USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 944 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 Single : A 5 LYS NZ :NH3+ -123:sc= -0.0521 (180deg=-1.77) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.445 K(o=-0.44,f=-1.1) USER MOD Single : A 24 ASN : amide:sc= -0.283 X(o=-0.28,f=-0.074) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot -15:sc= -0.562 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= -0.224 K(o=-0.22,f=-2.7!) USER MOD Single : A 35 ASN : amide:sc= -1.01 K(o=-1,f=-14!) USER MOD Single : A 38 GLN :FLIP amide:sc= -0.727 F(o=-1.9,f=-0.73) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 MET CE :methyl 144:sc= -0.539 (180deg=-2.86!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 156:sc= -10.4! (180deg=-13.6!) USER MOD Single : A 67 LYS NZ :NH3+ 156:sc=-0.000754 (180deg=-0.659) USER MOD Single : A 69 MET CE :methyl 180:sc= -3.22! (180deg=-3.22!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.643 K(o=-0.64,f=-6.1!) USER MOD Single : A 81 MET CE :methyl -121:sc= -4.69! (180deg=-6.5!) USER MOD Single : A 82 THR OG1 : rot -56:sc= 0.653 USER MOD Single : A 91 GLN : amide:sc= -0.154 K(o=-0.15,f=-2.7!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot -129:sc= -0.082 USER MOD Single : A 101 HIS : no HE2:sc= -32.8! C(o=-33!,f=-39!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 51 N GLU A 4 2.615 -11.836 -3.297 1.00 0.00 N ATOM 52 CA GLU A 4 1.925 -10.774 -2.513 1.00 0.00 C ATOM 53 C GLU A 4 2.861 -9.575 -2.346 1.00 0.00 C ATOM 54 O GLU A 4 3.232 -9.215 -1.246 1.00 0.00 O ATOM 55 CB GLU A 4 1.546 -11.321 -1.136 1.00 0.00 C ATOM 56 CG GLU A 4 2.756 -12.017 -0.512 1.00 0.00 C ATOM 57 CD GLU A 4 2.696 -11.880 1.011 1.00 0.00 C ATOM 58 OE1 GLU A 4 1.662 -11.464 1.508 1.00 0.00 O ATOM 59 OE2 GLU A 4 3.685 -12.193 1.654 1.00 0.00 O ATOM 0 HA GLU A 4 1.023 -10.461 -3.040 1.00 0.00 H new ATOM 0 HB2 GLU A 4 1.208 -10.510 -0.491 1.00 0.00 H new ATOM 0 HB3 GLU A 4 0.717 -12.023 -1.227 1.00 0.00 H new ATOM 0 HG2 GLU A 4 2.768 -13.070 -0.793 1.00 0.00 H new ATOM 0 HG3 GLU A 4 3.678 -11.576 -0.891 1.00 0.00 H new ATOM 66 N LYS A 5 3.243 -8.953 -3.428 1.00 0.00 N ATOM 67 CA LYS A 5 4.155 -7.779 -3.329 1.00 0.00 C ATOM 68 C LYS A 5 3.551 -6.599 -4.093 1.00 0.00 C ATOM 69 O LYS A 5 3.012 -6.755 -5.171 1.00 0.00 O ATOM 70 CB LYS A 5 5.515 -8.135 -3.932 1.00 0.00 C ATOM 71 CG LYS A 5 6.088 -9.358 -3.214 1.00 0.00 C ATOM 72 CD LYS A 5 7.506 -9.631 -3.722 1.00 0.00 C ATOM 73 CE LYS A 5 8.256 -10.493 -2.706 1.00 0.00 C ATOM 74 NZ LYS A 5 8.579 -9.675 -1.502 1.00 0.00 N ATOM 0 H LYS A 5 2.963 -9.207 -4.375 1.00 0.00 H new ATOM 0 HA LYS A 5 4.284 -7.507 -2.281 1.00 0.00 H new ATOM 0 HB2 LYS A 5 5.409 -8.342 -4.997 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.199 -7.291 -3.837 1.00 0.00 H new ATOM 0 HG2 LYS A 5 6.103 -9.187 -2.138 1.00 0.00 H new ATOM 0 HG3 LYS A 5 5.454 -10.227 -3.390 1.00 0.00 H new ATOM 0 HD2 LYS A 5 7.467 -10.138 -4.686 1.00 0.00 H new ATOM 0 HD3 LYS A 5 8.035 -8.691 -3.878 1.00 0.00 H new ATOM 0 HE2 LYS A 5 7.648 -11.352 -2.423 1.00 0.00 H new ATOM 0 HE3 LYS A 5 9.172 -10.883 -3.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 9.606 -9.688 -1.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 8.264 -8.695 -1.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 8.092 -10.071 -0.673 1.00 0.00 H new ATOM 88 N ILE A 6 3.635 -5.418 -3.544 1.00 0.00 N ATOM 89 CA ILE A 6 3.066 -4.230 -4.240 1.00 0.00 C ATOM 90 C ILE A 6 3.955 -3.012 -3.977 1.00 0.00 C ATOM 91 O ILE A 6 4.659 -2.947 -2.988 1.00 0.00 O ATOM 92 CB ILE A 6 1.657 -3.957 -3.712 1.00 0.00 C ATOM 93 CG1 ILE A 6 0.755 -5.152 -4.030 1.00 0.00 C ATOM 94 CG2 ILE A 6 1.094 -2.702 -4.383 1.00 0.00 C ATOM 95 CD1 ILE A 6 -0.507 -5.085 -3.166 1.00 0.00 C ATOM 0 H ILE A 6 4.073 -5.225 -2.643 1.00 0.00 H new ATOM 0 HA ILE A 6 3.021 -4.423 -5.312 1.00 0.00 H new ATOM 0 HB ILE A 6 1.696 -3.806 -2.633 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.486 -5.147 -5.086 1.00 0.00 H new ATOM 0 HG13 ILE A 6 1.288 -6.084 -3.842 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.090 -2.508 -4.007 1.00 0.00 H new ATOM 0 HG22 ILE A 6 1.737 -1.850 -4.159 1.00 0.00 H new ATOM 0 HG23 ILE A 6 1.054 -2.853 -5.462 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -1.149 -5.936 -3.393 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -0.229 -5.111 -2.113 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -1.043 -4.160 -3.377 1.00 0.00 H new ATOM 107 N LEU A 7 3.930 -2.046 -4.854 1.00 0.00 N ATOM 108 CA LEU A 7 4.774 -0.835 -4.653 1.00 0.00 C ATOM 109 C LEU A 7 3.929 0.421 -4.876 1.00 0.00 C ATOM 110 O LEU A 7 3.396 0.641 -5.946 1.00 0.00 O ATOM 111 CB LEU A 7 5.934 -0.853 -5.651 1.00 0.00 C ATOM 112 CG LEU A 7 7.091 -0.017 -5.104 1.00 0.00 C ATOM 113 CD1 LEU A 7 6.573 1.359 -4.680 1.00 0.00 C ATOM 114 CD2 LEU A 7 7.705 -0.725 -3.896 1.00 0.00 C ATOM 0 H LEU A 7 3.362 -2.043 -5.701 1.00 0.00 H new ATOM 0 HA LEU A 7 5.167 -0.831 -3.636 1.00 0.00 H new ATOM 0 HB2 LEU A 7 6.262 -1.878 -5.825 1.00 0.00 H new ATOM 0 HB3 LEU A 7 5.607 -0.456 -6.612 1.00 0.00 H new ATOM 0 HG LEU A 7 7.848 0.104 -5.878 1.00 0.00 H new ATOM 0 HD11 LEU A 7 7.399 1.954 -4.290 1.00 0.00 H new ATOM 0 HD12 LEU A 7 6.136 1.865 -5.541 1.00 0.00 H new ATOM 0 HD13 LEU A 7 5.815 1.240 -3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 7 8.530 -0.129 -3.506 1.00 0.00 H new ATOM 0 HD22 LEU A 7 6.947 -0.847 -3.122 1.00 0.00 H new ATOM 0 HD23 LEU A 7 8.076 -1.704 -4.198 1.00 0.00 H new ATOM 126 N ILE A 8 3.804 1.249 -3.874 1.00 0.00 N ATOM 127 CA ILE A 8 2.995 2.489 -4.029 1.00 0.00 C ATOM 128 C ILE A 8 3.926 3.676 -4.285 1.00 0.00 C ATOM 129 O ILE A 8 4.547 4.197 -3.379 1.00 0.00 O ATOM 130 CB ILE A 8 2.191 2.737 -2.752 1.00 0.00 C ATOM 131 CG1 ILE A 8 1.299 1.525 -2.469 1.00 0.00 C ATOM 132 CG2 ILE A 8 1.317 3.980 -2.930 1.00 0.00 C ATOM 133 CD1 ILE A 8 0.295 1.875 -1.370 1.00 0.00 C ATOM 0 H ILE A 8 4.228 1.119 -2.955 1.00 0.00 H new ATOM 0 HA ILE A 8 2.312 2.375 -4.871 1.00 0.00 H new ATOM 0 HB ILE A 8 2.875 2.891 -1.917 1.00 0.00 H new ATOM 0 HG12 ILE A 8 0.772 1.228 -3.376 1.00 0.00 H new ATOM 0 HG13 ILE A 8 1.909 0.675 -2.162 1.00 0.00 H new ATOM 0 HG21 ILE A 8 0.744 4.156 -2.019 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.950 4.844 -3.133 1.00 0.00 H new ATOM 0 HG23 ILE A 8 0.633 3.827 -3.765 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -0.340 1.012 -1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.831 2.151 -0.462 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -0.323 2.712 -1.695 1.00 0.00 H new ATOM 145 N VAL A 9 4.029 4.108 -5.512 1.00 0.00 N ATOM 146 CA VAL A 9 4.922 5.260 -5.824 1.00 0.00 C ATOM 147 C VAL A 9 4.134 6.566 -5.703 1.00 0.00 C ATOM 148 O VAL A 9 3.524 7.024 -6.648 1.00 0.00 O ATOM 149 CB VAL A 9 5.456 5.119 -7.251 1.00 0.00 C ATOM 150 CG1 VAL A 9 6.637 6.070 -7.451 1.00 0.00 C ATOM 151 CG2 VAL A 9 5.919 3.679 -7.482 1.00 0.00 C ATOM 0 H VAL A 9 3.534 3.713 -6.312 1.00 0.00 H new ATOM 0 HA VAL A 9 5.756 5.272 -5.122 1.00 0.00 H new ATOM 0 HB VAL A 9 4.666 5.366 -7.960 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.017 5.969 -8.468 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.310 7.096 -7.286 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.427 5.823 -6.742 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.300 3.578 -8.498 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.709 3.433 -6.773 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.079 2.999 -7.340 1.00 0.00 H new ATOM 161 N ASP A 10 4.145 7.169 -4.546 1.00 0.00 N ATOM 162 CA ASP A 10 3.399 8.446 -4.364 1.00 0.00 C ATOM 163 C ASP A 10 4.141 9.327 -3.356 1.00 0.00 C ATOM 164 O ASP A 10 4.630 8.856 -2.349 1.00 0.00 O ATOM 165 CB ASP A 10 1.991 8.145 -3.843 1.00 0.00 C ATOM 166 CG ASP A 10 1.335 9.440 -3.361 1.00 0.00 C ATOM 167 OD1 ASP A 10 0.702 10.097 -4.171 1.00 0.00 O ATOM 168 OD2 ASP A 10 1.477 9.753 -2.190 1.00 0.00 O ATOM 0 H ASP A 10 4.638 6.833 -3.719 1.00 0.00 H new ATOM 0 HA ASP A 10 3.327 8.967 -5.319 1.00 0.00 H new ATOM 0 HB2 ASP A 10 1.390 7.692 -4.631 1.00 0.00 H new ATOM 0 HB3 ASP A 10 2.041 7.425 -3.026 1.00 0.00 H new ATOM 173 N ASP A 11 4.230 10.602 -3.620 1.00 0.00 N ATOM 174 CA ASP A 11 4.943 11.509 -2.676 1.00 0.00 C ATOM 175 C ASP A 11 3.923 12.370 -1.926 1.00 0.00 C ATOM 176 O ASP A 11 4.093 12.679 -0.764 1.00 0.00 O ATOM 177 CB ASP A 11 5.894 12.414 -3.459 1.00 0.00 C ATOM 178 CG ASP A 11 5.086 13.448 -4.246 1.00 0.00 C ATOM 179 OD1 ASP A 11 4.178 13.045 -4.955 1.00 0.00 O ATOM 180 OD2 ASP A 11 5.386 14.624 -4.124 1.00 0.00 O ATOM 0 H ASP A 11 3.841 11.054 -4.447 1.00 0.00 H new ATOM 0 HA ASP A 11 5.512 10.914 -1.962 1.00 0.00 H new ATOM 0 HB2 ASP A 11 6.579 12.916 -2.776 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.502 11.818 -4.140 1.00 0.00 H new ATOM 185 N GLN A 12 2.866 12.761 -2.583 1.00 0.00 N ATOM 186 CA GLN A 12 1.839 13.602 -1.908 1.00 0.00 C ATOM 187 C GLN A 12 1.141 12.778 -0.823 1.00 0.00 C ATOM 188 O GLN A 12 0.340 11.910 -1.108 1.00 0.00 O ATOM 189 CB GLN A 12 0.809 14.071 -2.938 1.00 0.00 C ATOM 190 CG GLN A 12 -0.171 15.042 -2.276 1.00 0.00 C ATOM 191 CD GLN A 12 -1.397 15.221 -3.172 1.00 0.00 C ATOM 192 OE1 GLN A 12 -2.424 14.611 -2.946 1.00 0.00 O ATOM 193 NE2 GLN A 12 -1.334 16.037 -4.189 1.00 0.00 N ATOM 0 H GLN A 12 2.669 12.534 -3.558 1.00 0.00 H new ATOM 0 HA GLN A 12 2.317 14.469 -1.453 1.00 0.00 H new ATOM 0 HB2 GLN A 12 1.311 14.558 -3.774 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.270 13.215 -3.345 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -0.473 14.661 -1.300 1.00 0.00 H new ATOM 0 HG3 GLN A 12 0.312 16.004 -2.107 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -0.473 16.549 -4.379 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -2.146 16.162 -4.793 1.00 0.00 H new ATOM 202 N TYR A 13 1.441 13.044 0.419 1.00 0.00 N ATOM 203 CA TYR A 13 0.799 12.278 1.524 1.00 0.00 C ATOM 204 C TYR A 13 -0.695 12.118 1.237 1.00 0.00 C ATOM 205 O TYR A 13 -1.312 12.960 0.613 1.00 0.00 O ATOM 206 CB TYR A 13 0.987 13.031 2.843 1.00 0.00 C ATOM 207 CG TYR A 13 0.130 12.397 3.912 1.00 0.00 C ATOM 208 CD1 TYR A 13 -1.205 12.792 4.066 1.00 0.00 C ATOM 209 CD2 TYR A 13 0.671 11.415 4.751 1.00 0.00 C ATOM 210 CE1 TYR A 13 -1.999 12.205 5.058 1.00 0.00 C ATOM 211 CE2 TYR A 13 -0.123 10.829 5.744 1.00 0.00 C ATOM 212 CZ TYR A 13 -1.458 11.223 5.897 1.00 0.00 C ATOM 213 OH TYR A 13 -2.242 10.644 6.875 1.00 0.00 O ATOM 0 H TYR A 13 2.104 13.760 0.716 1.00 0.00 H new ATOM 0 HA TYR A 13 1.261 11.293 1.598 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.035 13.008 3.141 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.715 14.079 2.718 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -1.622 13.550 3.419 1.00 0.00 H new ATOM 0 HD2 TYR A 13 1.700 11.110 4.632 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -3.028 12.509 5.176 1.00 0.00 H new ATOM 0 HE2 TYR A 13 0.294 10.073 6.392 1.00 0.00 H new ATOM 0 HH TYR A 13 -1.714 9.982 7.368 1.00 0.00 H new ATOM 223 N GLY A 14 -1.284 11.044 1.688 1.00 0.00 N ATOM 224 CA GLY A 14 -2.738 10.831 1.442 1.00 0.00 C ATOM 225 C GLY A 14 -2.940 9.528 0.666 1.00 0.00 C ATOM 226 O GLY A 14 -3.731 8.686 1.043 1.00 0.00 O ATOM 0 H GLY A 14 -0.821 10.305 2.216 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -3.275 10.789 2.389 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -3.149 11.669 0.879 1.00 0.00 H new ATOM 230 N ILE A 15 -2.232 9.354 -0.416 1.00 0.00 N ATOM 231 CA ILE A 15 -2.385 8.105 -1.213 1.00 0.00 C ATOM 232 C ILE A 15 -1.571 6.983 -0.563 1.00 0.00 C ATOM 233 O ILE A 15 -1.968 5.835 -0.562 1.00 0.00 O ATOM 234 CB ILE A 15 -1.885 8.346 -2.641 1.00 0.00 C ATOM 235 CG1 ILE A 15 -2.924 9.165 -3.411 1.00 0.00 C ATOM 236 CG2 ILE A 15 -1.672 7.006 -3.351 1.00 0.00 C ATOM 237 CD1 ILE A 15 -2.261 10.416 -3.990 1.00 0.00 C ATOM 0 H ILE A 15 -1.554 10.023 -0.782 1.00 0.00 H new ATOM 0 HA ILE A 15 -3.436 7.817 -1.243 1.00 0.00 H new ATOM 0 HB ILE A 15 -0.940 8.888 -2.603 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.354 8.565 -4.212 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.743 9.448 -2.749 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.317 7.184 -4.366 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.933 6.419 -2.806 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -2.615 6.460 -3.388 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.001 10.999 -4.538 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.852 11.019 -3.180 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.457 10.122 -4.665 1.00 0.00 H new ATOM 249 N ARG A 16 -0.434 7.303 -0.013 1.00 0.00 N ATOM 250 CA ARG A 16 0.398 6.251 0.633 1.00 0.00 C ATOM 251 C ARG A 16 -0.364 5.656 1.818 1.00 0.00 C ATOM 252 O ARG A 16 -0.194 4.503 2.160 1.00 0.00 O ATOM 253 CB ARG A 16 1.708 6.868 1.125 1.00 0.00 C ATOM 254 CG ARG A 16 2.875 6.301 0.314 1.00 0.00 C ATOM 255 CD ARG A 16 3.444 7.393 -0.595 1.00 0.00 C ATOM 256 NE ARG A 16 4.887 7.600 -0.281 1.00 0.00 N ATOM 257 CZ ARG A 16 5.238 8.293 0.770 1.00 0.00 C ATOM 258 NH1 ARG A 16 4.327 8.808 1.551 1.00 0.00 N ATOM 259 NH2 ARG A 16 6.502 8.470 1.037 1.00 0.00 N ATOM 0 H ARG A 16 -0.045 8.246 0.017 1.00 0.00 H new ATOM 0 HA ARG A 16 0.617 5.465 -0.090 1.00 0.00 H new ATOM 0 HB2 ARG A 16 1.673 7.953 1.022 1.00 0.00 H new ATOM 0 HB3 ARG A 16 1.849 6.653 2.184 1.00 0.00 H new ATOM 0 HG2 ARG A 16 3.651 5.930 0.984 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.538 5.454 -0.284 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.326 7.109 -1.641 1.00 0.00 H new ATOM 0 HD3 ARG A 16 2.893 8.323 -0.453 1.00 0.00 H new ATOM 0 HE ARG A 16 5.602 7.200 -0.888 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.338 8.670 1.342 1.00 0.00 H new ATOM 0 HH12 ARG A 16 4.604 9.348 2.371 1.00 0.00 H new ATOM 0 HH21 ARG