00 0.00 N ATOM 0 H GLN A 122 6.713 1.472 10.952 1.00 0.00 H new ATOM 0 HA GLN A 122 8.983 3.067 11.010 1.00 0.00 H new ATOM 0 HB2 GLN A 122 7.970 0.624 12.372 1.00 0.00 H new ATOM 0 HB3 GLN A 122 9.707 0.848 12.422 1.00 0.00 H new ATOM 0 HG2 GLN A 122 7.654 2.958 13.228 1.00 0.00 H new ATOM 0 HG3 GLN A 122 8.534 1.939 14.350 1.00 0.00 H new ATOM 0 HE21 GLN A 122 8.526 4.925 12.767 1.00 0.00 H new ATOM 0 HE22 GLN A 122 10.236 5.339 12.925 1.00 0.00 H new ATOM 978 N ARG A 123 9.864 0.087 9.940 1.00 0.00 N ATOM 979 CA ARG A 123 10.839 -0.584 9.079 1.00 0.00 C ATOM 980 C ARG A 123 10.439 -0.434 7.614 1.00 0.00 C ATOM 981 O ARG A 123 11.320 -0.451 6.755 1.00 0.00 O ATOM 982 CB ARG A 123 11.084 -2.037 9.512 1.00 0.00 C ATOM 983 CG ARG A 123 11.956 -2.239 10.761 1.00 0.00 C ATOM 984 CD ARG A 123 11.591 -1.337 11.948 1.00 0.00 C ATOM 985 NE ARG A 123 12.137 -1.811 13.226 1.00 0.00 N ATOM 986 CZ ARG A 123 13.094 -1.255 13.975 1.00 0.00 C ATOM 987 NH1 ARG A 123 13.915 -0.319 13.505 1.00 0.00 N ATOM 988 NH2 ARG A 123 13.227 -1.645 15.237 1.00 0.00 N ATOM 0 H ARG A 123 9.303 -0.542 10.514 1.00 0.00 H new ATOM 0 HA ARG A 123 11.806 -0.094 9.192 1.00 0.00 H new ATOM 0 HB2 ARG A 123 10.117 -2.508 9.690 1.00 0.00 H new ATOM 0 HB3 ARG A 123 11.549 -2.568 8.681 1.00 0.00 H new ATOM 0 HG2 ARG A 123 11.881 -3.280 11.076 1.00 0.00 H new ATOM 0 HG3 ARG A 123 12.998 -2.061 10.493 1.00 0.00 H new ATOM 0 HD2 ARG A 123 11.958 -0.329 11.756 1.00 0.00 H new ATOM 0 HD3 ARG A 123 10.506 -1.272 12.026 1.00 0.00 H new ATOM 0 HE ARG A 123 11.734 -2.675 13.588 1.00 0.00 H new ATOM 0 HH11 ARG A 123 13.826 -0.001 12.540 1.00 0.00 H new ATOM 0 HH12 ARG A 123 14.633 0.080 14.110 1.00 0.00 H new ATOM 0 HH21 ARG A 123 12.605 -2.357 15.619 1.00 0.00 H new ATOM 0 HH22 ARG A 123 13.951 -1.232 15.825 1.00 0.00 H new ATOM 1002 N ALA A 124 9.165 -0.148 7.325 1.00 0.00 N ATOM 1003 CA ALA A 124 8.744 0.184 5.976 1.00 0.00 C ATOM 1004 C ALA A 124 9.435 1.427 5.411 1.00 0.00 C ATOM 1005 O ALA A 124 9.362 1.636 4.198 1.00 0.00 O ATOM 1006 CB ALA A 124 7.224 0.376 5.943 1.00 0.00 C ATOM 0 H ALA A 124 8.413 -0.142 8.014 1.00 0.00 H new ATOM 0 HA ALA A 124 9.039 -0.652 5.341 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.911 0.625 4.929 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.734 -0.545 6.258 1.00 0.00 H new ATOM 0 HB3 ALA A 124 6.945 1.185 6.618 1.00 0.00 H new ATOM 1012 N TRP A 125 10.099 2.241 6.241 1.00 0.00 N ATOM 1013 CA TRP A 125 11.040 3.238 5.758 1.00 0.00 C ATOM 1014 C TRP A 125 12.444 3.030 6.325 1.00 0.00 C ATOM 1015 O TRP A 125 13.390 3.004 5.559 1.00 0.00 O ATOM 1016 CB TRP A 125 10.460 4.642 5.924 1.00 0.00 C ATOM 1017 CG TRP A 125 11.027 5.693 5.017 1.00 0.00 C ATOM 1018 CD1 TRP A 125 11.355 6.933 5.430 1.00 0.00 C ATOM 1019 CD2 TRP A 125 11.280 5.673 3.570 1.00 0.00 C ATOM 1020 NE1 TRP A 125 11.766 7.692 4.354 1.00 0.00 N ATOM 1021 CE2 TRP A 125 11.744 6.969 3.181 1.00 0.00 C ATOM 1022 CE3 TRP A 125 11.123 4.725 2.528 1.00 0.00 C ATOM 1023 CZ2 TRP A 125 12.046 7.299 1.849 1.00 0.00 C ATOM 1024 CZ3 TRP A 125 11.413 5.047 1.186 1.00 0.00 C ATOM 1025 CH2 TRP A 125 