USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 960 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 104 SER OG : rot -75:sc= 1.25 USER MOD Set 1.2: A 119 LYS NZ :NH3+ 150:sc= -0.631 (180deg=-2.45!) USER MOD Set 2.1: A 63 MET CE :methyl -160:sc= 0 (180deg=-0.138) USER MOD Set 2.2: A 71 THR OG1 : rot 82:sc= 1.31 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0.56 (180deg=0.56) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 110:sc= 0.0525 USER MOD Single : A 17 MET CE :methyl -178:sc= -0.586 (180deg=-0.602) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 ASN : amide:sc=-0.000313 K(o=-0.00031,f=-0.84) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 LYS NZ :NH3+ -168:sc= 1.26 (180deg=1.17) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 76:sc= 0.973 USER MOD Single : A 59 ASN : amide:sc= 0.63 K(o=0.63,f=-3.2!) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN :FLIP amide:sc=-0.000103 F(o=-0.89,f=-0.0001) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 161:sc= -0.153 (180deg=-0.324) USER MOD Single : A 79 SER OG : rot 180:sc= -0.0533 USER MOD Single : A 85 MET CE :methyl 155:sc= -0.819 (180deg=-2.36!) USER MOD Single : A 87 THR OG1 : rot 57:sc= 1.21 USER MOD Single : A 91 LYS NZ :NH3+ 172:sc= 1.24 (180deg=1.17) USER MOD Single : A 92 LYS NZ :NH3+ 167:sc=-0.00532 (180deg=-0.146) USER MOD Single : A 94 ASN : amide:sc= -0.81 K(o=-0.81,f=-1.6!) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 TYR OH : rot -4:sc= 1.02 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc=-0.00521 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 122 LYS NZ :NH3+ -158:sc= 1.07 (180deg=0.162) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 79 N LEU A 6 11.045 -10.290 0.402 1.00 0.00 N ATOM 80 CA LEU A 6 9.773 -9.592 0.483 1.00 0.00 C ATOM 81 C LEU A 6 10.052 -8.100 0.488 1.00 0.00 C ATOM 82 O LEU A 6 10.586 -7.562 1.456 1.00 0.00 O ATOM 83 CB LEU A 6 8.987 -10.005 1.734 1.00 0.00 C ATOM 84 CG LEU A 6 7.661 -9.210 1.816 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.475 -10.158 1.962 1.00 0.00 C ATOM 86 CD2 LEU A 6 7.639 -8.202 2.964 1.00 0.00 C ATOM 0 HA LEU A 6 9.157 -9.855 -0.377 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.778 -11.074 1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 6 9.586 -9.822 2.626 1.00 0.00 H new ATOM 0 HG LEU A 6 7.585 -8.652 0.883 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.552 -9.580 2.018 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.434 -10.825 1.101 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.590 -10.747 2.872 1.00 0.00 H new ATOM 0 HD21 LEU A 6 6.684 -7.677 2.969 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.769 -8.726 3.911 1.00 0.00 H new ATOM 0 HD23 LEU A 6 8.448 -7.483 2.833 1.00 0.00 H new ATOM 98 N LYS A 7 9.802 -7.482 -0.654 1.00 0.00 N ATOM 99 CA LYS A 7 9.784 -6.042 -0.802 1.00 0.00 C ATOM 100 C LYS A 7 8.399 -5.467 -0.587 1.00 0.00 C ATOM 101 O LYS A 7 7.415 -6.203 -0.508 1.00 0.00 O ATOM 102 CB LYS A 7 10.456 -5.594 -2.103 1.00 0.00 C ATOM 103 CG LYS A 7 9.697 -5.866 -3.402 1.00 0.00 C ATOM 104 CD LYS A 7 9.798 -7.335 -3.836 1.00 0.00 C ATOM 105 CE LYS A 7 9.534 -7.514 -5.337 1.00 0.00 C ATOM 106 NZ LYS A 7 9.658 -8.937 -5.710 1.00 0.00 N ATOM 0 H LYS A 7 9.602 -7.981 -1.521 1.00 0.00 H new ATOM 0 HA LYS A 7 10.394 -5.617 -0.005 1.00 0.00 H new ATOM 0 HB2 LYS A 7 10.643 -4.522 -2.037 1.00 0.00 H new ATOM 0 HB3 LYS A 7 11.428 -6.083 -2.169 1.00 0.00 H new ATOM 0 HG2 LYS A 7 8.648 -5.599 -3.271 1.00 0.00 H new ATOM 0 HG3 LYS A 7 10.092 -5.227 -4.192 1.00 0.00 H new ATOM 0 HD2 LYS A 7 10.790 -7.716 -3.595 1.00 0.00 H new ATOM 0 HD3 LYS A 7 9.082 -7.930 -3.269 1.00 0.00 H new ATOM 0 HE2 LYS A 7 8.536 -7.151 -5.584 1.00 0.00 H new ATOM 0 HE3 LYS A 7 10.242 -6.917 -5.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 9.477 -9.046 -6.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 10.618 -9.271 -5.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 8.966 -9.498 -5.174 1.00 0.00 H new ATOM 120 N PHE A 8 8.332 -4.148 -0.651 1.00 0.00 N ATOM 121 CA PHE A 8 7.142 -3.330 -0.588 1.00 0.00 C ATOM 122 C PHE A 8 7.129 -2.507 -1.864 1.00 0.00 C ATOM 123 O PHE A 8 8.118 -1.833 -2.145 1.00 0.00 O ATOM 124 CB PHE A 8 7.234 -2.403 0.635 1.00 0.00 C ATOM 125 CG PHE A 8 6.935 -3.055 1.971 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.727 -4.100 2.479 1.00 0.00 C ATOM 127 CD2 PHE A 8 5.827 -2.615 2.712 1.00 0.00 C ATOM 128 CE1 PHE A 8 7.348 -4.748 3.665 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.441 -3.267 3.891 1.00 0.00 C ATOM 130 CZ PHE A 8 6.201 -4.345 4.366 1.00 0.00 C ATOM 0 H PHE A 8 9.174 -3.583 -0.756 1.00 0.00 H new ATOM 0 HA PHE A 8 6.236 -3.930 -0.496 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.238 -1.979 0.673 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.543 -1.572 0.493 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.624 -4.403 1.959 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.263 -1.761 2.368 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.945 -5.565 4.042 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.564 -2.941 4.430 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.905 -4.863 5.267 1.00 0.00 H new ATOM 140 N LEU A 9 6.066 -2.562 -2.660 1.00 0.00 N ATOM 141 CA LEU A 9 5.813 -1.489 -3.607 1.00 0.00 C ATOM 142 C LEU A 9 5.074 -0.407 -2.827 1.00 0.00 C ATOM 143 O LEU A 9 4.153 -0.728 -2.070 1.00 0.00 O ATOM 144 CB LEU A 9 4.981 -1.974 -4.802 1.00 0.00 C ATOM 145 CG LEU A 9 4.993 -0.935 -5.937 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.335 -0.913 -6.678 1.00 0.00 C ATOM 147 CD2 LEU A 9 3.892 -1.245 -6.945 1.00 0.00 C ATOM 0 H LEU A 9 5.383 -3.319 -2.668 1.00 0.00 H new ATOM 0 HA LEU A 9 6.745 -1.112 -4.027 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.378 -2.921 -5.166 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.955 -2.160 -4.484 1.00 0.00 H new ATOM 0 HG LEU A 9 4.829 0.040 -5.478 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.301 -0.166 -7.471 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.133 -0.663 -5.979 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.527 -1.894 -7.112 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.910 -0.503 -7.743 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.054 -2.237 -7.367 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.923 -1.217 -6.446 1.00 0.00 H new ATOM 159 N VAL A 10 5.482 0.847 -2.995 1.00 0.00 N ATOM 160 CA VAL A 10 4.929 1.992 -2.284 1.00 0.00 C ATOM 161 C VAL A 10 4.684 3.077 -3.335 1.00 0.00 C ATOM 162 O VAL A 10 5.593 3.825 -3.689 1.00 0.00 O ATOM 163 CB VAL A 10 5.874 2.425 -1.133 1.00 0.00 C ATOM 164 CG1 VAL A 10 5.199 3.481 -0.251 1.00 0.00 C ATOM 165 CG2 VAL A 10 6.296 1.271 -0.205 1.00 0.00 C ATOM 0 H VAL A 10 6.225 1.100 -3.646 1.00 0.00 H new ATOM 0 HA VAL A 10 3.985 1.762 -1.791 1.00 0.00 H new ATOM 0 HB VAL A 10 6.762 2.814 -1.632 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.877 3.773 0.551 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.953 4.355 -0.854 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.286 3.067 0.178 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.956 1.653 0.574 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.411 0.830 0.253 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.821 0.511 -0.784 1.00 0.00 H new ATOM 175 N VAL A 11 3.475 3.124 -3.894 1.00 0.00 N ATOM 176 CA VAL A 11 3.066 4.076 -4.931 1.00 0.00 C ATOM 177 C VAL A 11 2.362 5.246 -4.230 1.00 0.00 C ATOM 178 O VAL A 11 1.220 5.600 -4.525 1.00 0.00 O ATOM 179 CB VAL A 11 2.233 3.368 -6.028 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.213 4.168 -7.342 1.00 0.00 C ATOM 181 CG2 VAL A 11 2.807 1.976 -6.340 1.00 0.00 C ATOM 0 H VAL A 11 2.728 2.481 -3.630 1.00 0.00 H new ATOM 0 HA VAL A 11 3.919 4.485 -5.473 1.00 0.00 H new ATOM 0 HB VAL A 11 1.220 3.287 -5.635 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.618 3.635 -8.083 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.776 5.150 -7.163 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.232 4.286 -7.711 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.205 1.499 -7.113 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.834 2.076 -6.690 1.00 0.00 H new ATOM 0 HG23 VAL A 11 2.789 1.365 -5.438 1.00 0.00 H new ATOM 191 N ASP A 12 3.038 5.793 -3.224 1.00 0.00 N ATOM 192 CA ASP A 12 2.645 6.992 -2.499 1.00 0.00 C ATOM 193 C ASP A 12 2.838 8.151 -3.478 1.00 0.00 C ATOM 194 O ASP A 12 3.971 8.533 -3.771 1.00 0.00 O ATOM 195 CB ASP A 12 3.527 7.180 -1.252 1.00 0.00 C ATOM 196 CG ASP A 12 2.912 6.661 0.047 1.00 0.00 C ATOM 197 OD1 ASP A 12 2.711 5.432 0.148 1.00 0.00 O ATOM 198 OD2 ASP A 12 2.762 7.484 0.976 1.00 0.00 O ATOM 0 H ASP A 12 3.911 5.394 -2.879 1.00 0.00 H new ATOM 0 HA ASP A 12 1.614 6.932 -2.150 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.478 6.673 -1.416 1.00 0.00 H new ATOM 0 HB3 ASP A 12 3.747 8.241 -1.136 1.00 0.00 H new ATOM 203 N ASP A 13 1.735 8.679 -4.015 1.00 0.00 N ATOM 204 CA ASP A 13 1.697 9.743 -5.028 1.00 0.00 C ATOM 205 C ASP A 13 2.606 10.918 -4.663 1.00 0.00 C ATOM 206 O ASP A 13 3.322 11.445 -5.517 1.00 0.00 O ATOM 207 CB ASP A 13 0.247 10.232 -5.192 1.00 0.00 C ATOM 208 CG ASP A 13 0.164 11.592 -5.890 1.00 0.00 C ATOM 209 OD1 ASP A 13 0.178 11.637 -7.140 1.00 0.00 O ATOM 210 OD2 ASP A 13 0.108 12.621 -5.180 1.00 0.00 O ATOM 0 H ASP A 13 0.803 8.365 -3.746 1.00 0.00 H new ATOM 0 HA ASP A 13 2.065 9.329 -5.967 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.318 9.497 -5.766 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.223 10.301 -4.211 1.00 0.00 H new ATOM 215 N PHE A 14 2.583 11.328 -3.397 1.00 0.00 N ATOM 216 CA PHE A 14 3.405 12.401 -2.870 1.00 0.00 C ATOM 217 C PHE A 14 4.742 11.811 -2.416 1.00 0.00 C ATOM 218 O PHE A 14 4.771 11.030 -1.468 1.00 0.00 O ATOM 219 CB PHE A 14 2.644 13.064 -1.713 1.00 0.00 C ATOM 220 CG PHE A 14 3.364 14.178 -0.969 1.00 0.00 C ATOM 221 CD1 PHE A 14 4.282 15.033 -1.616 1.00 0.00 C ATOM 222 CD2 PHE A 14 3.062 14.397 0.387 1.00 0.00 C ATOM 223 CE1 PHE A 14 4.882 16.093 -0.914 1.00 0.00 C ATOM 224 CE2 PHE A 14 3.659 15.457 1.087 1.00 0.00 C ATOM 225 CZ PHE A 14 4.561 16.317 0.436 1.00 0.00 C ATOM 0 H PHE A 14 1.974 10.908 -2.695 1.00 0.00 H new ATOM 0 HA PHE A 14 3.612 13.161 -3.623 1.00 0.00 H new ATOM 0 HB2 PHE A 14 1.710 13.466 -2.106 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.379 12.290 -0.993 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.525 14.872 -2.656 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.366 13.745 0.893 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.591 16.737 -1.413 1.00 0.00 H new ATOM 0 HE2 PHE A 14 3.425 15.613 2.130 1.00 0.00 H new ATOM 0 HZ PHE A 14 5.004 17.144 0.970 1.00 0.00 H new ATOM 235 N SER A 15 5.856 12.212 -3.035 1.00 0.00 N ATOM 236 CA SER A 15 7.177 11.627 -2.809 1.00 0.00 C ATOM 237 C SER A 15 7.514 11.605 -1.310 1.00 0.00 C ATOM 238 O SER A 15 7.814 10.546 -0.756 1.00 0.00 O ATOM 239 CB SER A 15 8.223 12.388 -3.643 1.00 0.00 C ATOM 240 OG SER A 15 9.396 11.624 -3.847 1.00 0.00 O ATOM 0 H SER A 15 5.863 12.967 -3.720 1.00 0.00 H new ATOM 0 HA SER A 15 7.182 10.588 -3.138 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.792 12.656 -4.608 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.480 13.320 -3.139 1.00 0.00 H new ATOM 0 HG SER A 15 10.034 12.141 -4.382 1.00 0.00 H new ATOM 246 N THR A 16 7.386 12.745 -0.616 1.00 0.00 N ATOM 247 CA THR A 16 7.614 12.840 0.826 1.00 0.00 C ATOM 248 C THR A 16 6.806 11.788 1.588 1.00 0.00 C ATOM 249 O THR A 16 7.301 11.212 2.550 1.00 0.00 O ATOM 250 CB THR A 16 7.227 14.243 1.317 1.00 0.00 C ATOM 251 OG1 THR A 16 7.934 15.237 0.597 1.00 0.00 O ATOM 252 CG2 THR A 16 7.486 14.446 2.813 1.00 0.00 C ATOM 0 H THR A 16 7.119 13.631 -1.046 1.00 0.00 H new ATOM 0 HA THR A 16 8.672 12.658 1.016 1.00 0.00 H new ATOM 0 HB THR A 16 6.155 14.335 1.144 1.00 0.00 H new ATOM 0 HG1 THR A 16 7.314 15.719 0.011 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.193 15.456 3.099 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.904 13.723 3.384 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.546 14.303 3.021 1.00 0.00 H new ATOM 260 N MET A 17 5.570 11.524 1.180 1.00 0.00 N ATOM 261 CA MET A 17 4.731 10.504 1.781 1.00 0.00 C ATOM 262 C MET A 17 5.396 9.132 1.616 1.00 0.00 C ATOM 263 O MET A 17 5.550 8.441 2.623 1.00 0.00 O ATOM 264 CB MET A 17 3.325 10.631 1.180 1.00 0.00 C ATOM 265 CG MET A 17 2.186 10.435 2.178 1.00 0.00 C ATOM 266 SD MET A 17 0.585 11.069 1.611 1.00 0.00 S ATOM 267 CE MET A 17 0.329 9.940 0.214 1.00 0.00 C ATOM 0 H MET A 17 5.120 12.021 0.412 1.00 0.00 H new ATOM 0 HA MET A 17 4.618 10.632 2.858 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.226 11.617 0.725 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.219 9.899 0.380 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.087 9.371 2.395 1.00 0.00 H new ATOM 0 HG3 MET A 17 2.449 10.928 3.114 1.00 0.00 H new ATOM 0 HE1 MET A 17 -0.601 10.195 -0.294 1.00 0.00 H new ATOM 0 HE2 MET A 17 1.161 10.031 -0.484 1.00 0.00 H new ATOM 0 HE3 MET A 17 0.273 8.915 0.580 1.00 0.00 H new ATOM 277 N ARG A 18 5.981 8.807 0.448 1.00 0.00 N ATOM 278 CA ARG A 18 6.694 7.535 0.276 1.00 0.00 C ATOM 279 C ARG A 18 7.888 7.483 1.204 1.00 0.00 C ATOM 280 O ARG A 18 8.229 6.429 1.750 1.00 0.00 O ATOM 281 CB ARG A 18 7.180 7.349 -1.178 1.00 0.00 C ATOM 282 CG ARG A 18 7.599 5.891 -1.460 1.00 0.00 C ATOM 283 CD ARG A 18 9.105 5.651 -1.660 1.00 0.00 C ATOM 284 NE ARG A 18 9.918 5.817 -0.444 1.00 0.00 N ATOM 285 CZ ARG A 18 11.257 5.767 -0.408 1.00 0.00 C ATOM 286 NH1 ARG A 18 11.957 5.482 -1.495 1.00 0.00 N ATOM 287 NH2 ARG A 18 11.900 5.999 0.734 1.00 0.00 N ATOM 0 H ARG A 18 5.973 9.403 -0.380 1.00 0.00 H new ATOM 0 HA ARG A 18 5.996 6.732 0.514 1.00 0.00 H new ATOM 0 HB2 ARG A 18 6.386 7.639 -1.866 1.00 0.00 H new ATOM 0 HB3 ARG A 18 8.024 8.013 -1.367 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.259 5.269 -0.632 1.00 0.00 H new ATOM 0 HG3 ARG A 18 7.075 5.549 -2.352 1.00 0.00 H new ATOM 0 HD2 ARG A 18 9.251 4.641 -2.044 1.00 0.00 H new ATOM 0 HD3 ARG A 18 9.471 6.338 -2.423 1.00 0.00 H new ATOM 0 HE ARG A 18 9.427 5.982 0.435 1.00 0.00 H new ATOM 0 HH11 ARG A 18 11.478 5.297 -2.376 1.00 0.00 H new ATOM 0 HH12 ARG A 18 12.975 5.448 -1.451 1.00 0.00 H new ATOM 0 HH21 ARG A 18 11.374 6.215 1.581 1.00 0.00 H new ATOM 0 HH22 ARG A 18 12.919 5.961 0.762 1.00 0.00 H new ATOM 301 N ARG A 19 8.611 8.599 1.310 1.00 0.00 N ATOM 302 CA ARG A 19 9.796 8.706 2.146 1.00 0.00 C ATOM 303 C ARG A 19 9.397 8.359 3.575 1.00 0.00 C ATOM 304 O ARG A 19 9.941 7.398 4.126 1.00 0.00 O ATOM 305 CB ARG A 19 10.419 10.102 2.018 1.00 0.00 C