A 16 7.213 8.068 0.426 1.00 0.00 H new ATOM 0 HH22 ARG A 16 6.779 9.010 1.856 1.00 0.00 H new ATOM 273 N ILE A 17 -1.201 6.434 2.449 1.00 0.00 N ATOM 274 CA ILE A 17 -1.971 5.912 3.614 1.00 0.00 C ATOM 275 C ILE A 17 -3.304 5.331 3.137 1.00 0.00 C ATOM 276 O ILE A 17 -3.826 4.401 3.715 1.00 0.00 O ATOM 277 CB ILE A 17 -2.237 7.050 4.602 1.00 0.00 C ATOM 278 CG1 ILE A 17 -1.058 8.026 4.585 1.00 0.00 C ATOM 279 CG2 ILE A 17 -2.401 6.477 6.010 1.00 0.00 C ATOM 280 CD1 ILE A 17 0.253 7.246 4.701 1.00 0.00 C ATOM 0 H ILE A 17 -1.385 7.408 2.208 1.00 0.00 H new ATOM 0 HA ILE A 17 -1.392 5.129 4.104 1.00 0.00 H new ATOM 0 HB ILE A 17 -3.149 7.574 4.314 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -1.067 8.607 3.663 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -1.146 8.734 5.409 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.590 7.288 6.713 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -3.240 5.781 6.024 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.490 5.953 6.298 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.092 7.941 4.689 1.00 0.00 H new ATOM 0 HD12 ILE A 17 0.261 6.684 5.635 1.00 0.00 H new ATOM 0 HD13 ILE A 17 0.341 6.556 3.862 1.00 0.00 H new ATOM 292 N LEU A 18 -3.862 5.872 2.089 1.00 0.00 N ATOM 293 CA LEU A 18 -5.162 5.344 1.585 1.00 0.00 C ATOM 294 C LEU A 18 -4.949 3.947 1.000 1.00 0.00 C ATOM 295 O LEU A 18 -5.521 2.978 1.458 1.00 0.00 O ATOM 296 CB LEU A 18 -5.706 6.275 0.499 1.00 0.00 C ATOM 297 CG LEU A 18 -6.706 7.253 1.118 1.00 0.00 C ATOM 298 CD1 LEU A 18 -7.256 8.178 0.031 1.00 0.00 C ATOM 299 CD2 LEU A 18 -7.857 6.470 1.752 1.00 0.00 C ATOM 0 H LEU A 18 -3.476 6.655 1.561 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.876 5.291 2.407 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -4.888 6.823 0.031 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.189 5.693 -0.286 1.00 0.00 H new ATOM 0 HG LEU A 18 -6.206 7.849 1.882 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.969 8.875 0.472 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.436 8.736 -0.421 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.756 7.584 -0.734 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -8.571 7.166 2.194 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.356 5.874 0.988 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -7.465 5.811 2.527 1.00 0.00 H new ATOM 311 N LEU A 19 -4.122 3.835 -0.001 1.00 0.00 N ATOM 312 CA LEU A 19 -3.865 2.499 -0.608 1.00 0.00 C ATOM 313 C LEU A 19 -3.158 1.618 0.422 1.00 0.00 C ATOM 314 O LEU A 19 -3.126 0.409 0.311 1.00 0.00 O ATOM 315 CB LEU A 19 -2.977 2.661 -1.843 1.00 0.00 C ATOM 316 CG LEU A 19 -3.785 3.304 -2.969 1.00 0.00 C ATOM 317 CD1 LEU A 19 -4.018 4.783 -2.653 1.00 0.00 C ATOM 318 CD2 LEU A 19 -3.015 3.183 -4.286 1.00 0.00 C ATOM 0 H LEU A 19 -3.613 4.610 -0.425 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.807 2.038 -0.904 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.111 3.278 -1.603 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.598 1.690 -2.161 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.745 2.795 -3.059 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.594 5.240 -3.457 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.568 4.873 -1.716 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.058 5.291 -2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.592 3.642 -5.089 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.055 3.690 -4.194 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.849 2.130 -4.515 1.00 0.00 H new ATOM 330 N ASN A 20 -2.595 2.226 1.427 1.00 0.00 N ATOM 331 CA ASN A 20 -1.887 1.448 2.481 1.00 0.00 C ATOM 332 C ASN A 20 -2.920 0.673 3.309 1.00 0.00 C ATOM 333 O ASN A 20 -2.962 -0.541 3.290 1.00 0.00 O ATOM 334 CB ASN A 20 -1.101 2.428 3.371 1.00 0.00 C ATOM 335 CG ASN A 20 -0.988 1.896 4.803 1.00 0.00 C ATOM 336 OD1 ASN A 20 -1.741 2.291 5.670 1.00 0.00 O ATOM 337 ND2 ASN A 20 -0.073 1.015 5.089 1.00 0.00 N ATOM 0 H ASN A 20 -2.595 3.237 1.565 1.00 0.00 H new ATOM 0 HA ASN A 20 -1.192 0.736 2.035 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -0.105 2.583 2.957 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -1.598 3.398 3.377 1.00 0.00 H new ATOM 0 HD21 ASN A 20 0.011 0.657 6.041 1.00 0.00 H new ATOM 0 HD22 ASN A 20 0.560 0.683 4.362 1.00 0.00 H new ATOM 344 N GLU A 21 -3.750 1.369 4.035 1.00 0.00 N ATOM 345 CA GLU A 21 -4.775 0.678 4.865 1.00 0.00 C ATOM 346 C GLU A 21 -5.588 -0.275 3.987 1.00 0.00 C ATOM 347 O GLU A 21 -5.855 -1.401 4.357 1.00 0.00 O ATOM 348 CB GLU A 21 -5.709 1.718 5.487 1.00 0.00 C ATOM 349 CG GLU A 21 -5.183 2.119 6.867 1.00 0.00 C ATOM 350 CD GLU A 21 -6.089 1.528 7.950 1.00 0.00 C ATOM 351 OE1 GLU A 21 -6.953 0.738 7.606 1.00 0.00 O ATOM 352 OE2 GLU A 21 -5.905 1.878 9.104 1.00 0.00 O ATOM 0 H GLU A 21 -3.762 2.387 4.089 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.281 0.111 5.654 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.774 2.595 4.843 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -6.716 1.311 5.575 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -4.162 1.761 6.997 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -5.154 3.205 6.955 1.00 0.00 H new ATOM 359 N VAL A 22 -5.985 0.166 2.824 1.00 0.00 N ATOM 360 CA VAL A 22 -6.781 -0.715 1.924 1.00 0.00 C ATOM 361 C VAL A 22 -6.026 -2.026 1.694 1.00 0.00 C ATOM 362 O VAL A 22 -6.487 -3.091 2.057 1.00 0.00 O ATOM 363 CB VAL A 22 -7.001 -0.012 0.584 1.00 0.00 C ATOM 364 CG1 VAL A 22 -7.886 -0.880 -0.310 1.00 0.00 C ATOM 365 CG2 VAL A 22 -7.686 1.336 0.824 1.00 0.00 C ATOM 0 H VAL A 22 -5.792 1.099 2.459 1.00 0.00 H new ATOM 0 HA VAL A 22 -7.746 -0.927 2.385 1.00 0.00 H new ATOM 0 HB VAL A 22 -6.040 0.148 0.096 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -8.042 -0.378 -1.265 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.400 -1.841 -0.480 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -8.848 -1.041 0.177 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -7.844 1.839 -0.130 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -8.647 1.174 1.312 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -7.056 1.956 1.461 1.00 0.00 H new ATOM 375 N PHE A 23 -4.870 -1.959 1.091 1.00 0.00 N ATOM 376 CA PHE A 23 -4.089 -3.202 0.838 1.00 0.00 C ATOM 377 C PHE A 23 -3.669 -3.823 2.172 1.00 0.00 C ATOM 378 O PHE A 23 -3.191 -4.939 2.224 1.00 0.00 O ATOM 379 CB PHE A 23 -2.843 -2.861 0.018 1.00 0.00 C ATOM 380 CG PHE A 23 -3.258 -2.333 -1.334 1.00 0.00 C ATOM 381 CD1 PHE A 23 -4.244 -2.999 -2.072 1.00 0.00 C ATOM 382 CD2 PHE A 23 -2.657 -1.179 -1.849 1.00 0.00 C ATOM 383 CE1 PHE A 23 -4.628 -2.509 -3.326 1.00 0.00 C ATOM 384 CE2 PHE A 23 -3.042 -0.689 -3.103 1.00 0.00 C ATOM 385 CZ PHE A 23 -4.028 -1.355 -3.841 1.00 0.00 C ATOM 0 H PHE A 23 -4.433 -1.097 0.763 1.00 0.00 H new ATOM 0 HA PHE A 23 -4.705 -3.913 0.286 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -2.242 -2.117 0.542 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -2.220 -3.747 -0.102 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.708 -3.890 -1.674 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -1.896 -0.666 -1.279 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -5.388 -3.022 -3.896 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -2.579 0.202 -3.501 1.00 0.00 H new ATOM 0 HZ PHE A 23 -4.325 -0.978 -4.808 1.00 0.00 H new ATOM 395 N ASN A 24 -3.845 -3.111 3.251 1.00 0.00 N ATOM 396 CA ASN A 24 -3.457 -3.663 4.579 1.00 0.00 C ATOM 397 C ASN A 24 -4.475 -4.720 5.009 1.00 0.00 C ATOM 398 O ASN A 24 -4.141 -5.870 5.212 1.00 0.00 O ATOM 399 CB ASN A 24 -3.427 -2.534 5.612 1.00 0.00 C ATOM 400 CG ASN A 24 -1.976 -2.152 5.909 1.00 0.00 C ATOM 401 OD1 ASN A 24 -1.638 -1.826 7.030 1.00 0.00 O ATOM 402 ND2 ASN A 24 -1.097 -2.178 4.945 1.00 0.00 N ATOM 0 H ASN A 24 -4.241 -2.171 3.270 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.469 -4.118 4.509 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.972 -1.668 5.236 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -3.925 -2.852 6.528 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -0.127 -1.925 5.132 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.380 -2.452 4.004 1.00 0.00 H new ATOM 409 N LYS A 25 -5.716 -4.341 5.147 1.00 0.00 N ATOM 410 CA LYS A 25 -6.755 -5.325 5.561 1.00 0.00 C ATOM 411 C LYS A 25 -6.959 -6.349 4.443 1.00 0.00 C ATOM 412 O LYS A 25 -7.385 -7.463 4.677 1.00 0.00 O ATOM 413 CB LYS A 25 -8.071 -4.595 5.833 1.00 0.00 C ATOM 414 CG LYS A 25 -9.110 -5.590 6.354 1.00 0.00 C ATOM 415 CD LYS A 25 -10.442 -4.870 6.574 1.00 0.00 C ATOM 416 CE LYS A 25 -11.404 -5.794 7.322 1.00 0.00 C ATOM 417 NZ LYS A 25 -11.965 -5.076 8.501 1.00 0.00 N ATOM 0 H LYS A 25 -6.055 -3.392 4.991 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.432 -5.836 6.468 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.914 -3.801 6.563 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.432 -4.121 4.920 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.238 -6.405 5.641 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.767 -6.035 7.288 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.283 -3.955 7.144 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.872 -4.578 5.616 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.209 -6.112 6.659 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.883 -6.695 7.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.619 -5.703 9.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.191 -4.794 9.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.476 -4.229 8.181 1.00 0.00 H new ATOM 431 N GLU A 26 -6.660 -5.980 3.228 1.00 0.00 N ATOM 432 CA GLU A 26 -6.836 -6.931 2.094 1.00 0.00 C ATOM 433 C GLU A 26 -5.805 -8.054 2.207 1.00 0.00 C ATOM 434 O GLU A 26 -6.069 -9.190 1.868 1.00 0.00 O ATOM 435 CB GLU A 26 -6.639 -6.188 0.771 1.00 0.00 C ATOM 436 CG GLU A 26 -7.965 -6.142 0.009 1.00 0.00 C ATOM 437 CD GLU A 26 -7.795 -5.305 -1.261 1.00 0.00 C ATOM 438 OE1 GLU A 26 -7.289 -4.201 -1.155 1.00 0.00 O ATOM 439 OE2 GLU A 26 -8.174 -5.784 -2.317 1.00 0.00 O ATOM 0 H GLU A 26 -6.301 -5.060 2.971 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.840 -7.355 2.127 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -6.281 -5.176 0.960 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -5.879 -6.688 0.170 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.284 -7.152 -0.248 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.744 -5.712 0.639 1.00 0.00 H new ATOM 446 N GLY A 27 -4.629 -7.745 2.682 1.00 0.00 N ATOM 447 CA GLY A 27 -3.580 -8.796 2.817 1.00 0.00 C ATOM 448 C GLY A 27 -2.568 -8.655 1.679 1.00 0.00 C ATOM 449 O GLY A 27 -2.541 -9.447 0.758 1.00 0.00 O ATOM 0 H GLY A 27 -4.349 -6.811 2.982 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.077 -8.701 3.779 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.036 -9.786 2.792 1.00 0.00 H new ATOM 453 N TYR A 28 -1.735 -7.652 1.733 1.00 0.00 N ATOM 454 CA TYR A 28 -0.727 -7.462 0.654 1.00 0.00 C ATOM 455 C TYR A 28 0.448 -6.642 1.189 1.00 0.00 C ATOM 456 O TYR A 28 0.277 -5.747 1.993 1.00 0.00 O ATOM 457 CB TYR A 28 -1.370 -6.721 -0.520 1.00 0.00 C ATOM 458 CG TYR A 28 -2.438 -7.588 -1.142 1.00 0.00 C ATOM 459 CD1 TYR A 28 -2.079 -8.615 -2.024 1.00 0.00 C ATOM 460 CD2 TYR A 28 -3.786 -7.364 -0.837 1.00 0.00 C ATOM 461 CE1 TYR A 28 -3.069 -9.419 -2.600 1.00 0.00 C ATOM 462 CE2 TYR A 28 -4.775 -8.169 -1.413 1.00 0.00 C ATOM 463 CZ TYR A 28 -4.417 -9.195 -2.295 1.00 0.00 C ATOM 464 OH TYR A 28 -5.394 -9.989 -2.863 1.00 0.00 O ATOM 0 H TYR A 28 -1.710 -6.956 2.478 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.368 -8.435 0.319 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -1.804 -5.782 -0.177 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.613 -6.470 -1.263 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -1.039 -8.786 -2.259 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -4.062 -6.571 -0.158 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -2.793 -10.212 -3.279 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -5.815 -7.999 -1.177 1.00 0.00 H new ATOM 0 HH TYR A 28 -5.014 -10.485 -3.618 1.00 0.00 H new ATOM 474 N GLN A 29 1.640 -6.937 0.748 1.00 0.00 N ATOM 475 CA GLN A 29 2.823 -6.171 1.228 1.00 0.00 C ATOM 476 C GLN A 29 3.053 -4.970 0.309 1.00 0.00 C ATOM 477 O GLN A 29 3.858 -5.018 -0.601 1.00 0.00 O ATOM 478 CB GLN A 29 4.059 -7.073 1.210 1.00 0.00 C ATOM 479 CG GLN A 29 3.699 -8.443 1.790 1.00 0.00 C ATOM 480 CD GLN A 29 4.871 -8.969 2.621 1.00 0.00 C ATOM 481 OE1 GLN A 29 5.778 -9.582 2.093 1.00 0.00 O ATOM 482 NE2 GLN A 29 4.892 -8.753 3.908 1.00 0.00 N ATOM 0 H GLN A 29 1.845 -7.676 0.076 1.00 0.00 H new ATOM 0 HA GLN A 29 2.645 -5.824 2.246 1.00 0.00 H new ATOM 0 HB2 GLN A 29 4.427 -7.183 0.190 1.00 0.00 H new ATOM 0 HB3 GLN A 29 4.862 -6.620 1.791 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.806 -8.364 2.410 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.468 -9.141 0.985 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.131 -8.239 4.351 1.00 0.00 H new ATOM 0 HE22 GLN A 29 5.670 -9.099 4.471 1.00 0.00 H new ATOM 491 N THR A 30 2.352 -3.894 0.537 1.00 0.00 N ATOM 492 CA THR A 30 2.528 -2.693 -0.327 1.00 0.00 C ATOM 493 C THR A 30 3.620 -1.797 0.258 1.00 0.00 C ATOM 494 O THR A 30 3.691 -1.586 1.453 1.00 0.00 O ATOM 495 CB THR A 30 1.211 -1.914 -0.391 1.00 0.00 C ATOM 496 OG1 THR A 30 1.072 -1.125 0.782 1.00 0.00 O ATOM 497 CG2 THR A 30 0.040 -2.894 -0.489 1.00 0.00 C ATOM 0 H THR A 30 1.665 -3.794 1.284 1.00 0.00 H new ATOM 0 HA THR A 30 2.815 -3.007 -1.330 1.00 0.00 H new ATOM 0 HB THR A 30 1.214 -1.266 -1.268 1.00 0.00 H new ATOM 0 HG1 THR A 30 0.230 -0.624 0.742 1.00 0.00 H new ATOM 0 HG21 THR A 30 -0.897 -2.338 -0.534 1.00 0.00 H new ATOM 0 HG22 THR