11.876 6.330 0.848 1.00 0.00 C ATOM 0 H TRP A 125 9.995 2.222 7.256 1.00 0.00 H new ATOM 0 HA TRP A 125 11.183 3.110 4.685 1.00 0.00 H new ATOM 0 HB2 TRP A 125 9.383 4.591 5.762 1.00 0.00 H new ATOM 0 HB3 TRP A 125 10.613 4.958 6.956 1.00 0.00 H new ATOM 0 HD1 TRP A 125 11.304 7.281 6.451 1.00 0.00 H new ATOM 0 HE1 TRP A 125 12.051 8.669 4.419 1.00 0.00 H new ATOM 0 HE3 TRP A 125 10.773 3.732 2.768 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 12.405 8.286 1.598 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 11.279 4.304 0.414 1.00 0.00 H new ATOM 0 HH2 TRP A 125 12.101 6.570 -0.181 1.00 0.00 H new ATOM 1036 N ASP A 126 12.608 2.803 7.625 1.00 0.00 N ATOM 1037 CA ASP A 126 13.895 2.561 8.301 1.00 0.00 C ATOM 1038 C ASP A 126 14.757 1.481 7.636 1.00 0.00 C ATOM 1039 O ASP A 126 15.966 1.657 7.490 1.00 0.00 O ATOM 1040 CB ASP A 126 13.601 2.151 9.750 1.00 0.00 C ATOM 1041 CG ASP A 126 14.791 1.633 10.560 1.00 0.00 C ATOM 1042 OD1 ASP A 126 15.703 2.425 10.875 1.00 0.00 O ATOM 1043 OD2 ASP A 126 14.737 0.452 10.982 1.00 0.00 O ATOM 0 H ASP A 126 11.819 2.780 8.271 1.00 0.00 H new ATOM 0 HA ASP A 126 14.470 3.485 8.241 1.00 0.00 H new ATOM 0 HB2 ASP A 126 13.180 3.011 10.271 1.00 0.00 H new ATOM 0 HB3 ASP A 126 12.832 1.378 9.738 1.00 0.00 H new ATOM 1048 N LEU A 127 14.163 0.358 7.221 1.00 0.00 N ATOM 1049 CA LEU A 127 14.897 -0.742 6.596 1.00 0.00 C ATOM 1050 C LEU A 127 15.100 -0.418 5.115 1.00 0.00 C ATOM 1051 O LEU A 127 16.181 -0.585 4.552 1.00 0.00 O ATOM 1052 CB LEU A 127 14.144 -2.053 6.909 1.00 0.00 C ATOM 1053 CG LEU A 127 13.918 -3.096 5.808 1.00 0.00 C ATOM 1054 CD1 LEU A 127 15.237 -3.597 5.237 1.00 0.00 C ATOM 1055 CD2 LEU A 127 13.143 -4.281 6.388 1.00 0.00 C ATOM 0 H LEU A 127 13.161 0.188 7.310 1.00 0.00 H new ATOM 0 HA LEU A 127 15.903 -0.877 6.993 1.00 0.00 H new ATOM 0 HB2 LEU A 127 14.681 -2.549 7.718 1.00 0.00 H new ATOM 0 HB3 LEU A 127 13.164 -1.777 7.299 1.00 0.00 H new ATOM 0 HG LEU A 127 13.353 -2.624 5.004 1.00 0.00 H new ATOM 0 HD11 LEU A 127 15.040 -4.335 4.459 1.00 0.00 H new ATOM 0 HD12 LEU A 127 15.790 -2.760 4.811 1.00 0.00 H new ATOM 0 HD13 LEU A 127 15.826 -4.055 6.031 1.00 0.00 H new ATOM 0 HD21 LEU A 127 12.980 -5.025 5.609 1.00 0.00 H new ATOM 0 HD22 LEU A 127 13.715 -4.727 7.202 1.00 0.00 H new ATOM 0 HD23 LEU A 127 12.181 -3.936 6.767 1.00 0.00 H new ATOM 1067 N ALA A 128 14.071 0.130 4.488 1.00 0.00 N ATOM 1068 CA ALA A 128 14.149 0.727 3.161 1.00 0.00 C ATOM 1069 C ALA A 128 15.296 1.760 3.038 1.00 0.00 C ATOM 1070 O ALA A 128 15.961 1.787 2.005 1.00 0.00 O ATOM 1071 CB ALA A 128 12.772 1.288 2.823 1.00 0.00 C ATOM 0 H ALA A 128 13.137 0.174 4.895 1.00 0.00 H new ATOM 0 HA ALA A 128 14.411 -0.031 2.422 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.798 1.743 1.833 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.038 0.482 2.833 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.495 2.041 3.561 1.00 0.00 H new ATOM 1077 N LEU A 129 15.607 2.552 4.072 1.00 0.00 N ATOM 1078 CA LEU A 129 16.728 3.494 4.106 1.00 0.00 C ATOM 1079 C LEU A 129 18.069 2.770 4.007 1.00 0.00 C ATOM 1080 