ATOM 306 CG ARG A 19 10.904 10.439 0.596 1.00 0.00 C ATOM 307 CD ARG A 19 12.364 10.037 0.409 1.00 0.00 C ATOM 308 NE ARG A 19 13.237 10.854 1.263 1.00 0.00 N ATOM 309 CZ ARG A 19 14.393 10.493 1.823 1.00 0.00 C ATOM 310 NH1 ARG A 19 14.963 9.331 1.522 1.00 0.00 N ATOM 311 NH2 ARG A 19 14.961 11.316 2.696 1.00 0.00 N ATOM 0 H ARG A 19 8.384 9.459 0.811 1.00 0.00 H new ATOM 0 HA ARG A 19 10.567 8.006 1.825 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.686 10.847 2.327 1.00 0.00 H new ATOM 0 HB3 ARG A 19 11.261 10.178 2.706 1.00 0.00 H new ATOM 0 HG2 ARG A 19 10.284 9.922 -0.136 1.00 0.00 H new ATOM 0 HG3 ARG A 19 10.790 11.507 0.412 1.00 0.00 H new ATOM 0 HD2 ARG A 19 12.491 8.982 0.653 1.00 0.00 H new ATOM 0 HD3 ARG A 19 12.650 10.159 -0.636 1.00 0.00 H new ATOM 0 HE ARG A 19 12.923 11.807 1.449 1.00 0.00 H new ATOM 0 HH11 ARG A 19 14.517 8.702 0.855 1.00 0.00 H new ATOM 0 HH12 ARG A 19 15.847 9.068 1.958 1.00 0.00 H new ATOM 0 HH21 ARG A 19 14.514 12.203 2.926 1.00 0.00 H new ATOM 0 HH22 ARG A 19 15.845 11.061 3.137 1.00 0.00 H new ATOM 325 N ILE A 20 8.426 9.091 4.119 1.00 0.00 N ATOM 326 CA ILE A 20 7.833 8.877 5.427 1.00 0.00 C ATOM 327 C ILE A 20 7.454 7.395 5.564 1.00 0.00 C ATOM 328 O ILE A 20 8.025 6.738 6.427 1.00 0.00 O ATOM 329 CB ILE A 20 6.695 9.911 5.648 1.00 0.00 C ATOM 330 CG1 ILE A 20 7.187 11.221 6.309 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.595 9.375 6.566 1.00 0.00 C ATOM 332 CD1 ILE A 20 8.298 11.994 5.595 1.00 0.00 C ATOM 0 H ILE A 20 8.015 9.887 3.631 1.00 0.00 H new ATOM 0 HA ILE A 20 8.530 9.062 6.244 1.00 0.00 H new ATOM 0 HB ILE A 20 6.319 10.104 4.643 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.330 11.886 6.418 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.535 10.982 7.314 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.823 10.134 6.690 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.157 8.480 6.125 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.021 9.129 7.539 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.544 12.889 6.167 1.00 0.00 H new ATOM 0 HD12 ILE A 20 9.183 11.363 5.509 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.959 12.282 4.600 1.00 0.00 H new ATOM 344 N VAL A 21 6.571 6.842 4.725 1.00 0.00 N ATOM 345 CA VAL A 21 6.130 5.445 4.805 1.00 0.00 C ATOM 346 C VAL A 21 7.325 4.497 4.913 1.00 0.00 C ATOM 347 O VAL A 21 7.353 3.667 5.819 1.00 0.00 O ATOM 348 CB VAL A 21 5.243 5.081 3.589 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.945 3.577 3.478 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.899 5.793 3.674 1.00 0.00 C ATOM 0 H VAL A 21 6.137 7.359 3.961 1.00 0.00 H new ATOM 0 HA VAL A 21 5.532 5.331 5.709 1.00 0.00 H new ATOM 0 HB VAL A 21 5.815 5.394 2.716 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.319 3.394 2.605 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.881 3.027 3.376 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.423 3.242 4.375 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.290 5.525 2.811 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.386 5.493 4.588 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.058 6.871 3.684 1.00 0.00 H new ATOM 360 N ARG A 22 8.325 4.606 4.027 1.00 0.00 N ATOM 361 CA ARG A 22 9.480 3.708 4.065 1.00 0.00 C ATOM 362 C ARG A 22 10.216 3.820 5.392 1.00 0.00 C ATOM 363 O ARG A 22 10.692 2.809 5.903 1.00 0.00 O ATOM 364 CB ARG A 22 10.442 4.004 2.910 1.00 0.00 C ATOM 365 CG ARG A 22 11.539 2.934 2.771 1.00 0.00 C ATOM 366 CD ARG A 22 12.870 3.205 3.489 1.00 0.00 C ATOM 367 NE ARG A 22 13.837 2.102 3.308 1.00 0.00 N ATOM 368 CZ ARG A 22 14.356 1.669 2.152 1.00 0.00 C ATOM 369 NH1 ARG A 22 14.191 2.360 1.032 1.00 0.00 N ATOM 370 NH2 ARG A 22 15.027 0.527 2.129 1.00 0.00 N ATOM 0 H ARG A 22 8.355 5.302 3.282 1.00 0.00 H new ATOM 0 HA ARG A 22 9.107 2.689 3.958 1.00 0.00 H new ATOM 0 HB2 ARG A 22 9.879 4.066 1.979 1.00 0.00 H new ATOM 0 HB3 ARG A 22 10.906 4.978 3.068 1.00 0.00 H new ATOM 0 HG2 ARG A 22 11.140 1.989 3.141 1.00 0.00 H new ATOM 0 HG3 ARG A 22 11.748 2.798 1.710 1.00 0.00 H new ATOM 0 HD2 ARG A 22 13.303 4.131 3.111 1.00 0.00 H new ATOM 0 HD3 ARG A 22 12.684 3.352 4.553 1.00 0.00 H new ATOM 0 HE ARG A 22 14.141 1.619 4.153 1.00 0.00 H new ATOM 0 HH11 ARG A 22 13.663 3.233 1.044 1.00 0.00 H new ATOM 0 HH12 ARG A 22 14.592 2.019 0.158 1.00 0.00 H new ATOM 0 HH21 ARG A 22 15.144 -0.013 2.986 1.00 0.00 H new ATOM 0 HH22 ARG A 22 15.427 0.188 1.254 1.00 0.00 H new ATOM 384 N ASN A 23 10.376 5.039 5.909 1.00 0.00 N ATOM 385 CA ASN A 23 11.038 5.260 7.184 1.00 0.00 C ATOM 386 C ASN A 23 10.250 4.571 8.297 1.00 0.00 C ATOM 387 O ASN A 23 10.800 3.729 9.001 1.00 0.00 O ATOM 388 CB ASN A 23 11.212 6.756 7.448 1.00 0.00 C ATOM 389 CG ASN A 23 11.982 6.989 8.734 1.00 0.00 C ATOM 390 OD1 ASN A 23 11.397 7.364 9.742 1.00 0.00 O ATOM 391 ND2 ASN A 23 13.293 6.835 8.710 1.00 0.00 N ATOM 0 H ASN A 23 10.051 5.892 5.455 1.00 0.00 H new ATOM 0 HA ASN A 23 12.036 4.823 7.156 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.740 7.218 6.614 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.235 7.235 7.512 1.00 0.00 H new ATOM 0 HD21 ASN A 23 13.845 7.030 9.545 1.00 0.00 H new ATOM 0 HD22 ASN A 23 13.754 6.521 7.856 1.00 0.00 H new ATOM 398 N LEU A 24 8.953 4.866 8.406 1.00 0.00 N ATOM 399 CA LEU A 24 8.055 4.288 9.405 1.00 0.00 C ATOM 400 C LEU A 24 8.014 2.763 9.309 1.00 0.00 C ATOM 401 O LEU A 24 7.885 2.097 10.332 1.00 0.00 O ATOM 402 CB LEU A 24 6.629 4.817 9.215 1.00 0.00 C ATOM 403 CG LEU A 24 6.458 6.342 9.315 1.00 0.00 C ATOM 404 CD1 LEU A 24 5.040 6.651 8.835 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.747 6.908 10.709 1.00 0.00 C ATOM 0 H LEU A 24 8.488 5.530 7.787 1.00 0.00 H new ATOM 0 HA LEU A 24 8.441 4.577 10.383 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.270 4.494 8.238 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.987 4.349 9.961 1.00 0.00 H new ATOM 0 HG LEU A 24 7.199 6.838 8.688 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.865 7.726 8.886 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.922 6.312 7.806 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.320 6.136 9.471 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.605 7.989 10.700 1.00 0.00 H new ATOM 0 HD22 LEU A 24 6.066 6.459 11.432 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.776 6.680 10.988 1.00 0.00 H new ATOM 417 N LEU A 25 8.126 2.212 8.098 1.00 0.00 N ATOM 418 CA LEU A 25 8.300 0.786 7.869 1.00 0.00 C ATOM 419 C LEU A 25 9.576 0.322 8.543 1.00 0.00 C ATOM 420 O LEU A 25 9.497 -0.483 9.458 1.00 0.00 O ATOM 421 CB LEU A 25 8.309 0.454 6.366 1.00 0.00 C ATOM 422 CG LEU A 25 6.890 0.165 5.856 1.00 0.00 C ATOM 423 CD1 LEU A 25 6.800 0.345 4.339 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.474 -1.264 6.216 1.00 0.00 C ATOM 0 H LEU A 25 8.097 2.759 7.237 1.00 0.00 H new ATOM 0 HA LEU A 25 7.454 0.253 8.304 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.736 1.288 5.809 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.947 -0.411 6.185 1.00 0.00 H new ATOM 0 HG LEU A 25 6.217 0.876 6.336 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.784 0.133 4.007 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.061 1.371 4.078 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.492 -0.341 3.850 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.466 -1.453 5.848 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.166 -1.971 5.758 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.494 -1.387 7.299 1.00 0.00 H new ATOM 436 N LYS A 26 10.748 0.826 8.138 1.00 0.00 N ATOM 437 CA LYS A 26 12.020 0.326 8.664 1.00 0.00 C ATOM 438 C LYS A 26 12.216 0.597 10.162 1.00 0.00 C ATOM 439 O LYS A 26 13.061 -0.058 10.777 1.00 0.00 O ATOM 440 CB LYS A 26 13.186 0.704 7.733 1.00 0.00 C ATOM 441 CG LYS A 26 13.522 2.197 7.598 1.00 0.00 C ATOM 442 CD LYS A 26 14.379 2.794 8.724 1.00 0.00 C ATOM 443 CE LYS A 26 15.762 2.132 8.754 1.00 0.00 C ATOM 444 NZ LYS A 26 16.593 2.626 9.865 1.00 0.00 N ATOM 0 H LYS A 26 10.840 1.575 7.452 1.00 0.00 H new ATOM 0 HA LYS A 26 11.996 -0.764 8.647 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.079 0.187 8.084 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.963 0.317 6.739 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.042 2.349 6.652 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.588 2.757 7.542 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.487 3.869 8.576 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.880 2.652 9.683 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.644 1.052 8.844 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.273 2.319 7.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.518 2.151 9.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.729 3.652 9.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.120 2.424 10.769 1.00 0.00 H new ATOM 458 N GLU A 27 11.426 1.469 10.791 1.00 0.00 N ATOM 459 CA GLU A 27 11.305 1.612 12.253 1.00 0.00 C ATOM 460 C GLU A 27 10.635 0.395 12.929 1.00 0.00 C ATOM 461 O GLU A 27 10.593 0.298 14.161 1.00 0.00 O ATOM 462 CB GLU A 27 10.479 2.866 12.569 1.00 0.00 C ATOM 463 CG GLU A 27 11.100 4.168 12.061 1.00 0.00 C ATOM 464 CD GLU A 27 11.943 4.866 13.118 1.00 0.00 C ATOM 465 OE1 GLU A 27 13.054 4.362 13.415 1.00 0.00 O ATOM 466 OE2 GLU A 27 11.518 5.915 13.654 1.00 0.00 O ATOM 0 H GLU A 27 10.829 2.121 10.283 1.00 0.00 H new ATOM 0 HA GLU A 27 12.317 1.689 12.649 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.487 2.754 12.131 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.345 2.937 13.648 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.720 3.955 11.190 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.307 4.840 11.732 1.00 0.00 H new ATOM 473 N LEU A 28 10.113 -0.529 12.123 1.00 0.00 N ATOM 474 CA LEU A 28 9.413 -1.771 12.460 1.00 0.00 C ATOM 475 C LEU A 28 10.046 -2.996 11.776 1.00 0.00 C ATOM 476 O LEU A 28 9.474 -4.088 11.822 1.00 0.00 O ATOM 477 CB LEU A 28 7.931 -1.678 12.042 1.00 0.00 C ATOM 478 CG LEU A 28 7.155 -0.476 12.602 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.827 -0.361 11.856 1.00 0.00 C ATOM 480 CD2 LEU A 28 6.917 -0.624 14.107 1.00 0.00 C ATOM 0 H LEU A 28 10.176 -0.415 11.111 1.00 0.00 H new ATOM 0 HA LEU A 28 9.495 -1.899 13.539 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.881 -1.644 10.954 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.426 -2.591 12.356 1.00 0.00 H new ATOM 0 HG LEU A 28 7.742 0.431 12.455 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.265 0.489 12.243 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.018 -0.216 10.793 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.249 -1.274 11.999 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.366 0.241 14.475 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.340 -1.529 14.297 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.875 -0.690 14.622 1.00 0.00 H new ATOM 492 N GLY A 29 11.199 -2.843 11.117 1.00 0.00 N ATOM 493 CA GLY A 29 11.774 -3.869 10.255 1.00 0.00 C ATOM 494 C GLY A 29 11.120 -3.783 8.879 1.00 0.00 C ATOM 495 O GLY A 29 10.842 -2.686 8.417 1.00 0.00 O ATOM 0 H GLY A 29 11.761 -1.994 11.171 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.852 -3.729 10.169 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.614 -4.857 10.687 1.00 0.00 H new ATOM 499 N PHE A 30 10.892 -4.904 8.197 1.00 0.00 N ATOM 500 CA PHE A 30 10.205 -4.937 6.898 1.00 0.00 C ATOM 501 C PHE A 30 10.767 -3.920 5.885 1.00 0.00 C ATOM 502 O PHE A 30 10.034 -3.255 5.153 1.00 0.00 O ATOM 503 CB PHE A 30 8.691 -4.799 7.126 1.00 0.00 C ATOM 504 CG PHE A 30 8.074 -5.978 7.847 1.00 0.00 C ATOM 505 CD1 PHE A 30 8.117 -7.257 7.256 1.00 0.00 C ATOM 506 CD2 PHE A 30 7.468 -5.808 9.104 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.578 -8.365 7.930 1.00 0.00 C ATOM 508 CE2 PHE A 30 6.920 -6.917 9.771 1.00 0.00 C ATOM 509 CZ PHE A 30 6.982 -8.196 9.188 1.00 0.00 C ATOM 0 H PHE A 30 11.179 -5.825 8.529 1.00 0.00 H new ATOM 0 HA PHE A 30 10.396 -5.902 6.429 1.00 0.00 H new ATOM 0 HB2 PHE A 30 8.500 -3.893 7.701 1.00 0.00 H new ATOM 0 HB3 PHE A 30 8.197 -4.675 6.162 1.00 0.00 H new ATOM 0 HD1 PHE A 30 8.566 -7.385 6.282 1.00 0.00 H new ATOM 0 HD2 PHE A 30 7.424 -4.828 9.556 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.622 -9.346 7.480 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.450 -6.787 10.734 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.571 -9.048 9.709 1.00 0.00 H new ATOM 519 N ASN A 31 12.094 -3.777 5.859 1.00 0.00 N ATOM 520 CA ASN A 31 12.773 -2.946 4.870 1.00 0.00 C ATOM 521 C ASN A 31 12.653 -3.555 3.467 1.00 0.00 C ATOM 522 O ASN A 31 12.307 -4.730 3.335 1.00 0.00 O ATOM 523 CB ASN A 31 14.257 -2.768 5.237 1.00 0.00 C ATOM 524 CG ASN A 31 15.149 -3.856 4.638 1.00 0.00 C ATOM 525 OD1 ASN A 31 15.960 -3.588 3.754 1.00 0.00 O ATOM 526 ND2 ASN A 31 15.030 -5.089 5.089 1.00 0.00 N ATOM 0 H ASN A 31 12.723 -4.233 6.520 1.00 0.00 H new ATOM 0 HA ASN A 31 12.290 -1.969 4.868 1.00 0.00 H new ATOM 0 HB2 ASN A 31 14.598 -1.793 4.890 1.00 0.00 H new ATOM 0 HB3 ASN A 31 14.362 -2.775 6.322 1.00 0.00 H new ATOM 0 HD21 ASN A 31 15.614 -5.831 4.704 1.00 0.00 H new ATOM 0 HD22 ASN A 31 14.354 -5.301 5.823 1.00 0.00 H new ATOM 533 N ASN A 32 13.081 -2.776 2.463 1.00 0.00 N ATOM 534 CA ASN A 32 13.310 -3.118 1.053 1.00 0.00 C ATOM 535 C ASN A 32 12.079 -2.665 0.275 1.00 0.00 C ATOM 536 O ASN A 32 11.055 -3.346 0.301 1.00 0.00 O ATOM 537 CB ASN A 32 13.642 -4.609 0.820 1.00 0.00 C ATOM 538 CG ASN A 32 14.398 -4.869 -0.472 1.00 0.00 C ATOM 539 OD1 ASN A 32 14.400 -4.056 -1.395 1.00 0.00 O ATOM 540 ND2 ASN A 32 15.126 -5.974 -0.535 1.00 0.00 N ATOM 0 H ASN A 32 13.296 -1.794 2.636 1.00 0.00 H new ATOM 0 HA ASN A 32 14.201 -2.600 0.697 1.00 0.00 H new ATOM 0 HB2 ASN A 32 14.235 -4.976 1.658 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.715 -5.182 0.810 1.00 0.00 H new ATOM 0 HD21 ASN A 32 15.699 -6.161 -1.358 1.00 0.00 H new ATOM 0 HD22 ASN A 32 15.113 -6.638 0.239 1.00 0.00 H new ATOM 547 N VAL A 33 12.118 -1.474 -0.336 1.00 0.00 N ATOM 548 CA VAL A 33 10.933 -0.905 -0.981 1.00 0.00 C ATOM 549 C VAL A 33 11.275 -0.441 -2.393 1.00 0.00 C ATOM 550 O VAL A 33 12.422 -0.096 -2.673 1.00 0.00 O ATOM 551 CB VAL A 33 10.245 0.194 -0.122 1.00 0.00 C ATOM 552 CG1 VAL A 33 10.344 -0.054 1.397 1.00 0.00 C ATOM 553 CG2 VAL A 33 10.727 1.627 -0.411 1.00 0.00 C ATOM 0 H VAL A 33 12.953 -0.891 -0.396 1.00 0.00 H new ATOM 0 HA VAL A 33 10.185 -1.693 -1.066 1.00 0.00 H new ATOM 0 HB VAL A 33 9.203 0.113 -0.433 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.842 0.753 1.931 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.867 -1.003 1.643 1.00 0.00 H new ATOM 