USER MOD reduce.3.24.130724 H: found=0, std=0, add=815, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 811 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 24 THR OG1 : rot -83:sc= 0.132 USER MOD Set 1.2: A 39 ASN : amide:sc= -3.5! C(o=-3.4!,f=-3.7!) USER MOD Set 2.1: A 8 GLN : amide:sc= 1.04 K(o=1.4,f=-1.1) USER MOD Set 2.2: A 74 CYS SG : rot 176:sc= 0.357 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 152:sc= -0.337 (180deg=-1.63!) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 30:sc= 0.855 USER MOD Single : A 7 ASN : amide:sc= 0.326 K(o=0.33,f=-5.4!) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 23:sc= 0.409 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ -126:sc= 0.0446 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= -0.151 K(o=-0.15,f=-1.7) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 156:sc= -0.105 (180deg=-0.546) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 HIS : no HD1:sc= -4.98! C(o=-5!,f=-6.6!) USER MOD Single : A 42 ASN : amide:sc= -0.0578 X(o=-0.058,f=-0.4) USER MOD Single : A 46 SER OG : rot 180:sc= -0.075 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ -157:sc= -0.133 (180deg=-0.537) USER MOD Single : A 59 LYS NZ :NH3+ 157:sc=-0.00203 (180deg=-0.476) USER MOD Single : A 63 ASN : amide:sc= -0.544 X(o=-0.54,f=-0.96) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot -120:sc= -0.164 USER MOD Single : A 72 THR OG1 : rot 74:sc= 0.314 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 HIS : no HE2:sc= -1.08 X(o=-1.1,f=-1.1) USER MOD Single : A 78 GLN :FLIP amide:sc= -0.302 F(o=-0.98,f=-0.3) USER MOD Single : A 79 ASN : amide:sc= -0.0124 K(o=-0.012,f=-0.93) USER MOD Single : A 80 MET CE :methyl 160:sc= -4.33 (180deg=-4.42) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot -109:sc= -0.169 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 12.598 19.472 -0.950 1.00 0.00 N ATOM 2 CA GLY A -6 11.554 18.852 -0.158 1.00 0.00 C ATOM 3 C GLY A -6 10.164 19.194 -0.658 1.00 0.00 C ATOM 4 O GLY A -6 9.989 19.564 -1.820 1.00 0.00 O ATOM 0 H1 GLY A -6 13.263 18.743 -1.279 1.00 0.00 H new ATOM 0 H2 GLY A -6 12.174 19.950 -1.770 1.00 0.00 H new ATOM 0 H3 GLY A -6 13.107 20.168 -0.369 1.00 0.00 H new ATOM 0 HA2 GLY A -6 11.686 17.770 -0.173 1.00 0.00 H new ATOM 0 HA3 GLY A -6 11.652 19.171 0.880 1.00 0.00 H new ATOM 8 N SER A -5 9.173 19.069 0.218 1.00 0.00 N ATOM 9 CA SER A -5 7.791 19.363 -0.143 1.00 0.00 C ATOM 10 C SER A -5 7.682 20.736 -0.799 1.00 0.00 C ATOM 11 O SER A -5 7.692 21.763 -0.120 1.00 0.00 O ATOM 12 CB SER A -5 6.894 19.303 1.094 1.00 0.00 C ATOM 13 OG SER A -5 6.935 18.019 1.692 1.00 0.00 O ATOM 0 H SER A -5 9.301 18.766 1.183 1.00 0.00 H new ATOM 0 HA SER A -5 7.460 18.610 -0.858 1.00 0.00 H new ATOM 0 HB2 SER A -5 7.214 20.054 1.816 1.00 0.00 H new ATOM 0 HB3 SER A -5 5.868 19.545 0.815 1.00 0.00 H new ATOM 0 HG SER A -5 6.355 18.007 2.482 1.00 0.00 H new ATOM 19 N SER A -4 7.577 20.747 -2.124 1.00 0.00 N ATOM 20 CA SER A -4 7.469 21.993 -2.873 1.00 0.00 C ATOM 21 C SER A -4 6.280 21.951 -3.829 1.00 0.00 C ATOM 22 O SER A -4 6.179 21.061 -4.672 1.00 0.00 O ATOM 23 CB SER A -4 8.758 22.257 -3.655 1.00 0.00 C ATOM 24 OG SER A -4 8.955 21.275 -4.658 1.00 0.00 O ATOM 0 H SER A -4 7.564 19.906 -2.701 1.00 0.00 H new ATOM 0 HA SER A -4 7.312 22.803 -2.161 1.00 0.00 H new ATOM 0 HB2 SER A -4 8.714 23.245 -4.113 1.00 0.00 H new ATOM 0 HB3 SER A -4 9.608 22.260 -2.972 1.00 0.00 H new ATOM 0 HG SER A -4 8.095 20.867 -4.890 1.00 0.00 H new ATOM 30 N GLY A -3 5.382 22.922 -3.691 1.00 0.00 N ATOM 31 CA GLY A -3 4.213 22.979 -4.547 1.00 0.00 C ATOM 32 C GLY A -3 3.013 23.589 -3.850 1.00 0.00 C ATOM 33 O GLY A -3 3.138 24.153 -2.763 1.00 0.00 O ATOM 0 H GLY A -3 5.444 23.670 -3.001 1.00 0.00 H new ATOM 0 HA2 GLY A -3 4.447 23.562 -5.438 1.00 0.00 H new ATOM 0 HA3 GLY A -3 3.962 21.972 -4.882 1.00 0.00 H new ATOM 37 N SER A -2 1.847 23.479 -4.478 1.00 0.00 N ATOM 38 CA SER A -2 0.620 24.029 -3.915 1.00 0.00 C ATOM 39 C SER A -2 -0.085 22.998 -3.038 1.00 0.00 C ATOM 40 O SER A -2 0.187 21.801 -3.127 1.00 0.00 O ATOM 41 CB SER A -2 -0.318 24.492 -5.031 1.00 0.00 C ATOM 42 OG SER A -2 -1.303 25.381 -4.535 1.00 0.00 O ATOM 0 H SER A -2 1.726 23.014 -5.378 1.00 0.00 H new ATOM 0 HA SER A -2 0.887 24.886 -3.297 1.00 0.00 H new ATOM 0 HB2 SER A -2 0.259 24.984 -5.814 1.00 0.00 H new ATOM 0 HB3 SER A -2 -0.801 23.627 -5.486 1.00 0.00 H new ATOM 0 HG SER A -2 -1.888 25.663 -5.269 1.00 0.00 H new ATOM 48 N SER A -1 -0.993 23.473 -2.192 1.00 0.00 N ATOM 49 CA SER A -1 -1.736 22.594 -1.295 1.00 0.00 C ATOM 50 C SER A -1 -3.162 22.386 -1.797 1.00 0.00 C ATOM 51 O SER A -1 -4.109 22.355 -1.013 1.00 0.00 O ATOM 52 CB SER A -1 -1.761 23.176 0.119 1.00 0.00 C ATOM 53 OG SER A -1 -0.530 22.952 0.785 1.00 0.00 O ATOM 0 H SER A -1 -1.232 24.461 -2.108 1.00 0.00 H new ATOM 0 HA SER A -1 -1.232 21.628 -1.273 1.00 0.00 H new ATOM 0 HB2 SER A -1 -1.963 24.246 0.072 1.00 0.00 H new ATOM 0 HB3 SER A -1 -2.573 22.723 0.688 1.00 0.00 H new ATOM 0 HG SER A -1 -0.571 23.335 1.686 1.00 0.00 H new ATOM 59 N GLY A 0 -3.305 22.243 -3.112 1.00 0.00 N ATOM 60 CA GLY A 0 -4.617 22.040 -3.697 1.00 0.00 C ATOM 61 C GLY A 0 -4.543 21.538 -5.125 1.00 0.00 C ATOM 62 O GLY A 0 -4.225 22.296 -6.041 1.00 0.00 O ATOM 0 H GLY A 0 -2.536 22.264 -3.781 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -5.175 21.325 -3.092 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -5.171 22.978 -3.673 1.00 0.00 H new ATOM 66 N MET A 1 -4.837 20.255 -5.316 1.00 0.00 N ATOM 67 CA MET A 1 -4.802 19.653 -6.644 1.00 0.00 C ATOM 68 C MET A 1 -6.067 18.843 -6.907 1.00 0.00 C ATOM 69 O MET A 1 -6.846 18.574 -5.992 1.00 0.00 O ATOM 70 CB MET A 1 -3.570 18.758 -6.788 1.00 0.00 C ATOM 71 CG MET A 1 -2.263 19.530 -6.871 1.00 0.00 C ATOM 72 SD MET A 1 -0.939 18.575 -7.635 1.00 0.00 S ATOM 73 CE MET A 1 0.064 19.885 -8.335 1.00 0.00 C ATOM 0 H MET A 1 -5.102 19.613 -4.569 1.00 0.00 H new ATOM 0 HA MET A 1 -4.747 20.456 -7.379 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.526 18.076 -5.939 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.678 18.146 -7.684 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.422 20.445 -7.442 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.958 19.829 -5.868 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.925 19.452 -8.843 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.530 20.456 -9.049 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.407 20.546 -7.539 1.00 0.00 H new ATOM 83 N LYS A 2 -6.267 18.457 -8.163 1.00 0.00 N ATOM 84 CA LYS A 2 -7.436 17.677 -8.548 1.00 0.00 C ATOM 85 C LYS A 2 -7.530 16.396 -7.726 1.00 0.00 C ATOM 86 O LYS A 2 -6.614 16.059 -6.976 1.00 0.00 O ATOM 87 CB LYS A 2 -7.381 17.338 -10.038 1.00 0.00 C ATOM 88 CG LYS A 2 -7.419 18.558 -10.942 1.00 0.00 C ATOM 89 CD LYS A 2 -8.843 18.931 -11.317 1.00 0.00 C ATOM 90 CE LYS A 2 -9.450 19.896 -10.309 1.00 0.00 C ATOM 91 NZ LYS A 2 -8.535 21.031 -10.010 1.00 0.00 N ATOM 0 H LYS A 2 -5.633 18.673 -8.932 1.00 0.00 H new ATOM 0 HA LYS A 2 -8.324 18.279 -8.352 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -6.470 16.775 -10.240 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -8.220 16.687 -10.285 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -6.942 19.399 -10.439 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -6.844 18.360 -11.846 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -8.853 19.385 -12.308 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -9.454 18.030 -11.373 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -10.393 20.282 -10.697 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -9.680 19.362 -9.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -9.094 21.864 -9.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -7.900 20.768 -9.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -7.971 21.254 -10.855 1.00 0.00 H new ATOM 105 N THR A 3 -8.642 15.683 -7.876 1.00 0.00 N ATOM 106 CA THR A 3 -8.855 14.438 -7.147 1.00 0.00 C ATOM 107 C THR A 3 -8.459 13.233 -7.993 1.00 0.00 C ATOM 108 O THR A 3 -9.224 12.276 -8.123 1.00 0.00 O ATOM 109 CB THR A 3 -10.325 14.285 -6.713 1.00 0.00 C ATOM 110 OG1 THR A 3 -11.178 14.285 -7.863 1.00 0.00 O ATOM 111 CG2 THR A 3 -10.731 15.411 -5.774 1.00 0.00 C ATOM 0 H THR A 3 -9.409 15.946 -8.495 1.00 0.00 H new ATOM 0 HA THR A 3 -8.225 14.479 -6.259 1.00 0.00 H new ATOM 0 HB THR A 3 -10.429 13.337 -6.185 1.00 0.00 H new ATOM 0 HG1 THR A 3 -12.111 14.186 -7.579 1.00 0.00 H new ATOM 0 HG21 THR A 3 -11.773 15.282 -5.481 1.00 0.00 H new ATOM 0 HG22 THR A 3 -10.099 15.390 -4.886 1.00 0.00 H new ATOM 0 HG23 THR A 3 -10.613 16.368 -6.281 1.00 0.00 H new ATOM 119 N ILE A 4 -7.261 13.284 -8.564 1.00 0.00 N ATOM 120 CA ILE A 4 -6.763 12.196 -9.396 1.00 0.00 C ATOM 121 C ILE A 4 -7.110 10.839 -8.790 1.00 0.00 C ATOM 122 O ILE A 4 -6.893 10.605 -7.600 1.00 0.00 O ATOM 123 CB ILE A 4 -5.238 12.284 -9.588 1.00 0.00 C ATOM 124 CG1 ILE A 4 -4.836 11.682 -10.935 1.00 0.00 C ATOM 125 CG2 ILE A 4 -4.519 11.578 -8.448 1.00 0.00 C ATOM 126 CD1 ILE A 4 -4.524 10.203 -10.866 1.00 0.00 C ATOM 0 H ILE A 4 -6.616 14.068 -8.466 1.00 0.00 H new ATOM 0 HA ILE A 4 -7.248 12.294 -10.367 1.00 0.00 H new ATOM 0 HB ILE A 4 -4.945 13.334 -9.580 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -5.642 11.842 -11.651 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -3.963 12.212 -11.315 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -3.442 11.649 -8.598 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.786 12.050 -7.502 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -4.814 10.529 -8.426 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.247 9.843 -11.857 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -3.697 10.037 -10.175 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -5.403 9.662 -10.516 1.00 0.00 H new ATOM 138 N LEU A 5 -7.647 9.949 -9.616 1.00 0.00 N ATOM 139 CA LEU A 5 -8.022 8.614 -9.163 1.00 0.00 C ATOM 140 C LEU A 5 -7.064 7.562 -9.714 1.00 0.00 C ATOM 141 O LEU A 5 -7.125 7.209 -10.892 1.00 0.00 O ATOM 142 CB LEU A 5 -9.453 8.291 -9.594 1.00 0.00 C ATOM 143 CG LEU A 5 -10.563 8.830 -8.691 1.00 0.00 C ATOM 144 CD1 LEU A 5 -11.876 8.921 -9.454 1.00 0.00 C ATOM 145 CD2 LEU A 5 -10.722 7.953 -7.458 1.00 0.00 C ATOM 0 H LEU A 5 -7.833 10.127 -10.603 1.00 0.00 H new ATOM 0 HA LEU A 5 -7.964 8.598 -8.075 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -9.606 8.684 -10.599 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -9.557 7.208 -9.657 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.284 9.832 -8.366 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.654 9.307 -8.795 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -11.756 9.591 -10.305 