A 30 0.147 -3.500 -1.389 1.00 0.00 H new ATOM 0 HG23 THR A 30 0.035 -3.543 0.387 1.00 0.00 H new ATOM 505 N PHE A 31 4.473 -1.266 -0.575 1.00 0.00 N ATOM 506 CA PHE A 31 5.560 -0.383 -0.068 1.00 0.00 C ATOM 507 C PHE A 31 5.222 1.073 -0.391 1.00 0.00 C ATOM 508 O PHE A 31 4.138 1.383 -0.847 1.00 0.00 O ATOM 509 CB PHE A 31 6.881 -0.762 -0.740 1.00 0.00 C ATOM 510 CG PHE A 31 7.449 -1.992 -0.075 1.00 0.00 C ATOM 511 CD1 PHE A 31 8.085 -1.886 1.168 1.00 0.00 C ATOM 512 CD2 PHE A 31 7.341 -3.239 -0.701 1.00 0.00 C ATOM 513 CE1 PHE A 31 8.613 -3.026 1.785 1.00 0.00 C ATOM 514 CE2 PHE A 31 7.868 -4.380 -0.085 1.00 0.00 C ATOM 515 CZ PHE A 31 8.505 -4.273 1.158 1.00 0.00 C ATOM 0 H PHE A 31 4.464 -1.406 -1.585 1.00 0.00 H new ATOM 0 HA PHE A 31 5.655 -0.504 1.011 1.00 0.00 H new ATOM 0 HB2 PHE A 31 6.720 -0.951 -1.801 1.00 0.00 H new ATOM 0 HB3 PHE A 31 7.589 0.064 -0.667 1.00 0.00 H new ATOM 0 HD1 PHE A 31 8.168 -0.924 1.651 1.00 0.00 H new ATOM 0 HD2 PHE A 31 6.851 -3.321 -1.660 1.00 0.00 H new ATOM 0 HE1 PHE A 31 9.103 -2.944 2.744 1.00 0.00 H new ATOM 0 HE2 PHE A 31 7.784 -5.342 -0.568 1.00 0.00 H new ATOM 0 HZ PHE A 31 8.913 -5.153 1.633 1.00 0.00 H new ATOM 525 N GLN A 32 6.139 1.972 -0.160 1.00 0.00 N ATOM 526 CA GLN A 32 5.867 3.406 -0.456 1.00 0.00 C ATOM 527 C GLN A 32 7.088 4.029 -1.135 1.00 0.00 C ATOM 528 O GLN A 32 8.215 3.663 -0.865 1.00 0.00 O ATOM 529 CB GLN A 32 5.574 4.150 0.849 1.00 0.00 C ATOM 530 CG GLN A 32 4.289 3.602 1.471 1.00 0.00 C ATOM 531 CD GLN A 32 4.293 3.873 2.977 1.00 0.00 C ATOM 532 OE1 GLN A 32 5.286 4.312 3.524 1.00 0.00 O ATOM 533 NE2 GLN A 32 3.219 3.630 3.675 1.00 0.00 N ATOM 0 H GLN A 32 7.065 1.775 0.221 1.00 0.00 H new ATOM 0 HA GLN A 32 5.005 3.482 -1.119 1.00 0.00 H new ATOM 0 HB2 GLN A 32 6.406 4.031 1.543 1.00 0.00 H new ATOM 0 HB3 GLN A 32 5.471 5.218 0.656 1.00 0.00 H new ATOM 0 HG2 GLN A 32 3.420 4.071 1.009 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.210 2.531 1.284 1.00 0.00 H new ATOM 0 HE21 GLN A 32 2.385 3.262 3.217 1.00 0.00 H new ATOM 0 HE22 GLN A 32 3.212 3.808 4.679 1.00 0.00 H new ATOM 542 N ALA A 33 6.874 4.967 -2.017 1.00 0.00 N ATOM 543 CA ALA A 33 8.023 5.611 -2.712 1.00 0.00 C ATOM 544 C ALA A 33 7.549 6.899 -3.390 1.00 0.00 C ATOM 545 O ALA A 33 6.508 7.435 -3.066 1.00 0.00 O ATOM 546 CB ALA A 33 8.581 4.656 -3.769 1.00 0.00 C ATOM 0 H ALA A 33 5.953 5.315 -2.286 1.00 0.00 H new ATOM 0 HA ALA A 33 8.802 5.845 -1.987 1.00 0.00 H new ATOM 0 HB1 ALA A 33 9.422 5.127 -4.278 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.917 3.737 -3.288 1.00 0.00 H new ATOM 0 HB3 ALA A 33 7.803 4.422 -4.495 1.00 0.00 H new ATOM 552 N ALA A 34 8.306 7.400 -4.328 1.00 0.00 N ATOM 553 CA ALA A 34 7.898 8.653 -5.024 1.00 0.00 C ATOM 554 C ALA A 34 9.105 9.241 -5.759 1.00 0.00 C ATOM 555 O ALA A 34 9.054 9.507 -6.944 1.00 0.00 O ATOM 556 CB ALA A 34 7.384 9.664 -3.998 1.00 0.00 C ATOM 0 H ALA A 34 9.188 6.996 -4.642 1.00 0.00 H new ATOM 0 HA ALA A 34 7.107 8.430 -5.740 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.086 10.580 -4.508 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.526 9.245 -3.473 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.174 9.888 -3.281 1.00 0.00 H new ATOM 562 N ASN A 35 10.189 9.448 -5.064 1.00 0.00 N ATOM 563 CA ASN A 35 11.398 10.020 -5.721 1.00 0.00 C ATOM 564 C ASN A 35 11.855 9.090 -6.845 1.00 0.00 C ATOM 565 O ASN A 35 12.650 9.460 -7.687 1.00 0.00 O ATOM 566 CB ASN A 35 12.519 10.162 -4.689 1.00 0.00 C ATOM 567 CG ASN A 35 12.830 8.794 -4.080 1.00 0.00 C ATOM 568 OD1 ASN A 35 11.968 7.942 -3.999 1.00 0.00 O ATOM 569 ND2 ASN A 35 14.036 8.546 -3.643 1.00 0.00 N ATOM 0 H ASN A 35 10.290 9.246 -4.069 1.00 0.00 H new ATOM 0 HA ASN A 35 11.158 10.999 -6.135 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.412 10.573 -5.161 1.00 0.00 H new ATOM 0 HB3 ASN A 35 12.221 10.861 -3.907 1.00 0.00 H new ATOM 0 HD21 ASN A 35 14.253 7.637 -3.234 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.760 9.261 -3.711 1.00 0.00 H new ATOM 576 N GLY A 36 11.361 7.882 -6.868 1.00 0.00 N ATOM 577 CA GLY A 36 11.768 6.930 -7.938 1.00 0.00 C ATOM 578 C GLY A 36 12.905 6.042 -7.428 1.00 0.00 C ATOM 579 O GLY A 36 12.899 4.842 -7.612 1.00 0.00 O ATOM 0 H GLY A 36 10.693 7.514 -6.191 1.00 0.00 H new ATOM 0 HA2 GLY A 36 10.918 6.316 -8.235 1.00 0.00 H new ATOM 0 HA3 GLY A 36 12.090 7.478 -8.823 1.00 0.00 H new ATOM 583 N LEU A 37 13.882 6.624 -6.788 1.00 0.00 N ATOM 584 CA LEU A 37 15.018 5.814 -6.265 1.00 0.00 C ATOM 585 C LEU A 37 14.523 4.911 -5.134 1.00 0.00 C ATOM 586 O LEU A 37 15.032 3.829 -4.922 1.00 0.00 O ATOM 587 CB LEU A 37 16.109 6.746 -5.734 1.00 0.00 C ATOM 588 CG LEU A 37 17.073 7.101 -6.867 1.00 0.00 C ATOM 589 CD1 LEU A 37 17.955 8.275 -6.439 1.00 0.00 C ATOM 590 CD2 LEU A 37 17.954 5.891 -7.183 1.00 0.00 C ATOM 0 H LEU A 37 13.943 7.626 -6.605 1.00 0.00 H new ATOM 0 HA LEU A 37 15.425 5.200 -7.068 1.00 0.00 H new ATOM 0 HB2 LEU A 37 15.661 7.652 -5.326 1.00 0.00 H new ATOM 0 HB3 LEU A 37 16.650 6.263 -4.920 1.00 0.00 H new ATOM 0 HG LEU A 37 16.504 7.379 -7.754 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.642 8.528 -7.247 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.328 9.138 -6.213 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.525 7.998 -5.552 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.642 6.143 -7.990 1.00 0.00 H new ATOM 0 HD22 LEU A 37 18.523 5.613 -6.295 1.00 0.00 H new ATOM 0 HD23 LEU A 37 17.326 5.054 -7.489 1.00 0.00 H new ATOM 602 N GLN A 38 13.532 5.348 -4.404 1.00 0.00 N ATOM 603 CA GLN A 38 13.006 4.514 -3.288 1.00 0.00 C ATOM 604 C GLN A 38 12.226 3.329 -3.861 1.00 0.00 C ATOM 605 O GLN A 38 12.362 2.208 -3.410 1.00 0.00 O ATOM 606 CB GLN A 38 12.078 5.359 -2.412 1.00 0.00 C ATOM 607 CG GLN A 38 11.818 4.631 -1.092 1.00 0.00 C ATOM 608 CD GLN A 38 13.151 4.296 -0.421 1.00 0.00 C ATOM 609 OE1 GLN A 38 14.171 5.093 -0.589 1.00 0.00 O flip ATOM 610 NE2 GLN A 38 13.267 3.297 0.260 1.00 0.00 N flip ATOM 0 H GLN A 38 13.065 6.246 -4.533 1.00 0.00 H new ATOM 0 HA GLN A 38 13.837 4.146 -2.687 1.00 0.00 H new ATOM 0 HB2 GLN A 38 12.529 6.333 -2.220 1.00 0.00 H new ATOM 0 HB3 GLN A 38 11.137 5.541 -2.931 1.00 0.00 H new ATOM 0 HG2 GLN A 38 11.214 5.255 -0.433 1.00 0.00 H new ATOM 0 HG3 GLN A 38 11.251 3.718 -1.274 1.00 0.00 H new ATOM 0 HE21 GLN A 38 12.470 2.674 0.391 1.00 0.00 H new ATOM 0 HE22 GLN A 38 14.161 3.081 0.700 1.00 0.00 H new ATOM 619 N ALA A 39 11.411 3.566 -4.852 1.00 0.00 N ATOM 620 CA ALA A 39 10.624 2.452 -5.453 1.00 0.00 C ATOM 621 C ALA A 39 11.580 1.434 -6.080 1.00 0.00 C ATOM 622 O ALA A 39 11.553 0.263 -5.756 1.00 0.00 O ATOM 623 CB ALA A 39 9.693 3.009 -6.531 1.00 0.00 C ATOM 0 H ALA A 39 11.256 4.483 -5.272 1.00 0.00 H new ATOM 0 HA ALA A 39 10.032 1.965 -4.678 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.117 2.195 -6.971 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.013 3.735 -6.085 1.00 0.00 H new ATOM 0 HB3 ALA A 39 10.284 3.495 -7.307 1.00 0.00 H new ATOM 629 N LEU A 40 12.423 1.870 -6.975 1.00 0.00 N ATOM 630 CA LEU A 40 13.378 0.927 -7.621 1.00 0.00 C ATOM 631 C LEU A 40 14.132 0.145 -6.542 1.00 0.00 C ATOM 632 O LEU A 40 14.302 -1.053 -6.635 1.00 0.00 O ATOM 633 CB LEU A 40 14.377 1.715 -8.472 1.00 0.00 C ATOM 634 CG LEU A 40 13.624 2.509 -9.539 1.00 0.00 C ATOM 635 CD1 LEU A 40 14.625 3.254 -10.423 1.00 0.00 C ATOM 636 CD2 LEU A 40 12.799 1.550 -10.400 1.00 0.00 C ATOM 0 H LEU A 40 12.492 2.839 -7.287 1.00 0.00 H new ATOM 0 HA LEU A 40 12.828 0.232 -8.256 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.955 2.391 -7.841 1.00 0.00 H new ATOM 0 HB3 LEU A 40 15.086 1.034 -8.943 1.00 0.00 H new ATOM 0 HG LEU A 40 12.961 3.227 -9.057 1.00 0.00 H new ATOM 0 HD11 LEU A 40 14.088 3.820 -11.184 1.00 0.00 H new ATOM 0 HD12 LEU A 40 15.213 3.937 -9.810 1.00 0.00 H new ATOM 0 HD13 LEU A 40 15.289 2.537 -10.906 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.262 2.115 -11.161 1.00 0.00 H new ATOM 0 HD22 LEU A 40 13.462 0.832 -10.882 1.00 0.00 H new ATOM 0 HD23 LEU A 40 12.085 1.019 -9.771 1.00 0.00 H new ATOM 648 N ASP A 41 14.584 0.816 -5.518 1.00 0.00 N ATOM 649 CA ASP A 41 15.325 0.112 -4.435 1.00 0.00 C ATOM 650 C ASP A 41 14.459 -1.020 -3.877 1.00 0.00 C ATOM 651 O ASP A 41 14.898 -2.146 -3.752 1.00 0.00 O ATOM 652 CB ASP A 41 15.653 1.100 -3.314 1.00 0.00 C ATOM 653 CG ASP A 41 17.162 1.105 -3.063 1.00 0.00 C ATOM 654 OD1 ASP A 41 17.895 0.729 -3.964 1.00 0.00 O ATOM 655 OD2 ASP A 41 17.561 1.486 -1.974 1.00 0.00 O ATOM 0 H ASP A 41 14.472 1.821 -5.385 1.00 0.00 H new ATOM 0 HA ASP A 41 16.250 -0.301 -4.838 1.00 0.00 H new ATOM 0 HB2 ASP A 41 15.316 2.100 -3.586 1.00 0.00 H new ATOM 0 HB3 ASP A 41 15.123 0.822 -2.403 1.00 0.00 H new ATOM 660 N ILE A 42 13.232 -0.731 -3.543 1.00 0.00 N ATOM 661 CA ILE A 42 12.340 -1.791 -2.995 1.00 0.00 C ATOM 662 C ILE A 42 12.054 -2.829 -4.082 1.00 0.00 C ATOM 663 O ILE A 42 11.657 -3.942 -3.801 1.00 0.00 O ATOM 664 CB ILE A 42 11.025 -1.162 -2.531 1.00 0.00 C ATOM 665 CG1 ILE A 42 11.274 -0.331 -1.270 1.00 0.00 C ATOM 666 CG2 ILE A 42 10.012 -2.266 -2.221 1.00 0.00 C ATOM 667 CD1 ILE A 42 10.765 1.095 -1.490 1.00 0.00 C ATOM 0 H ILE A 42 12.808 0.193 -3.626 1.00 0.00 H new ATOM 0 HA ILE A 42 12.828 -2.276 -2.150 1.00 0.00 H new ATOM 0 HB ILE A 42 10.632 -0.519 -3.319 1.00 0.00 H new ATOM 0 HG12 ILE A 42 10.766 -0.782 -0.418 1.00 0.00 H new ATOM 0 HG13 ILE A 42 12.338 -0.316 -1.035 1.00 0.00 H new ATOM 0 HG21 ILE A 42 9.075 -1.818 -1.890 1.00 0.00 H new ATOM 0 HG22 ILE A 42 9.834 -2.859 -3.118 1.00 0.00 H new ATOM 0 HG23 ILE A 42 10.404 -2.909 -1.433 1.00 0.00 H new ATOM 0 HD11 ILE A 42 10.942 1.687 -0.592 1.00 0.00 H new ATOM 0 HD12 ILE A 42 11.293 1.544 -2.331 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.696 1.071 -1.704 1.00 0.00 H new ATOM 679 N VAL A 43 12.253 -2.474 -5.321 1.00 0.00 N ATOM 680 CA VAL A 43 11.992 -3.442 -6.424 1.00 0.00 C ATOM 681 C VAL A 43 13.159 -4.426 -6.525 1.00 0.00 C ATOM 682 O VAL A 43 12.985 -5.576 -6.875 1.00 0.00 O ATOM 683 CB VAL A 43 11.851 -2.683 -7.746 1.00 0.00 C ATOM 684 CG1 VAL A 43 11.701 -3.681 -8.895 1.00 0.00 C ATOM 685 CG2 VAL A 43 10.613 -1.785 -7.686 1.00 0.00 C ATOM 0 H VAL A 43 12.585 -1.556 -5.618 1.00 0.00 H new ATOM 0 HA VAL A 43 11.072 -3.988 -6.218 1.00 0.00 H new ATOM 0 HB VAL A 43 12.738 -2.071 -7.911 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.601 -3.140 -9.836 1.00 0.00 H new ATOM 0 HG12 VAL A 43 12.581 -4.322 -8.937 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.814 -4.293 -8.732 1.00 0.00 H new ATOM 0 HG21 VAL A 43 10.510 -1.243 -8.626 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.727 -2.398 -7.522 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.719 -1.073 -6.867 1.00 0.00 H new ATOM 695 N THR A 44 14.348 -3.985 -6.220 1.00 0.00 N ATOM 696 CA THR A 44 15.524 -4.897 -6.297 1.00 0.00 C ATOM 697 C THR A 44 15.717 -5.596 -4.950 1.00 0.00 C ATOM 698 O THR A 44 16.368 -6.617 -4.858 1.00 0.00 O ATOM 699 CB THR A 44 16.777 -4.086 -6.636 1.00 0.00 C ATOM 700 OG1 THR A 44 16.676 -3.596 -7.966 1.00 0.00 O ATOM 701 CG2 THR A 44 18.013 -4.977 -6.511 1.00 0.00 C ATOM 0 H THR A 44 14.556 -3.032 -5.921 1.00 0.00 H new ATOM 0 HA THR A 44 15.354 -5.644 -7.072 1.00 0.00 H new ATOM 0 HB THR A 44 16.866 -3.248 -5.945 1.00 0.00 H new ATOM 0 HG1 THR A 44 17.477 -3.075 -8.184 1.00 0.00 H new ATOM 0 HG21 THR A 44 18.905 -4.398 -6.753 1.00 0.00 H new ATOM 0 HG22 THR A 44 18.089 -5.352 -5.490 1.00 0.00 H new ATOM 0 HG23 THR A 44 17.927 -5.817 -7.201 1.00 0.00 H new ATOM 709 N LYS A 45 15.158 -5.053 -3.903 1.00 0.00 N ATOM 710 CA LYS A 45 15.311 -5.685 -2.564 1.00 0.00 C ATOM 711 C LYS A 45 14.172 -6.682 -2.335 1.00 0.00 C ATOM 712 O LYS A 45 14.338 -7.687 -1.672 1.00 0.00 O ATOM 713 CB LYS A 45 15.269 -4.606 -1.481 1.00 0.00 C ATOM 714 CG LYS A 45 16.605 -4.576 -0.737 1.00 0.00 C ATOM 715 CD LYS A 45 16.709 -5.800 0.175 1.00 0.00 C ATOM 716 CE LYS A 45 18.069 -5.801 0.877 1.00 0.00 C ATOM 717 NZ LYS A 45 17.888 -6.166 2.310 1.00 0.00 N ATOM 0 H LYS A 45 14.602 -4.198 -3.918 1.00 0.00 H new ATOM 0 HA LYS A 45 16.266 -6.208 -2.518 1.00 0.00 H new ATOM 0 HB2 LYS A 45 15.069 -3.633 -1.930 1.00 0.00 H new ATOM 0 HB3 LYS A 45 14.457 -4.808 -0.783 1.00 0.00 H new ATOM 0 HG2 LYS A 45 17.430 -4.569 -1.449 1.00 0.00 H new ATOM 0 HG3 LYS A 45 16.685 -3.662 -0.148 1.00 0.00 H new ATOM 0 HD2 LYS A 45 15.907 -5.786 0.913 1.00 0.00 H new ATOM 0 HD3 LYS A 45 16.589 -6.713 -0.409 1.00 0.00 H new ATOM 0 HE2 LYS A 45 18.740 -6.510 0.392 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.532 -4.818 0.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 18.812 -6.167 2.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 17.262 -5.473 2.