0 HG13 VAL A 33 11.393 -0.087 1.693 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.194 2.327 0.233 1.00 0.00 H new ATOM 0 HG22 VAL A 33 11.797 1.697 -0.216 1.00 0.00 H new ATOM 0 HG23 VAL A 33 10.531 1.873 -1.455 1.00 0.00 H new ATOM 563 N GLU A 34 10.269 -0.358 -3.251 1.00 0.00 N ATOM 564 CA GLU A 34 10.285 0.289 -4.549 1.00 0.00 C ATOM 565 C GLU A 34 9.041 1.172 -4.641 1.00 0.00 C ATOM 566 O GLU A 34 8.167 1.125 -3.774 1.00 0.00 O ATOM 567 CB GLU A 34 10.248 -0.761 -5.671 1.00 0.00 C ATOM 568 CG GLU A 34 11.435 -1.738 -5.724 1.00 0.00 C ATOM 569 CD GLU A 34 12.821 -1.087 -5.666 1.00 0.00 C ATOM 570 OE1 GLU A 34 13.060 -0.003 -6.251 1.00 0.00 O ATOM 571 OE2 GLU A 34 13.721 -1.683 -5.033 1.00 0.00 O ATOM 0 H GLU A 34 9.360 -0.770 -3.042 1.00 0.00 H new ATOM 0 HA GLU A 34 11.194 0.880 -4.661 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.331 -1.341 -5.568 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.190 -0.240 -6.627 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.345 -2.438 -4.894 1.00 0.00 H new ATOM 0 HG3 GLU A 34 11.364 -2.321 -6.642 1.00 0.00 H new ATOM 578 N GLU A 35 8.924 1.925 -5.728 1.00 0.00 N ATOM 579 CA GLU A 35 7.742 2.684 -6.108 1.00 0.00 C ATOM 580 C GLU A 35 7.392 2.295 -7.537 1.00 0.00 C ATOM 581 O GLU A 35 8.217 1.734 -8.268 1.00 0.00 O ATOM 582 CB GLU A 35 7.963 4.209 -6.040 1.00 0.00 C ATOM 583 CG GLU A 35 8.747 4.698 -4.818 1.00 0.00 C ATOM 584 CD GLU A 35 10.262 4.473 -4.910 1.00 0.00 C ATOM 585 OE1 GLU A 35 10.796 4.227 -6.017 1.00 0.00 O ATOM 586 OE2 GLU A 35 10.958 4.582 -3.874 1.00 0.00 O ATOM 0 H GLU A 35 9.686 2.027 -6.398 1.00 0.00 H new ATOM 0 HA GLU A 35 6.940 2.450 -5.408 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.490 4.525 -6.940 1.00 0.00 H new ATOM 0 HB3 GLU A 35 6.991 4.702 -6.050 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.557 5.763 -4.681 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.369 4.190 -3.931 1.00 0.00 H new ATOM 593 N ALA A 36 6.192 2.669 -7.951 1.00 0.00 N ATOM 594 CA ALA A 36 5.812 2.792 -9.341 1.00 0.00 C ATOM 595 C ALA A 36 5.557 4.278 -9.585 1.00 0.00 C ATOM 596 O ALA A 36 5.479 5.050 -8.626 1.00 0.00 O ATOM 597 CB ALA A 36 4.573 1.934 -9.578 1.00 0.00 C ATOM 0 H ALA A 36 5.436 2.901 -7.307 1.00 0.00 H new ATOM 0 HA ALA A 36 6.579 2.444 -10.033 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.270 2.013 -10.622 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.800 0.894 -9.344 1.00 0.00 H new ATOM 0 HB3 ALA A 36 3.762 2.281 -8.937 1.00 0.00 H new ATOM 603 N GLU A 37 5.421 4.693 -10.842 1.00 0.00 N ATOM 604 CA GLU A 37 5.113 6.090 -11.108 1.00 0.00 C ATOM 605 C GLU A 37 3.675 6.435 -10.725 1.00 0.00 C ATOM 606 O GLU A 37 3.420 7.604 -10.446 1.00 0.00 O ATOM 607 CB GLU A 37 5.412 6.505 -12.551 1.00 0.00 C ATOM 608 CG GLU A 37 4.632 5.726 -13.610 1.00 0.00 C ATOM 609 CD GLU A 37 4.559 6.498 -14.918 1.00 0.00 C ATOM 610 OE1 GLU A 37 5.633 6.780 -15.497 1.00 0.00 O ATOM 611 OE2 GLU A 37 3.438 6.801 -15.384 1.00 0.00 O ATOM 0 H GLU A 37 5.516 4.101 -11.667 1.00 0.00 H new ATOM 0 HA GLU A 37 5.781 6.669 -10.471 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.191 7.567 -12.663 1.00 0.00 H new ATOM 0 HB3 GLU A 37 6.478 6.379 -12.738 1.00 0.00 H new ATOM 0 HG2 GLU A 37 5.109 4.761 -13.780 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.624 5.524 -13.247 1.00 0.00 H new ATOM 618 N ASP A 38 2.744 5.474 -10.726 1.00 0.00 N ATOM 619 CA ASP A 38 1.320 5.652 -10.423 1.00 0.00 C ATOM 620 C ASP A 38 0.629 4.293 -10.614 1.00 0.00 C ATOM 621 O ASP A 38 1.278 3.344 -11.057 1.00 0.00 O ATOM 622 CB ASP A 38 0.682 6.735 -11.322 1.00 0.00 C ATOM 623 CG ASP A 38 0.179 7.933 -10.505 1.00 0.00 C ATOM 624 OD1 ASP A 38 -0.560 7.736 -9.513 1.00 0.00 O ATOM 625 OD2 ASP A 38 0.483 9.094 -10.876 1.00 0.00 O ATOM 0 H ASP A 38 2.974 4.506 -10.949 1.00 0.00 H new ATOM 0 HA ASP A 38 1.198 5.995 -9.396 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.414 7.076 -12.054 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -0.148 6.301 -11.879 1.00 0.00 H new ATOM 630 N GLY A 39 -0.661 4.159 -10.298 1.00 0.00 N ATOM 631 CA GLY A 39 -1.394 2.893 -10.282 1.00 0.00 C ATOM 632 C GLY A 39 -1.274 2.046 -11.556 1.00 0.00 C ATOM 633 O GLY A 39 -1.121 0.829 -11.464 1.00 0.00 O ATOM 0 H GLY A 39 -1.242 4.956 -10.038 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.043 2.300 -9.438 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.448 3.106 -10.105 1.00 0.00 H new ATOM 637 N VAL A 40 -1.284 2.657 -12.745 1.00 0.00 N ATOM 638 CA VAL A 40 -1.118 1.932 -14.011 1.00 0.00 C ATOM 639 C VAL A 40 0.235 1.202 -14.023 1.00 0.00 C ATOM 640 O VAL A 40 0.325 0.034 -14.417 1.00 0.00 O ATOM 641 CB VAL A 40 -1.240 2.921 -15.193 1.00 0.00 C ATOM 642 CG1 VAL A 40 -1.030 2.251 -16.554 1.00 0.00 C ATOM 643 CG2 VAL A 40 -2.619 3.593 -15.241 1.00 0.00 C ATOM 0 H VAL A 40 -1.407 3.663 -12.858 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.902 1.182 -14.113 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.455 3.656 -15.014 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.128 2.995 -17.345 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.034 1.809 -16.592 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.779 1.471 -16.695 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.660 4.279 -16.087 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.391 2.832 -15.354 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.787 4.146 -14.317 1.00 0.00 H new ATOM 653 N ASP A 41 1.285 1.893 -13.577 1.00 0.00 N ATOM 654 CA ASP A 41 2.641 1.370 -13.489 1.00 0.00 C ATOM 655 C ASP A 41 2.773 0.411 -12.307 1.00 0.00 C ATOM 656 O ASP A 41 3.577 -0.514 -12.355 1.00 0.00 O ATOM 657 CB ASP A 41 3.616 2.535 -13.327 1.00 0.00 C ATOM 658 CG ASP A 41 5.080 2.097 -13.425 1.00 0.00 C ATOM 659 OD1 ASP A 41 5.483 1.443 -14.415 1.00 0.00 O ATOM 660 OD2 ASP A 41 5.871 2.464 -12.529 1.00 0.00 O ATOM 0 H ASP A 41 1.209 2.859 -13.259 1.00 0.00 H new ATOM 0 HA ASP A 41 2.871 0.820 -14.401 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.413 3.283 -14.093 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.448 3.013 -12.362 1.00 0.00 H new ATOM 665 N ALA A 42 1.970 0.588 -11.252 1.00 0.00 N ATOM 666 CA ALA A 42 1.932 -0.298 -10.103 1.00 0.00 C ATOM 667 C ALA A 42 1.498 -1.690 -10.531 1.00 0.00 C ATOM 668 O ALA A 42 2.126 -2.679 -10.146 1.00 0.00 O ATOM 669 CB ALA A 42 0.973 0.254 -9.050 1.00 0.00 C ATOM 0 H ALA A 42 1.319 1.370 -11.180 1.00 0.00 H new ATOM 0 HA ALA A 42 2.931 -0.361 -9.671 1.00 0.00 H new ATOM 0 HB1 ALA A 42 0.950 -0.417 -8.191 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.311 1.240 -8.731 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.028 0.333 -9.475 1.00 0.00 H new ATOM 675 N LEU A 43 0.440 -1.772 -11.343 1.00 0.00 N ATOM 676 CA LEU A 43 0.009 -3.048 -11.881 1.00 0.00 C ATOM 677 C LEU A 43 1.129 -3.643 -12.727 1.00 0.00 C ATOM 678 O LEU A 43 1.428 -4.822 -12.566 1.00 0.00 O ATOM 679 CB LEU A 43 -1.277 -2.909 -12.702 1.00 0.00 C ATOM 680 CG LEU A 43 -1.873 -4.303 -12.996 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.671 -4.836 -11.803 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.746 -4.235 -14.247 1.00 0.00 C ATOM 0 H LEU A 43 -0.124 -0.974 -11.635 1.00 0.00 H new ATOM 0 HA LEU A 43 -0.213 -3.718 -11.050 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.001 -2.303 -12.158 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.066 -2.391 -13.637 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.052 -4.999 -13.171 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.076 -5.819 -12.046 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.017 -4.917 -10.935 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.489 -4.152 -11.578 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.165 -5.220 -14.452 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.555 -3.522 -14.088 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.142 -3.914 -15.095 1.00 0.00 H new ATOM 694 N ASN A 44 1.771 -2.849 -13.591 1.00 0.00 N ATOM 695 CA ASN A 44 2.888 -3.336 -14.397 1.00 0.00 C ATOM 696 C ASN A 44 4.019 -3.887 -13.522 1.00 0.00 C ATOM 697 O ASN A 44 4.517 -4.978 -13.793 1.00 0.00 O ATOM 698 CB ASN A 44 3.418 -2.250 -15.335 1.00 0.00 C ATOM 699 CG ASN A 44 4.566 -2.810 -16.161 1.00 0.00 C ATOM 700 OD1 ASN A 44 5.734 -2.568 -15.864 1.00 0.00 O ATOM 701 ND2 ASN A 44 4.273 -3.617 -17.166 1.00 0.00 N ATOM 0 H ASN A 44 1.534 -1.869 -13.747 1.00 0.00 H new ATOM 0 HA ASN A 44 2.505 -4.154 -15.007 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.621 -1.900 -15.991 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.757 -1.390 -14.758 1.00 0.00 H new ATOM 0 HD21 ASN A 44 5.021 -4.049 -17.708 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.299 -3.808 -17.400 1.00 0.00 H new ATOM 708 N LYS A 45 4.385 -3.180 -12.446 1.00 0.00 N ATOM 709 CA LYS A 45 5.362 -3.645 -11.462 1.00 0.00 C ATOM 710 C LYS A 45 4.960 -5.020 -10.947 1.00 0.00 C ATOM 711 O LYS A 45 5.801 -5.919 -10.941 1.00 0.00 O ATOM 712 CB LYS A 45 5.519 -2.651 -10.288 1.00 0.00 C ATOM 713 CG LYS A 45 6.789 -1.795 -10.372 1.00 0.00 C ATOM 714 CD LYS A 45 6.754 -0.766 -11.503 1.00 0.00 C ATOM 715 CE LYS A 45 8.070 0.015 -11.523 1.00 0.00 C ATOM 716 NZ LYS A 45 8.120 0.950 -12.661 1.00 0.00 N ATOM 0 H LYS A 45 4.004 -2.258 -12.234 1.00 0.00 H new ATOM 0 HA LYS A 45 6.331 -3.712 -11.957 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.650 -1.994 -10.261 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.528 -3.207 -9.351 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.932 -1.277 -9.424 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.650 -2.448 -10.512 1.00 0.00 H new ATOM 0 HD2 LYS A 45 6.601 -1.266 -12.459 1.00 0.00 H new ATOM 0 HD3 LYS A 45 5.916 -0.084 -11.362 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.182 0.568 -10.590 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.907 -0.680 -11.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.088 1.313 -12.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 7.837 0.454 -13.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.470 1.743 -12.487 1.00 0.00 H new ATOM 730 N LEU A 46 3.710 -5.186 -10.508 1.00 0.00 N ATOM 731 CA LEU A 46 3.224 -6.437 -9.932 1.00 0.00 C ATOM 732 C LEU A 46 3.169 -7.557 -10.963 1.00 0.00 C ATOM 733 O LEU A 46 3.464 -8.707 -10.646 1.00 0.00 O ATOM 734 CB LEU A 46 1.840 -6.231 -9.284 1.00 0.00 C ATOM 735 CG LEU A 46 1.888 -5.964 -7.771 1.00 0.00 C ATOM 736 CD1 LEU A 46 2.385 -7.200 -7.013 1.00 0.00 C ATOM 737 CD2 LEU A 46 2.715 -4.720 -7.424 1.00 0.00 C ATOM 0 H LEU A 46 3.004 -4.450 -10.543 1.00 0.00 H new ATOM 0 HA LEU A 46 3.934 -6.738 -9.162 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.342 -5.394 -9.774 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.230 -7.116 -9.467 1.00 0.00 H new ATOM 0 HG LEU A 46 0.868 -5.757 -7.448 1.00 0.00 H new ATOM 0 HD11 LEU A 46 2.410 -6.986 -5.945 1.00 0.00 H new ATOM 0 HD12 LEU A 46 1.712 -8.036 -7.200 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.387 -7.458 -7.355 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.718 -4.575 -6.344 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.738 -4.854 -7.775 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.277 -3.846 -7.906 1.00 0.00 H new ATOM 749 N GLN A 47 2.833 -7.238 -12.211 1.00 0.00 N ATOM 750 CA GLN A 47 2.889 -8.170 -13.329 1.00 0.00 C ATOM 751 C GLN A 47 4.332 -8.539 -13.705 1.00 0.00 C ATOM 752 O GLN A 47 4.521 -9.374 -14.592 1.00 0.00 O ATOM 753 CB GLN A 47 2.096 -7.593 -14.511 1.00 0.00 C ATOM 754 CG GLN A 47 0.588 -7.609 -14.206 1.00 0.00 C ATOM 755 CD GLN A 47 -0.281 -7.213 -15.396 1.00 0.00 C ATOM 756 OE1 GLN A 47 0.187 -6.679 -16.401 1.00 0.00 O ATOM 757 NE2 GLN A 47 -1.573 -7.485 -15.320 1.00 0.00 N ATOM 0 H GLN A 47 2.509 -6.308 -12.476 1.00 0.00 H new ATOM 0 HA GLN A 47 2.423 -9.109 -13.030 1.00 0.00 H new ATOM 0 HB2 GLN A 47 2.422 -6.572 -14.712 1.00 0.00 H new ATOM 0 HB3 GLN A 47 2.297 -8.175 -15.411 1.00 0.00 H new ATOM 0 HG2 GLN A 47 0.303 -8.608 -13.876 1.00 0.00 H new ATOM 0 HG3 GLN A 47 0.386 -6.930 -13.378 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -1.953 -7.928 -14.483 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -2.190 -7.252 -16.098 1.00 0.00 H new ATOM 766 N ALA A 48 5.333 -7.976 -13.024 1.00 0.00 N ATOM 767 CA ALA A 48 6.749 -8.230 -13.202 1.00 0.00 C ATOM 768 C ALA A 48 7.448 -8.617 -11.886 1.00 0.00 C ATOM 769 O ALA A 48 8.681 -8.629 -11.851 1.00 0.00 O ATOM 770 CB ALA A 48 7.369 -6.995 -13.858 1.00 0.00 C ATOM 0 H ALA A 48 5.156 -7.290 -12.290 1.00 0.00 H new ATOM 0 HA ALA A 48 6.888 -9.095 -13.851 1.00 0.00 H new ATOM 0 HB1 ALA A 48 8.437 -7.158 -14.004 1.00 0.00 H new ATOM 0 HB2 ALA A 48 6.893 -6.818 -14.823 1.00 0.00 H new ATOM 0 HB3 ALA A 48 7.219 -6.128 -13.215 1.00 0.00 H new ATOM 776 N GLY A 49 6.722 -8.940 -10.806 1.00 0.00 N ATOM 777 CA GLY A 49 7.345 -9.526 -9.624 1.00 0.00 C ATOM 778 C GLY A 49 6.433 -9.568 -8.403 1.00 0.00 C ATOM 779 O GLY A 49 5.445 -8.843 -8.314 1.00 0.00 O ATOM 0 H GLY A 49 5.714 -8.805 -10.732 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.667 -10.540 -9.860 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.241 -8.956 -9.377 1.00 0.00 H new ATOM 783 N GLY A 50 6.807 -10.372 -7.406 1.00 0.00 N ATOM 784 CA GLY A 50 6.041 -10.558 -6.182 1.00 0.00 C ATOM 785 C GLY A 50 6.412 -9.500 -5.152 1.00 0.00 C ATOM 786 O GLY A 50 7.234 -9.765 -4.271 1.00 0.00 O ATOM 0 H GLY A 50 7.667 -10.920 -7.432 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.975 -10.501 -6.402 1.00 0.00 H new ATOM 0 HA3 GLY A 50 6.230 -11.551 -5.775 1.00 0.00 H new ATOM 790 N TYR A 51 5.883 -8.285 -5.289 1.00 0.00 N ATOM 791 CA TYR A 51 5.971 -7.240 -4.269 1.00 0.00 C ATOM 792 C TYR A 51 5.068 -7.678 -3.119 1.00 0.00 C ATOM 793 O TYR A 51 3.882 -7.909 -3.337 1.00 0.00 O ATOM 794 CB TYR A 51 5.575 -5.871 -4.849 1.00 0.00 C ATOM 795 CG TYR A 51 6.542 -5.415 -5.927 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.447 -5.967 -7.215 1.00 0.00 C ATOM 797 CD2 TYR A 51 7.612 -4.553 -5.621 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.466 -5.765 -8.155 1.00 0.00 C ATOM 799 CE2 TYR A 51 8.631 -4.329 -6.565 1.00 0.00 C ATOM 800 CZ TYR A 51 8.572 -4.957 -7.830 1.00 0.00 C ATOM 801 OH TYR A 51 9.576 -4.822 -8.734 1.00 0.00 O ATOM 0 H TYR A 51 5.374 -7.994 -6.124 1.00 0.00 H new ATOM 0 HA TYR A 51 6.992 -7.115 -3.909 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.569 -5.929 -5.264 1.00 0.00 H new ATOM 0 HB3 TYR A 51 5.547 -5.131 -4.049 1.00 0.00 H new ATOM 0 HD1 TYR A 51 5.580 -6.553 -7.483 1.00 0.00 H new ATOM 0 HD2 TYR A 51 7.651 -4.063 -4.660 1.00 0.00 H new ATOM 0 HE1 TYR A 51 7.403 -6.229 -9.128 1.00 0.00 H new ATOM 0 HE2 