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -12.160 7.930 -9.809 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -11.516 8.352 -6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.977 6.938 -7.764 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -9.787 7.939 -6.898 1.00 0.00 H new ATOM 157 N SER A 6 -6.181 7.065 -8.854 1.00 0.00 N ATOM 158 CA SER A 6 -5.208 6.055 -9.255 1.00 0.00 C ATOM 159 C SER A 6 -4.831 5.165 -8.075 1.00 0.00 C ATOM 160 O SER A 6 -4.131 5.595 -7.158 1.00 0.00 O ATOM 161 CB SER A 6 -3.955 6.722 -9.826 1.00 0.00 C ATOM 162 OG SER A 6 -3.316 7.526 -8.851 1.00 0.00 O ATOM 0 H SER A 6 -6.119 7.345 -7.875 1.00 0.00 H new ATOM 0 HA SER A 6 -5.663 5.433 -10.026 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.263 5.959 -10.182 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.225 7.334 -10.686 1.00 0.00 H new ATOM 0 HG SER A 6 -3.486 7.156 -7.960 1.00 0.00 H new ATOM 168 N ASN A 7 -5.301 3.923 -8.105 1.00 0.00 N ATOM 169 CA ASN A 7 -5.014 2.970 -7.038 1.00 0.00 C ATOM 170 C ASN A 7 -4.130 1.835 -7.545 1.00 0.00 C ATOM 171 O ASN A 7 -4.101 1.544 -8.740 1.00 0.00 O ATOM 172 CB ASN A 7 -6.316 2.403 -6.469 1.00 0.00 C ATOM 173 CG ASN A 7 -7.422 2.344 -7.505 1.00 0.00 C ATOM 174 OD1 ASN A 7 -7.163 2.186 -8.698 1.00 0.00 O ATOM 175 ND2 ASN A 7 -8.663 2.472 -7.052 1.00 0.00 N ATOM 0 H ASN A 7 -5.883 3.552 -8.856 1.00 0.00 H new ATOM 0 HA ASN A 7 -4.479 3.497 -6.248 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -6.133 1.402 -6.079 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -6.641 3.018 -5.629 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -9.449 2.441 -7.702 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -8.831 2.601 -6.054 1.00 0.00 H new ATOM 182 N GLN A 8 -3.409 1.199 -6.626 1.00 0.00 N ATOM 183 CA GLN A 8 -2.523 0.096 -6.980 1.00 0.00 C ATOM 184 C GLN A 8 -3.155 -1.245 -6.623 1.00 0.00 C ATOM 185 O GLN A 8 -3.999 -1.329 -5.730 1.00 0.00 O ATOM 186 CB GLN A 8 -1.178 0.245 -6.268 1.00 0.00 C ATOM 187 CG GLN A 8 -0.187 -0.857 -6.602 1.00 0.00 C ATOM 188 CD GLN A 8 1.254 -0.393 -6.517 1.00 0.00 C ATOM 189 OE1 GLN A 8 1.976 -0.742 -5.582 1.00 0.00 O ATOM 190 NE2 GLN A 8 1.680 0.399 -7.494 1.00 0.00 N ATOM 0 H GLN A 8 -3.421 1.429 -5.632 1.00 0.00 H new ATOM 0 HA GLN A 8 -2.360 0.125 -8.057 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -0.741 1.208 -6.533 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -1.346 0.257 -5.191 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.336 -1.693 -5.919 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.387 -1.227 -7.608 1.00 0.00 H new ATOM 0 HE21 GLN A 8 1.047 0.663 -8.249 1.00 0.00 H new ATOM 0 HE22 GLN A 8 2.640 0.743 -7.489 1.00 0.00 H new ATOM 199 N THR A 9 -2.742 -2.295 -7.327 1.00 0.00 N ATOM 200 CA THR A 9 -3.267 -3.632 -7.085 1.00 0.00 C ATOM 201 C THR A 9 -2.153 -4.602 -6.707 1.00 0.00 C ATOM 202 O THR A 9 -1.035 -4.505 -7.213 1.00 0.00 O ATOM 203 CB THR A 9 -4.009 -4.176 -8.321 1.00 0.00 C ATOM 204 OG1 THR A 9 -3.232 -3.944 -9.500 1.00 0.00 O ATOM 205 CG2 THR A 9 -5.373 -3.517 -8.468 1.00 0.00 C ATOM 0 H THR A 9 -2.045 -2.244 -8.070 1.00 0.00 H new ATOM 0 HA THR A 9 -3.969 -3.550 -6.255 1.00 0.00 H new ATOM 0 HB THR A 9 -4.154 -5.248 -8.187 1.00 0.00 H new ATOM 0 HG1 THR A 9 -3.710 -4.294 -10.281 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.878 -3.917 -9.347 1.00 0.00 H new ATOM 0 HG22 THR A 9 -5.973 -3.721 -7.581 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.247 -2.440 -8.581 1.00 0.00 H new ATOM 213 N VAL A 10 -2.465 -5.538 -5.816 1.00 0.00 N ATOM 214 CA VAL A 10 -1.491 -6.526 -5.372 1.00 0.00 C ATOM 215 C VAL A 10 -1.918 -7.935 -5.766 1.00 0.00 C ATOM 216 O VAL A 10 -3.110 -8.240 -5.825 1.00 0.00 O ATOM 217 CB VAL A 10 -1.289 -6.470 -3.846 1.00 0.00 C ATOM 218 CG1 VAL A 10 0.019 -7.141 -3.455 1.00 0.00 C ATOM 219 CG2 VAL A 10 -1.327 -5.031 -3.356 1.00 0.00 C ATOM 0 H VAL A 10 -3.386 -5.632 -5.388 1.00 0.00 H new ATOM 0 HA VAL A 10 -0.549 -6.284 -5.864 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.105 -7.013 -3.369 1.00 0.00 H new ATOM 0 HG11 VAL A 10 0.144 -7.091 -2.373 1.00 0.00 H new ATOM 0 HG12 VAL A 10 0.001 -8.184 -3.771 1.00 0.00 H new ATOM 0 HG13 VAL A 10 0.850 -6.629 -3.940 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.183 -5.011 -2.276 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.533 -4.461 -3.839 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.292 -4.588 -3.601 1.00 0.00 H new ATOM 229 N ASP A 11 -0.939 -8.792 -6.035 1.00 0.00 N ATOM 230 CA ASP A 11 -1.213 -10.171 -6.422 1.00 0.00 C ATOM 231 C ASP A 11 -0.806 -11.137 -5.314 1.00 0.00 C ATOM 232 O ASP A 11 0.207 -10.937 -4.643 1.00 0.00 O ATOM 233 CB ASP A 11 -0.474 -10.517 -7.715 1.00 0.00 C ATOM 234 CG ASP A 11 -0.952 -11.820 -8.324 1.00 0.00 C ATOM 235 OD1 ASP A 11 -2.031 -11.820 -8.952 1.00 0.00 O ATOM 236 OD2 ASP A 11 -0.246 -12.840 -8.174 1.00 0.00 O ATOM 0 H ASP A 11 0.052 -8.556 -5.992 1.00 0.00 H new ATOM 0 HA ASP A 11 -2.286 -10.269 -6.589 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -0.611 -9.711 -8.435 1.00 0.00 H new ATOM 0 HB3 ASP A 11 0.595 -10.585 -7.512 1.00 0.00 H new ATOM 241 N ILE A 12 -1.602 -12.184 -5.128 1.00 0.00 N ATOM 242 CA ILE A 12 -1.325 -13.182 -4.102 1.00 0.00 C ATOM 243 C ILE A 12 -1.305 -14.588 -4.693 1.00 0.00 C ATOM 244 O ILE A 12 -2.139 -14.951 -5.521 1.00 0.00 O ATOM 245 CB ILE A 12 -2.365 -13.128 -2.969 1.00 0.00 C ATOM 246 CG1 ILE A 12 -2.341 -11.757 -2.289 1.00 0.00 C ATOM 247 CG2 ILE A 12 -2.102 -14.232 -1.955 1.00 0.00 C ATOM 248 CD1 ILE A 12 -3.571 -11.476 -1.453 1.00 0.00 C ATOM 0 H ILE A 12 -2.444 -12.364 -5.674 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.342 -12.949 -3.693 1.00 0.00 H new ATOM 0 HB ILE A 12 -3.355 -13.283 -3.398 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -1.457 -11.690 -1.654 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.245 -10.984 -3.051 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.846 -14.181 -1.160 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.165 -15.202 -2.449 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.107 -14.105 -1.529 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -3.486 -10.488 -1.001 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -4.457 -11.510 -2.087 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -3.657 -12.228 -0.668 1.00 0.00 H new ATOM 260 N PRO A 13 -0.331 -15.400 -4.256 1.00 0.00 N ATOM 261 CA PRO A 13 -0.179 -16.780 -4.726 1.00 0.00 C ATOM 262 C PRO A 13 -1.296 -17.689 -4.224 1.00 0.00 C ATOM 263 O PRO A 13 -2.307 -17.216 -3.705 1.00 0.00 O ATOM 264 CB PRO A 13 1.166 -17.210 -4.137 1.00 0.00 C ATOM 265 CG PRO A 13 1.347 -16.348 -2.935 1.00 0.00 C ATOM 266 CD PRO A 13 0.699 -15.033 -3.269 1.00 0.00 C ATOM 0 HA PRO A 13 -0.224 -16.848 -5.813 1.00 0.00 H new ATOM 0 HB2 PRO A 13 1.161 -18.267 -3.869 1.00 0.00 H new ATOM 0 HB3 PRO A 13 1.976 -17.066 -4.853 1.00 0.00 H new ATOM 0 HG2 PRO A 13 0.884 -16.800 -2.057 1.00 0.00 H new ATOM 0 HG3 PRO A 13 2.404 -16.215 -2.705 1.00 0.00 H new ATOM 0 HD2 PRO A 13 0.262 -14.565 -2.387 1.00 0.00 H new ATOM 0 HD3 PRO A 13 1.417 -14.325 -3.682 1.00 0.00 H new ATOM 274 N GLU A 14 -1.107 -18.995 -4.383 1.00 0.00 N ATOM 275 CA GLU A 14 -2.100 -19.969 -3.945 1.00 0.00 C ATOM 276 C GLU A 14 -1.628 -20.701 -2.692 1.00 0.00 C ATOM 277 O GLU A 14 -2.433 -21.258 -1.946 1.00 0.00 O ATOM 278 CB GLU A 14 -2.385 -20.976 -5.061 1.00 0.00 C ATOM 279 CG GLU A 14 -1.156 -21.746 -5.516 1.00 0.00 C ATOM 280 CD GLU A 14 -1.496 -22.891 -6.447 1.00 0.00 C ATOM 281 OE1 GLU A 14 -1.576 -22.658 -7.672 1.00 0.00 O ATOM 282 OE2 GLU A 14 -1.684 -24.023 -5.953 1.00 0.00 O ATOM 0 H GLU A 14 -0.276 -19.403 -4.812 1.00 0.00 H new ATOM 0 HA GLU A 14 -3.018 -19.432 -3.707 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -3.139 -21.683 -4.716 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -2.809 -20.448 -5.915 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -0.471 -21.064 -6.020 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -0.633 -22.136 -4.643 1.00 0.00 H new ATOM 289 N ASN A 15 -0.318 -20.696 -2.469 1.00 0.00 N ATOM 290 CA ASN A 15 0.262 -21.360 -1.307 1.00 0.00 C ATOM 291 C ASN A 15 0.184 -20.466 -0.074 1.00 0.00 C ATOM 292 O ASN A 15 0.615 -20.851 1.013 1.00 0.00 O ATOM 293 CB ASN A 15 1.718 -21.739 -1.585 1.00 0.00 C ATOM 294 CG ASN A 15 2.629 -20.528 -1.649 1.00 0.00 C ATOM 295 OD1 ASN A 15 2.613 -19.777 -2.624 1.00 0.00 O ATOM 296 ND2 ASN A 15 3.429 -20.334 -0.607 1.00 0.00 N ATOM 0 H ASN A 15 0.362 -20.240 -3.077 1.00 0.00 H new ATOM 0 HA ASN A 15 -0.312 -22.266 -1.113 1.00 0.00 H new ATOM 0 HB2 ASN A 15 2.070 -22.414 -0.805 1.00 0.00 H new ATOM 0 HB3 ASN A 15 1.775 -22.283 -2.528 1.00 0.00 H new ATOM 0 HD21 ASN A 15 4.064 -19.536 -0.593 1.00 0.00 H new ATOM 0 HD22 ASN A 15 3.408 -20.983 0.180 1.00 0.00 H new ATOM 303 N VAL A 16 -0.369 -19.270 -0.251 1.00 0.00 N ATOM 304 CA VAL A 16 -0.506 -18.321 0.848 1.00 0.00 C ATOM 305 C VAL A 16 -1.966 -17.942 1.069 1.00 0.00 C ATOM 306 O VAL A 16 -2.755 -17.894 0.125 1.00 0.00 O ATOM 307 CB VAL A 16 0.312 -17.042 0.589 1.00 0.00 C ATOM 308 CG1 VAL A 16 0.247 -16.114 1.793 1.00 0.00 C ATOM 309 CG2 VAL A 16 1.754 -17.389 0.251 1.00 0.00 C ATOM 0 H VAL A 16 -0.729 -18.935 -1.145 1.00 0.00 H new ATOM 0 HA VAL A 16 -0.123 -18.814 1.742 1.00 0.00 H new ATOM 0 HB VAL A 16 -0.122 -16.522 -0.265 1.00 0.00 H new ATOM 0 HG11 VAL A 16 0.831 -15.216 1.592 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -0.790 -15.838 1.984 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.654 -16.623 2.667 1.00 0.00 H new ATOM 0 HG21 VAL A 16 2.316 -16.473 0.071 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.202 -17.932 1.083 1.00 0.00 H new ATOM 0 HG23 VAL A 16 1.778 -18.011 -0.644 1.00 0.00 H new ATOM 319 N ASP A 17 -2.318 -17.675 2.322 1.00 0.00 N ATOM 320 CA ASP A 17 -3.684 -17.298 2.668 1.00 0.00 C ATOM 321 C ASP A 17 -3.709 -15.968 3.414 1.00 0.00 C ATOM 322 O ASP A 17 -3.041 -15.808 4.436 1.00 0.00 O ATOM 323 CB ASP A 17 -4.336 -18.388 3.519 1.00 0.00 C ATOM 324 CG ASP A 17 -5.000 -19.460 2.678 1.00 0.00 C ATOM 325 OD1 ASP A 17 -5.611 -19.112 1.646 1.00 0.00 O ATOM 326 OD2 ASP A 17 -4.910 -20.649 3.052 1.00 0.00 O ATOM 0 H ASP A 17 -1.677 -17.713 3.115 1.00 0.00 H new ATOM 0 HA ASP A 17 -4.249 -17.184 1.743 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -3.581 -18.847 4.157 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.078 -17.936 4.177 1.00 0.00 H new ATOM 331 N ILE A 18 -4.483 -15.020 2.898 1.00 0.00 N ATOM 332 CA ILE A 18 -4.594 -13.704 3.516 1.00 0.00 C ATOM 333 C ILE A 18 -6.043 -13.381 3.863 1.00 0.00 C ATOM 334 O ILE A 18 -6.950 -13.604 3.061 1.00 0.00 O ATOM 335 CB ILE A 18 -4.040 -12.601 2.596 1.00 0.00 C ATOM 336 CG1 ILE A 18 -2.561 -12.853 2.294 1.00 0.00 C ATOM 337 CG2 ILE A 18 -4.228 -11.233 3.235 1.00 0.00 C ATOM 338 CD1 ILE A 18 -2.334 -13.789 1.128 1.00 0.00 C ATOM 0 H ILE A 18 -5.043 -15.138 2.054 1.00 0.00 H new ATOM 0 HA ILE A 18 -4.001 -13.734 4.430 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.593 -12.622 1.657 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -2.074 -11.901 2.085 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.083 -13.268 3.181 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.831 -10.464 2.572 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.290 -11.053 3.404 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -3.698 -11.200 4.187 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -1.264 -13.922 0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -2.792 -14.755 1.342 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -2.783 -13.366 0.229 1.00 0.00 H new ATOM 350 N THR A 19 -6.254 -12.852 5.065 1.00 0.00 N ATOM 351 CA THR A 19 -7.593 -12.496 5.519 1.00 0.00 C ATOM 352 C THR A 19 -7.709 -10.997 5.766 1.00 0.00 C ATOM 353 O THR A 19 -6.887 -10.407 6.470 1.00 0.00 O ATOM 354 CB THR A 19 -7.966 -13.248 6.809 1.00 0.00 C ATOM 355 OG1 THR A 19 -7.824 -14.660 6.613 1.00 0.00 O ATOM 356 CG2 THR A 19 -9.394 -12.931 7.226 1.00 0.00 C ATOM 0 H THR A 19 -5.515 -12.661 5.741 1.00 0.00 H new ATOM 0 HA THR A 19 -8.283 -12.785 4.726 1.00 0.00 H new ATOM 0 HB THR A 19 -7.291 -12.922 7.601 1.00 0.00 H new ATOM 0 HG1 THR A 19 -8.062 -15.130 7.439 1.00 0.00 H new ATOM 0 HG21 THR A 19 -9.635 -13.474 8.140 1.00 0.00 H new ATOM 0 HG22 THR A 19 -9.492 -11.860 7.403 1.00 0.00 H new ATOM 0 HG23 THR A 19 -10.080 -13.232 6.434 1.00 0.00 H new ATOM 364 N LEU A 20 -8.734 -10.383 5.184 1.00 0.00 N ATOM 365 CA LEU A 20 -8.959 -8.951 5.342 1.00 0.00 C ATOM 366 C LEU A 20 -10.107 -8.684 6.310 1.00 0.00 C ATOM 367 O LEU A 20 -11.236 -9.119 6.086 1.00 0.00 O ATOM 368 CB LEU A 20 -9.260 -8.309 3.987 1.00 0.00 C ATOM 369 CG LEU A 20 -8.181 -8.470 2.914 1.00 0.00 C ATOM 370 CD1 LEU A 20 -8.714 -8.043 1.555 1.00 0.00 C ATOM 371 CD2 LEU A 20 -6.941 -7.669 3.280 1.00 0.00 C ATOM 0 H LEU A 20 -9.422 -10.855 4.598 1.00 0.00 H new ATOM 0 HA LEU A 20 -8.051 -8.509 5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.190 -8.731 3.606 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -9.434 -7.244 4.142 1.00 0.00 H new ATOM 0 HG LEU A 20 -7.904 -9.523 2.858 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -7.934 -8.164 0.804 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -9.572 -8.661 1.290 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -9.019 -6.997 1.596 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -6.184 -7.796 2.506 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.201 -6.614 3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -6.547 -8.023 4.233 1.00 0.00 H new ATOM 383 N LYS A 21 -9.810 -7.963 7.387 1.00 0.00 N ATOM 384 CA LYS A 21 -10.817 -7.634 8.389 1.00 0.00 C ATOM 385 C LYS A 21 -10.927 -6.123 8.574 1.00 0.00 C ATOM 386 O LYS A 21 -10.106 -5.511 9.255 1.00 0.00 O ATOM 387 CB LYS A 21 -10.476 -8.298 9.723 1.00 0.00 C ATOM 388 CG LYS A 21 -10.949 -9.738 9.825 1.00 0.00 C ATOM 389 CD LYS A 21 -10.176 -10.506 10.885 1.00 0.00 C ATOM 390 CE LYS A 21 -10.759 -10.283 12.271 1.00 0.00 C ATOM 391 NZ LYS A 21 -12.141 -10.826 12.386 1.00 0.00 N ATOM 0 H LYS A 21 -8.880 -7.596 7.588 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.778 -8.011 8.039 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.396 -8.268 9.868 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.923 -7.720 10.532 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -12.012 -9.756 10.064 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.831 -10.230 8.860 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.192 -11.570 10.649 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -9.132 -10.193 10.874 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -10.119 -10.758 13.015 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -10.768 -9.216 12.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -12.352 -11.031 13.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.820 -10.126 12.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -12.218 -11.701 11.829 1.00 0.00 H new ATOM 405 N GLY A 22 -11.948 -5.529 7.963 1.00 0.00 N ATOM 406 CA GLY A 22 -12.146 -4.096 8.074 1.00 0.00 C ATOM 407 C GLY A 22 -10.978 -3.304 7.519 1.00 0.00 C ATOM 408 O GLY A 22 -10.886 -3.085 6.311 1.00 0.00 O ATOM 0 H GLY A 22 -12.641 -6.015 7.394 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -13.056 -3.816 7.543 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -12.294 -3.833 9.121 1.00 0.00 H new ATOM 412 N ARG A 23 -10.085 -2.873 8.403 1.00 0.00 N ATOM 413 CA ARG A 23 -8.918 -2.098 7.995 1.00 0.00 C ATOM 414 C ARG A 23 -7.628 -2.810 8.389 1.00 0.00 C ATOM 415 O ARG A 23 -6.562 -2.196 8.454 1.00 0.00 O ATOM 416 CB ARG A 23 -8.958 -0.706 8.625 1.00 0.00 C ATOM 417 CG ARG A 23 -10.016 0.206 8.024 1.00 0.00 C ATOM 418 CD ARG A 23 -9.463 1.005 6.854 1.00 0.00 C ATOM 419 NE ARG A 23 -10.512 1.401 5.918 1.00 0.00 N ATOM 420 CZ ARG A 23 -11.120 0.554 5.095 1.00 0.00 C ATOM 421 NH1 ARG A 23 -10.787 -0.730 5.094 1.00 0.00 N ATOM 422 NH2 ARG A 23 -12.064 0.990 4.272 1.00 0.00 N ATOM 0 H ARG A 23 -10.146 -3.047 9.406 1.00 0.00 H new ATOM 0 HA ARG A 23 -8.941 -1.998 6.910 