O LEU A 129 18.964 3.238 3.304 1.00 0.00 O ATOM 1081 CB LEU A 129 16.677 4.359 5.384 1.00 0.00 C ATOM 1082 CG LEU A 129 16.109 5.782 5.233 1.00 0.00 C ATOM 1083 CD1 LEU A 129 16.943 6.675 4.317 1.00 0.00 C ATOM 1084 CD2 LEU A 129 14.658 5.847 4.756 1.00 0.00 C ATOM 0 H LEU A 129 15.065 2.553 4.936 1.00 0.00 H new ATOM 0 HA LEU A 129 16.635 4.147 3.239 1.00 0.00 H new ATOM 0 HB2 LEU A 129 16.080 3.832 6.128 1.00 0.00 H new ATOM 0 HB3 LEU A 129 17.688 4.437 5.783 1.00 0.00 H new ATOM 0 HG LEU A 129 16.152 6.155 6.256 1.00 0.00 H new ATOM 0 HD11 LEU A 129 16.485 7.662 4.256 1.00 0.00 H new ATOM 0 HD12 LEU A 129 17.952 6.767 4.719 1.00 0.00 H new ATOM 0 HD13 LEU A 129 16.988 6.234 3.321 1.00 0.00 H new ATOM 0 HD21 LEU A 129 14.346 6.889 4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 129 14.574 5.371 3.779 1.00 0.00 H new ATOM 0 HD23 LEU A 129 14.017 5.328 5.469 1.00 0.00 H new ATOM 1096 N HIS A 130 18.216 1.622 4.670 1.00 0.00 N ATOM 1097 CA HIS A 130 19.369 0.745 4.480 1.00 0.00 C ATOM 1098 C HIS A 130 19.401 0.243 3.030 1.00 0.00 C ATOM 1099 O HIS A 130 20.459 0.235 2.405 1.00 0.00 O ATOM 1100 CB HIS A 130 19.332 -0.400 5.514 1.00 0.00 C ATOM 1101 CG HIS A 130 19.657 -1.777 4.987 1.00 0.00 C ATOM 1102 ND1 HIS A 130 18.829 -2.560 4.229 1.00 0.00 N flip ATOM 1103 CD2 HIS A 130 20.847 -2.450 5.132 1.00 0.00 C flip ATOM 1104 CE1 HIS A 130 19.509 -3.746 3.937 1.00 0.00 C flip ATOM 1105 NE2 HIS A 130 20.725 -3.628 4.502 1.00 0.00 N flip ATOM 0 H HIS A 130 17.541 1.276 5.352 1.00 0.00 H new ATOM 0 HA HIS A 130 20.296 1.293 4.649 1.00 0.00 H new ATOM 0 HB2 HIS A 130 20.034 -0.164 6.314 1.00 0.00 H new ATOM 0 HB3 HIS A 130 18.338 -0.428 5.960 1.00 0.00 H new ATOM 0 HD2 HIS A 130 21.721 -2.095 5.658 1.00 0.00 H new ATOM 0 HE1 HIS A 130 19.134 -4.587 3.372 1.00 0.00 H new ATOM 0 HE2 HIS A 130 21.455 -4.339 4.457 1.00 0.00 H new ATOM 1113 N THR A 131 18.247 -0.155 2.485 1.00 0.00 N ATOM 1114 CA THR A 131 18.139 -0.763 1.158 1.00 0.00 C ATOM 1115 C THR A 131 18.630 0.234 0.101 1.00 0.00 C ATOM 1116 O THR A 131 19.308 -0.129 -0.860 1.00 0.00 O ATOM 1117 CB THR A 131 16.687 -1.197 0.887 1.00 0.00 C ATOM 1118 OG1 THR A 131 16.159 -1.934 1.980 1.00 0.00 O ATOM 1119 CG2 THR A 131 16.582 -2.071 -0.363 1.00 0.00 C ATOM 0 H THR A 131 17.350 -0.062 2.961 1.00 0.00 H new ATOM 0 HA THR A 131 18.764 -1.655 1.111 1.00 0.00 H new ATOM 0 HB THR A 131 16.117 -0.280 0.742 1.00 0.00 H new ATOM 0 HG1 THR A 131 16.065 -1.345 2.757 1.00 0.00 H new ATOM 0 HG21 THR A 131 15.542 -2.357 -0.521 1.00 0.00 H new ATOM 0 HG22 THR A 131 16.940 -1.513 -1.228 1.00 0.00 H new ATOM 0 HG23 THR A 131 17.189 -2.967 -0.233 1.00 0.00 H new ATOM 1127 N TRP A 132 18.329 1.512 0.323 1.00 0.00 N ATOM 1128 CA TRP A 132 18.772 2.584 -0.561 1.00 0.00 C ATOM 1129 C TRP A 132 20.297 2.707 -0.582 1.00 0.00 C ATOM 1130 O TRP A 132 20.859 3.049 -1.625 1.00 0.00 O ATOM 1131 CB TRP A 132 18.173 3.933 -0.148 1.00 0.00 C ATOM 1132 CG TRP A 132 16.746 4.217 -0.489 1.00 0.00 C ATOM 1133 CD1 TRP A 132 15.821 4.709 0.365 1.00 0.00 C ATOM 1134 CD2 TRP A 132 16.080 4.108 -1.780 1.00 0.00 C ATOM 1135 NE1 TRP A 132 