TYR A 51 9.458 -3.678 -6.323 1.00 0.00 H new ATOM 0 HH TYR A 51 10.269 -4.233 -8.368 1.00 0.00 H new ATOM 811 N GLY A 52 5.625 -7.864 -1.918 1.00 0.00 N ATOM 812 CA GLY A 52 4.877 -8.515 -0.843 1.00 0.00 C ATOM 813 C GLY A 52 3.805 -7.622 -0.218 1.00 0.00 C ATOM 814 O GLY A 52 2.868 -8.125 0.405 1.00 0.00 O ATOM 0 H GLY A 52 6.572 -7.579 -1.670 1.00 0.00 H new ATOM 0 HA2 GLY A 52 4.405 -9.416 -1.234 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.573 -8.831 -0.066 1.00 0.00 H new ATOM 818 N PHE A 53 3.934 -6.309 -0.399 1.00 0.00 N ATOM 819 CA PHE A 53 2.959 -5.282 -0.079 1.00 0.00 C ATOM 820 C PHE A 53 2.860 -4.391 -1.299 1.00 0.00 C ATOM 821 O PHE A 53 3.856 -4.224 -2.012 1.00 0.00 O ATOM 822 CB PHE A 53 3.434 -4.422 1.092 1.00 0.00 C ATOM 823 CG PHE A 53 3.208 -5.009 2.463 1.00 0.00 C ATOM 824 CD1 PHE A 53 3.936 -6.138 2.878 1.00 0.00 C ATOM 825 CD2 PHE A 53 2.328 -4.369 3.354 1.00 0.00 C ATOM 826 CE1 PHE A 53 3.769 -6.644 4.176 1.00 0.00 C ATOM 827 CE2 PHE A 53 2.195 -4.852 4.665 1.00 0.00 C ATOM 828 CZ PHE A 53 2.902 -6.000 5.069 1.00 0.00 C ATOM 0 H PHE A 53 4.784 -5.913 -0.801 1.00 0.00 H new ATOM 0 HA PHE A 53 2.008 -5.742 0.191 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.500 -4.229 0.970 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.928 -3.458 1.041 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.624 -6.616 2.197 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.758 -3.511 3.031 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.307 -7.527 4.486 1.00 0.00 H new ATOM 0 HE2 PHE A 53 1.549 -4.342 5.365 1.00 0.00 H new ATOM 0 HZ PHE A 53 2.776 -6.386 6.070 1.00 0.00 H new ATOM 838 N VAL A 54 1.689 -3.797 -1.508 1.00 0.00 N ATOM 839 CA VAL A 54 1.410 -2.942 -2.650 1.00 0.00 C ATOM 840 C VAL A 54 0.628 -1.748 -2.103 1.00 0.00 C ATOM 841 O VAL A 54 -0.593 -1.666 -2.214 1.00 0.00 O ATOM 842 CB VAL A 54 0.717 -3.771 -3.752 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.631 -3.025 -5.087 1.00 0.00 C ATOM 844 CG2 VAL A 54 1.488 -5.068 -4.034 1.00 0.00 C ATOM 0 H VAL A 54 0.895 -3.900 -0.876 1.00 0.00 H new ATOM 0 HA VAL A 54 2.296 -2.545 -3.145 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.284 -3.971 -3.370 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.135 -3.655 -5.825 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.062 -2.105 -4.954 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.636 -2.783 -5.434 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.977 -5.632 -4.814 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.499 -4.826 -4.363 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.536 -5.668 -3.125 1.00 0.00 H new ATOM 854 N ILE A 55 1.341 -0.886 -1.387 1.00 0.00 N ATOM 855 CA ILE A 55 0.793 0.313 -0.776 1.00 0.00 C ATOM 856 C ILE A 55 0.641 1.333 -1.914 1.00 0.00 C ATOM 857 O ILE A 55 1.502 1.376 -2.804 1.00 0.00 O ATOM 858 CB ILE A 55 1.782 0.746 0.333 1.00 0.00 C ATOM 859 CG1 ILE A 55 1.586 -0.135 1.596 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.578 2.211 0.739 1.00 0.00 C ATOM 861 CD1 ILE A 55 2.892 -0.486 2.313 1.00 0.00 C ATOM 0 H ILE A 55 2.339 -1.007 -1.213 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.181 0.187 -0.303 1.00 0.00 H new ATOM 0 HB ILE A 55 2.787 0.625 -0.072 1.00 0.00 H new ATOM 0 HG12 ILE A 55 0.929 0.386 2.292 1.00 0.00 H new ATOM 0 HG13 ILE A 55 1.080 -1.057 1.309 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.292 2.475 1.519 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.734 2.854 -0.127 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.564 2.347 1.114 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.674 -1.103 3.185 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.544 -1.035 1.634 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.390 0.430 2.632 1.00 0.00 H new ATOM 873 N SER A 56 -0.406 2.157 -1.898 1.00 0.00 N ATOM 874 CA SER A 56 -0.502 3.287 -2.813 1.00 0.00 C ATOM 875 C SER A 56 -1.287 4.434 -2.185 1.00 0.00 C ATOM 876 O SER A 56 -2.069 4.226 -1.253 1.00 0.00 O ATOM 877 CB SER A 56 -1.141 2.833 -4.145 1.00 0.00 C ATOM 878 OG SER A 56 -2.525 2.528 -4.037 1.00 0.00 O ATOM 0 H SER A 56 -1.197 2.061 -1.261 1.00 0.00 H new ATOM 0 HA SER A 56 0.502 3.656 -3.020 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.008 3.619 -4.889 1.00 0.00 H new ATOM 0 HB3 SER A 56 -0.611 1.954 -4.511 1.00 0.00 H new ATOM 0 HG SER A 56 -3.040 3.360 -3.987 1.00 0.00 H new ATOM 884 N ASP A 57 -1.144 5.623 -2.770 1.00 0.00 N ATOM 885 CA ASP A 57 -2.130 6.689 -2.612 1.00 0.00 C ATOM 886 C ASP A 57 -3.403 6.259 -3.364 1.00 0.00 C ATOM 887 O ASP A 57 -3.472 5.164 -3.940 1.00 0.00 O ATOM 888 CB ASP A 57 -1.555 8.024 -3.118 1.00 0.00 C ATOM 889 CG ASP A 57 -2.473 9.219 -2.824 1.00 0.00 C ATOM 890 OD1 ASP A 57 -2.472 9.728 -1.688 1.00 0.00 O ATOM 891 OD2 ASP A 57 -3.267 9.619 -3.701 1.00 0.00 O ATOM 0 H ASP A 57 -0.350 5.872 -3.360 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.381 6.850 -1.564 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.584 8.195 -2.653 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -1.387 7.957 -4.193 1.00 0.00 H new ATOM 896 N TRP A 58 -4.434 7.098 -3.344 1.00 0.00 N ATOM 897 CA TRP A 58 -5.531 7.010 -4.280 1.00 0.00 C ATOM 898 C TRP A 58 -5.015 7.451 -5.660 1.00 0.00 C ATOM 899 O TRP A 58 -4.710 6.606 -6.505 1.00 0.00 O ATOM 900 CB TRP A 58 -6.706 7.848 -3.738 1.00 0.00 C ATOM 901 CG TRP A 58 -8.010 7.610 -4.426 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.417 8.189 -5.577 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.073 6.692 -4.036 1.00 0.00 C ATOM 904 NE1 TRP A 58 -9.639 7.671 -5.951 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.085 6.738 -5.038 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.275 5.819 -2.944 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.237 5.945 -4.966 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.429 5.016 -2.858 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.404 5.084 -3.870 1.00 0.00 C ATOM 0 H TRP A 58 -4.525 7.859 -2.671 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.910 5.995 -4.396 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.827 7.636 -2.676 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.452 8.904 -3.825 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -7.868 8.943 -6.122 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.147 7.942 -6.793 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.532 5.766 -2.162 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -11.986 5.995 -5.742 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -10.565 4.351 -2.018 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.289 4.468 -3.803 1.00 0.00 H new ATOM 920 N ASN A 59 -4.883 8.770 -5.869 1.00 0.00 N ATOM 921 CA ASN A 59 -4.722 9.492 -7.137 1.00 0.00 C ATOM 922 C ASN A 59 -5.664 8.967 -8.243 1.00 0.00 C ATOM 923 O ASN A 59 -6.465 8.077 -7.996 1.00 0.00 O ATOM 924 CB ASN A 59 -3.236 9.517 -7.527 1.00 0.00 C ATOM 925 CG ASN A 59 -2.921 10.478 -8.666 1.00 0.00 C ATOM 926 OD1 ASN A 59 -3.634 11.453 -8.920 1.00 0.00 O ATOM 927 ND2 ASN A 59 -1.904 10.182 -9.445 1.00 0.00 N ATOM 0 H ASN A 59 -4.887 9.417 -5.080 1.00 0.00 H new ATOM 0 HA ASN A 59 -5.036 10.527 -7.002 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -2.645 9.794 -6.654 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.927 8.512 -7.815 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -1.702 10.759 -10.262 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.317 9.376 -9.233 1.00 0.00 H new ATOM 934 N MET A 60 -5.677 9.534 -9.452 1.00 0.00 N ATOM 935 CA MET A 60 -6.485 9.038 -10.571 1.00 0.00 C ATOM 936 C MET A 60 -5.692 9.127 -11.894 1.00 0.00 C ATOM 937 O MET A 60 -6.037 9.918 -12.780 1.00 0.00 O ATOM 938 CB MET A 60 -7.855 9.747 -10.612 1.00 0.00 C ATOM 939 CG MET A 60 -8.716 9.505 -9.358 1.00 0.00 C ATOM 940 SD MET A 60 -10.364 10.252 -9.337 1.00 0.00 S ATOM 941 CE MET A 60 -9.997 11.830 -8.524 1.00 0.00 C ATOM 0 H MET A 60 -5.122 10.358 -9.685 1.00 0.00 H new ATOM 0 HA MET A 60 -6.703 7.980 -10.423 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.696 10.819 -10.731 1.00 0.00 H new ATOM 0 HB3 MET A 60 -8.404 9.407 -11.490 1.00 0.00 H new ATOM 0 HG2 MET A 60 -8.830 8.429 -9.228 1.00 0.00 H new ATOM 0 HG3 MET A 60 -8.166 9.874 -8.493 1.00 0.00 H new ATOM 0 HE1 MET A 60 -10.913 12.414 -8.433 1.00 0.00 H new ATOM 0 HE2 MET A 60 -9.587 11.641 -7.532 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.270 12.385 -9.118 1.00 0.00 H new ATOM 951 N PRO A 61 -4.629 8.317 -12.058 1.00 0.00 N ATOM 952 CA PRO A 61 -3.795 8.245 -13.255 1.00 0.00 C ATOM 953 C PRO A 61 -4.406 7.278 -14.291 1.00 0.00 C ATOM 954 O PRO A 61 -3.729 6.366 -14.750 1.00 0.00 O ATOM 955 CB PRO A 61 -2.460 7.722 -12.712 1.00 0.00 C ATOM 956 CG PRO A 61 -2.930 6.672 -11.712 1.00 0.00 C ATOM 957 CD PRO A 61 -4.110 7.381 -11.068 1.00 0.00 C ATOM 0 HA PRO A 61 -3.695 9.197 -13.776 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -1.838 7.292 -13.497 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -1.874 8.508 -12.236 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -3.225 5.743 -12.200 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -2.156 6.420 -10.987 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -4.877 6.665 -10.773 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -3.800 7.906 -10.165 1.00 0.00 H new ATOM 965 N ASN A 62 -5.699 7.392 -14.610 1.00 0.00 N ATOM 966 CA ASN A 62 -6.525 6.335 -15.214 1.00 0.00 C ATOM 967 C ASN A 62 -6.814 5.278 -14.158 1.00 0.00 C ATOM 968 O ASN A 62 -7.898 5.289 -13.574 1.00 0.00 O ATOM 969 CB ASN A 62 -5.948 5.696 -16.498 1.00 0.00 C ATOM 970 CG ASN A 62 -7.020 5.044 -17.367 1.00 0.00 C ATOM 971 OD1 ASN A 62 -7.903 4.204 -16.847 1.00 0.00 O flip ATOM 972 ND2 ASN A 62 -7.068 5.285 -18.567 1.00 0.00 N flip ATOM 0 H ASN A 62 -6.221 8.254 -14.450 1.00 0.00 H new ATOM 0 HA ASN A 62 -7.443 6.815 -15.552 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.432 6.461 -17.078 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.204 4.948 -16.224 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.397 5.929 -18.985 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.779 4.842 -19.148 1.00 0.00 H new ATOM 979 N MET A 63 -5.862 4.375 -13.908 1.00 0.00 N ATOM 980 CA MET A 63 -5.986 3.334 -12.898 1.00 0.00 C ATOM 981 C MET A 63 -5.693 3.963 -11.546 1.00 0.00 C ATOM 982 O MET A 63 -4.573 3.908 -11.044 1.00 0.00 O ATOM 983 CB MET A 63 -5.101 2.122 -13.229 1.00 0.00 C ATOM 984 CG MET A 63 -5.385 0.942 -12.293 1.00 0.00 C ATOM 985 SD MET A 63 -4.566 -0.615 -12.739 1.00 0.00 S ATOM 986 CE MET A 63 -5.540 -1.078 -14.197 1.00 0.00 C ATOM 0 H MET A 63 -4.975 4.351 -14.410 1.00 0.00 H new ATOM 0 HA MET A 63 -6.998 2.930 -12.875 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.272 1.817 -14.261 1.00 0.00 H new ATOM 0 HB3 MET A 63 -4.051 2.405 -13.150 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.079 1.218 -11.284 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.461 0.772 -12.265 1.00 0.00 H new ATOM 0 HE1 MET A 63 -5.425 -2.145 -14.388 1.00 0.00 H new ATOM 0 HE2 MET A 63 -6.591 -0.852 -14.019 1.00 0.00 H new ATOM 0 HE3 MET A 63 -5.190 -0.515 -15.062 1.00 0.00 H new ATOM 996 N ASP A 64 -6.717 4.611 -10.996 1.00 0.00 N ATOM 997 CA ASP A 64 -6.760 5.065 -9.613 1.00 0.00 C ATOM 998 C ASP A 64 -6.505 3.903 -8.656 1.00 0.00 C ATOM 999 O ASP A 64 -6.650 2.733 -9.021 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.078 5.804 -9.351 1.00 0.00 C ATOM 1001 CG ASP A 64 -9.324 4.942 -9.250 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -9.401 4.071 -8.360 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -10.297 5.241 -9.985 1.00 0.00 O ATOM 0 H ASP A 64 -7.563 4.840 -11.517 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.958 5.780 -9.429 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.976 6.368 -8.424 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.228 6.530 -10.150 1.00 0.00 H new ATOM 1008 N GLY A 65 -6.107 4.222 -7.425 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.668 3.234 -6.453 1.00 0.00 C ATOM 1010 C GLY A 65 -6.744 2.198 -6.111 1.00 0.00 C ATOM 1011 O GLY A 65 -6.399 1.090 -5.686 1.00 0.00 O ATOM 0 H GLY A 65 -6.082 5.180 -7.077 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.789 2.719 -6.841 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.362 3.744 -5.540 1.00 0.00 H new ATOM 1015 N LEU A 66 -8.027 2.522 -6.313 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.147 1.607 -6.144 1.00 0.00 C ATOM 1017 C LEU A 66 -9.177 0.629 -7.307 1.00 0.00 C ATOM 1018 O LEU A 66 -9.314 -0.575 -7.097 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.465 2.403 -6.095 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.567 1.813 -5.217 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.166 0.500 -5.729 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.083 1.671 -3.775 1.00 0.00 C ATOM 0 H LEU A 66 -8.316 3.455 -6.606 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.030 1.056 -5.211 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.246 3.411 -5.742 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.848 2.498 -7.111 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.388 2.529 -5.261 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -12.939 0.160 -5.040 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.603 0.659 -6.715 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.383 -0.255 -5.797 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.881 1.249 -3.163 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.216 1.011 -3.746 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.807 2.651 -3.386 1.00 0.00 H new ATOM 1034 N GLU A 67 -9.044 1.126 -8.536 1.00 0.00 N ATOM 1035 CA GLU A 67 -9.002 0.279 -9.717 1.00 0.00 C ATOM 1036 C GLU A 67 -7.768 -0.619 -9.689 1.00 0.00 C ATOM 1037 O GLU A 67 -7.889 -1.789 -10.060 1.00 0.00 O ATOM 1038 CB GLU A 67 -9.040 1.098 -11.016 1.00 0.00 C ATOM 1039 CG GLU A 67 -10.333 1.896 -11.220 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.631 1.082 -11.292 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.636 -0.172 -11.368 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -12.709 1.716 -11.256 1.00 0.00 O ATOM 0 H GLU A 67 -8.963 2.123 -8.736 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.895 -0.345 -9.699 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.196 1.788 -11.022 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.906 0.423 -11.861 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.424 2.614 -10.405 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -10.238 2.471 -12.141 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.612 -0.129 -9.227 