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 17.463 -7.113 2.376 1.00 0.00 H new ATOM 731 N GLU A 46 13.016 -6.410 -2.875 1.00 0.00 N ATOM 732 CA GLU A 46 11.868 -7.342 -2.686 1.00 0.00 C ATOM 733 C GLU A 46 11.431 -7.898 -4.042 1.00 0.00 C ATOM 734 O GLU A 46 10.994 -9.026 -4.150 1.00 0.00 O ATOM 735 CB GLU A 46 10.701 -6.589 -2.043 1.00 0.00 C ATOM 736 CG GLU A 46 11.149 -5.999 -0.704 1.00 0.00 C ATOM 737 CD GLU A 46 11.206 -7.107 0.349 1.00 0.00 C ATOM 738 OE1 GLU A 46 11.376 -8.253 -0.034 1.00 0.00 O ATOM 739 OE2 GLU A 46 11.079 -6.791 1.520 1.00 0.00 O ATOM 0 H GLU A 46 12.816 -5.584 -3.439 1.00 0.00 H new ATOM 0 HA GLU A 46 12.172 -8.165 -2.038 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.358 -5.795 -2.706 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.859 -7.264 -1.891 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.128 -5.533 -0.810 1.00 0.00 H new ATOM 0 HG3 GLU A 46 10.457 -5.218 -0.389 1.00 0.00 H new ATOM 746 N ARG A 47 11.545 -7.115 -5.080 1.00 0.00 N ATOM 747 CA ARG A 47 11.135 -7.600 -6.428 1.00 0.00 C ATOM 748 C ARG A 47 9.641 -7.942 -6.414 1.00 0.00 C ATOM 749 O ARG A 47 9.272 -9.099 -6.433 1.00 0.00 O ATOM 750 CB ARG A 47 11.941 -8.850 -6.786 1.00 0.00 C ATOM 751 CG ARG A 47 12.734 -8.596 -8.069 1.00 0.00 C ATOM 752 CD ARG A 47 13.901 -9.582 -8.152 1.00 0.00 C ATOM 753 NE ARG A 47 13.410 -10.886 -8.683 1.00 0.00 N ATOM 754 CZ ARG A 47 14.262 -11.808 -9.047 1.00 0.00 C ATOM 755 NH1 ARG A 47 15.546 -11.592 -8.949 1.00 0.00 N ATOM 756 NH2 ARG A 47 13.827 -12.948 -9.510 1.00 0.00 N ATOM 0 H ARG A 47 11.904 -6.161 -5.053 1.00 0.00 H new ATOM 0 HA ARG A 47 11.323 -6.822 -7.168 1.00 0.00 H new ATOM 0 HB2 ARG A 47 12.619 -9.104 -5.971 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.273 -9.700 -6.921 1.00 0.00 H new ATOM 0 HG2 ARG A 47 12.086 -8.709 -8.938 1.00 0.00 H new ATOM 0 HG3 ARG A 47 13.108 -7.572 -8.081 1.00 0.00 H new ATOM 0 HD2 ARG A 47 14.682 -9.184 -8.799 1.00 0.00 H new ATOM 0 HD3 ARG A 47 14.344 -9.722 -7.166 1.00 0.00 H new ATOM 0 HE ARG A 47 12.408 -11.059 -8.762 1.00 0.00 H new ATOM 0 HH11 ARG A 47 15.887 -10.701 -8.587 1.00 0.00 H new ATOM 0 HH12 ARG A 47 16.208 -12.314 -9.234 1.00 0.00 H new ATOM 0 HH21 ARG A 47 12.824 -13.118 -9.587 1.00 0.00 H new ATOM 0 HH22 ARG A 47 14.490 -13.669 -9.795 1.00 0.00 H new ATOM 770 N PRO A 48 8.827 -6.917 -6.383 1.00 0.00 N ATOM 771 CA PRO A 48 7.362 -7.068 -6.365 1.00 0.00 C ATOM 772 C PRO A 48 6.841 -7.390 -7.769 1.00 0.00 C ATOM 773 O PRO A 48 7.602 -7.545 -8.704 1.00 0.00 O ATOM 774 CB PRO A 48 6.867 -5.695 -5.900 1.00 0.00 C ATOM 775 CG PRO A 48 7.999 -4.691 -6.221 1.00 0.00 C ATOM 776 CD PRO A 48 9.293 -5.515 -6.360 1.00 0.00 C ATOM 0 HA PRO A 48 7.021 -7.879 -5.722 1.00 0.00 H new ATOM 0 HB2 PRO A 48 5.946 -5.420 -6.414 1.00 0.00 H new ATOM 0 HB3 PRO A 48 6.646 -5.703 -4.833 1.00 0.00 H new ATOM 0 HG2 PRO A 48 7.785 -4.148 -7.141 1.00 0.00 H new ATOM 0 HG3 PRO A 48 8.095 -3.949 -5.428 1.00 0.00 H new ATOM 0 HD2 PRO A 48 9.832 -5.259 -7.272 1.00 0.00 H new ATOM 0 HD3 PRO A 48 9.972 -5.334 -5.527 1.00 0.00 H new ATOM 784 N ASP A 49 5.550 -7.491 -7.924 1.00 0.00 N ATOM 785 CA ASP A 49 4.982 -7.804 -9.265 1.00 0.00 C ATOM 786 C ASP A 49 3.917 -6.764 -9.627 1.00 0.00 C ATOM 787 O ASP A 49 3.362 -6.782 -10.707 1.00 0.00 O ATOM 788 CB ASP A 49 4.346 -9.195 -9.238 1.00 0.00 C ATOM 789 CG ASP A 49 5.437 -10.251 -9.056 1.00 0.00 C ATOM 790 OD1 ASP A 49 6.336 -10.016 -8.266 1.00 0.00 O ATOM 791 OD2 ASP A 49 5.355 -11.279 -9.709 1.00 0.00 O ATOM 0 H ASP A 49 4.863 -7.370 -7.179 1.00 0.00 H new ATOM 0 HA ASP A 49 5.778 -7.782 -10.009 1.00 0.00 H new ATOM 0 HB2 ASP A 49 3.623 -9.260 -8.425 1.00 0.00 H new ATOM 0 HB3 ASP A 49 3.801 -9.376 -10.165 1.00 0.00 H new ATOM 796 N LEU A 50 3.627 -5.859 -8.733 1.00 0.00 N ATOM 797 CA LEU A 50 2.598 -4.822 -9.030 1.00 0.00 C ATOM 798 C LEU A 50 3.093 -3.457 -8.546 1.00 0.00 C ATOM 799 O LEU A 50 3.444 -3.286 -7.394 1.00 0.00 O ATOM 800 CB LEU A 50 1.295 -5.177 -8.310 1.00 0.00 C ATOM 801 CG LEU A 50 0.163 -4.294 -8.838 1.00 0.00 C ATOM 802 CD1 LEU A 50 -0.303 -4.820 -10.197 1.00 0.00 C ATOM 803 CD2 LEU A 50 -1.007 -4.324 -7.853 1.00 0.00 C ATOM 0 H LEU A 50 4.057 -5.793 -7.811 1.00 0.00 H new ATOM 0 HA LEU A 50 2.421 -4.783 -10.105 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.054 -6.228 -8.468 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.410 -5.035 -7.236 1.00 0.00 H new ATOM 0 HG LEU A 50 0.521 -3.270 -8.948 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.110 -4.191 -10.573 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.530 -4.801 -10.900 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.662 -5.843 -10.087 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.814 -3.695 -8.228 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.365 -5.348 -7.744 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.676 -3.950 -6.884 1.00 0.00 H new ATOM 815 N VAL A 51 3.122 -2.485 -9.415 1.00 0.00 N ATOM 816 CA VAL A 51 3.592 -1.132 -9.004 1.00 0.00 C ATOM 817 C VAL A 51 2.438 -0.134 -9.123 1.00 0.00 C ATOM 818 O VAL A 51 1.422 -0.415 -9.727 1.00 0.00 O ATOM 819 CB VAL A 51 4.740 -0.693 -9.915 1.00 0.00 C ATOM 820 CG1 VAL A 51 5.123 0.753 -9.595 1.00 0.00 C ATOM 821 CG2 VAL A 51 5.950 -1.602 -9.683 1.00 0.00 C ATOM 0 H VAL A 51 2.841 -2.569 -10.392 1.00 0.00 H new ATOM 0 HA VAL A 51 3.939 -1.166 -7.971 1.00 0.00 H new ATOM 0 HB VAL A 51 4.424 -0.763 -10.956 1.00 0.00 H new ATOM 0 HG11 VAL A 51 5.941 1.065 -10.244 1.00 0.00 H new ATOM 0 HG12 VAL A 51 4.262 1.402 -9.758 1.00 0.00 H new ATOM 0 HG13 VAL A 51 5.439 0.824 -8.554 1.00 0.00 H new ATOM 0 HG21 VAL A 51 6.769 -1.290 -10.331 1.00 0.00 H new ATOM 0 HG22 VAL A 51 6.264 -1.531 -8.642 1.00 0.00 H new ATOM 0 HG23 VAL A 51 5.679 -2.633 -9.910 1.00 0.00 H new ATOM 831 N LEU A 52 2.585 1.029 -8.550 1.00 0.00 N ATOM 832 CA LEU A 52 1.495 2.042 -8.631 1.00 0.00 C ATOM 833 C LEU A 52 2.098 3.425 -8.883 1.00 0.00 C ATOM 834 O LEU A 52 2.434 4.144 -7.964 1.00 0.00 O ATOM 835 CB LEU A 52 0.715 2.058 -7.314 1.00 0.00 C ATOM 836 CG LEU A 52 -0.097 0.768 -7.186 1.00 0.00 C ATOM 837 CD1 LEU A 52 0.237 0.085 -5.859 1.00 0.00 C ATOM 838 CD2 LEU A 52 -1.590 1.102 -7.226 1.00 0.00 C ATOM 0 H LEU A 52 3.412 1.321 -8.030 1.00 0.00 H new ATOM 0 HA LEU A 52 0.823 1.786 -9.450 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.402 2.153 -6.473 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.052 2.922 -7.282 1.00 0.00 H new ATOM 0 HG LEU A 52 0.149 0.099 -8.011 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -0.341 -0.834 -5.767 1.00 0.00 H new ATOM 0 HD12 LEU A 52 1.301 -0.151 -5.829 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.010 0.753 -5.034 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.171 0.184 -7.135 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.836 1.770 -6.401 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.828 1.590 -8.171 1.00 0.00 H new ATOM 850 N LEU A 53 2.238 3.804 -10.124 1.00 0.00 N ATOM 851 CA LEU A 53 2.819 5.140 -10.433 1.00 0.00 C ATOM 852 C LEU A 53 1.699 6.179 -10.509 1.00 0.00 C ATOM 853 O LEU A 53 0.756 6.036 -11.263 1.00 0.00 O ATOM 854 CB LEU A 53 3.550 5.080 -11.777 1.00 0.00 C ATOM 855 CG LEU A 53 5.058 4.986 -11.534 1.00 0.00 C ATOM 856 CD1 LEU A 53 5.341 3.901 -10.494 1.00 0.00 C ATOM 857 CD2 LEU A 53 5.763 4.631 -12.845 1.00 0.00 C ATOM 0 H LEU A 53 1.975 3.246 -10.936 1.00 0.00 H new ATOM 0 HA LEU A 53 3.522 5.420 -9.648 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.209 4.218 -12.350 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.321 5.967 -12.368 1.00 0.00 H new ATOM 0 HG LEU A 53 5.428 5.944 -11.169 1.00 0.00 H new ATOM 0 HD11 LEU A 53 6.415 3.834 -10.321 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.838 4.152 -9.560 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.972 2.942 -10.859 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.837 4.564 -12.674 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.393 3.673 -13.209 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.562 5.404 -13.587 1.00 0.00 H new ATOM 869 N ASP A 54 1.792 7.223 -9.732 1.00 0.00 N ATOM 870 CA ASP A 54 0.729 8.269 -9.759 1.00 0.00 C ATOM 871 C ASP A 54 1.191 9.452 -10.606 1.00 0.00 C ATOM 872 O ASP A 54 0.440 10.367 -10.879 1.00 0.00 O ATOM 873 CB ASP A 54 0.447 8.743 -8.332 1.00 0.00 C ATOM 874 CG ASP A 54 -0.890 9.485 -8.294 1.00 0.00 C ATOM 875 OD1 ASP A 54 -1.753 9.150 -9.087 1.00 0.00 O ATOM 876 OD2 ASP A 54 -1.028 10.377 -7.472 1.00 0.00 O ATOM 0 H ASP A 54 2.557 7.398 -9.080 1.00 0.00 H new ATOM 0 HA ASP A 54 -0.179 7.850 -10.192 1.00 0.00 H new ATOM 0 HB2 ASP A 54 0.421 7.891 -7.653 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.248 9.398 -7.990 1.00 0.00 H new ATOM 881 N MET A 55 2.424 9.440 -11.022 1.00 0.00 N ATOM 882 CA MET A 55 2.949 10.561 -11.852 1.00 0.00 C ATOM 883 C MET A 55 2.650 11.899 -11.167 1.00 0.00 C ATOM 884 O MET A 55 2.675 12.943 -11.789 1.00 0.00 O ATOM 885 CB MET A 55 2.280 10.532 -13.228 1.00 0.00 C ATOM 886 CG MET A 55 2.352 9.116 -13.804 1.00 0.00 C ATOM 887 SD MET A 55 4.057 8.514 -13.713 1.00 0.00 S ATOM 888 CE MET A 55 3.907 7.215 -14.965 1.00 0.00 C ATOM 0 H MET A 55 3.096 8.699 -10.823 1.00 0.00 H new ATOM 0 HA MET A 55 4.027 10.449 -11.967 1.00 0.00 H new ATOM 0 HB2 MET A 55 1.241 10.849 -13.145 1.00 0.00 H new ATOM 0 HB3 MET A 55 2.775 11.234 -13.899 1.00 0.00 H new ATOM 0 HG2 MET A 55 1.690 8.452 -13.248 1.00 0.00 H new ATOM 0 HG3 MET A 55 2.009 9.115 -14.839 1.00 0.00 H new ATOM 0 HE1 MET A 55 4.837 7.145 -15.530 1.00 0.00 H new ATOM 0 HE2 MET A 55 3.706 6.261 -14.477 1.00 0.00 H new ATOM 0 HE3 MET A 55 3.088 7.456 -15.643 1.00 0.00 H new ATOM 898 N LYS A 56 2.368 11.881 -9.891 1.00 0.00 N ATOM 899 CA LYS A 56 2.072 13.154 -9.176 1.00 0.00 C ATOM 900 C LYS A 56 3.368 13.727 -8.600 1.00 0.00 C ATOM 901 O LYS A 56 3.579 14.924 -8.588 1.00 0.00 O ATOM 902 CB LYS A 56 1.085 12.883 -8.039 1.00 0.00 C ATOM 903 CG LYS A 56 -0.321 12.709 -8.615 1.00 0.00 C ATOM 904 CD LYS A 56 -0.741 13.994 -9.334 1.00 0.00 C ATOM 905 CE LYS A 56 -2.267 14.064 -9.405 1.00 0.00 C ATOM 906 NZ LYS A 56 -2.678 15.375 -9.983 1.00 0.00 N ATOM 0 H LYS A 56 2.330 11.040 -9.315 1.00 0.00 H new ATOM 0 HA LYS A 56 1.636 13.870 -9.873 1.00 0.00 H new ATOM 0 HB2 LYS A 56 1.380 11.987 -7.493 1.00 0.00 H new ATOM 0 HB3 LYS A 56 1.098 13.708 -7.327 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.340 11.869 -9.309 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -1.027 12.479 -7.817 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.351 14.863 -8.805 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.318 14.016 -10.338 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.651 13.248 -10.017 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.694 13.944 -8.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.716 15.423 -10.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -2.323 16.146 -9.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -2.282 15.472 -10.940 1.00 0.00 H new ATOM 920 N ILE A 57 4.236 12.879 -8.120 1.00 0.00 N ATOM 921 CA ILE A 57 5.519 13.366 -7.542 1.00 0.00 C ATOM 922 C ILE A 57 6.102 14.467 -8.438 1.00 0.00 C ATOM 923 O ILE A 57 6.472 14.207 -9.565 1.00 0.00 O ATOM 924 CB ILE A 57 6.507 12.202 -7.458 1.00 0.00 C ATOM 925 CG1 ILE A 57 5.873 11.053 -6.671 1.00 0.00 C ATOM 926 CG2 ILE A 57 7.780 12.664 -6.746 1.00 0.00 C ATOM 927 CD1 ILE A 57 5.871 9.785 -7.527 1.00 0.00 C ATOM 0 H ILE A 57 4.111 11.867 -8.104 1.00 0.00 H new ATOM 0 HA ILE A 57 5.340 13.769 -6.545 1.00 0.00 H new ATOM 0 HB ILE A 57 6.755 11.862 -8.464 1.00 0.00 H new ATOM 0 HG12 ILE A 57 6.428 10.881 -5.749 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.854 11.313 -6.386 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.485 11.835 -6.686 1.00 0.00 H new ATOM 0 HG22 ILE A 57 8.232 13.484 -7.304 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.532 13.003 -5.740 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.419 8.967 -6.965 1.00 0.00 H new ATOM 0 HD12 ILE A 57 5.297 9.961 -8.437 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.896 9.522 -7.790 1.00 0.00 H new ATOM 939 N PRO A 58 6.167 15.667 -7.913 1.00 0.00 N ATOM 940 CA PRO A 58 6.702 16.824 -8.652 1.00 0.00 C ATOM 941 C PRO A 58 8.233 16.771 -8.685 1.00 0.00 C ATOM 942 O PRO A 58 8.863 16.212 -7.810 1.00 0.00 O ATOM 943 CB PRO A 58 6.209 18.027 -7.846 1.00 0.00 C ATOM 944 CG PRO A 58 5.915 17.506 -6.419 1.00 0.00 C ATOM 945 CD PRO A 58 5.716 15.983 -6.541 1.00 0.00 C ATOM 0 HA PRO A 58 6.378 16.858 -9.692 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.962 18.815 -7.824 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.313 18.455 -8.296 1.00 0.00 H new ATOM 0 HG2 PRO A 58 6.740 17.737 -5.744 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.025 17.982 -6.008 1.00 0.00 H new ATOM 0 HD2 PRO A 58 6.301 15.444 -5.796 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.673 15.704 -6.391 1.00 0.00 H new ATOM 953 N GLY A 59 8.833 17.348 -9.689 1.00 0.00 N ATOM 954 CA GLY A 59 10.321 17.329 -9.781 1.00 0.00 C ATOM 955 C GLY A 59 10.746 16.397 -10.917 1.00 0.00 C ATOM 956 O GLY A 59 11.618 16.716 -11.701 1.00 0.00 O ATOM 0 H GLY A 59 8.357 17.832 -10.450 1.00 0.00 H new ATOM 0 HA2 GLY A 59 10.698 18.336 -9.961 1.00 0.00 H new ATOM 0 HA3 GLY A 59 10.751 16.991 -8.838 1.00 0.00 H new ATOM 960 N MET A 60 10.133 15.250 -11.014 1.00 0.00 N ATOM 961 CA MET A 60 10.497 14.298 -12.102 1.00 0.00 C ATOM 962 C MET A 60 9.296 13.400 -12.411 1.00 0.00 C ATOM 963 O MET A 60 8.397 13.252 -11.607 1.00 0.00 O ATOM 964 CB MET A 60 11.687 13.441 -11.657 1.00 0.00 C ATOM 965 CG MET A 60 11.220 12.378 -10.660 1.00 0.00 C ATOM 966 SD MET A 60 10.651 13.179 -9.141 1.00 0.00 S ATOM 967 CE MET A 60 9.918 11.713 -8.375 1.00 0.00 C ATOM 0 H MET A 60 9.395 14.930 -10.387 1.00 0.00 H new ATOM 0 HA MET A 60 10.773 14.853 -12.998 1.00 0.00 H new ATOM 0 HB2 MET A 60 12.146 12.963 -12.523 1.00 0.00 H new ATOM 0 HB3 MET A 60 12.449 14.071 -11.199 1.00 0.00 H new ATOM 0 HG2 MET A 60 10.414 11.786 -11.095 1.00 0.00 H new ATOM 0 HG3 MET A 60 12.036 11.691 -10.437 1.00 0.00 H new ATOM 0 HE1 MET A 60 9.886 11.845 -7.293 1.00 0.00 H new ATOM 0 HE2 MET A 60 8.905 11.573 -8.753 1.00 0.00 H new ATOM 0 HE3 MET A 60 10.520 10.837 -8.616 1.00 0.00 H new ATOM 977 N ASP A 61 9.274 12.799 -13.568 1.00 0.00 N ATOM 978 CA ASP A 61 8.128 11.914 -13.924 1.00 0.00 C ATOM 979 C ASP A 61 8.428 10.482 -13.474 1.00 0.00 C ATOM 980 O ASP A 61 9.553 10.138 -13.171 1.00 0.00 O ATOM 981 CB ASP A 61 7.917 11.938 -15.439 1.00 0.00 C ATOM 982 CG ASP A 61 7.143 13.199 -15.827 1.00 0.00 C ATOM 983 OD1 ASP A 61 6.024 13.350 -15.367 1.00 0.00 O ATOM 984 OD2 ASP A 61 7.684 13.994 -16.578 1.00 0.00 O ATOM 0 H ASP A 61 9.998 12.882 -14.282 1.00 0.00 H new ATOM 0 HA ASP A 61 7.227 12.270 -13.425 1.00 0.00 H new ATOM 0 HB2 ASP A 61 8.879 11.917 -15.951 