14.626 4.892 -0.296 1.00 0.00 N ATOM 1136 CE2 TRP A 132 14.733 4.553 -1.629 1.00 0.00 C ATOM 1137 CE3 TRP A 132 16.468 3.661 -3.059 1.00 0.00 C ATOM 1138 CZ2 TRP A 132 13.827 4.562 -2.697 1.00 0.00 C ATOM 1139 CZ3 TRP A 132 15.561 3.645 -4.131 1.00 0.00 C ATOM 1140 CH2 TRP A 132 14.242 4.103 -3.958 1.00 0.00 C ATOM 0 H TRP A 132 17.774 1.831 1.117 1.00 0.00 H new ATOM 0 HA TRP A 132 18.422 2.323 -1.560 1.00 0.00 H new ATOM 0 HB2 TRP A 132 18.280 4.025 0.933 1.00 0.00 H new ATOM 0 HB3 TRP A 132 18.783 4.717 -0.597 1.00 0.00 H new ATOM 0 HD1 TRP A 132 15.993 4.926 1.409 1.00 0.00 H new ATOM 0 HE1 TRP A 132 13.772 5.234 0.144 1.00 0.00 H new ATOM 0 HE3 TRP A 132 17.482 3.324 -3.218 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 12.818 4.919 -2.552 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 15.878 3.278 -5.096 1.00 0.00 H new ATOM 0 HH2 TRP A 132 13.553 4.102 -4.790 1.00 0.00 H new ATOM 1151 N GLU A 133 20.974 2.501 0.550 1.00 0.00 N ATOM 1152 CA GLU A 133 22.432 2.535 0.602 1.00 0.00 C ATOM 1153 C GLU A 133 23.007 1.257 -0.012 1.00 0.00 C ATOM 1154 O GLU A 133 23.975 1.341 -0.760 1.00 0.00 O ATOM 1155 CB GLU A 133 22.921 2.790 2.036 1.00 0.00 C ATOM 1156 CG GLU A 133 24.411 3.169 2.027 1.00 0.00 C ATOM 1157 CD GLU A 133 24.899 3.710 3.372 1.00 0.00 C ATOM 1158 OE1 GLU A 133 24.547 4.854 3.742 1.00 0.00 O ATOM 1159 OE2 GLU A 133 25.696 3.032 4.059 1.00 0.00 O ATOM 0 H GLU A 133 20.529 2.308 1.447 1.00 0.00 H new ATOM 0 HA GLU A 133 22.799 3.369 0.004 1.00 0.00 H new ATOM 0 HB2 GLU A 133 22.337 3.590 2.491 1.00 0.00 H new ATOM 0 HB3 GLU A 133 22.768 1.899 2.644 1.00 0.00 H new ATOM 0 HG2 GLU A 133 25.001 2.293 1.758 1.00 0.00 H new ATOM 0 HG3 GLU A 133 24.585 3.919 1.255 1.00 0.00 H new ATOM 1166 N GLN A 134 22.372 0.105 0.225 1.00 0.00 N ATOM 1167 CA GLN A 134 22.713 -1.173 -0.392 1.00 0.00 C ATOM 1168 C GLN A 134 22.751 -1.063 -1.922 1.00 0.00 C ATOM 1169 O GLN A 134 23.688 -1.558 -2.551 1.00 0.00 O ATOM 1170 CB GLN A 134 21.700 -2.246 0.054 1.00 0.00 C ATOM 1171 CG GLN A 134 22.201 -3.137 1.195 1.00 0.00 C ATOM 1172 CD GLN A 134 22.827 -4.418 0.652 1.00 0.00 C ATOM 1173 OE1 GLN A 134 23.930 -4.412 0.108 1.00 0.00 O ATOM 1174 NE2 GLN A 134 22.128 -5.536 0.754 1.00 0.00 N ATOM 0 H GLN A 134 21.585 0.038 0.870 1.00 0.00 H new ATOM 0 HA GLN A 134 23.711 -1.463 -0.063 1.00 0.00 H new ATOM 0 HB2 GLN A 134 20.779 -1.754 0.368 1.00 0.00 H new ATOM 0 HB3 GLN A 134 21.450 -2.874 -0.801 1.00 0.00 H new ATOM 0 HG2 GLN A 134 22.934 -2.594 1.791 1.00 0.00 H new ATOM 0 HG3 GLN A 134 21.372 -3.385 1.858 1.00 0.00 H new ATOM 0 HE21 GLN A 134 21.214 -5.527 1.208 1.00 0.00 H new ATOM 0 HE22 GLN A 134 22.502 -6.408 0.379 1.00 0.00 H new ATOM 1183 N MET A 135 21.747 -0.434 -2.535 1.00 0.00 N ATOM 1184 CA MET A 135 21.703 -0.258 -3.976 1.00 0.00 C ATOM 1185 C MET A 135 22.629 0.853 -4.476 1.00 0.00 C ATOM 1186 O MET A 135 22.917 0.889 -5.671 1.00 0.00 O ATOM 1187 CB MET A 135 20.275 0.089 -4.357 1.00 0.00 C ATOM 1188 CG MET A 135 19.346 -1.105 -4.163 1.00 0.00 C ATOM 1189 SD MET A 135 17.623 -0.627 -4.083 1.00 0.00 S ATOM 1190 CE MET A 135 17.479 0.243 -5.661 1.00 0.00 C ATOM 0 H MET A 135 20.947 -0.036 -2.043 1.00 0.00 H new ATOM 0 HA MET A 135 22.043 -1.185 -4.437 1.00 0.00 H new ATOM 0 HB2 MET A 135 19.927 0.926 -3.751 1.00 0.00 H new ATOM 0 HB3 MET A 135 20.242 0.413 -5.397 1.00 0.00 H new ATOM 0 HG2 MET A 135 19.487 -1.808 -4.984 1.00 0.00 H new ATOM 0 HG3 MET A 135 19.618 -1.627 -3.246 1.00 0.00 H new ATOM 0 HE1 MET A 135 16.500 0.045 -6.098 1.00 0.00 H new ATOM 0 HE2 MET A 135 17.593 1.315 -5.497 1.00 0.00 H new ATOM 0 HE3 MET A 135 18.257 -0.105 -6.341 1.00 0.00 H new ATOM 1200 N GLY A 136 23.104 1.741 -3.600 1.00 0.00 N ATOM 1201 CA GLY A 136 23.958 2.849 -3.987 1.00 0.00 C ATOM 1202 C GLY A 136 23.179 3.982 -4.656 1.00 0.00 C ATOM 1203 O GLY A 136 23.664 4.562 -5.627 1.00 0.00 O ATOM 0 H GLY A 136 22.902 1.705 -2.601 1.00 0.00 H new ATOM 0 HA2 GLY A 136 24.469 3.235 -3.105 1.00 0.00 H new ATOM 0 HA3 GLY A 136 24.728 2.489 -4.670 1.00 0.00 H new ATOM 1207 N LEU A 137 21.991 4.337 -4.149 1.00 0.00 N ATOM 1208 CA LEU A 137 21.214 5.492 -4.606 1.00 0.00 C ATOM 1209 C LEU A 137 21.277 6.611 -3.572 1.00 0.00 C ATOM 1210 O LEU A 137 20.376 6.767 -2.736 1.00 0.00 O ATOM 1211 CB LEU A 137 19.758 5.096 -4.921 1.00 0.00 C ATOM 1212 CG LEU A 137 19.504 4.433 -6.288 1.00 0.00 C ATOM 1213 CD1 LEU A 137 20.083 5.239 -7.447 1.00 0.00 C ATOM 1214 CD2 LEU A 137 20.039 3.010 -6.353 1.00 0.00 C ATOM 0 H LEU A 137 21.537 3.819 -3.397 1.00 0.00 H new ATOM 0 HA LEU A 137 21.654 5.859 -5.533 1.00 0.00 H new ATOM 0 HB2 LEU A 137 19.414 4.415 -4.143 1.00 0.00 H new ATOM 0 HB3 LEU A 137 19.140 5.991 -4.856 1.00 0.00 H new ATOM 0 HG LEU A 137 18.419 4.405 -6.391 1.00 0.00 H new ATOM 0 HD11 LEU A 137 19.875 4.726 -8.386 1.00 0.00 H new ATOM 0 HD12 LEU A 137 19.627 6.229 -7.465 1.00 0.00 H new ATOM 0 HD13 LEU A 137 21.161 5.338 -7.318 1.00 0.00 H new ATOM 0 HD21 LEU A 137 19.834 2.589 -7.337 1.00 0.00 H new ATOM 0 HD22 LEU A 137 21.115 3.017 -6.178 1.00 0.00 H new ATOM 0 HD23 LEU A 137 19.552 2.403 -5.590 1.00 0.00 H new ATOM 1226 N ARG A 138 22.353 7.399 -3.587 1.00 0.00 N ATOM 1227 CA ARG A 138 22.522 8.503 -2.645 1.00 0.00 C ATOM 1228 C ARG A 138 21.418 9.534 -2.814 1.00 0.00 C ATOM 1229 O ARG A 138 20.812 9.949 -1.831 1.00 0.00 O ATOM 1230 CB ARG A 138 23.885 9.172 -2.843 1.00 0.00 C ATOM 1231 CG ARG A 138 24.499 9.568 -1.509 1.00 0.00 C ATOM 1232 CD ARG A 138 25.855 10.199 -1.798 1.00 0.00 C ATOM 1233 NE ARG A 138 26.511 10.595 -0.554 1.00 0.00 N ATOM 1234 CZ ARG A 138 27.700 11.182 -0.451 1.00 0.00 C ATOM 1235 NH1 ARG A 138 28.494 11.320 -1.514 1.00 0.00 N ATOM 1236 NH2 ARG A 138 28.079 11.642 0.730 1.00 0.00 N ATOM 0 H ARG A 138 23.124 7.291 -4.246 1.00 0.00 H new ATOM 0 HA ARG A 138 22.467 8.093 -1.636 1.00 0.00 H new ATOM 0 HB2 ARG A 138 24.555 8.491 -3.368 1.00 0.00 H new ATOM 0 HB3 ARG A 138 23.772 10.055 -3.472 1.00 0.00 H new ATOM 0 HG2 ARG A 138 23.853 10.271 -0.983 1.00 0.00 H new ATOM 0 HG3 ARG A 138 24.611 8.696 -0.865 1.00 0.00 H new ATOM 0 HD2 ARG A 138 26.484 9.492 -2.338 1.00 0.00 H new ATOM 0 HD3 ARG A 138 25.728 11.069 -2.442 1.00 0.00 H new ATOM 0 HE ARG A 138 26.012 10.404 0.315 1.00 