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.415 -0.943 -9.001 1.00 0.00 C ATOM 1051 C LEU A 68 -5.745 -2.056 -8.020 1.00 0.00 C ATOM 1052 O LEU A 68 -5.524 -3.223 -8.351 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.257 -0.086 -8.454 1.00 0.00 C ATOM 1054 CG LEU A 68 -3.027 -0.914 -8.002 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.347 -1.609 -9.187 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -2.043 0.001 -7.268 1.00 0.00 C ATOM 0 H LEU A 68 -6.481 0.856 -8.997 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.097 -1.370 -9.952 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.945 0.621 -9.223 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.619 0.501 -7.610 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.366 -1.698 -7.325 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.489 -2.180 -8.831 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.056 -2.282 -9.669 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.012 -0.860 -9.905 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.177 -0.578 -6.949 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.720 0.799 -7.937 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.531 0.435 -6.395 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.291 -1.702 -6.846 1.00 0.00 N ATOM 1069 CA LEU A 69 -6.739 -2.658 -5.839 1.00 0.00 C ATOM 1070 C LEU A 69 -7.599 -3.696 -6.532 1.00 0.00 C ATOM 1071 O LEU A 69 -7.247 -4.860 -6.468 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.434 -1.957 -4.652 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.595 -2.680 -3.922 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.377 -4.111 -3.398 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -8.948 -1.834 -2.695 1.00 0.00 C ATOM 0 H LEU A 69 -6.433 -0.730 -6.573 1.00 0.00 H new ATOM 0 HA LEU A 69 -5.888 -3.166 -5.386 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.668 -1.733 -3.909 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.817 -1.003 -5.013 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.356 -2.783 -4.695 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.288 -4.464 -2.915 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.128 -4.769 -4.230 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.560 -4.114 -2.677 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.764 -2.307 -2.149 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.076 -1.753 -2.046 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.255 -0.839 -3.016 1.00 0.00 H new ATOM 1087 N LYS A 70 -8.665 -3.325 -7.237 1.00 0.00 N ATOM 1088 CA LYS A 70 -9.570 -4.307 -7.835 1.00 0.00 C ATOM 1089 C LYS A 70 -8.936 -5.144 -8.946 1.00 0.00 C ATOM 1090 O LYS A 70 -9.342 -6.291 -9.128 1.00 0.00 O ATOM 1091 CB LYS A 70 -10.836 -3.615 -8.337 1.00 0.00 C ATOM 1092 CG LYS A 70 -11.694 -3.150 -7.152 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.050 -2.653 -7.661 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.094 -2.677 -6.546 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.459 -2.565 -7.090 1.00 0.00 N ATOM 0 H LYS A 70 -8.924 -2.354 -7.409 1.00 0.00 H new ATOM 0 HA LYS A 70 -9.820 -5.013 -7.043 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.569 -2.761 -8.959 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.409 -4.299 -8.963 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.837 -3.971 -6.450 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.183 -2.353 -6.611 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -12.948 -1.639 -8.047 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.383 -3.278 -8.490 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.001 -3.602 -5.978 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.908 -1.857 -5.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.146 -2.584 -6.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.552 -1.670 -7.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.643 -3.362 -7.733 1.00 0.00 H new ATOM 1109 N THR A 71 -7.949 -4.623 -9.670 1.00 0.00 N ATOM 1110 CA THR A 71 -7.232 -5.392 -10.686 1.00 0.00 C ATOM 1111 C THR A 71 -6.320 -6.429 -10.010 1.00 0.00 C ATOM 1112 O THR A 71 -6.132 -7.536 -10.514 1.00 0.00 O ATOM 1113 CB THR A 71 -6.442 -4.432 -11.589 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.253 -3.376 -12.055 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.918 -5.123 -12.842 1.00 0.00 C ATOM 0 H THR A 71 -7.624 -3.661 -9.571 1.00 0.00 H new ATOM 0 HA THR A 71 -7.938 -5.937 -11.312 1.00 0.00 H new ATOM 0 HB THR A 71 -5.623 -4.070 -10.968 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.317 -2.684 -11.365 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.366 -4.406 -13.449 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.257 -5.941 -12.557 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.756 -5.517 -13.417 1.00 0.00 H new ATOM 1123 N ILE A 72 -5.763 -6.105 -8.843 1.00 0.00 N ATOM 1124 CA ILE A 72 -4.998 -7.028 -8.016 1.00 0.00 C ATOM 1125 C ILE A 72 -5.966 -8.023 -7.350 1.00 0.00 C ATOM 1126 O ILE A 72 -5.783 -9.238 -7.452 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.112 -6.180 -7.068 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -2.880 -5.725 -7.889 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -3.712 -6.936 -5.798 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -1.899 -4.814 -7.149 1.00 0.00 C ATOM 0 H ILE A 72 -5.835 -5.171 -8.440 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.310 -7.659 -8.579 1.00 0.00 H new ATOM 0 HB ILE A 72 -4.672 -5.317 -6.707 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.343 -6.611 -8.227 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.231 -5.205 -8.781 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.093 -6.294 -5.172 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.608 -7.223 -5.248 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.150 -7.830 -6.068 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.074 -4.554 -7.812 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.413 -3.905 -6.835 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.511 -5.333 -6.273 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.047 -7.526 -6.748 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.204 -8.226 -6.182 1.00 0.00 C ATOM 1144 C ARG A 73 -9.063 -8.878 -7.283 1.00 0.00 C ATOM 1145 O ARG A 73 -10.263 -9.067 -7.094 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.005 -7.262 -5.274 1.00 0.00 C ATOM 1147 CG ARG A 73 -9.473 -7.876 -3.941 1.00 0.00 C ATOM 1148 CD ARG A 73 -10.497 -8.986 -4.156 1.00 0.00 C ATOM 1149 NE ARG A 73 -10.834 -9.707 -2.924 1.00 0.00 N ATOM 1150 CZ ARG A 73 -11.243 -10.977 -2.885 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -11.388 -11.661 -4.015 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -11.491 -11.556 -1.719 1.00 0.00 N ATOM 0 H ARG A 73 -7.145 -6.517 -6.632 1.00 0.00 H new ATOM 0 HA ARG A 73 -7.857 -9.049 -5.558 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -8.388 -6.389 -5.060 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -9.878 -6.909 -5.822 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.613 -8.274 -3.403 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.908 -7.097 -3.315 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.406 -8.557 -4.578 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -10.108 -9.693 -4.889 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.750 -9.205 -2.040 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -11.187 -11.215 -4.910 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -11.700 -12.632 -3.987 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -11.369 -11.031 -0.853 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -11.804 -12.526 -1.688 1.00 0.00 H new ATOM 1166 N ALA A 74 -8.483 -9.177 -8.445 1.00 0.00 N ATOM 1167 CA ALA A 74 -9.116 -9.934 -9.502 1.00 0.00 C ATOM 1168 C ALA A 74 -9.324 -11.362 -9.005 1.00 0.00 C ATOM 1169 O ALA A 74 -10.455 -11.743 -8.720 1.00 0.00 O ATOM 1170 CB ALA A 74 -8.227 -9.888 -10.747 1.00 0.00 C ATOM 0 H ALA A 74 -7.532 -8.887 -8.674 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.086 -9.514 -9.769 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -8.696 -10.456 -11.550 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -8.097 -8.853 -11.063 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -7.254 -10.322 -10.516 1.00 0.00 H new ATOM 1205 N MET A 78 -2.770 -12.345 -7.229 1.00 0.00 N ATOM 1206 CA MET A 78 -2.458 -11.061 -6.621 1.00 0.00 C ATOM 1207 C MET A 78 -3.480 -10.710 -5.536 1.00 0.00 C ATOM 1208 O MET A 78 -3.193 -9.923 -4.644 1.00 0.00 O ATOM 1209 CB MET A 78 -2.343 -9.992 -7.718 1.00 0.00 C ATOM 1210 CG MET A 78 -1.370 -10.439 -8.812 1.00 0.00 C ATOM 1211 SD MET A 78 -0.904 -9.129 -9.971 1.00 0.00 S ATOM 1212 CE MET A 78 0.385 -10.013 -10.890 1.00 0.00 C ATOM 0 HA MET A 78 -1.494 -11.112 -6.115 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.325 -9.803 -8.153 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.001 -9.053 -7.283 1.00 0.00 H new ATOM 0 HG2 MET A 78 -0.468 -10.831 -8.342 1.00 0.00 H new ATOM 0 HG3 MET A 78 -1.821 -11.259 -9.370 1.00 0.00 H new ATOM 0 HE1 MET A 78 0.559 -9.515 -11.844 1.00 0.00 H new ATOM 0 HE2 MET A 78 1.308 -10.018 -10.309 1.00 0.00 H new ATOM 0 HE3 MET A 78 0.065 -11.039 -11.070 1.00 0.00 H new ATOM 1222 N SER A 79 -4.645 -11.351 -5.561 1.00 0.00 N ATOM 1223 CA SER A 79 -5.802 -10.987 -4.756 1.00 0.00 C ATOM 1224 C SER A 79 -5.545 -11.077 -3.248 1.00 0.00 C ATOM 1225 O SER A 79 -6.217 -10.377 -2.489 1.00 0.00 O ATOM 1226 CB SER A 79 -6.987 -11.862 -5.187 1.00 0.00 C ATOM 1227 OG SER A 79 -8.213 -11.372 -4.696 1.00 0.00 O ATOM 0 H SER A 79 -4.813 -12.160 -6.159 1.00 0.00 H new ATOM 0 HA SER A 79 -6.030 -9.936 -4.936 1.00 0.00 H new ATOM 0 HB2 SER A 79 -7.026 -11.909 -6.275 1.00 0.00 H new ATOM 0 HB3 SER A 79 -6.834 -12.880 -4.829 1.00 0.00 H new ATOM 0 HG SER A 79 -8.942 -11.956 -4.994 1.00 0.00 H new ATOM 1233 N ALA A 80 -4.592 -11.904 -2.804 1.00 0.00 N ATOM 1234 CA ALA A 80 -4.255 -12.023 -1.393 1.00 0.00 C ATOM 1235 C ALA A 80 -3.503 -10.803 -0.850 1.00 0.00 C ATOM 1236 O ALA A 80 -3.410 -10.652 0.368 1.00 0.00 O ATOM 1237 CB ALA A 80 -3.409 -13.279 -1.181 1.00 0.00 C ATOM 0 H ALA A 80 -4.038 -12.505 -3.415 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.194 -12.088 -0.843 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.154 -13.372 -0.125 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -3.974 -14.156 -1.497 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.495 -13.205 -1.770 1.00 0.00 H new ATOM 1243 N LEU A 81 -2.947 -9.955 -1.724 1.00 0.00 N ATOM 1244 CA LEU A 81 -2.026 -8.899 -1.330 1.00 0.00 C ATOM 1245 C LEU A 81 -2.682 -7.918 -0.365 1.00 0.00 C ATOM 1246 O LEU A 81 -3.830 -7.527 -0.599 1.00 0.00 O ATOM 1247 CB LEU A 81 -1.558 -8.097 -2.552 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.449 -8.776 -3.366 1.00 0.00 C ATOM 1249 CD1 LEU A 81 -0.308 -8.025 -4.691 1.00 0.00 C ATOM 1250 CD2 LEU A 81 0.877 -8.785 -2.596 1.00 0.00 C ATOM 0 H LEU A 81 -3.129 -9.988 -2.727 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.181 -9.390 -0.847 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.413 -7.918 -3.204 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.202 -7.122 -2.218 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.712 -9.817 -3.553 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.476 -8.488 -5.290 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.252 -8.065 -5.234 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.047 -6.985 -4.494 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.644 -9.273 -3.198 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.181 -7.760 -2.382 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.750 -9.329 -1.660 1.00 0.00 H new ATOM 1262 N PRO A 82 -1.948 -7.424 0.645 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.367 -6.286 1.431 1.00 0.00 C ATOM 1264 C PRO A 82 -2.117 -5.011 0.611 1.00 0.00 C ATOM 1265 O PRO A 82 -1.196 -4.242 0.896 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.542 -6.380 2.717 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.223 -6.992 2.248 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.618 -7.855 1.050 1.00 0.00 C ATOM 0 HA PRO A 82 -3.427 -6.266 1.685 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.392 -5.400 3.170 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.032 -7.005 3.464 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.495 -6.222 1.965 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.241 -7.589 3.033 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.094 -7.733 0.234 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.618 -8.912 1.317 1.00 0.00 H new ATOM 1276 N VAL A 83 -2.936 -4.786 -0.419 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.086 -3.460 -1.002 1.00 0.00 C ATOM 1278 C VAL A 83 -3.609 -2.540 0.100 1.00 0.00 C ATOM 1279 O VAL A 83 -4.429 -2.956 0.930 1.00 0.00 O ATOM 1280 CB VAL A 83 -3.985 -3.462 -2.253 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -3.224 -3.932 -3.499 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.232 -4.336 -2.091 1.00 0.00 C ATOM 0 H VAL A 83 -3.503 -5.508 -0.863 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.124 -3.098 -1.364 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.299 -2.426 -2.378 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -3.892 -3.919 -4.360 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.382 -3.265 -3.684 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.856 -4.946 -3.340 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.825 -4.297 -3.005 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.932 -5.366 -1.897 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.828 -3.968 -1.256 1.00 0.00 H new ATOM 1292 N LEU A 84 -3.081 -1.327 0.194 1.00 0.00 N ATOM 1293 CA LEU A 84 -3.168 -0.522 1.402 1.00 0.00 C ATOM 1294 C LEU A 84 -3.224 0.927 0.966 1.00 0.00 C ATOM 1295 O LEU A 84 -2.249 1.417 0.399 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.941 -0.853 2.270 1.00 0.00 C ATOM 1297 CG LEU A 84 -1.785 -0.101 3.606 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.107 0.197 4.319 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -0.895 -0.933 4.545 1.00 0.00 C ATOM 0 H LEU A 84 -2.579 -0.873 -0.569 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.055 -0.726 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.962 -1.921 2.487 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.048 -0.666 1.674 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.339 0.864 3.364 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.907 0.728 5.250 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.735 