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -9.142 -0.806 9.695 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -7.980 -0.237 8.512 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -10.865 -0.390 7.690 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -10.387 0.888 8.789 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -8.957 1.895 7.229 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -8.715 0.410 6.330 1.00 0.00 H new ATOM 0 HE ARG A 23 -10.793 2.381 5.895 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -10.062 -1.069 5.726 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -11.256 -1.378 4.461 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -12.324 1.976 4.271 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -12.530 0.339 3.640 1.00 0.00 H new ATOM 436 N THR A 24 -7.730 -4.110 8.650 1.00 0.00 N ATOM 437 CA THR A 24 -6.572 -4.905 9.039 1.00 0.00 C ATOM 438 C THR A 24 -6.324 -6.036 8.048 1.00 0.00 C ATOM 439 O THR A 24 -7.234 -6.800 7.721 1.00 0.00 O ATOM 440 CB THR A 24 -6.749 -5.501 10.448 1.00 0.00 C ATOM 441 OG1 THR A 24 -6.980 -4.454 11.398 1.00 0.00 O ATOM 442 CG2 THR A 24 -5.520 -6.300 10.856 1.00 0.00 C ATOM 0 H THR A 24 -8.603 -4.634 8.599 1.00 0.00 H new ATOM 0 HA THR A 24 -5.713 -4.234 9.042 1.00 0.00 H new ATOM 0 HB THR A 24 -7.609 -6.171 10.429 1.00 0.00 H new ATOM 0 HG1 THR A 24 -6.123 -4.068 11.675 1.00 0.00 H new ATOM 0 HG21 THR A 24 -5.668 -6.711 11.855 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.364 -7.114 10.148 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.646 -5.648 10.858 1.00 0.00 H new ATOM 450 N VAL A 25 -5.087 -6.140 7.573 1.00 0.00 N ATOM 451 CA VAL A 25 -4.719 -7.181 6.620 1.00 0.00 C ATOM 452 C VAL A 25 -3.902 -8.277 7.293 1.00 0.00 C ATOM 453 O VAL A 25 -2.860 -8.009 7.893 1.00 0.00 O ATOM 454 CB VAL A 25 -3.912 -6.602 5.442 1.00 0.00 C ATOM 455 CG1 VAL A 25 -3.485 -7.711 4.493 1.00 0.00 C ATOM 456 CG2 VAL A 25 -4.724 -5.546 4.709 1.00 0.00 C ATOM 0 H VAL A 25 -4.323 -5.516 7.832 1.00 0.00 H new ATOM 0 HA VAL A 25 -5.648 -7.607 6.240 1.00 0.00 H new ATOM 0 HB VAL A 25 -3.014 -6.127 5.837 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.916 -7.284 3.667 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.864 -8.429 5.028 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -4.369 -8.216 4.102 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.139 -5.148 3.880 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.640 -5.994 4.324 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.976 -4.738 5.396 1.00 0.00 H new ATOM 466 N ILE A 26 -4.380 -9.512 7.188 1.00 0.00 N ATOM 467 CA ILE A 26 -3.692 -10.650 7.786 1.00 0.00 C ATOM 468 C ILE A 26 -3.116 -11.569 6.714 1.00 0.00 C ATOM 469 O ILE A 26 -3.803 -11.937 5.761 1.00 0.00 O ATOM 470 CB ILE A 26 -4.634 -11.465 8.692 1.00 0.00 C ATOM 471 CG1 ILE A 26 -5.150 -10.596 9.840 1.00 0.00 C ATOM 472 CG2 ILE A 26 -3.917 -12.694 9.231 1.00 0.00 C ATOM 473 CD1 ILE A 26 -6.410 -11.133 10.484 1.00 0.00 C ATOM 0 H ILE A 26 -5.240 -9.750 6.695 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.880 -10.246 8.390 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.487 -11.797 8.101 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.372 -10.510 10.598 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -5.343 -9.591 9.466 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -4.595 -13.260 9.870 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -3.594 -13.320 8.400 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.048 -12.383 9.811 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -6.719 -10.467 11.290 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -7.203 -11.193 9.738 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -6.217 -12.127 10.888 1.00 0.00 H new ATOM 485 N VAL A 27 -1.849 -11.937 6.876 1.00 0.00 N ATOM 486 CA VAL A 27 -1.180 -12.816 5.923 1.00 0.00 C ATOM 487 C VAL A 27 -0.716 -14.103 6.595 1.00 0.00 C ATOM 488 O VAL A 27 -0.111 -14.074 7.668 1.00 0.00 O ATOM 489 CB VAL A 27 0.033 -12.121 5.277 1.00 0.00 C ATOM 490 CG1 VAL A 27 0.726 -13.059 4.297 1.00 0.00 C ATOM 491 CG2 VAL A 27 -0.396 -10.836 4.584 1.00 0.00 C ATOM 0 H VAL A 27 -1.265 -11.640 7.658 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.908 -13.057 5.148 1.00 0.00 H new ATOM 0 HB VAL A 27 0.744 -11.864 6.062 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.581 -12.551 3.850 1.00 0.00 H new ATOM 0 HG12 VAL A 27 1.068 -13.949 4.825 1.00 0.00 H new ATOM 0 HG13 VAL A 27 0.026 -13.349 3.514 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.474 -10.358 4.133 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.126 -11.067 3.808 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.843 -10.161 5.314 1.00 0.00 H new ATOM 501 N LYS A 28 -1.002 -15.233 5.958 1.00 0.00 N ATOM 502 CA LYS A 28 -0.614 -16.533 6.492 1.00 0.00 C ATOM 503 C LYS A 28 0.231 -17.304 5.483 1.00 0.00 C ATOM 504 O LYS A 28 -0.196 -17.545 4.356 1.00 0.00 O ATOM 505 CB LYS A 28 -1.856 -17.347 6.861 1.00 0.00 C ATOM 506 CG LYS A 28 -1.590 -18.427 7.897 1.00 0.00 C ATOM 507 CD LYS A 28 -2.879 -19.084 8.360 1.00 0.00 C ATOM 508 CE LYS A 28 -3.665 -18.176 9.291 1.00 0.00 C ATOM 509 NZ LYS A 28 -5.129 -18.438 9.219 1.00 0.00 N ATOM 0 H LYS A 28 -1.502 -15.275 5.070 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.017 -16.367 7.389 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -2.623 -16.672 7.241 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -2.257 -17.811 5.960 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.927 -19.182 7.475 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -1.074 -17.992 8.753 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.491 -19.336 7.494 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.649 -20.019 8.871 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.321 -18.321 10.315 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.470 -17.135 9.