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.369 11.050 -15.754 1.00 0.00 H new ATOM 989 N GLY A 62 7.428 9.645 -13.429 1.00 0.00 N ATOM 990 CA GLY A 62 7.654 8.236 -13.000 1.00 0.00 C ATOM 991 C GLY A 62 7.993 7.378 -14.220 1.00 0.00 C ATOM 992 O GLY A 62 8.376 6.231 -14.097 1.00 0.00 O ATOM 0 H GLY A 62 6.464 9.876 -13.671 1.00 0.00 H new ATOM 0 HA2 GLY A 62 8.466 8.192 -12.274 1.00 0.00 H new ATOM 0 HA3 GLY A 62 6.763 7.848 -12.506 1.00 0.00 H new ATOM 996 N ILE A 63 7.857 7.923 -15.398 1.00 0.00 N ATOM 997 CA ILE A 63 8.173 7.137 -16.624 1.00 0.00 C ATOM 998 C ILE A 63 9.517 6.430 -16.440 1.00 0.00 C ATOM 999 O ILE A 63 9.665 5.267 -16.758 1.00 0.00 O ATOM 1000 CB ILE A 63 8.253 8.078 -17.827 1.00 0.00 C ATOM 1001 CG1 ILE A 63 6.848 8.571 -18.182 1.00 0.00 C ATOM 1002 CG2 ILE A 63 8.846 7.330 -19.022 1.00 0.00 C ATOM 1003 CD1 ILE A 63 5.949 7.371 -18.489 1.00 0.00 C ATOM 0 H ILE A 63 7.541 8.878 -15.564 1.00 0.00 H new ATOM 0 HA ILE A 63 7.391 6.397 -16.794 1.00 0.00 H new ATOM 0 HB ILE A 63 8.887 8.930 -17.580 1.00 0.00 H new ATOM 0 HG12 ILE A 63 6.433 9.147 -17.355 1.00 0.00 H new ATOM 0 HG13 ILE A 63 6.891 9.236 -19.044 1.00 0.00 H new ATOM 0 HG21 ILE A 63 8.903 8.001 -19.879 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.846 6.977 -18.770 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.212 6.478 -19.269 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.948 7.721 -18.742 1.00 0.00 H new ATOM 0 HD12 ILE A 63 6.361 6.813 -19.330 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.896 6.723 -17.614 1.00 0.00 H new ATOM 1015 N GLU A 64 10.496 7.123 -15.928 1.00 0.00 N ATOM 1016 CA GLU A 64 11.830 6.490 -15.723 1.00 0.00 C ATOM 1017 C GLU A 64 11.678 5.273 -14.810 1.00 0.00 C ATOM 1018 O GLU A 64 12.269 4.235 -15.038 1.00 0.00 O ATOM 1019 CB GLU A 64 12.779 7.500 -15.076 1.00 0.00 C ATOM 1020 CG GLU A 64 12.547 8.884 -15.688 1.00 0.00 C ATOM 1021 CD GLU A 64 13.758 9.775 -15.406 1.00 0.00 C ATOM 1022 OE1 GLU A 64 14.373 9.597 -14.368 1.00 0.00 O ATOM 1023 OE2 GLU A 64 14.050 10.623 -16.234 1.00 0.00 O ATOM 0 H GLU A 64 10.431 8.100 -15.643 1.00 0.00 H new ATOM 0 HA GLU A 64 12.237 6.175 -16.684 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.612 7.534 -13.999 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.813 7.192 -15.228 1.00 0.00 H new ATOM 0 HG2 GLU A 64 12.389 8.796 -16.763 1.00 0.00 H new ATOM 0 HG3 GLU A 64 11.646 9.333 -15.269 1.00 0.00 H new ATOM 1030 N ILE A 65 10.891 5.390 -13.776 1.00 0.00 N ATOM 1031 CA ILE A 65 10.700 4.240 -12.849 1.00 0.00 C ATOM 1032 C ILE A 65 10.363 2.986 -13.658 1.00 0.00 C ATOM 1033 O ILE A 65 10.964 1.944 -13.487 1.00 0.00 O ATOM 1034 CB ILE A 65 9.555 4.545 -11.882 1.00 0.00 C ATOM 1035 CG1 ILE A 65 9.756 5.935 -11.272 1.00 0.00 C ATOM 1036 CG2 ILE A 65 9.534 3.499 -10.767 1.00 0.00 C ATOM 1037 CD1 ILE A 65 11.199 6.077 -10.782 1.00 0.00 C ATOM 0 H ILE A 65 10.372 6.234 -13.533 1.00 0.00 H new ATOM 0 HA ILE A 65 11.617 4.074 -12.283 1.00 0.00 H new ATOM 0 HB ILE A 65 8.609 4.519 -12.423 1.00 0.00 H new ATOM 0 HG12 ILE A 65 9.536 6.704 -12.013 1.00 0.00 H new ATOM 0 HG13 ILE A 65 9.064 6.083 -10.443 1.00 0.00 H new ATOM 0 HG21 ILE A 65 8.718 3.717 -10.079 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.389 2.509 -11.199 1.00 0.00 H new ATOM 0 HG23 ILE A 65 10.480 3.524 -10.227 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.340 7.067 -10.348 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.403 5.318 -10.027 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.883 5.948 -11.621 1.00 0.00 H new ATOM 1049 N LEU A 66 9.406 3.078 -14.542 1.00 0.00 N ATOM 1050 CA LEU A 66 9.032 1.892 -15.362 1.00 0.00 C ATOM 1051 C LEU A 66 10.256 1.409 -16.144 1.00 0.00 C ATOM 1052 O LEU A 66 10.582 0.238 -16.143 1.00 0.00 O ATOM 1053 CB LEU A 66 7.922 2.277 -16.341 1.00 0.00 C ATOM 1054 CG LEU A 66 6.685 2.723 -15.560 1.00 0.00 C ATOM 1055 CD1 LEU A 66 5.603 3.188 -16.537 1.00 0.00 C ATOM 1056 CD2 LEU A 66 6.154 1.549 -14.735 1.00 0.00 C ATOM 0 H LEU A 66 8.868 3.924 -14.731 1.00 0.00 H new ATOM 0 HA LEU A 66 8.678 1.095 -14.708 1.00 0.00 H new ATOM 0 HB2 LEU A 66 8.262 3.080 -16.995 1.00 0.00 H new ATOM 0 HB3 LEU A 66 7.676 1.429 -16.980 1.00 0.00 H new ATOM 0 HG LEU A 66 6.952 3.545 -14.896 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.722 3.506 -15.980 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.980 4.024 -17.127 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.335 2.366 -17.201 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.272 1.865 -14.178 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.887 0.728 -15.400 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.923 1.216 -14.038 1.00 0.00 H new ATOM 1068 N LYS A 67 10.937 2.301 -16.810 1.00 0.00 N ATOM 1069 CA LYS A 67 12.139 1.892 -17.589 1.00 0.00 C ATOM 1070 C LYS A 67 12.987 0.935 -16.750 1.00 0.00 C ATOM 1071 O LYS A 67 13.403 -0.109 -17.212 1.00 0.00 O ATOM 1072 CB LYS A 67 12.964 3.131 -17.941 1.00 0.00 C ATOM 1073 CG LYS A 67 12.749 3.488 -19.413 1.00 0.00 C ATOM 1074 CD LYS A 67 13.188 4.933 -19.657 1.00 0.00 C ATOM 1075 CE LYS A 67 13.410 5.155 -21.154 1.00 0.00 C ATOM 1076 NZ LYS A 67 12.294 4.528 -21.919 1.00 0.00 N ATOM 0 H LYS A 67 10.713 3.295 -16.848 1.00 0.00 H new ATOM 0 HA LYS A 67 11.826 1.392 -18.506 1.00 0.00 H new ATOM 0 HB2 LYS A 67 12.671 3.968 -17.307 1.00 0.00 H new ATOM 0 HB3 LYS A 67 14.021 2.942 -17.752 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.319 2.811 -20.049 1.00 0.00 H new ATOM 0 HG3 LYS A 67 11.699 3.366 -19.678 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.430 5.622 -19.285 1.00 0.00 H new ATOM 0 HD3 LYS A 67 14.106 5.143 -19.108 1.00 0.00 H new ATOM 0 HE2 LYS A 67 13.460 6.222 -21.371 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.363 4.723 -21.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 12.203 4.994 -22.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 12.494 3.517 -22.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 11.406 4.635 -21.388 1.00 0.00 H new ATOM 1090 N ARG A 68 13.245 1.280 -15.518 1.00 0.00 N ATOM 1091 CA ARG A 68 14.065 0.389 -14.651 1.00 0.00 C ATOM 1092 C ARG A 68 13.304 -0.912 -14.393 1.00 0.00 C ATOM 1093 O ARG A 68 13.882 -1.980 -14.336 1.00 0.00 O ATOM 1094 CB ARG A 68 14.345 1.090 -13.319 1.00 0.00 C ATOM 1095 CG ARG A 68 15.676 1.838 -13.405 1.00 0.00 C ATOM 1096 CD ARG A 68 15.412 3.319 -13.683 1.00 0.00 C ATOM 1097 NE ARG A 68 16.383 4.150 -12.916 1.00 0.00 N ATOM 1098 CZ ARG A 68 16.175 5.431 -12.765 1.00 0.00 C ATOM 1099 NH1 ARG A 68 15.117 5.990 -13.285 1.00 0.00 N ATOM 1100 NH2 ARG A 68 17.029 6.153 -12.092 1.00 0.00 N ATOM 0 H ARG A 68 12.923 2.141 -15.075 1.00 0.00 H new ATOM 0 HA ARG A 68 15.008 0.165 -15.149 1.00 0.00 H new ATOM 0 HB2 ARG A 68 13.539 1.786 -13.086 1.00 0.00 H new ATOM 0 HB3 ARG A 68 14.378 0.359 -12.511 1.00 0.00 H new ATOM 0 HG2 ARG A 68 16.230 1.725 -12.473 1.00 0.00 H new ATOM 0 HG3 ARG A 68 16.294 1.413 -14.196 1.00 0.00 H new ATOM 0 HD2 ARG A 68 15.506 3.522 -14.750 1.00 0.00 H new ATOM 0 HD3 ARG A 68 14.392 3.577 -13.398 1.00 0.00 H new ATOM 0 HE ARG A 68 17.212 3.718 -12.508 1.00 0.00 H new ATOM 0 HH11 ARG A 68 14.449 5.427 -13.811 1.00 0.00 H new ATOM 0 HH12 ARG A 68 14.958 6.990 -13.165 1.00 0.00 H new ATOM 0 HH21 ARG A 68 17.857 5.717 -11.685 1.00 0.00 H new ATOM 0 HH22 ARG A 68 16.869 7.153 -11.973 1.00 0.00 H new ATOM 1114 N MET A 69 12.010 -0.833 -14.238 1.00 0.00 N ATOM 1115 CA MET A 69 11.213 -2.066 -13.985 1.00 0.00 C ATOM 1116 C MET A 69 11.338 -3.008 -15.184 1.00 0.00 C ATOM 1117 O MET A 69 11.139 -4.202 -15.072 1.00 0.00 O ATOM 1118 CB MET A 69 9.745 -1.691 -13.780 1.00 0.00 C ATOM 1119 CG MET A 69 9.638 -0.620 -12.694 1.00 0.00 C ATOM 1120 SD MET A 69 8.767 -1.297 -11.259 1.00 0.00 S ATOM 1121 CE MET A 69 8.543 0.264 -10.372 1.00 0.00 C ATOM 0 H MET A 69 11.471 0.032 -14.276 1.00 0.00 H new ATOM 0 HA MET A 69 11.588 -2.565 -13.091 1.00 0.00 H new ATOM 0 HB2 MET A 69 9.320 -1.321 -14.713 1.00 0.00 H new ATOM 0 HB3 MET A 69 9.170 -2.572 -13.494 1.00 0.00 H new ATOM 0 HG2 MET A 69 10.633 -0.282 -12.403 1.00 0.00 H new ATOM 0 HG3 MET A 69 9.106 0.250 -13.078 1.00 0.00 H new ATOM 0 HE1 MET A 69 8.016 0.078 -9.436 1.00 0.00 H new ATOM 0 HE2 MET A 69 9.517 0.704 -10.158 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.961 0.951 -10.986 1.00 0.00 H new ATOM 1131 N LYS A 70 11.663 -2.481 -16.333 1.00 0.00 N ATOM 1132 CA LYS A 70 11.799 -3.347 -17.538 1.00 0.00 C ATOM 1133 C LYS A 70 13.206 -3.946 -17.578 1.00 0.00 C ATOM 1134 O LYS A 70 13.385 -5.116 -17.850 1.00 0.00 O ATOM 1135 CB LYS A 70 11.567 -2.509 -18.798 1.00 0.00 C ATOM 1136 CG LYS A 70 10.344 -1.611 -18.600 1.00 0.00 C ATOM 1137 CD LYS A 70 9.075 -2.393 -18.939 1.00 0.00 C ATOM 1138 CE LYS A 70 7.851 -1.617 -18.451 1.00 0.00 C ATOM 1139 NZ LYS A 70 6.841 -2.572 -17.911 1.00 0.00 N ATOM 0 H LYS A 70 11.840 -1.489 -16.489 1.00 0.00 H new ATOM 0 HA LYS A 70 11.062 -4.149 -17.494 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.447 -1.901 -19.009 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.416 -3.161 -19.658 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.302 -1.258 -17.569 1.00 0.00 H new ATOM 0 HG3 LYS A 70 10.421 -0.729 -19.236 1.00 0.00 H new ATOM 0 HD2 LYS A 70 9.011 -2.554 -20.015 1.00 0.00 H new ATOM 0 HD3 LYS A 70 9.105 -3.377 -18.471 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.143 -0.904 -17.679 1.00 0.00 H new ATOM 0 HE3 LYS A 70 7.421 -1.041 -19.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.008 -2.045 -17.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.555 -3.235 -18.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.254 -3.102 -17.118 1.00 0.00 H new ATOM 1153 N VAL A 71 14.205 -3.152 -17.308 1.00 0.00 N ATOM 1154 CA VAL A 71 15.600 -3.674 -17.331 1.00 0.00 C ATOM 1155 C VAL A 71 15.765 -4.736 -16.242 1.00 0.00 C ATOM 1156 O VAL A 71 16.578 -5.632 -16.354 1.00 0.00 O ATOM 1157 CB VAL A 71 16.577 -2.525 -17.075 1.00 0.00 C ATOM 1158 CG1 VAL A 71 17.968 -2.916 -17.578 1.00 0.00 C ATOM 1159 CG2 VAL A 71 16.100 -1.276 -17.819 1.00 0.00 C ATOM 0 H VAL A 71 14.115 -2.164 -17.072 1.00 0.00 H new ATOM 0 HA VAL A 71 15.807 -4.118 -18.305 1.00 0.00 H new ATOM 0 HB VAL A 71 16.622 -2.318 -16.006 1.00 0.00 H new ATOM 0 HG11 VAL A 71 18.664 -2.097 -17.396 1.00 0.00 H new ATOM 0 HG12 VAL A 71 18.309 -3.807 -17.050 1.00 0.00 H new ATOM 0 HG13 VAL A 71 17.923 -3.123 -18.647 1.00 0.00 H new ATOM 0 HG21 VAL A 71 16.795 -0.457 -17.637 1.00 0.00 H new ATOM 0 HG22 VAL A 71 16.056 -1.484 -18.888 1.00 0.00 H new ATOM 0 HG23 VAL A 71 15.109 -0.996 -17.462 1.00 0.00 H new ATOM 1169 N ILE A 72 14.999 -4.644 -15.188 1.00 0.00 N ATOM 1170 CA ILE A 72 15.114 -5.649 -14.095 1.00 0.00 C ATOM 1171 C ILE A 72 14.161 -6.815 -14.371 1.00 0.00 C ATOM 1172 O ILE A 72 14.567 -7.957 -14.440 1.00 0.00 O ATOM 1173 CB ILE A 72 14.746 -4.995 -12.762 1.00 0.00 C ATOM 1174 CG1 ILE A 72 15.634 -3.773 -12.532 1.00 0.00 C ATOM 1175 CG2 ILE A 72 14.956 -5.997 -11.625 1.00 0.00 C ATOM 1176 CD1 ILE A 72 17.091 -4.165 -12.756 1.00 0.00 C ATOM 0 H ILE A 72 14.300 -3.917 -15.038 1.00 0.00 H new ATOM 0 HA ILE A 72 16.138 -6.020 -14.048 1.00 0.00 H new ATOM 0 HB ILE A 72 13.701 -4.687 -12.786 1.00 0.00 H new ATOM 0 HG12 ILE A 72 15.352 -2.970 -13.213 1.00 0.00 H new ATOM 0 HG13 ILE A 72 15.498 -3.395 -11.519 1.00 0.00 H new ATOM 0 HG21 ILE A 72 14.694 -5.530 -10.676 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.323 -6.870 -11.788 1.00 0.00 H new ATOM 0 HG23 ILE A 72 16.001 -6.306 -11.601 1.00 0.00 H new ATOM 0 HD11 ILE A 72 17.730 -3.297 -12.593 1.00 0.00 H new ATOM 0 HD12 ILE A 72 17.367 -4.955 -12.057 1.00 0.00 H new ATOM 0 HD13 ILE A 72 17.218 -4.523 -13.777 1.00 0.00 H new ATOM 1188 N ASP A 73 12.896 -6.534 -14.530 1.00 0.00 N ATOM 1189 CA ASP A 73 11.920 -7.627 -14.803 1.00 0.00 C ATOM 1190 C ASP A 73 11.127 -7.298 -16.069 1.00 0.00 C ATOM 1191 O ASP A 73 10.667 -6.189 -16.255 1.00 0.00 O ATOM 1192 CB ASP A 73 10.959 -7.759 -13.618 1.00 0.00 C ATOM 1193 CG ASP A 73 11.621 -8.584 -12.513 1.00 0.00 C ATOM 1194 OD1 ASP A 73 12.820 -8.445 -12.335 1.00 0.00 O ATOM 1195 OD2 ASP A 73 10.919 -9.341 -11.865 1.00 0.00 O ATOM 0 H ASP A 73 12.497 -5.596 -14.483 1.00 0.00 H new ATOM 0 HA ASP A 73 12.455 -8.566 -14.944 1.00 0.00 H new ATOM 0 HB2 ASP A 73 10.694 -6.772 -13.240 1.00 0.00 H new ATOM 0 HB3 ASP A 73 10.033 -8.237 -13.938 1.00 0.00 H new ATOM 1200 N GLU A 74 10.964 -8.254 -16.942 1.00 0.00 N ATOM 1201 CA GLU A 74 10.202 -7.995 -18.197 1.00 0.00 C ATOM 1202 C GLU A 74 8.718 -8.281 -17.961 1.00 0.00 C ATOM 1203 O GLU A 74 7.868 -7.878 -18.731 1.00 0.00 O ATOM 1204 CB GLU A 74 10.728 -8.905 -19.309 1.00 0.00 C ATOM 1205 CG GLU A 74 11.797 -8.164 -20.114 1.00 0.00 C ATOM 1206 CD GLU A 74 12.633 -9.173 -20.903 1.00 0.00 C ATOM 1207 OE1 GLU A 74 13.410 -9.881 -20.285 1.00 0.00 O ATOM 1208 OE2 GLU A 74 12.481 -9.221 -22.112 1.00 0.00 O ATOM 0 H GLU A 74 11.325 -9.203 -16.841 1.00 0.00 H new ATOM 0 HA GLU A 74 10.328 -6.953 -18.491 1.00 0.00 H new ATOM 0 HB2 GLU A 74 11.147 -9.815 -18.880 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.910 -9.207 -19.963 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.328 -7.454 -20.795 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.438 -7.589 -19.445 1.00 0.00 H new ATOM 1215 N ASN A 75 8.397 -8.975 -16.903 1.00 0.00 N ATOM 1216 CA ASN A 75 6.968 -9.285 -16.621 1.00 0.00 C ATOM 1217 C ASN A 75 6.539 -8.583 -15.330 1.00 0.00 C ATOM 1218 O ASN A 75 6.061 -9.205 -14.403 1.00 0.00 O ATOM 1219 CB ASN A 75 6.797 -10.798 -16.459 1.00 0.00 C ATOM 1220 CG ASN A 75 7.832 -11.325 -15.463 1.00 0.00 C ATOM 1221 OD1 ASN A 75 8.363 -10.577 -14.667 1.00 0.00 O ATOM 1222 ND2 ASN A 75 8.142 -12.593 -15.473 1.00 0.00 N ATOM 0 H ASN A 75 9.063 -9.340 -16.222 1.00 0.00 H new ATOM 