0.815 3.677 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.621 -0.739 4.538 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.778 -0.410 5.494 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.359 -1.904 4.721 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.084 -1.076 4.087 1.00 0.00 H new ATOM 1311 N MET A 85 -4.376 1.571 1.171 1.00 0.00 N ATOM 1312 CA MET A 85 -4.528 2.973 0.819 1.00 0.00 C ATOM 1313 C MET A 85 -3.773 3.758 1.887 1.00 0.00 C ATOM 1314 O MET A 85 -4.049 3.581 3.078 1.00 0.00 O ATOM 1315 CB MET A 85 -6.013 3.381 0.753 1.00 0.00 C ATOM 1316 CG MET A 85 -6.903 2.522 -0.160 1.00 0.00 C ATOM 1317 SD MET A 85 -7.068 3.026 -1.895 1.00 0.00 S ATOM 1318 CE MET A 85 -5.351 2.943 -2.461 1.00 0.00 C ATOM 0 H MET A 85 -5.208 1.142 1.576 1.00 0.00 H new ATOM 0 HA MET A 85 -4.127 3.177 -0.174 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.424 3.351 1.762 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.071 4.416 0.416 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.517 1.503 -0.142 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.901 2.492 0.277 1.00 0.00 H new ATOM 0 HE1 MET A 85 -5.331 2.784 -3.539 1.00 0.00 H new ATOM 0 HE2 MET A 85 -4.844 3.878 -2.222 1.00 0.00 H new ATOM 0 HE3 MET A 85 -4.843 2.117 -1.963 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.811 4.576 1.480 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.033 5.451 2.339 1.00 0.00 C ATOM 1330 C VAL A 86 -2.067 6.802 1.648 1.00 0.00 C ATOM 1331 O VAL A 86 -1.423 6.989 0.622 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.605 4.903 2.546 1.00 0.00 C ATOM 1333 CG1 VAL A 86 0.185 5.819 3.483 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.611 3.494 3.159 1.00 0.00 C ATOM 0 H VAL A 86 -2.542 4.649 0.499 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.439 5.526 3.348 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.141 4.862 1.560 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.190 5.420 3.620 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.247 6.817 3.049 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.318 5.873 4.448 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.415 3.148 3.287 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.108 3.521 4.129 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.144 2.811 2.497 1.00 0.00 H new ATOM 1344 N THR A 87 -2.895 7.716 2.145 1.00 0.00 N ATOM 1345 CA THR A 87 -3.146 8.972 1.462 1.00 0.00 C ATOM 1346 C THR A 87 -3.281 10.108 2.475 1.00 0.00 C ATOM 1347 O THR A 87 -3.264 9.908 3.694 1.00 0.00 O ATOM 1348 CB THR A 87 -4.352 8.799 0.511 1.00 0.00 C ATOM 1349 OG1 THR A 87 -4.582 9.975 -0.234 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.646 8.411 1.223 1.00 0.00 C ATOM 0 H THR A 87 -3.403 7.605 3.022 1.00 0.00 H new ATOM 0 HA THR A 87 -2.302 9.256 0.833 1.00 0.00 H new ATOM 0 HB THR A 87 -4.078 7.976 -0.148 1.00 0.00 H new ATOM 0 HG1 THR A 87 -3.773 10.208 -0.736 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.447 8.308 0.491 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.505 7.463 1.743 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.911 9.185 1.944 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.405 11.329 1.965 1.00 0.00 N ATOM 1359 CA ALA A 88 -3.759 12.494 2.744 1.00 0.00 C ATOM 1360 C ALA A 88 -5.268 12.726 2.755 1.00 0.00 C ATOM 1361 O ALA A 88 -5.757 13.416 3.652 1.00 0.00 O ATOM 1362 CB ALA A 88 -3.059 13.705 2.140 1.00 0.00 C ATOM 0 H ALA A 88 -3.257 11.533 0.977 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.443 12.338 3.775 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.313 14.596 2.714 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -1.980 13.552 2.166 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.382 13.834 1.107 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.001 12.225 1.761 1.00 0.00 N ATOM 1369 CA GLU A 89 -7.426 12.465 1.626 1.00 0.00 C ATOM 1370 C GLU A 89 -8.185 11.430 2.440 1.00 0.00 C ATOM 1371 O GLU A 89 -8.177 10.255 2.082 1.00 0.00 O ATOM 1372 CB GLU A 89 -7.835 12.410 0.148 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.271 13.631 -0.600 1.00 0.00 C ATOM 1374 CD GLU A 89 -8.088 14.042 -1.829 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.341 13.941 -1.808 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -7.487 14.582 -2.788 1.00 0.00 O ATOM 0 H GLU A 89 -5.613 11.637 1.024 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.669 13.458 2.003 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.464 11.491 -0.307 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.922 12.391 0.063 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.221 14.474 0.089 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -6.250 13.413 -0.912 1.00 0.00 H new ATOM 1383 N ALA A 90 -8.841 11.849 3.530 1.00 0.00 N ATOM 1384 CA ALA A 90 -9.821 11.006 4.206 1.00 0.00 C ATOM 1385 C ALA A 90 -10.907 10.635 3.198 1.00 0.00 C ATOM 1386 O ALA A 90 -10.910 9.513 2.727 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.384 11.688 5.461 1.00 0.00 C ATOM 0 H ALA A 90 -8.707 12.765 3.958 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.345 10.093 4.564 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.111 11.030 5.938 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.572 11.896 6.157 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.870 12.622 5.180 1.00 0.00 H new ATOM 1393 N LYS A 91 -11.784 11.577 2.841 1.00 0.00 N ATOM 1394 CA LYS A 91 -12.905 11.391 1.919 1.00 0.00 C ATOM 1395 C LYS A 91 -13.666 10.082 2.178 1.00 0.00 C ATOM 1396 O LYS A 91 -13.396 9.014 1.620 1.00 0.00 O ATOM 1397 CB LYS A 91 -12.409 11.541 0.474 1.00 0.00 C ATOM 1398 CG LYS A 91 -13.542 11.675 -0.556 1.00 0.00 C ATOM 1399 CD LYS A 91 -14.411 12.922 -0.307 1.00 0.00 C ATOM 1400 CE LYS A 91 -15.249 13.316 -1.524 1.00 0.00 C ATOM 1401 NZ LYS A 91 -16.124 12.219 -1.969 1.00 0.00 N ATOM 0 H LYS A 91 -11.729 12.529 3.202 1.00 0.00 H new ATOM 0 HA LYS A 91 -13.644 12.172 2.097 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.765 12.418 0.409 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.797 10.676 0.218 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -13.116 11.726 -1.558 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -14.169 10.784 -0.521 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -15.073 12.734 0.538 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -13.768 13.757 -0.029 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -15.856 14.188 -1.279 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -14.588 13.607 -2.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -16.770 12.567 -2.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -15.544 11.446 -2.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.677 11.867 -1.162 1.00 0.00 H new ATOM 1415 N LYS A 92 -14.687 10.178 3.025 1.00 0.00 N ATOM 1416 CA LYS A 92 -15.424 9.019 3.501 1.00 0.00 C ATOM 1417 C LYS A 92 -15.921 8.123 2.366 1.00 0.00 C ATOM 1418 O LYS A 92 -15.917 6.913 2.535 1.00 0.00 O ATOM 1419 CB LYS A 92 -16.576 9.460 4.426 1.00 0.00 C ATOM 1420 CG LYS A 92 -16.489 8.838 5.827 1.00 0.00 C ATOM 1421 CD LYS A 92 -16.499 7.303 5.791 1.00 0.00 C ATOM 1422 CE LYS A 92 -16.767 6.671 7.157 1.00 0.00 C ATOM 1423 NZ LYS A 92 -18.150 6.910 7.606 1.00 0.00 N ATOM 0 H LYS A 92 -15.025 11.065 3.399 1.00 0.00 H new ATOM 0 HA LYS A 92 -14.730 8.408 4.078 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -16.568 10.546 4.515 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -17.527 9.185 3.970 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -15.578 9.181 6.317 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -17.327 9.189 6.430 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -17.260 6.967 5.087 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -15.539 6.948 5.416 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -16.582 5.598 7.104 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -16.071 7.079 7.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -18.364 6.293 8.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -18.255 7.905 7.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -18.808 6.701 6.829 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.305 8.657 1.207 1.00 0.00 N ATOM 1438 CA GLU A 93 -16.748 7.818 0.094 1.00 0.00 C ATOM 1439 C GLU A 93 -15.600 6.977 -0.473 1.00 0.00 C ATOM 1440 O GLU A 93 -15.818 5.830 -0.860 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.319 8.673 -1.043 1.00 0.00 C ATOM 1442 CG GLU A 93 -18.625 9.382 -0.689 1.00 0.00 C ATOM 1443 CD GLU A 93 -18.455 10.463 0.374 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -17.544 11.312 0.229 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -19.228 10.480 1.357 1.00 0.00 O ATOM 0 H GLU A 93 -16.319 9.659 1.015 1.00 0.00 H new ATOM 0 HA GLU A 93 -17.519 7.158 0.492 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -16.578 9.419 -1.330 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -17.486 8.038 -1.913 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.043 9.831 -1.590 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.346 8.645 -0.336 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.381 7.524 -0.509 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.184 6.759 -0.853 1.00 0.00 C ATOM 1454 C ASN A 94 -12.965 5.670 0.194 1.00 0.00 C ATOM 1455 O ASN A 94 -12.642 4.543 -0.185 1.00 0.00 O ATOM 1456 CB ASN A 94 -11.922 7.634 -0.986 1.00 0.00 C ATOM 1457 CG ASN A 94 -11.922 8.612 -2.155 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -11.436 9.730 -2.041 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -12.485 8.275 -3.305 1.00 0.00 N ATOM 0 H ASN A 94 -14.199 8.506 -0.301 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.352 6.315 -1.834 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -11.794 8.199 -0.063 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.056 6.979 -1.082 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -12.508 8.942 -4.076 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.895 7.348 -3.420 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.208 5.953 1.487 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.238 4.882 2.501 1.00 0.00 C ATOM 1468 C ILE A 95 -14.253 3.792 2.107 1.00 0.00 C ATOM 1469 O ILE A 95 -13.877 2.618 2.130 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.435 5.410 3.952 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.103 5.783 4.633 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -14.135 4.404 4.889 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -11.588 7.141 4.173 1.00 0.00 C ATOM 0 H ILE A 95 -13.383 6.891 1.849 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.251 4.420 2.515 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.065 6.289 3.815 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.239 5.794 5.714 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.357 5.019 4.414 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.237 4.842 5.882 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -15.123 4.165 4.494 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.540 3.493 4.954 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -10.648 7.364 4.678 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.426 7.123 3.095 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.321 7.910 4.416 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.503 4.145 1.757 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.537 3.169 1.382 1.00 0.00 C ATOM 1487 C ILE A 96 -16.000 2.317 0.240 1.00 0.00 C ATOM 1488 O ILE A 96 -15.979 1.097 0.365 1.00 0.00 O ATOM 1489 CB ILE A 96 -17.912 3.816 1.034 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.779 4.052 2.287 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.779 2.959 0.087 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.322 5.227 3.137 1.00 0.00 C ATOM 0 H ILE A 96 -15.822 5.113 1.727 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.747 2.542 2.249 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.635 4.752 0.550 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.811 4.219 1.977 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.772 3.149 2.898 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.720 3.473 -0.110 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.247 2.803 -0.852 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -18.983 1.995 0.553 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -18.980 5.330 4.000 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.301 5.054 3.478 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.356 6.141 2.543 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.570 2.936 -0.859 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.108 2.222 -2.039 1.00 0.00 C ATOM 1506 C ALA A 97 -13.965 1.267 -1.683 1.00 0.00 C ATOM 1507 O ALA A 97 -13.945 0.120 -2.137 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.676 3.238 -3.093 1.00 0.00 C ATOM 0 H ALA A 97 -15.534 3.951 -0.952 1.00 0.00 H new ATOM 0 HA ALA A 97 -15.919 1.615 -2.441 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.327 2.713 -3.983 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.522 3.873 -3.354 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -13.869 3.854 -2.696 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.015 1.717 -0.859 1.00 0.00 N ATOM 1515 CA ALA A 98 -11.875 0.908 -0.461 1.00 0.00 C ATOM 1516 C ALA A 98 -12.330 -0.280 0.386 1.00 0.00 C ATOM 1517 O ALA A 98 -11.847 -1.393 0.184 1.00 0.00 O ATOM 1518 CB ALA A 98 -10.859 1.795 0.261 1.00 0.00 C ATOM 0 H ALA A 98 -13.020 2.653 -0.453 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.387 0.488 -1.340 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.001 1.194 0.562 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.529 2.589 -0.409 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.322 2.234 1.144 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.264 -0.079 1.317 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.798 -1.156 2.140 1.00 0.00 C ATOM 1526 C ALA A 99 -14.654 -2.125 1.321 1.00 0.00 C ATOM 1527 O ALA A 99 -14.608 -3.328 1.570 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.618 -0.564 3.287 1.00 0.00 C ATOM 0 H ALA A 99 -13.669 0.835 1.519 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.959 -1.724 2.543 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.017 -1.370 3.903 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -13.981 0.077 3.897 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.441 0.024 2.880 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.406 -1.616 0.347 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.217 -2.381 -0.588 1.00 0.00 C ATOM 