0.00 H new ATOM 0 HH11 ARG A 138 28.192 10.973 -2.424 1.00 0.00 H new ATOM 0 HH12 ARG A 138 29.403 11.773 -1.416 1.00 0.00 H new ATOM 0 HH21 ARG A 138 27.464 11.543 1.537 1.00 0.00 H new ATOM 0 HH22 ARG A 138 28.987 12.096 0.833 1.00 0.00 H new ATOM 1250 N SER A 139 21.101 9.874 -4.062 1.00 0.00 N ATOM 1251 CA SER A 139 20.075 10.836 -4.446 1.00 0.00 C ATOM 1252 C SER A 139 18.644 10.434 -4.037 1.00 0.00 C ATOM 1253 O SER A 139 17.676 11.108 -4.400 1.00 0.00 O ATOM 1254 CB SER A 139 20.198 11.068 -5.950 1.00 0.00 C ATOM 1255 OG SER A 139 19.795 9.906 -6.651 1.00 0.00 O ATOM 0 H SER A 139 21.575 9.467 -4.868 1.00 0.00 H new ATOM 0 HA SER A 139 20.248 11.761 -3.897 1.00 0.00 H new ATOM 0 HB2 SER A 139 19.581 11.915 -6.248 1.00 0.00 H new ATOM 0 HB3 SER A 139 21.228 11.319 -6.205 1.00 0.00 H new ATOM 0 HG SER A 139 19.874 10.062 -7.615 1.00 0.00 H new ATOM 1261 N LEU A 140 18.477 9.287 -3.375 1.00 0.00 N ATOM 1262 CA LEU A 140 17.238 8.848 -2.765 1.00 0.00 C ATOM 1263 C LEU A 140 17.377 9.012 -1.258 1.00 0.00 C ATOM 1264 O LEU A 140 16.541 9.670 -0.648 1.00 0.00 O ATOM 1265 CB LEU A 140 16.951 7.385 -3.134 1.00 0.00 C ATOM 1266 CG LEU A 140 16.288 7.148 -4.511 1.00 0.00 C ATOM 1267 CD1 LEU A 140 14.904 7.804 -4.580 1.00 0.00 C ATOM 1268 CD2 LEU A 140 17.100 7.494 -5.767 1.00 0.00 C ATOM 0 H LEU A 140 19.237 8.618 -3.249 1.00 0.00 H new ATOM 0 HA LEU A 140 16.401 9.445 -3.127 1.00 0.00 H new ATOM 0 HB2 LEU A 140 17.891 6.834 -3.106 1.00 0.00 H new ATOM 0 HB3 LEU A 140 16.308 6.957 -2.365 1.00 0.00 H new ATOM 0 HG LEU A 140 16.214 6.061 -4.548 1.00 0.00 H new ATOM 0 HD11 LEU A 140 14.463 7.620 -5.560 1.00 0.00 H new ATOM 0 HD12 LEU A 140 14.262 7.381 -3.808 1.00 0.00 H new ATOM 0 HD13 LEU A 140 15.002 8.878 -4.422 1.00 0.00 H new ATOM 0 HD21 LEU A 140 16.507 7.276 -6.655 1.00 0.00 H new ATOM 0 HD22 LEU A 140 17.357 8.553 -5.754 1.00 0.00 H new ATOM 0 HD23 LEU A 140 18.013 6.899 -5.785 1.00 0.00 H new ATOM 1280 N CYS A 141 18.434 8.448 -0.664 1.00 0.00 N ATOM 1281 CA CYS A 141 18.752 8.580 0.757 1.00 0.00 C ATOM 1282 C CYS A 141 18.814 10.035 1.234 1.00 0.00 C ATOM 1283 O CYS A 141 18.225 10.346 2.264 1.00 0.00 O ATOM 1284 CB CYS A 141 20.090 7.896 1.039 1.00 0.00 C ATOM 1285 SG CYS A 141 19.821 6.228 1.670 1.00 0.00 S ATOM 0 H CYS A 141 19.107 7.874 -1.172 1.00 0.00 H new ATOM 0 HA CYS A 141 17.943 8.102 1.309 1.00 0.00 H new ATOM 0 HB2 CYS A 141 20.685 7.855 0.126 1.00 0.00 H new ATOM 0 HB3 CYS A 141 20.658 8.479 1.764 1.00 0.00 H new ATOM 0 HG CYS A 141 20.968 5.662 1.902 1.00 0.00 H new ATOM 1291 N ALA A 142 19.502 10.919 0.513 1.00 0.00 N ATOM 1292 CA ALA A 142 19.637 12.324 0.871 1.00 0.00 C ATOM 1293 C ALA A 142 18.236 12.926 1.051 1.00 0.00 C ATOM 1294 O ALA A 142 17.782 13.165 2.176 1.00 0.00 O ATOM 1295 CB ALA A 142 20.483 13.019 -0.203 1.00 0.00 C ATOM 0 H ALA A 142 19.988 10.672 -0.349 1.00 0.00 H new ATOM 0 HA ALA A 142 20.156 12.461 1.820 1.00 0.00 H new ATOM 0 HB1 ALA A 142 20.595 14.074 0.048 1.00 0.00 H new ATOM 0 HB2 ALA A 142 21.466 12.551 -0.251 1.00 0.00 H new ATOM 0 HB3 ALA A 142 19.990 12.927 -1.171 1.00 0.00 H new ATOM 1301 N GLN