0 HA ASN A 75 6.350 -8.935 -17.448 1.00 0.00 H new ATOM 0 HB2 ASN A 75 5.790 -11.025 -16.108 1.00 0.00 H new ATOM 0 HB3 ASN A 75 6.918 -11.294 -17.422 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.830 -12.955 -14.813 1.00 0.00 H new ATOM 0 HD22 ASN A 75 7.696 -13.222 -16.141 1.00 0.00 H new ATOM 1229 N ILE A 76 6.708 -7.290 -15.264 1.00 0.00 N ATOM 1230 CA ILE A 76 6.310 -6.550 -14.034 1.00 0.00 C ATOM 1231 C ILE A 76 5.098 -5.668 -14.339 1.00 0.00 C ATOM 1232 O ILE A 76 5.160 -4.774 -15.160 1.00 0.00 O ATOM 1233 CB ILE A 76 7.474 -5.675 -13.569 1.00 0.00 C ATOM 1234 CG1 ILE A 76 6.984 -4.707 -12.489 1.00 0.00 C ATOM 1235 CG2 ILE A 76 8.021 -4.879 -14.755 1.00 0.00 C ATOM 1236 CD1 ILE A 76 8.012 -4.640 -11.358 1.00 0.00 C ATOM 0 H ILE A 76 7.104 -6.715 -16.008 1.00 0.00 H new ATOM 0 HA ILE A 76 6.053 -7.261 -13.249 1.00 0.00 H new ATOM 0 HB ILE A 76 8.263 -6.307 -13.161 1.00 0.00 H new ATOM 0 HG12 ILE A 76 6.833 -3.716 -12.916 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.021 -5.037 -12.100 1.00 0.00 H new ATOM 0 HG21 ILE A 76 8.851 -4.255 -14.423 1.00 0.00 H new ATOM 0 HG22 ILE A 76 8.370 -5.567 -15.525 1.00 0.00 H new ATOM 0 HG23 ILE A 76 7.233 -4.247 -15.163 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.663 -3.951 -10.589 1.00 0.00 H new ATOM 0 HD12 ILE A 76 8.141 -5.632 -10.925 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.966 -4.290 -11.753 1.00 0.00 H new ATOM 1248 N ARG A 77 3.995 -5.912 -13.685 1.00 0.00 N ATOM 1249 CA ARG A 77 2.780 -5.086 -13.939 1.00 0.00 C ATOM 1250 C ARG A 77 2.941 -3.721 -13.266 1.00 0.00 C ATOM 1251 O ARG A 77 3.509 -3.609 -12.199 1.00 0.00 O ATOM 1252 CB ARG A 77 1.553 -5.796 -13.366 1.00 0.00 C ATOM 1253 CG ARG A 77 1.429 -7.188 -13.990 1.00 0.00 C ATOM 1254 CD ARG A 77 0.674 -8.112 -13.033 1.00 0.00 C ATOM 1255 NE ARG A 77 1.528 -9.287 -12.699 1.00 0.00 N ATOM 1256 CZ ARG A 77 1.032 -10.289 -12.025 1.00 0.00 C ATOM 1257 NH1 ARG A 77 -0.216 -10.268 -11.640 1.00 0.00 N ATOM 1258 NH2 ARG A 77 1.785 -11.315 -11.736 1.00 0.00 N ATOM 0 H ARG A 77 3.883 -6.647 -12.987 1.00 0.00 H new ATOM 0 HA ARG A 77 2.652 -4.948 -15.013 1.00 0.00 H new ATOM 0 HB2 ARG A 77 1.641 -5.878 -12.283 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.655 -5.213 -13.570 1.00 0.00 H new ATOM 0 HG2 ARG A 77 0.903 -7.125 -14.942 1.00 0.00 H new ATOM 0 HG3 ARG A 77 2.419 -7.594 -14.199 1.00 0.00 H new ATOM 0 HD2 ARG A 77 0.408 -7.573 -12.124 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -0.258 -8.445 -13.491 1.00 0.00 H new ATOM 0 HE ARG A 77 2.503 -9.308 -12.998 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -0.806 -9.467 -11.866 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -0.601 -11.052 -11.114 1.00 0.00 H new ATOM 0 HH21 ARG A 77 2.760 -11.333 -12.037 1.00 0.00 H new ATOM 0 HH22 ARG A 77 1.399 -12.099 -11.209 1.00 0.00 H new ATOM 1272 N VAL A 78 2.443 -2.684 -13.882 1.00 0.00 N ATOM 1273 CA VAL A 78 2.568 -1.328 -13.276 1.00 0.00 C ATOM 1274 C VAL A 78 1.303 -0.518 -13.571 1.00 0.00 C ATOM 1275 O VAL A 78 1.069 -0.099 -14.689 1.00 0.00 O ATOM 1276 CB VAL A 78 3.781 -0.613 -13.873 1.00 0.00 C ATOM 1277 CG1 VAL A 78 4.074 0.654 -13.066 1.00 0.00 C ATOM 1278 CG2 VAL A 78 4.996 -1.542 -13.821 1.00 0.00 C ATOM 0 H VAL A 78 1.956 -2.717 -14.777 1.00 0.00 H new ATOM 0 HA VAL A 78 2.696 -1.423 -12.198 1.00 0.00 H new ATOM 0 HB VAL A 78 3.572 -0.345 -14.909 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.938 1.164 -13.491 1.00 0.00 H new ATOM 0 HG12 VAL A 78 3.209 1.316 -13.101 1.00 0.00 H new ATOM 0 HG13 VAL A 78 4.284 0.386 -12.031 1.00 0.00 H new ATOM 0 HG21 VAL A 78 5.861 -1.034 -14.246 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.205 -1.810 -12.785 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.788 -2.445 -14.394 1.00 0.00 H new ATOM 1288 N ILE A 79 0.485 -0.295 -12.580 1.00 0.00 N ATOM 1289 CA ILE A 79 -0.763 0.487 -12.805 1.00 0.00 C ATOM 1290 C ILE A 79 -0.483 1.973 -12.565 1.00 0.00 C ATOM 1291 O ILE A 79 0.217 2.343 -11.644 1.00 0.00 O ATOM 1292 CB ILE A 79 -1.844 0.010 -11.834 1.00 0.00 C ATOM 1293 CG1 ILE A 79 -2.316 -1.386 -12.245 1.00 0.00 C ATOM 1294 CG2 ILE A 79 -3.029 0.978 -11.871 1.00 0.00 C ATOM 1295 CD1 ILE A 79 -3.299 -1.921 -11.202 1.00 0.00 C ATOM 0 H ILE A 79 0.627 -0.621 -11.624 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.104 0.342 -13.830 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.435 -0.025 -10.824 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -2.794 -1.346 -13.224 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.463 -2.058 -12.334 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.799 0.637 -11.179 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.695 1.974 -11.580 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.439 1.013 -12.880 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.635 -2.916 -11.495 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.806 -1.976 -10.232 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.158 -1.253 -11.135 1.00 0.00 H new ATOM 1307 N ILE A 80 -1.027 2.827 -13.388 1.00 0.00 N ATOM 1308 CA ILE A 80 -0.795 4.290 -13.208 1.00 0.00 C ATOM 1309 C ILE A 80 -2.080 4.947 -12.702 1.00 0.00 C ATOM 1310 O ILE A 80 -3.141 4.356 -12.723 1.00 0.00 O ATOM 1311 CB ILE A 80 -0.385 4.932 -14.542 1.00 0.00 C ATOM 1312 CG1 ILE A 80 -0.728 3.998 -15.708 1.00 0.00 C ATOM 1313 CG2 ILE A 80 1.121 5.198 -14.536 1.00 0.00 C ATOM 1314 CD1 ILE A 80 -0.187 4.587 -17.013 1.00 0.00 C ATOM 0 H ILE A 80 -1.622 2.576 -14.177 1.00 0.00 H new ATOM 0 HA ILE A 80 0.007 4.436 -12.484 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.928 5.869 -14.665 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.297 3.012 -15.536 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.808 3.867 -15.777 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.414 5.654 -15.482 1.00 0.00 H new ATOM 0 HG22 ILE A 80 1.368 5.873 -13.716 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.656 4.257 -14.405 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.432 3.922 -17.841 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.639 5.564 -17.186 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.895 4.695 -16.942 1.00 0.00 H new ATOM 1326 N MET A 81 -1.995 6.167 -12.243 1.00 0.00 N ATOM 1327 CA MET A 81 -3.214 6.856 -11.732 1.00 0.00 C ATOM 1328 C MET A 81 -3.121 8.354 -12.033 1.00 0.00 C ATOM 1329 O MET A 81 -2.538 9.112 -11.284 1.00 0.00 O ATOM 1330 CB MET A 81 -3.328 6.648 -10.220 1.00 0.00 C ATOM 1331 CG MET A 81 -2.712 5.301 -9.834 1.00 0.00 C ATOM 1332 SD MET A 81 -2.566 5.199 -8.032 1.00 0.00 S ATOM 1333 CE MET A 81 -0.939 5.979 -7.891 1.00 0.00 C ATOM 0 H MET A 81 -1.136 6.715 -12.200 1.00 0.00 H new ATOM 0 HA MET A 81 -4.094 6.440 -12.223 1.00 0.00 H new ATOM 0 HB2 MET A 81 -2.819 7.455 -9.693 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.375 6.680 -9.917 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.332 4.485 -10.206 1.00 0.00 H new ATOM 0 HG3 MET A 81 -1.731 5.192 -10.296 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.245 5.288 -7.413 1.00 0.00 H new ATOM 0 HE2 MET A 81 -0.571 6.234 -8.885 1.00 0.00 H new ATOM 0 HE3 MET A 81 -1.021 6.885 -7.290 1.00 0.00 H new ATOM 1343 N THR A 82 -3.696 8.788 -13.122 1.00 0.00 N ATOM 1344 CA THR A 82 -3.644 10.236 -13.468 1.00 0.00 C ATOM 1345 C THR A 82 -4.343 10.462 -14.811 1.00 0.00 C ATOM 1346 O THR A 82 -3.912 11.258 -15.620 1.00 0.00 O ATOM 1347 CB THR A 82 -2.185 10.691 -13.568 1.00 0.00 C ATOM 1348 OG1 THR A 82 -2.144 12.095 -13.784 1.00 0.00 O ATOM 1349 CG2 THR A 82 -1.499 9.974 -14.731 1.00 0.00 C ATOM 0 H THR A 82 -4.200 8.201 -13.787 1.00 0.00 H new ATOM 0 HA THR A 82 -4.148 10.812 -12.692 1.00 0.00 H new ATOM 0 HB THR A 82 -1.665 10.448 -12.641 1.00 0.00 H new ATOM 0 HG1 THR A 82 -2.664 12.318 -14.584 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.461 10.301 -14.799 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.530 8.897 -14.564 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.016 10.212 -15.661 1.00 0.00 H new ATOM 1357 N ALA A 83 -5.420 9.766 -15.051 1.00 0.00 N ATOM 1358 CA ALA A 83 -6.146 9.939 -16.339 1.00 0.00 C ATOM 1359 C ALA A 83 -7.200 11.038 -16.187 1.00 0.00 C ATOM 1360 O ALA A 83 -8.329 10.892 -16.610 1.00 0.00 O ATOM 1361 CB ALA A 83 -6.832 8.625 -16.716 1.00 0.00 C ATOM 0 H ALA A 83 -5.828 9.085 -14.410 1.00 0.00 H new ATOM 0 HA ALA A 83 -5.439 10.219 -17.120 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -7.364 8.750 -17.659 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -6.082 7.841 -16.823 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -7.539 8.346 -15.935 1.00 0.00 H new ATOM 1458 N ILE A 90 0.867 8.106 -20.734 1.00 0.00 N ATOM 1459 CA ILE A 90 -0.102 7.006 -20.462 1.00 0.00 C ATOM 1460 C ILE A 90 -0.338 6.214 -21.751 1.00 0.00 C ATOM 1461 O ILE A 90 -0.451 5.005 -21.737 1.00 0.00 O ATOM 1462 CB ILE A 90 -1.426 7.600 -19.959 1.00 0.00 C ATOM 1463 CG1 ILE A 90 -2.558 6.582 -20.132 1.00 0.00 C ATOM 1464 CG2 ILE A 90 -1.764 8.866 -20.748 1.00 0.00 C ATOM 1465 CD1 ILE A 90 -3.887 7.223 -19.726 1.00 0.00 C ATOM 0 HA ILE A 90 0.300 6.340 -19.698 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.318 7.847 -18.903 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -2.605 6.247 -21.168 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.365 5.700 -19.521 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -2.704 9.281 -20.385 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -0.969 9.600 -20.616 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -1.860 8.621 -21.806 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -4.693 6.499 -19.849 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -3.836 7.536 -18.683 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -4.080 8.091 -20.356 1.00 0.00 H new ATOM 1477 N GLN A 91 -0.413 6.888 -22.864 1.00 0.00 N ATOM 1478 CA GLN A 91 -0.641 6.175 -24.153 1.00 0.00 C ATOM 1479 C GLN A 91 0.514 5.204 -24.408 1.00 0.00 C ATOM 1480 O GLN A 91 0.307 4.044 -24.709 1.00 0.00 O ATOM 1481 CB GLN A 91 -0.714 7.192 -25.294 1.00 0.00 C ATOM 1482 CG GLN A 91 -1.304 6.522 -26.537 1.00 0.00 C ATOM 1483 CD GLN A 91 -2.831 6.565 -26.465 1.00 0.00 C ATOM 1484 OE1 GLN A 91 -3.394 7.372 -25.753 1.00 0.00 O ATOM 1485 NE2 GLN A 91 -3.530 5.725 -27.178 1.00 0.00 N ATOM 0 H GLN A 91 -0.326 7.902 -22.938 1.00 0.00 H new ATOM 0 HA GLN A 91 -1.578 5.621 -24.101 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -1.329 8.042 -24.999 1.00 0.00 H new ATOM 0 HB3 GLN A 91 0.281 7.580 -25.514 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -0.958 7.031 -27.436 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -0.962 5.489 -26.603 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -3.057 5.047 -27.776 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -4.549 5.746 -27.137 1.00 0.00 H new ATOM 1494 N GLU A 92 1.728 5.666 -24.288 1.00 0.00 N ATOM 1495 CA GLU A 92 2.895 4.768 -24.522 1.00 0.00 C ATOM 1496 C GLU A 92 3.097 3.873 -23.299 1.00 0.00 C ATOM 1497 O GLU A 92 3.691 2.816 -23.383 1.00 0.00 O ATOM 1498 CB GLU A 92 4.150 5.612 -24.751 1.00 0.00 C ATOM 1499 CG GLU A 92 4.609 5.462 -26.203 1.00 0.00 C ATOM 1500 CD GLU A 92 4.925 6.841 -26.784 1.00 0.00 C ATOM 1501 OE1 GLU A 92 4.046 7.688 -26.758 1.00 0.00 O ATOM 1502 OE2 GLU A 92 6.038 7.028 -27.245 1.00 0.00 O ATOM 0 H GLU A 92 1.963 6.627 -24.038 1.00 0.00 H new ATOM 0 HA GLU A 92 2.710 4.149 -25.400 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.942 6.659 -24.531 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.943 5.295 -24.073 1.00 0.00 H new ATOM 0 HG2 GLU A 92 5.491 4.824 -26.252 1.00 0.00 H new ATOM 0 HG3 GLU A 92 3.831 4.977 -26.793 1.00 0.00 H new ATOM 1509 N SER A 93 2.607 4.286 -22.162 1.00 0.00 N ATOM 1510 CA SER A 93 2.771 3.458 -20.935 1.00 0.00 C ATOM 1511 C SER A 93 2.113 2.094 -21.152 1.00 0.00 C ATOM 1512 O SER A 93 2.778 1.083 -21.243 1.00 0.00 O ATOM 1513 CB SER A 93 2.107 4.163 -19.753 1.00 0.00 C ATOM 1514 OG SER A 93 3.112 4.650 -18.871 1.00 0.00 O ATOM 0 H SER A 93 2.100 5.161 -22.030 1.00 0.00 H new ATOM 0 HA SER A 93 3.832 3.321 -20.726 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.488 4.987 -20.107 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.448 3.473 -19.226 1.00 0.00 H new ATOM 0 HG SER A 93 2.689 5.104 -18.112 1.00 0.00 H new ATOM 1520 N LYS A 94 0.810 2.060 -21.238 1.00 0.00 N ATOM 1521 CA LYS A 94 0.112 0.760 -21.453 1.00 0.00 C ATOM 1522 C LYS A 94 0.852 -0.040 -22.526 1.00 0.00 C ATOM 1523 O LYS A 94 1.224 -1.178 -22.320 1.00 0.00 O ATOM 1524 CB LYS A 94 -1.324 1.023 -21.910 1.00 0.00 C ATOM 1525 CG LYS A 94 -1.943 -0.277 -22.428 1.00 0.00 C ATOM 1526 CD LYS A 94 -1.892 -1.341 -21.331 1.00 0.00 C ATOM 1527 CE LYS A 94 -2.252 -2.706 -21.924 1.00 0.00 C ATOM 1528 NZ LYS A 94 -2.815 -3.579 -20.857 1.00 0.00 N ATOM 0 H LYS A 94 0.200 2.875 -21.169 1.00 0.00 H new ATOM 0 HA LYS A 94 0.098 0.194 -20.522 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.914 1.414 -21.081 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.334 1.780 -22.694 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.975 -0.104 -22.733 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.403 -0.623 -23.310 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -0.896 -1.376 -20.890 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.586 -1.086 -20.530 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -2.977 -2.585 -22.729 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.367 -3.170 -22.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.059 -4.506 -21.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.110 -3.704 -20.