1536 C GLN A 100 -15.322 -3.304 -1.408 1.00 0.00 C ATOM 1537 O GLN A 100 -15.599 -4.501 -1.498 1.00 0.00 O ATOM 1538 CB GLN A 100 -16.982 -1.419 -1.509 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.179 -0.744 -0.825 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.447 -1.539 -1.088 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -20.126 -1.301 -2.085 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -19.794 -2.498 -0.252 1.00 0.00 N ATOM 0 H GLN A 100 -15.467 -0.611 0.184 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.935 -2.989 -0.038 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.298 -0.651 -1.869 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.334 -1.967 -2.383 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -18.002 -0.672 0.248 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.295 0.274 -1.198 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.224 -2.687 0.572 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.633 -3.051 -0.430 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.245 -2.768 -1.991 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.262 -3.558 -2.712 1.00 0.00 C ATOM 1553 C ALA A 101 -12.520 -4.517 -1.770 1.00 0.00 C ATOM 1554 O ALA A 101 -12.096 -5.594 -2.193 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.292 -2.609 -3.408 1.00 0.00 C ATOM 0 H ALA A 101 -14.037 -1.770 -1.972 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.766 -4.175 -3.456 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.547 -3.187 -3.954 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -12.840 -1.974 -4.104 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.795 -1.987 -2.664 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.399 -4.152 -0.494 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.761 -4.948 0.536 1.00 0.00 C ATOM 1563 C GLY A 102 -10.268 -4.682 0.594 1.00 0.00 C ATOM 1564 O GLY A 102 -9.487 -5.621 0.746 1.00 0.00 O ATOM 0 H GLY A 102 -12.757 -3.263 -0.145 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.210 -4.723 1.503 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.937 -6.006 0.342 1.00 0.00 H new ATOM 1568 N ALA A 103 -9.863 -3.412 0.485 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.478 -3.021 0.694 1.00 0.00 C ATOM 1570 C ALA A 103 -8.071 -3.422 2.117 1.00 0.00 C ATOM 1571 O ALA A 103 -8.926 -3.486 3.013 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.326 -1.502 0.516 1.00 0.00 C ATOM 0 H ALA A 103 -10.485 -2.638 0.251 1.00 0.00 H new ATOM 0 HA ALA A 103 -7.838 -3.520 -0.034 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.285 -1.219 0.675 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.628 -1.222 -0.493 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -8.956 -0.986 1.240 1.00 0.00 H new ATOM 1578 N SER A 104 -6.777 -3.599 2.381 1.00 0.00 N ATOM 1579 CA SER A 104 -6.343 -4.004 3.711 1.00 0.00 C ATOM 1580 C SER A 104 -6.646 -2.934 4.762 1.00 0.00 C ATOM 1581 O SER A 104 -6.768 -3.260 5.945 1.00 0.00 O ATOM 1582 CB SER A 104 -4.866 -4.381 3.726 1.00 0.00 C ATOM 1583 OG SER A 104 -4.008 -3.269 3.570 1.00 0.00 O ATOM 0 H SER A 104 -6.025 -3.470 1.703 1.00 0.00 H new ATOM 0 HA SER A 104 -6.918 -4.892 3.974 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.635 -4.882 4.666 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.672 -5.097 2.927 1.00 0.00 H new ATOM 0 HG SER A 104 -4.013 -2.981 2.633 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.799 -1.674 4.356 1.00 0.00 N ATOM 1590 CA GLY A 105 -7.221 -0.565 5.185 1.00 0.00 C ATOM 1591 C GLY A 105 -6.833 0.745 4.514 1.00 0.00 C ATOM 1592 O GLY A 105 -6.327 0.751 3.382 1.00 0.00 O ATOM 0 H GLY A 105 -6.621 -1.394 3.391 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -8.299 -0.602 5.339 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -6.756 -0.634 6.168 1.00 0.00 H new ATOM 1596 N TYR A 106 -7.098 1.836 5.231 1.00 0.00 N ATOM 1597 CA TYR A 106 -7.059 3.189 4.717 1.00 0.00 C ATOM 1598 C TYR A 106 -6.361 4.069 5.753 1.00 0.00 C ATOM 1599 O TYR A 106 -6.980 4.556 6.701 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.498 3.614 4.381 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.613 4.761 3.401 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.161 6.043 3.754 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.198 4.552 2.138 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.309 7.111 2.856 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.347 5.617 1.234 1.00 0.00 C ATOM 1606 CZ TYR A 106 -8.912 6.910 1.595 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.076 7.949 0.736 1.00 0.00 O ATOM 0 H TYR A 106 -7.353 1.792 6.218 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.486 3.282 3.795 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -9.029 2.754 3.974 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -9.004 3.893 5.305 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.700 6.207 4.717 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.535 3.564 1.861 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -7.959 8.095 3.132 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -9.793 5.447 0.265 1.00 0.00 H new ATOM 0 HH TYR A 106 -8.783 8.779 1.167 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.046 4.206 5.634 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.260 5.140 6.421 1.00 0.00 C ATOM 1619 C VAL A 107 -4.526 6.534 5.841 1.00 0.00 C ATOM 1620 O VAL A 107 -4.345 6.744 4.641 1.00 0.00 O ATOM 1621 CB VAL A 107 -2.774 4.740 6.362 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -1.895 5.755 7.089 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -2.515 3.370 7.011 1.00 0.00 C ATOM 0 H VAL A 107 -4.489 3.661 4.976 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.535 5.133 7.476 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.524 4.702 5.302 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -0.852 5.443 7.028 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.008 6.734 6.623 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.196 5.814 8.135 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.454 3.131 6.945 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -2.816 3.401 8.058 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.092 2.606 6.490 1.00 0.00 H new ATOM 1633 N VAL A 108 -4.940 7.481 6.686 1.00 0.00 N ATOM 1634 CA VAL A 108 -4.967 8.900 6.336 1.00 0.00 C ATOM 1635 C VAL A 108 -3.821 9.573 7.093 1.00 0.00 C ATOM 1636 O VAL A 108 -3.522 9.178 8.224 1.00 0.00 O ATOM 1637 CB VAL A 108 -6.324 9.555 6.673 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -6.454 10.852 5.863 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -7.540 8.673 6.354 1.00 0.00 C ATOM 0 H VAL A 108 -5.266 7.284 7.632 1.00 0.00 H new ATOM 0 HA VAL A 108 -4.841 9.020 5.260 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.327 9.728 7.749 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.408 11.328 6.089 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -5.640 11.528 6.125 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.406 10.622 4.798 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.454 9.204 6.619 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.551 8.440 5.289 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.479 7.748 6.927 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.160 10.568 6.497 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.091 11.308 7.170 1.00 0.00 C ATOM 1651 C LYS A 109 -2.658 12.305 8.200 1.00 0.00 C ATOM 1652 O LYS A 109 -3.836 12.658 8.103 1.00 0.00 O ATOM 1653 CB LYS A 109 -1.145 11.921 6.117 1.00 0.00 C ATOM 1654 CG LYS A 109 -1.417 13.383 5.740 1.00 0.00 C ATOM 1655 CD LYS A 109 -0.506 13.836 4.589 1.00 0.00 C ATOM 1656 CE LYS A 109 1.000 13.802 4.885 1.00 0.00 C ATOM 1657 NZ LYS A 109 1.426 14.862 5.819 1.00 0.00 N ATOM 0 H LYS A 109 -3.348 10.881 5.545 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.481 10.630 7.767 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.123 11.846 6.488 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.200 11.317 5.212 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -2.461 13.498 5.449 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.256 14.022 6.608 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -0.703 13.204 3.723 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -0.781 14.853 4.310 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.261 12.830 5.303 1.00 0.00 H new ATOM 0 HE3 LYS A 109 1.551 13.905 3.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.451 14.790 5.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 1.205 15.793 5.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 0.923 14.751 6.723 1.00 0.00 H new ATOM 1671 N PRO A 110 -1.852 12.809 9.156 1.00 0.00 N ATOM 1672 CA PRO A 110 -0.524 12.319 9.506 1.00 0.00 C ATOM 1673 C PRO A 110 -0.626 10.894 10.057 1.00 0.00 C ATOM 1674 O PRO A 110 -1.605 10.544 10.725 1.00 0.00 O ATOM 1675 CB PRO A 110 0.019 13.296 10.555 1.00 0.00 C ATOM 1676 CG PRO A 110 -1.246 13.829 11.224 1.00 0.00 C ATOM 1677 CD PRO A 110 -2.269 13.840 10.093 1.00 0.00 C ATOM 0 HA PRO A 110 0.143 12.273 8.645 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.673 12.797 11.270 1.00 0.00 H new ATOM 0 HB3 PRO A 110 0.600 14.096 10.097 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -1.565 13.190 12.047 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.092 14.826 11.636 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -3.271 13.638 10.473 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -2.302 14.816 9.608 1.00 0.00 H new ATOM 1685 N PHE A 111 0.380 10.068 9.779 1.00 0.00 N ATOM 1686 CA PHE A 111 0.411 8.664 10.159 1.00 0.00 C ATOM 1687 C PHE A 111 1.816 8.303 10.637 1.00 0.00 C ATOM 1688 O PHE A 111 2.782 9.028 10.390 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.078 7.789 8.991 1.00 0.00 C ATOM 1690 CG PHE A 111 0.619 7.974 7.655 1.00 0.00 C ATOM 1691 CD1 PHE A 111 1.914 7.467 7.469 1.00 0.00 C ATOM 1692 CD2 PHE A 111 -0.054 8.549 6.559 1.00 0.00 C ATOM 1693 CE1 PHE A 111 2.532 7.557 6.214 1.00 0.00 C ATOM 1694 CE2 PHE A 111 0.569 8.656 5.305 1.00 0.00 C ATOM 1695 CZ PHE A 111 1.869 8.160 5.132 1.00 0.00 C ATOM 0 H PHE A 111 1.213 10.366 9.272 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.271 8.476 10.989 1.00 0.00 H new ATOM 0 HB2 PHE A 111 0.023 6.744 9.284 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.142 7.978 8.848 1.00 0.00 H new ATOM 0 HD1 PHE A 111 2.436 7.006 8.295 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.063 8.913 6.685 1.00 0.00 H new ATOM 0 HE1 PHE A 111 3.527 7.159 6.078 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.050 9.118 4.478 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.358 8.241 4.172 1.00 0.00 H new ATOM 1705 N THR A 112 1.931 7.189 11.353 1.00 0.00 N ATOM 1706 CA THR A 112 3.093 6.849 12.164 1.00 0.00 C ATOM 1707 C THR A 112 3.365 5.351 12.088 1.00 0.00 C ATOM 1708 O THR A 112 2.541 4.589 11.578 1.00 0.00 O ATOM 1709 CB THR A 112 2.825 7.296 13.617 1.00 0.00 C ATOM 1710 OG1 THR A 112 1.474 7.039 13.968 1.00 0.00 O ATOM 1711 CG2 THR A 112 3.122 8.784 13.782 1.00 0.00 C ATOM 0 H THR A 112 1.199 6.480 11.385 1.00 0.00 H new ATOM 0 HA THR A 112 3.979 7.363 11.790 1.00 0.00 H new ATOM 0 HB THR A 112 3.482 6.729 14.276 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.316 7.325 14.892 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.928 9.082 14.812 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.167 8.975 13.540 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.483 9.359 13.111 1.00 0.00 H new ATOM 1719 N ALA A 113 4.496 4.913 12.647 1.00 0.00 N ATOM 1720 CA ALA A 113 4.765 3.504 12.848 1.00 0.00 C ATOM 1721 C ALA A 113 3.693 2.921 13.772 1.00 0.00 C ATOM 1722 O ALA A 113 3.320 1.772 13.587 1.00 0.00 O ATOM 1723 CB ALA A 113 6.183 3.296 13.390 1.00 0.00 C ATOM 0 H ALA A 113 5.242 5.529 12.969 1.00 0.00 H new ATOM 0 HA ALA A 113 4.719 2.974 11.897 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.365 2.231 13.534 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.906 3.695 12.679 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.288 3.814 14.343 1.00 0.00 H new ATOM 1729 N ALA A 114 3.111 3.725 14.675 1.00 0.00 N ATOM 1730 CA ALA A 114 1.987 3.321 15.510 1.00 0.00 C ATOM 1731 C ALA A 114 0.791 2.834 14.684 1.00 0.00 C ATOM 1732 O ALA A 114 0.195 1.824 15.053 1.00 0.00 O ATOM 1733 CB ALA A 114 1.551 4.461 16.434 1.00 0.00 C ATOM 0 H ALA A 114 3.417 4.684 14.842 1.00 0.00 H new ATOM 0 HA ALA A 114 2.336 2.484 16.114 1.00 0.00 H new ATOM 0 HB1 ALA A 114 0.711 4.132 17.046 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.382 4.744 17.080 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.249 5.320 15.835 1.00 0.00 H new ATOM 1739 N THR A 115 0.403 3.519 13.598 1.00 0.00 N ATOM 1740 CA THR A 115 -0.685 2.997 12.767 1.00 0.00 C ATOM 1741 C THR A 115 -0.150 1.934 11.807 1.00 0.00 C ATOM 1742 O THR A 115 -0.870 0.986 11.524 1.00 0.00 O ATOM 1743 CB THR A 115 -1.493 4.120 12.075 1.00 0.00 C ATOM 1744 OG1 THR A 115 -2.809 3.712 11.745 1.00 0.00 O ATOM 1745 CG2 THR A 115 -0.903 4.605 10.751 1.00 0.00 C ATOM 0 H THR A 115 0.809 4.401 13.285 1.00 0.00 H new ATOM 0 HA THR A 115 -1.411 2.504 13.414 1.00 0.00 H new ATOM 0 HB THR A 115 -1.470 4.916 12.820 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.282 4.453 11.312 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.534 5.392 10.338 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.100 4.997 10.921 1.00 0.00 H new ATOM 0 HG23 THR A 115 -0.853 3.773 10.048 1.00 0.00 H new ATOM 1753 N LEU A 116 1.096 2.049 11.319 1.00 0.00 N ATOM 1754 CA LEU A 116 1.682 1.081 10.394 1.00 0.00 C ATOM 1755 C LEU A 116 1.682 -0.307 11.055 1.00 0.00 C ATOM 1756 O LEU A 116 1.188 -1.258 10.453 1.00 0.00 O ATOM 1757 CB LEU A 116 3.092 1.552 9.973 1.00 0.00 C ATOM 1758 CG LEU A 116 3.735 0.939 8.710 1.00 0.00 C ATOM 1759 CD1 LEU A 116 3.765 -0.586 8.729 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.078 1.403 7.402 1.00 0.00 C ATOM 0 H LEU A 116 1.721 2.819 11.559 1.00 0.00 H new ATOM 0 HA LEU A 116 1.091 1.007 9.481 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.050 2.632 9.831 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.766 1.366 10.810 1.00 0.00 H new ATOM 0 HG LEU A 116 4.759 1.312 8.737 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.229 -0.952 7.813 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.340 -0.928 9.589 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.747 -0.969 8.798 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.580 0.933 6.556 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.026 1.119 7.403 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.161 