A 143 17.487 13.017 -0.051 1.00 0.00 N ATOM 1302 CA GLN A 143 16.101 13.469 -0.086 1.00 0.00 C ATOM 1303 C GLN A 143 15.158 12.678 0.834 1.00 0.00 C ATOM 1304 O GLN A 143 14.067 13.166 1.150 1.00 0.00 O ATOM 1305 CB GLN A 143 15.599 13.393 -1.535 1.00 0.00 C ATOM 1306 CG GLN A 143 16.136 14.538 -2.407 1.00 0.00 C ATOM 1307 CD GLN A 143 17.177 14.056 -3.409 1.00 0.00 C ATOM 1308 OE1 GLN A 143 18.256 13.589 -3.050 1.00 0.00 O ATOM 1309 NE2 GLN A 143 16.876 14.129 -4.695 1.00 0.00 N ATOM 0 H GLN A 143 17.845 12.769 -0.973 1.00 0.00 H new ATOM 0 HA GLN A 143 16.090 14.492 0.290 1.00 0.00 H new ATOM 0 HB2 GLN A 143 15.898 12.439 -1.970 1.00 0.00 H new ATOM 0 HB3 GLN A 143 14.509 13.418 -1.540 1.00 0.00 H new ATOM 0 HG2 GLN A 143 15.308 15.005 -2.941 1.00 0.00 H new ATOM 0 HG3 GLN A 143 16.576 15.304 -1.768 1.00 0.00 H new ATOM 0 HE21 GLN A 143 15.979 14.517 -4.988 1.00 0.00 H new ATOM 0 HE22 GLN A 143 17.541 13.797 -5.394 1.00 0.00 H new ATOM 1318 N ALA A 144 15.514 11.464 1.267 1.00 0.00 N ATOM 1319 CA ALA A 144 14.682 10.669 2.159 1.00 0.00 C ATOM 1320 C ALA A 144 14.626 11.256 3.561 1.00 0.00 C ATOM 1321 O ALA A 144 13.661 10.930 4.254 1.00 0.00 O ATOM 1322 CB ALA A 144 15.134 9.208 2.234 1.00 0.00 C ATOM 0 H ALA A 144 16.389 11.010 1.005 1.00 0.00 H new ATOM 0 HA ALA A 144 13.682 10.696 1.727 1.00 0.00 H new ATOM 0 HB1 ALA A 144 14.481 8.659 2.912 1.00 0.00 H new ATOM 0 HB2 ALA A 144 15.085 8.760 1.241 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.159 9.163 2.602 1.00 0.00 H new ATOM 1328 N GLN A 145 15.590 12.094 3.988 1.00 0.00 N ATOM 1329 CA GLN A 145 15.516 12.756 5.296 1.00 0.00 C ATOM 1330 C GLN A 145 15.649 14.280 5.169 1.00 0.00 C ATOM 1331 O GLN A 145 15.782 14.980 6.168 1.00 0.00 O ATOM 1332 CB GLN A 145 16.402 12.160 6.405 1.00 0.00 C ATOM 1333 CG GLN A 145 16.032 10.697 6.717 1.00 0.00 C ATOM 1334 CD GLN A 145 17.047 9.737 6.160 1.00 0.00 C ATOM 1335 OE1 GLN A 145 17.418 9.943 4.919 1.00 0.00 O flip ATOM 1336 NE2 GLN A 145 17.547 8.858 6.851 1.00 0.00 N flip ATOM 0 H GLN A 145 16.423 12.325 3.447 1.00 0.00 H new ATOM 0 HA GLN A 145 14.510 12.538 5.654 1.00 0.00 H new ATOM 0 HB2 GLN A 145 17.447 12.212 6.101 1.00 0.00 H new ATOM 0 HB3 GLN A 145 16.303 12.760 7.310 1.00 0.00 H new ATOM 0 HG2 GLN A 145 15.957 10.562 7.796 1.00 0.00 H new ATOM 0 HG3 GLN A 145 15.051 10.472 6.299 1.00 0.00 H new ATOM 0 HE21 GLN A 145 17.234 8.726 7.813 1.00 0.00 H new ATOM 0 HE22 GLN A 145 18.276 8.258 6.465 1.00 0.00 H new ATOM 1345 N GLU A 146 15.591 14.811 3.948 1.00 0.00 N ATOM 1346 CA GLU A 146 15.721 16.235 3.641 1.00 0.00 C ATOM 1347 C GLU A 146 14.409 16.784 3.052 1.00 0.00 C ATOM 1348 O GLU A 146 14.361 17.883 2.500 1.00 0.00 O ATOM 1349 CB GLU A 146 16.952 16.423 2.741 1.00 0.00 C ATOM 1350 CG GLU A 146 18.260 16.320 3.544 1.00 0.00 C ATOM 1351 CD GLU A 146 19.460 16.885 2.773 1.00 0.00 C ATOM 1352 OE1 GLU A 146 19.714 16.420 1.636 1.00 0.00 O ATOM 1353 OE2 GLU A 146 20.131 17.790 3.321 1.00 0.00 O ATOM 0 H GLU A 146 15.447 14.240 3.115 1.00 0.00 H new ATOM 0 HA GLU A 146 15.888 16.823 4.543 1.00 0.00 H new ATOM 0 HB2 GLU A 146 16.947 