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.670 -3.137 -20.462 1.00 0.00 H new ATOM 1542 N GLU A 95 1.070 0.549 -23.669 1.00 0.00 N ATOM 1543 CA GLU A 95 1.787 -0.172 -24.759 1.00 0.00 C ATOM 1544 C GLU A 95 2.989 -0.917 -24.173 1.00 0.00 C ATOM 1545 O GLU A 95 3.170 -2.097 -24.397 1.00 0.00 O ATOM 1546 CB GLU A 95 2.267 0.839 -25.803 1.00 0.00 C ATOM 1547 CG GLU A 95 3.270 0.170 -26.745 1.00 0.00 C ATOM 1548 CD GLU A 95 2.556 -0.899 -27.575 1.00 0.00 C ATOM 1549 OE1 GLU A 95 1.340 -0.845 -27.655 1.00 0.00 O ATOM 1550 OE2 GLU A 95 3.238 -1.754 -28.117 1.00 0.00 O ATOM 0 H GLU A 95 0.782 1.501 -23.896 1.00 0.00 H new ATOM 0 HA GLU A 95 1.114 -0.888 -25.230 1.00 0.00 H new ATOM 0 HB2 GLU A 95 1.419 1.220 -26.371 1.00 0.00 H new ATOM 0 HB3 GLU A 95 2.731 1.693 -25.310 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.721 0.914 -27.401 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.080 -0.281 -26.171 1.00 0.00 H new ATOM 1557 N LEU A 96 3.814 -0.235 -23.426 1.00 0.00 N ATOM 1558 CA LEU A 96 5.004 -0.904 -22.827 1.00 0.00 C ATOM 1559 C LEU A 96 4.547 -2.078 -21.957 1.00 0.00 C ATOM 1560 O LEU A 96 5.028 -3.185 -22.089 1.00 0.00 O ATOM 1561 CB LEU A 96 5.774 0.100 -21.967 1.00 0.00 C ATOM 1562 CG LEU A 96 6.203 1.288 -22.830 1.00 0.00 C ATOM 1563 CD1 LEU A 96 6.553 2.473 -21.929 1.00 0.00 C ATOM 1564 CD2 LEU A 96 7.429 0.898 -23.658 1.00 0.00 C ATOM 0 H LEU A 96 3.716 0.756 -23.205 1.00 0.00 H new ATOM 0 HA LEU A 96 5.652 -1.273 -23.622 1.00 0.00 H new ATOM 0 HB2 LEU A 96 5.149 0.443 -21.142 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.649 -0.378 -21.527 1.00 0.00 H new ATOM 0 HG LEU A 96 5.387 1.567 -23.496 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.859 3.320 -22.544 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.681 2.750 -21.337 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.370 2.195 -21.263 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.736 1.743 -24.274 1.00 0.00 H new ATOM 0 HD22 LEU A 96 8.245 0.619 -22.991 1.00 0.00 H new ATOM 0 HD23 LEU A 96 7.181 0.053 -24.300 1.00 0.00 H new ATOM 1576 N GLY A 97 3.621 -1.843 -21.068 1.00 0.00 N ATOM 1577 CA GLY A 97 3.133 -2.942 -20.189 1.00 0.00 C ATOM 1578 C GLY A 97 2.388 -2.347 -18.993 1.00 0.00 C ATOM 1579 O GLY A 97 2.529 -2.800 -17.874 1.00 0.00 O ATOM 0 H GLY A 97 3.181 -0.936 -20.913 1.00 0.00 H new ATOM 0 HA2 GLY A 97 2.473 -3.604 -20.749 1.00 0.00 H new ATOM 0 HA3 GLY A 97 3.972 -3.546 -19.844 1.00 0.00 H new ATOM 1583 N ALA A 98 1.595 -1.335 -19.220 1.00 0.00 N ATOM 1584 CA ALA A 98 0.842 -0.712 -18.094 1.00 0.00 C ATOM 1585 C ALA A 98 -0.545 -1.351 -17.996 1.00 0.00 C ATOM 1586 O ALA A 98 -1.410 -1.109 -18.814 1.00 0.00 O ATOM 1587 CB ALA A 98 0.696 0.790 -18.347 1.00 0.00 C ATOM 0 H ALA A 98 1.436 -0.913 -20.135 1.00 0.00 H new ATOM 0 HA ALA A 98 1.383 -0.871 -17.161 1.00 0.00 H new ATOM 0 HB1 ALA A 98 0.146 1.246 -17.524 1.00 0.00 H new ATOM 0 HB2 ALA A 98 1.684 1.245 -18.419 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.154 0.951 -19.279 1.00 0.00 H new ATOM 1593 N LEU A 99 -0.764 -2.165 -16.999 1.00 0.00 N ATOM 1594 CA LEU A 99 -2.095 -2.818 -16.849 1.00 0.00 C ATOM 1595 C LEU A 99 -3.200 -1.788 -17.092 1.00 0.00 C ATOM 1596 O LEU A 99 -3.683 -1.630 -18.196 1.00 0.00 O ATOM 1597 CB LEU A 99 -2.229 -3.388 -15.436 1.00 0.00 C ATOM 1598 CG LEU A 99 -1.364 -4.643 -15.305 1.00 0.00 C ATOM 1599 CD1 LEU A 99 -1.646 -5.320 -13.963 1.00 0.00 C ATOM 1600 CD2 LEU A 99 -1.697 -5.611 -16.442 1.00 0.00 C ATOM 0 H LEU A 99 -0.079 -2.406 -16.283 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.186 -3.626 -17.575 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -1.921 -2.643 -14.702 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.271 -3.629 -15.227 1.00 0.00 H new ATOM 0 HG LEU A 99 -0.311 -4.365 -15.358 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.030 -6.214 -13.870 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -1.411 -4.631 -13.152 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.699 -5.598 -13.910 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.081 -6.506 -16.350 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.750 -5.888 -16.388 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.497 -5.130 -17.400 1.00 0.00 H new ATOM 1612 N THR A 100 -3.604 -1.085 -16.070 1.00 0.00 N ATOM 1613 CA THR A 100 -4.677 -0.066 -16.243 1.00 0.00 C ATOM 1614 C THR A 100 -4.207 1.273 -15.672 1.00 0.00 C ATOM 1615 O THR A 100 -3.284 1.333 -14.885 1.00 0.00 O ATOM 1616 CB THR A 100 -5.938 -0.521 -15.504 1.00 0.00 C ATOM 1617 OG1 THR A 100 -6.913 0.510 -15.555 1.00 0.00 O ATOM 1618 CG2 THR A 100 -5.594 -0.829 -14.046 1.00 0.00 C ATOM 0 H THR A 100 -3.237 -1.172 -15.122 1.00 0.00 H new ATOM 0 HA THR A 100 -4.899 0.049 -17.304 1.00 0.00 H new ATOM 0 HB THR A 100 -6.333 -1.419 -15.979 1.00 0.00 H new ATOM 0 HG1 THR A 100 -7.248 0.688 -14.651 1.00 0.00 H new ATOM 0 HG21 THR A 100 -6.493 -1.153 -13.521 1.00 0.00 H new ATOM 0 HG22 THR A 100 -4.846 -1.621 -14.008 1.00 0.00 H new ATOM 0 HG23 THR A 100 -5.198 0.067 -13.569 1.00 0.00 H new ATOM 1626 N HIS A 101 -4.834 2.349 -16.064 1.00 0.00 N ATOM 1627 CA HIS A 101 -4.422 3.682 -15.543 1.00 0.00 C ATOM 1628 C HIS A 101 -5.631 4.387 -14.925 1.00 0.00 C ATOM 1629 O HIS A 101 -6.404 5.028 -15.609 1.00 0.00 O ATOM 1630 CB HIS A 101 -3.869 4.529 -16.691 1.00 0.00 C ATOM 1631 CG HIS A 101 -3.180 5.743 -16.129 1.00 0.00 C ATOM 1632 ND1 HIS A 101 -2.261 6.477 -16.861 1.00 0.00 N ATOM 1633 CD2 HIS A 101 -3.266 6.361 -14.907 1.00 0.00 C ATOM 1634 CE1 HIS A 101 -1.834 7.486 -16.081 1.00 0.00 C ATOM 1635 NE2 HIS A 101 -2.415 7.462 -14.878 1.00 0.00 N ATOM 0 H HIS A 101 -5.613 2.362 -16.722 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.652 3.552 -14.783 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -3.169 3.943 -17.286 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.677 4.831 -17.357 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -1.962 6.287 -17.818 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -3.898 6.042 -14.092 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -1.110 8.225 -16.389 1.00 0.00 H new ATOM 1643 N PHE A 102 -5.800 4.274 -13.636 1.00 0.00 N ATOM 1644 CA PHE A 102 -6.959 4.938 -12.975 1.00 0.00 C ATOM 1645 C PHE A 102 -6.759 6.455 -13.001 1.00 0.00 C ATOM 1646 O PHE A 102 -5.888 6.964 -13.678 1.00 0.00 O ATOM 1647 CB PHE A 102 -7.059 4.461 -11.524 1.00 0.00 C ATOM 1648 CG PHE A 102 -7.722 3.105 -11.483 1.00 0.00 C ATOM 1649 CD1 PHE A 102 -7.067 1.989 -12.016 1.00 0.00 C ATOM 1650 CD2 PHE A 102 -8.992 2.964 -10.912 1.00 0.00 C ATOM 1651 CE1 PHE A 102 -7.681 0.732 -11.978 1.00 0.00 C ATOM 1652 CE2 PHE A 102 -9.608 1.707 -10.874 1.00 0.00 C ATOM 1653 CZ PHE A 102 -8.952 0.591 -11.407 1.00 0.00 C ATOM 0 H PHE A 102 -5.186 3.751 -13.012 1.00 0.00 H new ATOM 0 HA PHE A 102 -7.876 4.683 -13.505 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -6.065 4.405 -11.079 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -7.633 5.176 -10.934 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -6.087 2.098 -12.457 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -9.497 3.825 -10.500 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -7.175 -0.129 -12.389 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -10.588 1.599 -10.434 1.00 0.00 H new ATOM 0 HZ PHE A 102 -9.426 -0.379 -11.378 1.00 0.00 H new ATOM 1663 N ALA A 103 -7.557 7.182 -12.268 1.00 0.00 N ATOM 1664 CA ALA A 103 -7.413 8.664 -12.250 1.00 0.00 C ATOM 1665 C ALA A 103 -8.144 9.231 -11.031 1.00 0.00 C ATOM 1666 O ALA A 103 -8.506 8.511 -10.123 1.00 0.00 O ATOM 1667 CB ALA A 103 -8.016 9.254 -13.527 1.00 0.00 C ATOM 0 H ALA A 103 -8.304 6.812 -11.680 1.00 0.00 H new ATOM 0 HA ALA A 103 -6.356 8.925 -12.196 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.910 10.339 -13.512 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -7.495 8.850 -14.395 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.073 8.994 -13.584 1.00 0.00 H new ATOM 1673 N LYS A 104 -8.365 10.517 -11.004 1.00 0.00 N ATOM 1674 CA LYS A 104 -9.073 11.126 -9.843 1.00 0.00 C ATOM 1675 C LYS A 104 -10.225 12.000 -10.349 1.00 0.00 C ATOM 1676 O LYS A 104 -10.118 12.622 -11.388 1.00 0.00 O ATOM 1677 CB LYS A 104 -8.094 11.984 -9.040 1.00 0.00 C ATOM 1678 CG LYS A 104 -7.751 11.278 -7.727 1.00 0.00 C ATOM 1679 CD LYS A 104 -6.679 12.075 -6.983 1.00 0.00 C ATOM 1680 CE LYS A 104 -7.126 13.533 -6.850 1.00 0.00 C ATOM 1681 NZ LYS A 104 -6.100 14.300 -6.089 1.00 0.00 N ATOM 0 H LYS A 104 -8.086 11.171 -11.735 1.00 0.00 H new ATOM 0 HA LYS A 104 -9.470 10.337 -9.205 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -7.187 12.157 -9.619 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.533 12.960 -8.836 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.644 11.184 -7.109 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -7.394 10.268 -7.928 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -6.510 11.644 -5.996 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -5.732 12.021 -7.521 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -7.266 13.973 -7.837 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -8.087 13.585 -6.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -6.403 15.291 -5.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.987 13.885 -5.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.192 14.261 -6.594 1.00 0.00 H new ATOM 1695 N PRO A 105 -11.296 12.021 -9.595 1.00 0.00 N ATOM 1696 CA PRO A 105 -11.415 11.262 -8.336 1.00 0.00 C ATOM 1697 C PRO A 105 -11.700 9.786 -8.628 1.00 0.00 C ATOM 1698 O PRO A 105 -12.286 9.444 -9.636 1.00 0.00 O ATOM 1699 CB PRO A 105 -12.603 11.919 -7.632 1.00 0.00 C ATOM 1700 CG PRO A 105 -13.437 12.611 -8.737 1.00 0.00 C ATOM 1701 CD PRO A 105 -12.494 12.812 -9.939 1.00 0.00 C ATOM 0 HA PRO A 105 -10.506 11.282 -7.735 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -13.200 11.176 -7.102 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -12.264 12.643 -6.891 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -14.295 11.999 -9.016 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -13.827 13.566 -8.387 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -12.950 12.462 -10.865 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -12.249 13.865 -10.081 1.00 0.00 H new ATOM 1709 N PHE A 106 -11.290 8.908 -7.754 1.00 0.00 N ATOM 1710 CA PHE A 106 -11.538 7.456 -7.983 1.00 0.00 C ATOM 1711 C PHE A 106 -12.077 6.822 -6.700 1.00 0.00 C ATOM 1712 O PHE A 106 -12.067 7.425 -5.646 1.00 0.00 O ATOM 1713 CB PHE A 106 -10.230 6.769 -8.381 1.00 0.00 C ATOM 1714 CG PHE A 106 -9.173 7.056 -7.342 1.00 0.00 C ATOM 1715 CD1 PHE A 106 -8.653 8.348 -7.208 1.00 0.00 C ATOM 1716 CD2 PHE A 106 -8.711 6.027 -6.511 1.00 0.00 C ATOM 1717 CE1 PHE A 106 -7.673 8.613 -6.245 1.00 0.00 C ATOM 1718 CE2 PHE A 106 -7.731 6.291 -5.548 1.00 0.00 C ATOM 1719 CZ PHE A 106 -7.212 7.585 -5.415 1.00 0.00 C ATOM 0 H PHE A 106 -10.794 9.133 -6.891 1.00 0.00 H new ATOM 0 HA PHE A 106 -12.268 7.335 -8.783 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -10.384 5.694 -8.470 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -9.902 7.126 -9.357 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -9.008 9.142 -7.849 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -9.112 5.029 -6.614 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -7.272 9.611 -6.142 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -7.375 5.498 -4.908 1.00 0.00 H new ATOM 0 HZ PHE A 106 -6.456 7.790 -4.672 1.00 0.00 H new ATOM 1729 N ASP A 107 -12.549 5.607 -6.780 1.00 0.00 N ATOM 1730 CA ASP A 107 -13.088 4.936 -5.565 1.00 0.00 C ATOM 1731 C ASP A 107 -12.065 3.924 -5.044 1.00 0.00 C ATOM 1732 O ASP A 107 -11.734 2.963 -5.709 1.00 0.00 O ATOM 1733 CB ASP A 107 -14.387 4.209 -5.918 1.00 0.00 C ATOM 1734 CG ASP A 107 -15.122 3.824 -4.633 1.00 0.00 C ATOM 1735 OD1 ASP A 107 -14.773 4.355 -3.592 1.00 0.00 O ATOM 1736 OD2 ASP A 107 -16.022 3.004 -4.712 1.00 0.00 O ATOM 0 H ASP A 107 -12.584 5.051 -7.635 1.00 0.00 H new ATOM 0 HA ASP A 107 -13.285 5.683 -4.796 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -15.019 4.850 -6.533 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -14.169 3.317 -6.506 1.00 0.00 H new ATOM 1741 N ILE A 108 -11.562 4.133 -3.858 1.00 0.00 N ATOM 1742 CA ILE A 108 -10.561 3.182 -3.296 1.00 0.00 C ATOM 1743 C ILE A 108 -11.093 1.753 -3.420 1.00 0.00 C ATOM 1744 O ILE A 108 -10.339 0.809 -3.549 1.00 0.00 O ATOM 1745 CB ILE A 108 -10.318 3.510 -1.822 1.00 0.00 C ATOM 1746 CG1 ILE A 108 -9.518 4.811 -1.716 1.00 0.00 C ATOM 1747 CG2 ILE A 108 -9.530 2.375 -1.168 1.00 0.00 C ATOM 1748 CD1 ILE A 108 -8.274 4.720 -2.603 1.00 0.00 C ATOM 0 H ILE A 108 -11.800 4.920 -3.255 1.00 0.00 H new ATOM 0 HA ILE A 108 -9.624 3.271 -3.846 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.275 3.627 -1.314 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -10.135 5.656 -2.023 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.227 4.988 -0.681 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -9.357 2.610 -0.118 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -10.097 1.447 -1.244 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -8.573 2.257 -1.675 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.705 5.646 -2.527 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -7.654 3.885 -2.276 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.576 4.563 -3.639 1.00 0.00 H new ATOM 1760 N ASP A 109 -12.386 1.585 -3.383 1.00 0.00 N ATOM 1761 CA ASP A 109 -12.964 0.217 -3.499 1.00 0.00 C ATOM 1762 C ASP A 109 -12.681 -0.337 -4.897 1.00 0.00 C ATOM 1763 O ASP A 109 -12.301 -1.480 -5.057 1.00 0.00 O ATOM 1764 CB ASP A 109 -14.476 0.280 -3.272 1.00 0.00 C ATOM 1765 CG ASP A 109 -14.762 0.943 -1.923 1.00 0.00 C ATOM 1766 OD1 ASP A 109 -14.227 0.478 -0.930 1.00 0.00 O ATOM 1767 OD2 ASP A 109 -15.513 1.905 -1.906 1.00 0.00 O ATOM 0 H ASP A 109 -13.068 2.336 -3.277 1.00 0.00 H new ATOM 