2.486 7.317 1.00 0.00 H new ATOM 1772 N GLU A 117 2.197 -0.416 12.282 1.00 0.00 N ATOM 1773 CA GLU A 117 2.327 -1.650 13.056 1.00 0.00 C ATOM 1774 C GLU A 117 0.957 -2.219 13.416 1.00 0.00 C ATOM 1775 O GLU A 117 0.716 -3.412 13.259 1.00 0.00 O ATOM 1776 CB GLU A 117 3.228 -1.407 14.286 1.00 0.00 C ATOM 1777 CG GLU A 117 2.602 -0.677 15.490 1.00 0.00 C ATOM 1778 CD GLU A 117 2.203 -1.640 16.613 1.00 0.00 C ATOM 1779 OE1 GLU A 117 3.081 -2.032 17.422 1.00 0.00 O ATOM 1780 OE2 GLU A 117 1.010 -1.993 16.729 1.00 0.00 O ATOM 0 H GLU A 117 2.552 0.396 12.787 1.00 0.00 H new ATOM 0 HA GLU A 117 2.815 -2.411 12.447 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.594 -2.374 14.631 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.097 -0.835 13.960 1.00 0.00 H new ATOM 0 HG2 GLU A 117 3.311 0.054 15.877 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.723 -0.124 15.159 1.00 0.00 H new ATOM 1787 N GLU A 118 0.020 -1.359 13.803 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.358 -1.719 14.073 1.00 0.00 C ATOM 1789 C GLU A 118 -1.988 -2.291 12.797 1.00 0.00 C ATOM 1790 O GLU A 118 -2.682 -3.308 12.824 1.00 0.00 O ATOM 1791 CB GLU A 118 -2.037 -0.457 14.603 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.533 -0.612 14.800 1.00 0.00 C ATOM 1793 CD GLU A 118 -3.942 -1.641 15.851 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -3.480 -1.586 17.010 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -4.815 -2.491 15.546 1.00 0.00 O ATOM 0 H GLU A 118 0.209 -0.366 13.940 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.465 -2.503 14.823 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.580 -0.180 15.553 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.853 0.364 13.910 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -3.950 0.356 15.079 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.983 -0.890 13.847 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.722 -1.673 11.645 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.172 -2.154 10.350 1.00 0.00 C ATOM 1804 C LYS A 119 -1.470 -3.449 9.933 1.00 0.00 C ATOM 1805 O LYS A 119 -2.108 -4.217 9.199 1.00 0.00 O ATOM 1806 CB LYS A 119 -1.984 -1.050 9.292 1.00 0.00 C ATOM 1807 CG LYS A 119 -3.216 -0.175 9.042 1.00 0.00 C ATOM 1808 CD LYS A 119 -4.417 -0.953 8.466 1.00 0.00 C ATOM 1809 CE LYS A 119 -4.289 -1.476 7.024 1.00 0.00 C ATOM 1810 NZ LYS A 119 -3.277 -2.538 6.784 1.00 0.00 N ATOM 0 H LYS A 119 -1.179 -0.811 11.591 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.232 -2.394 10.431 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.158 -0.409 9.601 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -1.691 -1.516 8.351 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.514 0.296 9.979 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.949 0.627 8.354 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.612 -1.804 9.118 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.293 -0.306 8.515 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.262 -1.857 6.713 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -4.056 -0.631 6.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -3.591 -3.146 6.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -2.366 -2.100 6.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -3.165 -3.112 7.644 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.222 -3.684 10.360 1.00 0.00 N ATOM 1825 CA LEU A 120 0.502 -4.936 10.144 1.00 0.00 C ATOM 1826 C LEU A 120 -0.213 -6.019 10.935 1.00 0.00 C ATOM 1827 O LEU A 120 -0.640 -7.004 10.348 1.00 0.00 O ATOM 1828 CB LEU A 120 1.990 -4.882 10.558 1.00 0.00 C ATOM 1829 CG LEU A 120 2.942 -4.093 9.643 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.349 -4.045 10.255 1.00 0.00 C ATOM 1831 CD2 LEU A 120 3.045 -4.703 8.244 1.00 0.00 C ATOM 0 H LEU A 120 0.321 -2.992 10.876 1.00 0.00 H new ATOM 0 HA LEU A 120 0.505 -5.140 9.073 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.048 -4.452 11.558 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.359 -5.905 10.629 1.00 0.00 H new ATOM 0 HG LEU A 120 2.526 -3.090 9.553 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.013 -3.484 9.597 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.306 -3.557 11.229 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.729 -5.060 10.374 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.729 -4.109 7.638 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.420 -5.724 8.319 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.060 -4.711 7.777 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.413 -5.820 12.239 1.00 0.00 N ATOM 1844 CA ASN A 121 -1.133 -6.769 13.083 1.00 0.00 C ATOM 1845 C ASN A 121 -2.522 -7.061 12.526 1.00 0.00 C ATOM 1846 O ASN A 121 -2.915 -8.223 12.439 1.00 0.00 O ATOM 1847 CB ASN A 121 -1.223 -6.252 14.517 1.00 0.00 C ATOM 1848 CG ASN A 121 -1.939 -7.250 15.417 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -1.727 -8.450 15.324 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -2.789 -6.793 16.317 1.00 0.00 N ATOM 0 H ASN A 121 -0.079 -4.995 12.738 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.574 -7.704 13.088 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.221 -6.064 14.902 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.753 -5.300 14.531 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -3.272 -7.442 16.938 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -2.963 -5.791 16.391 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.241 -6.028 12.067 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.491 -6.225 11.342 1.00 0.00 C ATOM 1859 C LYS A 122 -4.294 -7.214 10.207 1.00 0.00 C ATOM 1860 O LYS A 122 -4.988 -8.217 10.209 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.107 -4.914 10.841 1.00 0.00 C ATOM 1862 CG LYS A 122 -5.861 -4.188 11.958 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.525 -2.896 11.451 1.00 0.00 C ATOM 1864 CE LYS A 122 -5.966 -1.658 12.154 1.00 0.00 C ATOM 1865 NZ LYS A 122 -6.458 -1.558 13.545 1.00 0.00 N ATOM 0 H LYS A 122 -2.974 -5.051 12.188 1.00 0.00 H new ATOM 0 HA LYS A 122 -5.208 -6.641 12.050 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.321 -4.267 10.450 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.788 -5.122 10.016 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -6.622 -4.849 12.373 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -5.171 -3.949 12.767 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -6.370 -2.805 10.376 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.601 -2.952 11.614 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -4.877 -1.699 12.154 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -6.252 -0.764 11.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.386 -0.572 13.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.451 -1.864 13.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -5.883 -2.167 14.161 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.421 -6.979 9.225 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.333 -7.925 8.103 1.00 0.00 C ATOM 1881 C ILE A 123 -2.777 -9.297 8.495 1.00 0.00 C ATOM 1882 O ILE A 123 -3.200 -10.300 7.912 1.00 0.00 O ATOM 1883 CB ILE A 123 -2.570 -7.346 6.904 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.147 -6.906 7.270 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -3.383 -6.192 6.320 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -0.400 -6.209 6.146 1.00 0.00 C ATOM 0 H ILE A 123 -2.789 -6.180 9.178 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.366 -8.086 7.796 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.451 -8.128 6.154 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.196 -6.236 8.128 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.577 -7.782 7.581 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -2.853 -5.769 5.466 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.357 -6.560 5.997 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -3.519 -5.422 7.079 1.00 0.00 H new ATOM 0 HD11 ILE A 123 0.597 -5.931 6.489 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -0.316 -6.882 5.293 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -0.944 -5.313 5.849 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.868 -9.365 9.465 1.00 0.00 N ATOM 1899 CA PHE A 124 -1.328 -10.619 9.961 1.00 0.00 C ATOM 1900 C PHE A 124 -2.456 -11.488 10.485 1.00 0.00 C ATOM 1901 O PHE A 124 -2.501 -12.675 10.187 1.00 0.00 O ATOM 1902 CB PHE A 124 -0.322 -10.367 11.090 1.00 0.00 C ATOM 1903 CG PHE A 124 0.987 -9.671 10.743 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.529 -9.703 9.441 1.00 0.00 C ATOM 1905 CD2 PHE A 124 1.703 -9.014 11.763 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.742 -9.053 9.158 1.00 0.00 C ATOM 1907 CE2 PHE A 124 2.928 -8.383 11.487 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.442 -8.393 10.180 1.00 0.00 C ATOM 0 H PHE A 124 -1.485 -8.542 9.930 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.819 -11.124 9.140 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.822 -9.774 11.856 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.079 -11.329 11.540 1.00 0.00 H new ATOM 0 HD1 PHE A 124 1.008 -10.231 8.656 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.306 -8.995 12.767 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.136 -9.061 8.153 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.473 -7.891 12.279 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.374 -7.894 9.962 1.00 0.00 H new ATOM 1918 N GLU A 125 -3.371 -10.907 11.256 1.00 0.00 N ATOM 1919 CA GLU A 125 -4.410 -11.672 11.919 1.00 0.00 C ATOM 1920 C GLU A 125 -5.659 -11.789 11.051 1.00 0.00 C ATOM 1921 O GLU A 125 -6.359 -12.799 11.100 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.756 -10.980 13.244 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.595 -10.966 14.250 1.00 0.00 C ATOM 1924 CD GLU A 125 -3.282 -12.332 14.867 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -3.848 -13.364 14.441 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -2.426 -12.373 15.781 1.00 0.00 O ATOM 0 H GLU A 125 -3.409 -9.903 11.434 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.043 -12.682 12.101 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -5.062 -9.954 13.040 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.611 -11.483 13.695 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.701 -10.592 13.751 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -3.831 -10.264 15.050 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.968 -10.758 10.270 1.00 0.00 N ATOM 1934 CA LYS A 126 -7.161 -10.704 9.427 1.00 0.00 C ATOM 1935 C LYS A 126 -6.913 -11.587 8.215 1.00 0.00 C ATOM 1936 O LYS A 126 -7.508 -12.656 8.106 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.495 -9.249 9.043 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.791 -9.115 8.232 1.00 0.00 C ATOM 1939 CD LYS A 126 -8.867 -7.737 7.558 1.00 0.00 C ATOM 1940 CE LYS A 126 -10.053 -7.666 6.590 1.00 0.00 C ATOM 1941 NZ LYS A 126 -11.326 -7.392 7.289 1.00 0.00 N ATOM 0 H LYS A 126 -5.388 -9.922 10.203 1.00 0.00 H new ATOM 0 HA LYS A 126 -8.033 -11.077 9.964 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.580 -8.652 9.951 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.669 -8.835 8.465 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.836 -9.899 7.476 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.652 -9.254 8.886 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.965 -6.961 8.317 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -7.940 -7.540 7.019 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -9.871 -6.886 5.851 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -10.134 -8.607 6.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -12.101 -7.352 6.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -11.514 -8.149 7.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -11.260 -6.481 7.787 1.00 0.00 H new ATOM 1955 N LEU A 127 -6.053 -11.131 7.301 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.788 -11.814 6.043 1.00 0.00 C ATOM 1957 C LEU A 127 -5.046 -13.120 6.323 1.00 0.00 C ATOM 1958 O LEU A 127 -5.305 -14.126 5.666 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.952 -10.935 5.088 1.00 0.00 C ATOM 1960 CG LEU A 127 -5.315 -9.437 4.985 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.508 -8.749 3.874 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.815 -9.197 4.781 1.00 0.00 C ATOM 0 H LEU A 127 -5.519 -10.270 7.419 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.742 -12.022 5.559 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.908 -11.006 5.394 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -5.021 -11.366 4.089 1.00 0.00 H new ATOM 0 HG LEU A 127 -5.050 -8.993 5.945 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.783 -7.696 3.823 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.443 -8.836 4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.724 -9.227 2.918 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -7.007 -8.126 4.716 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.139 -9.680 3.859 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.368 -9.614 5.623 1.00 0.00 H new ATOM 1974 N GLY A 128 -4.145 -13.119 7.308 1.00 0.00 N ATOM 1975 CA GLY A 128 -3.148 -14.165 7.483 1.00 0.00 C ATOM 1976 C GLY A 128 -1.862 -13.764 6.770 1.00 0.00 C ATOM 1977 O GLY A 128 -1.303 -14.588 6.043 1.00 0.00 O ATOM 0 H GLY A 128 -4.091 -12.382 8.011 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.954 -14.324 8.544 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.520 -15.108 7.082 1.00 0.00 H new ATOM 1981 N MET A 129 -1.448 -12.494 6.865 1.00 0.00 N ATOM 1982 CA MET A 129 -0.170 -12.053 6.289 1.00 0.00 C ATOM 1983 C MET A 129 1.000 -12.494 7.161 1.00 0.00 C ATOM 1984 O MET A 129 0.770 -13.088 8.232 1.00 0.00 O ATOM 1985 CB MET A 129 -0.143 -10.533 6.054 1.00 0.00 C ATOM 1986 CG MET A 129 -0.961 -10.098 4.839 1.00 0.00 C ATOM 1987 SD MET A 129 -0.487 -10.832 3.250 1.00 0.00 S ATOM 1988 CE MET A 129 -1.908 -11.924 2.972 1.00 0.00 C ATOM 1989 OXT MET A 129 2.161 -12.264 6.752 1.00 0.00 O ATOM 0 H MET A 129 -1.976 -11.757 7.332 1.00 0.00 H new ATOM 0 HA MET A 129 -0.068 -12.532 5.315 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.525 -10.028 6.941 1.00 0.00 H new ATOM 0 HB3 MET A 129 0.890 -10.210 5.923 1.00 0.00 H new ATOM 0 HG2 MET A 129 -2.008 -10.336 5.028 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.892 -9.014 4.750 1.00 0.00 H new ATOM 0 HE1 MET A 129 -1.779 -12.457 2.030 1.00 0.00 H new ATOM 0 HE2 MET A 129 -1.980 -12.643 3.788 1.00 0.00 H new ATOM 0 HE3 MET A 129 -2.821 -11.330 2.931 1.00 0.00 H new