15.669 1.954 1.00 0.00 H new ATOM 0 HB3 GLU A 146 16.900 17.395 2.251 1.00 0.00 H new ATOM 0 HG2 GLU A 146 18.149 16.858 4.486 1.00 0.00 H new ATOM 0 HG3 GLU A 146 18.450 15.276 3.794 1.00 0.00 H new ATOM 1360 N GLY A 147 13.315 16.030 3.195 1.00 0.00 N ATOM 1361 CA GLY A 147 11.970 16.529 2.961 1.00 0.00 C ATOM 1362 C GLY A 147 11.663 16.773 1.486 1.00 0.00 C ATOM 1363 O GLY A 147 11.130 17.827 1.139 1.00 0.00 O ATOM 0 H GLY A 147 13.345 15.051 3.478 1.00 0.00 H new ATOM 0 HA2 GLY A 147 11.251 15.815 3.361 1.00 0.00 H new ATOM 0 HA3 GLY A 147 11.835 17.460 3.512 1.00 0.00 H new ATOM 1367 N ALA A 148 11.960 15.802 0.613 1.00 0.00 N ATOM 1368 CA ALA A 148 11.340 15.722 -0.692 1.00 0.00 C ATOM 1369 C ALA A 148 9.947 15.095 -0.536 1.00 0.00 C ATOM 1370 O ALA A 148 9.419 14.956 0.568 1.00 0.00 O ATOM 1371 CB ALA A 148 12.256 14.907 -1.610 1.00 0.00 C ATOM 0 H ALA A 148 12.634 15.060 0.801 1.00 0.00 H new ATOM 0 HA ALA A 148 11.207 16.706 -1.141 1.00 0.00 H new ATOM 0 HB1 ALA A 148 11.807 14.834 -2.601 1.00 0.00 H new ATOM 0 HB2 ALA A 148 13.226 15.399 -1.686 1.00 0.00 H new ATOM 0 HB3 ALA A 148 12.388 13.907 -1.197 1.00 0.00 H new ATOM 1377 N GLY A 149 9.366 14.681 -1.650 1.00 0.00 N ATOM 1378 CA GLY A 149 7.971 14.278 -1.796 1.00 0.00 C ATOM 1379 C GLY A 149 7.521 14.466 -3.246 1.00 0.00 C ATOM 1380 O GLY A 149 8.370 14.460 -4.140 1.00 0.00 O ATOM 0 H GLY A 149 9.881 14.612 -2.528 1.00 0.00 H new ATOM 0 HA2 GLY A 149 7.853 13.235 -1.502 1.00 0.00 H new ATOM 0 HA3 GLY A 149 7.341 14.870 -1.132 1.00 0.00 H new ATOM 1384 N HIS A 150 6.211 14.604 -3.484 1.00 0.00 N ATOM 1385 CA HIS A 150 5.661 15.002 -4.779 1.00 0.00 C ATOM 1386 C HIS A 150 4.674 16.155 -4.579 1.00 0.00 C ATOM 1387 O HIS A 150 5.065 17.318 -4.708 1.00 0.00 O ATOM 1388 CB HIS A 150 5.062 13.816 -5.559 1.00 0.00 C ATOM 1389 CG HIS A 150 4.454 14.239 -6.881 1.00 0.00 C ATOM 1390 ND1 HIS A 150 3.179 13.958 -7.327 1.00 0.00 N ATOM 1391 CD2 HIS A 150 5.030 15.083 -7.797 1.00 0.00 C ATOM 1392 CE1 HIS A 150 2.987 14.632 -8.470 1.00 0.00 C ATOM 1393 NE2 HIS A 150 4.083 15.346 -8.798 1.00 0.00 N ATOM 0 H HIS A 150 5.498 14.440 -2.773 1.00 0.00 H new ATOM 0 HA HIS A 150 6.475 15.359 -5.410 1.00 0.00 H new ATOM 0 HB2 HIS A 150 5.840 13.075 -5.741 1.00 0.00 H new ATOM 0 HB3 HIS A 150 4.298 13.333 -4.949 1.00 0.00 H new ATOM 0 HD2 HIS A 150 6.035 15.476 -7.755 1.00 0.00 H new ATOM 0 HE1 HIS A 150 2.077 14.607 -9.050 1.00 0.00 H new ATOM 0 HE2 HIS A 150 4.200 15.954 -9.609 1.00 0.00 H new ATOM 1401 N SER A 151 3.401 15.872 -4.287 1.00 0.00 N ATOM 1402 CA SER A 151 2.363 16.887 -4.225 1.00 0.00 C ATOM 1403 C SER A 151 1.125 16.327 -3.522 1.00 0.00 C ATOM 1404 O SER A 151 1.243 15.548 -2.574 1.00 0.00 O ATOM 1405 CB SER A 151 2.079 17.388 -5.648 1.00 0.00 C ATOM 1406 OG SER A 151 1.496 16.390 -6.456 1.00 0.00 O ATOM 0 H SER A 151 3.068 14.929 -4.088 1.00 0.00 H new ATOM 0 HA SER A 151 2.688 17.743 -3.633 1.00 0.00 H new ATOM 0 HB2 SER A 151 1.414 18.251 -5.602 1.00 0.00 H new ATOM 0 HB3 SER A 151 3.009 17.726 -6.105 1.00 0.00 H new ATOM 0 HG SER A 151 1.330 16.750 -7.352 1.00 0.00 H new TER 1412 SER A 151