0 HA ASP A 109 -12.512 -0.434 -2.750 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -14.952 0.844 -4.074 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -14.900 -0.724 -3.293 1.00 0.00 H new ATOM 1772 N GLU A 110 -12.864 0.464 -5.911 1.00 0.00 N ATOM 1773 CA GLU A 110 -12.605 -0.018 -7.297 1.00 0.00 C ATOM 1774 C GLU A 110 -11.118 -0.341 -7.456 1.00 0.00 C ATOM 1775 O GLU A 110 -10.750 -1.376 -7.972 1.00 0.00 O ATOM 1776 CB GLU A 110 -13.000 1.071 -8.298 1.00 0.00 C ATOM 1777 CG GLU A 110 -14.451 0.861 -8.736 1.00 0.00 C ATOM 1778 CD GLU A 110 -15.331 0.649 -7.503 1.00 0.00 C ATOM 1779 OE1 GLU A 110 -15.252 1.461 -6.596 1.00 0.00 O ATOM 1780 OE2 GLU A 110 -16.069 -0.322 -7.486 1.00 0.00 O ATOM 0 H GLU A 110 -13.181 1.431 -5.840 1.00 0.00 H new ATOM 0 HA GLU A 110 -13.194 -0.916 -7.485 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -12.885 2.055 -7.844 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -12.339 1.040 -9.165 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -14.800 1.725 -9.301 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -14.521 -0.002 -9.398 1.00 0.00 H new ATOM 1787 N ILE A 111 -10.261 0.540 -7.016 1.00 0.00 N ATOM 1788 CA ILE A 111 -8.799 0.284 -7.142 1.00 0.00 C ATOM 1789 C ILE A 111 -8.467 -1.088 -6.551 1.00 0.00 C ATOM 1790 O ILE A 111 -8.004 -1.975 -7.239 1.00 0.00 O ATOM 1791 CB ILE A 111 -8.024 1.365 -6.386 1.00 0.00 C ATOM 1792 CG1 ILE A 111 -8.397 2.741 -6.942 1.00 0.00 C ATOM 1793 CG2 ILE A 111 -6.523 1.135 -6.560 1.00 0.00 C ATOM 1794 CD1 ILE A 111 -7.790 2.910 -8.336 1.00 0.00 C ATOM 0 H ILE A 111 -10.511 1.425 -6.575 1.00 0.00 H new ATOM 0 HA ILE A 111 -8.518 0.304 -8.195 1.00 0.00 H new ATOM 0 HB ILE A 111 -8.277 1.319 -5.327 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -9.481 2.843 -6.991 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -8.032 3.524 -6.278 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -5.972 1.906 -6.021 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -6.257 0.155 -6.164 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -6.268 1.180 -7.619 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -8.056 3.890 -8.732 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -6.705 2.826 -8.273 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -8.176 2.134 -8.997 1.00 0.00 H new ATOM 1806 N ARG A 112 -8.701 -1.269 -5.280 1.00 0.00 N ATOM 1807 CA ARG A 112 -8.397 -2.583 -4.647 1.00 0.00 C ATOM 1808 C ARG A 112 -9.059 -3.705 -5.452 1.00 0.00 C ATOM 1809 O ARG A 112 -8.498 -4.768 -5.629 1.00 0.00 O ATOM 1810 CB ARG A 112 -8.938 -2.597 -3.215 1.00 0.00 C ATOM 1811 CG ARG A 112 -10.415 -2.199 -3.223 1.00 0.00 C ATOM 1812 CD ARG A 112 -10.900 -2.004 -1.785 1.00 0.00 C ATOM 1813 NE ARG A 112 -12.129 -2.818 -1.562 1.00 0.00 N ATOM 1814 CZ ARG A 112 -12.529 -3.082 -0.347 1.00 0.00 C ATOM 1815 NH1 ARG A 112 -11.856 -2.635 0.679 1.00 0.00 N ATOM 1816 NH2 ARG A 112 -13.606 -3.795 -0.158 1.00 0.00 N ATOM 0 H ARG A 112 -9.089 -0.564 -4.653 1.00 0.00 H new ATOM 0 HA ARG A 112 -7.318 -2.736 -4.631 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -8.820 -3.590 -2.780 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -8.368 -1.907 -2.593 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -10.551 -1.279 -3.792 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -11.007 -2.970 -3.716 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -10.121 -2.302 -1.083 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -11.110 -0.950 -1.600 1.00 0.00 H new ATOM 0 HE ARG A 112 -12.658 -3.169 -2.360 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -11.014 -2.077 0.533 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -12.172 -2.843 1.626 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -14.133 -4.145 -0.958 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -13.920 -4.003 0.790 1.00 0.00 H new ATOM 1830 N ASP A 113 -10.246 -3.476 -5.941 1.00 0.00 N ATOM 1831 CA ASP A 113 -10.941 -4.530 -6.733 1.00 0.00 C ATOM 1832 C ASP A 113 -10.029 -5.001 -7.867 1.00 0.00 C ATOM 1833 O ASP A 113 -9.629 -6.148 -7.918 1.00 0.00 O ATOM 1834 CB ASP A 113 -12.232 -3.956 -7.323 1.00 0.00 C ATOM 1835 CG ASP A 113 -13.200 -3.608 -6.191 1.00 0.00 C ATOM 1836 OD1 ASP A 113 -12.981 -4.075 -5.086 1.00 0.00 O ATOM 1837 OD2 ASP A 113 -14.145 -2.881 -6.449 1.00 0.00 O ATOM 0 H ASP A 113 -10.765 -2.605 -5.827 1.00 0.00 H new ATOM 0 HA ASP A 113 -11.180 -5.373 -6.085 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -12.011 -3.066 -7.913 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -12.690 -4.680 -7.997 1.00 0.00 H new ATOM 1842 N ALA A 114 -9.696 -4.127 -8.777 1.00 0.00 N ATOM 1843 CA ALA A 114 -8.810 -4.527 -9.906 1.00 0.00 C ATOM 1844 C ALA A 114 -7.549 -5.197 -9.354 1.00 0.00 C ATOM 1845 O ALA A 114 -7.220 -6.311 -9.709 1.00 0.00 O ATOM 1846 CB ALA A 114 -8.418 -3.287 -10.711 1.00 0.00 C ATOM 0 H ALA A 114 -9.999 -3.153 -8.787 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.340 -5.227 -10.552 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -7.770 -3.579 -11.537 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.316 -2.810 -11.105 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -7.889 -2.586 -10.065 1.00 0.00 H new ATOM 1852 N VAL A 115 -6.840 -4.525 -8.489 1.00 0.00 N ATOM 1853 CA VAL A 115 -5.602 -5.123 -7.916 1.00 0.00 C ATOM 1854 C VAL A 115 -5.868 -6.581 -7.537 1.00 0.00 C ATOM 1855 O VAL A 115 -5.006 -7.429 -7.654 1.00 0.00 O ATOM 1856 CB VAL A 115 -5.187 -4.340 -6.669 1.00 0.00 C ATOM 1857 CG1 VAL A 115 -4.095 -5.107 -5.922 1.00 0.00 C ATOM 1858 CG2 VAL A 115 -4.650 -2.968 -7.085 1.00 0.00 C ATOM 0 H VAL A 115 -7.065 -3.588 -8.155 1.00 0.00 H new ATOM 0 HA VAL A 115 -4.802 -5.080 -8.655 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.051 -4.212 -6.017 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -3.800 -4.548 -5.034 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -4.475 -6.085 -5.626 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -3.230 -5.236 -6.573 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -4.354 -2.409 -6.197 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -3.786 -3.098 -7.737 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.427 -2.419 -7.617 1.00 0.00 H new ATOM 1868 N LYS A 116 -7.054 -6.879 -7.084 1.00 0.00 N ATOM 1869 CA LYS A 116 -7.374 -8.283 -6.699 1.00 0.00 C ATOM 1870 C LYS A 116 -7.543 -9.132 -7.961 1.00 0.00 C ATOM 1871 O LYS A 116 -7.077 -10.252 -8.035 1.00 0.00 O ATOM 1872 CB LYS A 116 -8.673 -8.307 -5.890 1.00 0.00 C ATOM 1873 CG LYS A 116 -8.373 -7.951 -4.433 1.00 0.00 C ATOM 1874 CD LYS A 116 -8.797 -9.108 -3.527 1.00 0.00 C ATOM 1875 CE LYS A 116 -9.609 -8.564 -2.350 1.00 0.00 C ATOM 1876 NZ LYS A 116 -11.039 -8.438 -2.748 1.00 0.00 N ATOM 0 H LYS A 116 -7.816 -6.211 -6.964 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.562 -8.688 -6.095 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -9.388 -7.599 -6.309 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -9.131 -9.294 -5.947 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -7.309 -7.749 -4.309 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -8.905 -7.042 -4.153 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -9.391 -9.827 -4.091 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -7.918 -9.639 -3.162 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -9.517 -9.230 -1.492 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -9.219 -7.593 -2.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -11.591 -8.068 -1.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -11.119 -7.786 -3.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -11.407 -9.372 -3.020 1.00 0.00 H new ATOM 1890 N LYS A 117 -8.207 -8.607 -8.955 1.00 0.00 N ATOM 1891 CA LYS A 117 -8.405 -9.385 -10.211 1.00 0.00 C ATOM 1892 C LYS A 117 -7.045 -9.679 -10.848 1.00 0.00 C ATOM 1893 O LYS A 117 -6.902 -10.596 -11.632 1.00 0.00 O ATOM 1894 CB LYS A 117 -9.259 -8.571 -11.185 1.00 0.00 C ATOM 1895 CG LYS A 117 -10.418 -7.920 -10.428 1.00 0.00 C ATOM 1896 CD LYS A 117 -11.741 -8.297 -11.097 1.00 0.00 C ATOM 1897 CE LYS A 117 -12.881 -8.159 -10.087 1.00 0.00 C ATOM 1898 NZ LYS A 117 -14.125 -7.743 -10.796 1.00 0.00 N ATOM 0 H LYS A 117 -8.620 -7.674 -8.952 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.910 -10.324 -9.982 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -8.650 -7.806 -11.667 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.644 -9.216 -11.975 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -10.417 -8.248 -9.389 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -10.298 -6.837 -10.420 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -11.923 -7.652 -11.957 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -11.693 -9.320 -11.470 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -13.042 -9.106 -9.573 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -12.620 -7.424 -9.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.901 -7.649 -10.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -13.967 -6.829 -11.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -14.376 -8.460 -11.506 1.00 0.00 H new ATOM 1912 N TYR A 118 -6.045 -8.909 -10.516 1.00 0.00 N ATOM 1913 CA TYR A 118 -4.696 -9.147 -11.103 1.00 0.00 C ATOM 1914 C TYR A 118 -3.928 -10.142 -10.231 1.00 0.00 C ATOM 1915 O TYR A 118 -3.706 -11.272 -10.615 1.00 0.00 O ATOM 1916 CB TYR A 118 -3.928 -7.825 -11.166 1.00 0.00 C ATOM 1917 CG TYR A 118 -4.566 -6.919 -12.192 1.00 0.00 C ATOM 1918 CD1 TYR A 118 -4.542 -7.271 -13.547 1.00 0.00 C ATOM 1919 CD2 TYR A 118 -5.181 -5.727 -11.789 1.00 0.00 C ATOM 1920 CE1 TYR A 118 -5.133 -6.431 -14.499 1.00 0.00 C ATOM 1921 CE2 TYR A 118 -5.773 -4.888 -12.741 1.00 0.00 C ATOM 1922 CZ TYR A 118 -5.748 -5.241 -14.096 1.00 0.00 C ATOM 1923 OH TYR A 118 -6.331 -4.413 -15.034 1.00 0.00 O ATOM 0 H TYR A 118 -6.104 -8.126 -9.864 1.00 0.00 H new ATOM 0 HA TYR A 118 -4.804 -9.554 -12.109 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.931 -7.343 -10.188 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -2.886 -8.010 -11.427 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -4.068 -8.190 -13.858 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -5.199 -5.455 -10.744 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -5.114 -6.702 -15.544 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -6.249 -3.969 -12.431 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.714 -3.630 -14.586 1.00 0.00 H new ATOM 1933 N LEU A 119 -3.521 -9.730 -9.063 1.00 0.00 N ATOM 1934 CA LEU A 119 -2.768 -10.653 -8.166 1.00 0.00 C ATOM 1935 C LEU A 119 -3.755 -11.411 -7.268 1.00 0.00 C ATOM 1936 O LEU A 119 -4.387 -10.818 -6.416 1.00 0.00 O ATOM 1937 CB LEU A 119 -1.812 -9.839 -7.292 1.00 0.00 C ATOM 1938 CG LEU A 119 -0.827 -10.780 -6.598 1.00 0.00 C ATOM 1939 CD1 LEU A 119 0.118 -11.388 -7.636 1.00 0.00 C ATOM 1940 CD2 LEU A 119 -0.012 -9.997 -5.566 1.00 0.00 C ATOM 0 H LEU A 119 -3.677 -8.794 -8.690 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.202 -11.364 -8.767 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.271 -9.116 -7.902 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -2.374 -9.273 -6.550 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.379 -11.576 -6.098 1.00 0.00 H new ATOM 0 HD11 LEU A 119 0.820 -12.059 -7.140 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.461 -11.947 -8.371 1.00 0.00 H new ATOM 0 HD13 LEU A 119 0.669 -10.592 -8.137 1.00 0.00 H new ATOM 0 HD21 LEU A 119 0.690 -10.668 -5.071 1.00 0.00 H new ATOM 0 HD22 LEU A 119 0.539 -9.200 -6.066 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -0.684 -9.564 -4.825 1.00 0.00 H new ATOM 1952 N PRO A 120 -3.860 -12.701 -7.481 1.00 0.00 N ATOM 1953 CA PRO A 120 -4.766 -13.559 -6.698 1.00 0.00 C ATOM 1954 C PRO A 120 -4.155 -13.870 -5.328 1.00 0.00 C ATOM 1955 O PRO A 120 -3.000 -14.228 -5.220 1.00 0.00 O ATOM 1956 CB PRO A 120 -4.881 -14.829 -7.546 1.00 0.00 C ATOM 1957 CG PRO A 120 -3.627 -14.864 -8.450 1.00 0.00 C ATOM 1958 CD PRO A 120 -3.091 -13.422 -8.517 1.00 0.00 C ATOM 0 HA PRO A 120 -5.733 -13.096 -6.501 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.929 -15.715 -6.914 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.792 -14.815 -8.145 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.874 -15.538 -8.042 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -3.877 -15.231 -9.445 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.020 -13.385 -8.316 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -3.245 -12.985 -9.504 1.00 0.00 H new ATOM 1966 N LEU A 121 -4.923 -13.735 -4.282 1.00 0.00 N ATOM 1967 CA LEU A 121 -4.385 -14.023 -2.922 1.00 0.00 C ATOM 1968 C LEU A 121 -5.407 -14.845 -2.134 1.00 0.00 C ATOM 1969 O LEU A 121 -5.307 -14.989 -0.932 1.00 0.00 O ATOM 1970 CB LEU A 121 -4.117 -12.705 -2.190 1.00 0.00 C ATOM 1971 CG LEU A 121 -3.508 -12.998 -0.819 1.00 0.00 C ATOM 1972 CD1 LEU A 121 -2.124 -12.355 -0.726 1.00 0.00 C ATOM 1973 CD2 LEU A 121 -4.412 -12.419 0.274 1.00 0.00 C ATOM 0 H LEU A 121 -5.898 -13.438 -4.310 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.455 -14.585 -3.010 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.440 -12.083 -2.775 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -5.045 -12.145 -2.075 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.417 -14.076 -0.685 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.690 -12.564 0.252 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.480 -12.765 -1.504 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -2.214 -11.277 -0.860 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.979 -12.627 1.252 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.502 -11.341 0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -5.399 -12.876 0.210 1.00 0.00 H new