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -5.629 -17.798 9.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.463 -18.275 8.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -5.319 -19.424 9.490 1.00 0.00 H new ATOM 523 N GLY A 29 1.434 -17.691 5.899 1.00 0.00 N ATOM 524 CA GLY A 29 2.319 -18.432 5.020 1.00 0.00 C ATOM 525 C GLY A 29 2.830 -19.711 5.656 1.00 0.00 C ATOM 526 O GLY A 29 2.750 -19.901 6.869 1.00 0.00 O ATOM 0 H GLY A 29 1.810 -17.504 6.828 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.791 -18.674 4.098 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.166 -17.802 4.747 1.00 0.00 H new ATOM 530 N PRO A 30 3.369 -20.615 4.824 1.00 0.00 N ATOM 531 CA PRO A 30 3.904 -21.898 5.289 1.00 0.00 C ATOM 532 C PRO A 30 5.186 -21.732 6.098 1.00 0.00 C ATOM 533 O PRO A 30 5.798 -22.715 6.517 1.00 0.00 O ATOM 534 CB PRO A 30 4.185 -22.657 3.991 1.00 0.00 C ATOM 535 CG PRO A 30 4.394 -21.594 2.968 1.00 0.00 C ATOM 536 CD PRO A 30 3.497 -20.454 3.366 1.00 0.00 C ATOM 0 HA PRO A 30 3.211 -22.411 5.956 1.00 0.00 H new ATOM 0 HB2 PRO A 30 5.065 -23.293 4.087 1.00 0.00 H new ATOM 0 HB3 PRO A 30 3.351 -23.306 3.723 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.437 -21.279 2.940 1.00 0.00 H new ATOM 0 HG3 PRO A 30 4.144 -21.957 1.971 1.00 0.00 H new ATOM 0 HD2 PRO A 30 3.933 -19.490 3.105 1.00 0.00 H new ATOM 0 HD3 PRO A 30 2.529 -20.512 2.869 1.00 0.00 H new ATOM 544 N ARG A 31 5.587 -20.484 6.313 1.00 0.00 N ATOM 545 CA ARG A 31 6.798 -20.189 7.071 1.00 0.00 C ATOM 546 C ARG A 31 6.480 -19.333 8.292 1.00 0.00 C ATOM 547 O ARG A 31 7.352 -19.059 9.115 1.00 0.00 O ATOM 548 CB ARG A 31 7.819 -19.475 6.185 1.00 0.00 C ATOM 549 CG ARG A 31 8.102 -20.198 4.877 1.00 0.00 C ATOM 550 CD ARG A 31 9.517 -19.929 4.388 1.00 0.00 C ATOM 551 NE ARG A 31 10.013 -21.003 3.532 1.00 0.00 N ATOM 552 CZ ARG A 31 10.291 -22.225 3.971 1.00 0.00 C ATOM 553 NH1 ARG A 31 10.122 -22.527 5.251 1.00 0.00 N ATOM 554 NH2 ARG A 31 10.738 -23.148 3.129 1.00 0.00 N ATOM 0 H ARG A 31 5.091 -19.660 5.973 1.00 0.00 H new ATOM 0 HA ARG A 31 7.222 -21.133 7.412 1.00 0.00 H new ATOM 0 HB2 ARG A 31 7.457 -18.471 5.964 1.00 0.00 H new ATOM 0 HB3 ARG A 31 8.752 -19.363 6.738 1.00 0.00 H new ATOM 0 HG2 ARG A 31 7.961 -21.270 5.014 1.00 0.00 H new ATOM 0 HG3 ARG A 31 7.387 -19.877 4.120 1.00 0.00 H new ATOM 0 HD2 ARG A 31 9.538 -18.988 3.838 1.00 0.00 H new ATOM 0 HD3 ARG A 31 10.181 -19.812 5.245 1.00 0.00 H new ATOM 0 HE ARG A 31 10.154 -20.803 2.542 1.00 0.00 H new ATOM 0 HH11 ARG A 31 9.778 -21.820 5.901 1.00 0.00 H new ATOM 0 HH12 ARG A 31 10.336 -23.466 5.586 1.00 0.00 H new ATOM 0 HH21 ARG A 31 10.868 -22.919 2.144 1.00 0.00 H new ATOM 0 HH22 ARG A 31 10.951 -24.086 3.467 1.00 0.00 H new ATOM 568 N GLY A 32 5.223 -18.911 8.403 1.00 0.00 N ATOM 569 CA GLY A 32 4.813 -18.089 9.526 1.00 0.00 C ATOM 570 C GLY A 32 3.579 -17.264 9.220 1.00 0.00 C ATOM 571 O GLY A 32 3.050 -17.311 8.109 1.00 0.00 O ATOM 0 H GLY A 32 4.482 -19.124 7.735 1.00 0.00 H new ATOM 0 HA2 GLY A 32 4.615 -18.728 10.387 1.00 0.00 H new ATOM 0 HA3 GLY A 32 5.631 -17.424 9.804 1.00 0.00 H new ATOM 575 N THR A 33 3.116 -16.504 10.209 1.00 0.00 N ATOM 576 CA THR A 33 1.935 -15.668 10.040 1.00 0.00 C ATOM 577 C THR A 33 2.233 -14.217 10.404 1.00 0.00 C ATOM 578 O THR A 33 2.729 -13.928 11.493 1.00 0.00 O ATOM 579 CB THR A 33 0.762 -16.170 10.903 1.00 0.00 C ATOM 580 OG1 THR A 33 0.563 -17.573 10.690 1.00 0.00 O ATOM 581 CG2 THR A 33 -0.516 -15.416 10.573 1.00 0.00 C ATOM 0 H THR A 33 3.542 -16.451 11.134 1.00 0.00 H new ATOM 0 HA THR A 33 1.654 -15.727 8.989 1.00 0.00 H new ATOM 0 HB THR A 33 1.009 -15.992 11.950 1.00 0.00 H new ATOM 0 HG1 THR A 33 -0.183 -17.885 11.243 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.329 -15.789 11.195 1.00 0.00 H new ATOM 0 HG22 THR A 33 -0.371 -14.353 10.764 1.00 0.00 H new ATOM 0 HG23 THR A 33 -0.765 -15.565 9.522 1.00 0.00 H new ATOM 589 N LEU A 34 1.927 -13.308 9.485 1.00 0.00 N ATOM 590 CA LEU A 34 2.162 -11.885 9.708 1.00 0.00 C ATOM 591 C LEU A 34 0.927 -11.066 9.345 1.00 0.00 C ATOM 592 O LEU A 34 0.299 -11.299 8.312 1.00 0.00 O ATOM 593 CB LEU A 34 3.363 -11.411 8.889 1.00 0.00 C ATOM 594 CG LEU A 34 4.630 -12.258 9.003 1.00 0.00 C ATOM 595 CD1 LEU A 34 5.691 -11.765 8.032 1.00 0.00 C ATOM 596 CD2 LEU A 34 5.159 -12.237 10.430 1.00 0.00 C ATOM 0 H LEU A 34 1.516 -13.530 8.578 1.00 0.00 H new ATOM 0 HA LEU A 34 2.374 -11.738 10.767 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.069 -11.372 7.840 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.603 -10.392 9.191 1.00 0.00 H new ATOM 0 HG LEU A 34 4.380 -13.287 8.744 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.586 -12.380 8.128 1.00 0.00 H new ATOM 0 HD12 LEU A 34 5.311 -11.833 7.013 1.00 0.00 H new ATOM 0 HD13 LEU A 34 5.938 -10.728 8.259 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.061 -12.845 10.493 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.392 -11.212 10.717 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.403 -12.639 11.104 1.00 0.00 H new ATOM 608 N ARG A 35 0.588 -10.106 10.198 1.00 0.00 N ATOM 609 CA ARG A 35 -0.570 -9.252 9.966 1.00 0.00 C ATOM 610 C ARG A 35 -0.311 -7.835 10.472 1.00 0.00 C ATOM 611 O ARG A 35 0.400 -7.638 11.458 1.00 0.00 O ATOM 612 CB ARG A 35 -1.806 -9.833 10.655 1.00 0.00 C ATOM 613 CG ARG A 35 -1.784 -9.691 12.168 1.00 0.00 C ATOM 614 CD ARG A 35 -2.866 -10.534 12.823 1.00 0.00 C ATOM 615 NE ARG A 35 -2.563 -10.823 14.222 1.00 0.00 N ATOM 616 CZ ARG A 35 -3.378 -11.496 15.027 1.00 0.00 C ATOM 617 NH1 ARG A 35 -4.540 -11.947 14.574 1.00 0.00 N ATOM 618 NH2 ARG A 35 -3.032 -11.719 16.288 1.00 0.00 N ATOM 0 H ARG A 35 1.099 -9.900 11.056 1.00 0.00 H new ATOM 0 HA ARG A 35 -0.748 -9.209 8.892 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -2.695 -9.338 10.265 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -1.891 -10.889 10.399 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -0.808 -9.991 12.548 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -1.923 -8.644 12.438 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -3.821 -10.012 12.759 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -2.978 -11.470 12.275 1.00 0.00 H new ATOM 0 HE ARG A 35 -1.677 -10.490 14.602 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -4.810 -11.778 13.605 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -5.164 -12.463 15.194 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -2.139 -11.374 16.641 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -3.659 -12.236 16.905 1.00 0.00 H new ATOM 632 N ARG A 36 -0.894 -6.853 9.792 1.00 0.00 N ATOM 633 CA ARG A 36 -0.725 -5.457 10.171 1.00 0.00 C ATOM 634 C ARG A 36 -2.066 -4.729 10.180 1.00 0.00 C ATOM 635 O ARG A 36 -2.899 -4.932 9.295 1.00 0.00 O ATOM 636 CB ARG A 36 0.240 -4.758 9.212 1.00 0.00 C ATOM 637 CG ARG A 36 1.069 -3.666 9.869 1.00 0.00 C ATOM 638 CD ARG A 36 0.278 -2.373 10.005 1.00 0.00 C ATOM 639 NE ARG A 36 0.691 -1.600 11.172 1.00 0.00 N ATOM 640 CZ ARG A 36 1.867 -0.989 11.272 1.00 0.00 C ATOM 641 NH1 ARG A 36 2.741 -1.062 10.278 1.00 0.00 N ATOM 642 NH2 ARG A 36 2.170 -0.304 12.367 1.00 0.00 N ATOM 0 H ARG A 36 -1.488 -6.999 8.976 1.00 0.00 H new ATOM 0 HA ARG A 36 -0.309 -5.429 11.178 1.00 0.00 H new ATOM 0 HB2 ARG A 36 0.910 -5.501 8.780 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -0.329 -4.325 8.389 1.00 0.00 H new ATOM 0 HG2 ARG A 36 1.397 -3.999 10.854 1.00 0.00 H new ATOM 0 HG3 ARG A 36 1.967 -3.484 9.279 1.00 0.00 H new ATOM 0 HD2 ARG A 36 0.410 -1.771 9.106 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -0.785 -2.604 10.081 1.00 0.00 H new ATOM 0 HE ARG A 36 0.041 -1.524 11.954 1.00 0.00 H new ATOM 0 HH11 ARG A 36 2.511 -1.588 9.435 1.00 0.00 H new ATOM 0 HH12 ARG A 36 3.643 -0.592 10.357 1.00 0.00 H new ATOM 0 HH21 ARG A 36 1.500 -0.246 13.134 1.00 0.00 H new ATOM 0 HH22 ARG A 36 3.073 0.164 12.442 1.00 0.00 H new ATOM 656 N ASP A 37 -2.268 -3.881 11.182 1.00 0.00 N ATOM 657 CA ASP A 37 -3.507 -3.123 11.304 1.00 0.00 C ATOM 658 C ASP A 37 -3.331 -1.704 10.773 1.00 0.00 C ATOM 659 O ASP A 37 -2.425 -0.982 11.190 1.00 0.00 O ATOM 660 CB ASP A 37 -3.963 -3.082 12.764 1.00 0.00 C ATOM 661 CG ASP A 37 -5.133 -2.142 12.978 1.00 0.00 C ATOM 662 OD1 ASP A 37 -6.289 -2.594 12.848 1.00 0.00 O ATOM 663 OD2 ASP A 37 -4.892 -0.954 13.280 1.00 0.00 O ATOM 0 H ASP A 37 -1.589 -3.701 11.922 1.00 0.00 H new ATOM 0 HA ASP A 37 -4.270 -3.623 10.707 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -4.244 -4.086 13.082 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -3.130 -2.770 13.393 1.00 0.00 H new ATOM 668 N PHE A 38 -4.203 -1.310 9.851 1.00 0.00 N ATOM 669 CA PHE A 38 -4.143 0.021 9.260 1.00 0.00 C ATOM 670 C PHE A 38 -5.395 0.825 9.601 1.00 0.00 C ATOM 671 O PHE A 38 -5.775 1.739 8.872 1.00 0.00 O ATOM 672 CB PHE A 38 -3.984 -0.077 7.742 1.00 0.00 C ATOM 673 CG PHE A 38 -2.945 -1.073 7.311 1.00 0.00 C ATOM 674 CD1 PHE A 38 -1.596 -0.780 7.426 1.00 0.00 C ATOM 675 CD2 PHE A 38 -3.318 -2.301 6.790 1.00 0.00 C ATOM 676 CE1 PHE A 38 -0.639 -1.694 7.030 1.00 0.00 C ATOM 677 CE2 PHE A 38 -2.364 -3.220 6.392 1.00 0.00 C ATOM 678 CZ PHE A 38 -1.023 -2.916 6.513 1.00 0.00 C ATOM 0 H PHE A 38 -4.960 -1.894 9.497 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.277 0.536 9.676 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -4.943 -0.350 7.301 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -3.720 0.905 7.348 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -1.289 0.174 7.830 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -4.366 -2.544 6.693 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.410 -1.453 7.125 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.668 -4.174 5.987 1.00 0.00 H new ATOM 0 HZ PHE A 38 -0.276 -3.632 6.204 1.00 0.00 H new ATOM 688 N ASN A 39 -6.029 0.475 10.716 1.00 0.00 N ATOM 689 CA ASN A 39 -7.239 1.162 11.153 1.00 0.00 C ATOM 690 C ASN A 39 -6.946 2.622 11.482 1.00 0.00 C ATOM 691 O ASN A 39 -7.431 3.531 10.808 1.00 0.00 O ATOM 692 CB ASN A 39 -7.834 0.462 12.376 1.00 0.00 C ATOM 693 CG ASN A 39 -8.786 -0.656 11.996 1.00 0.00 C ATOM 694 OD1 ASN A 39 -10.003 -0.516 12.110 1.00 0.00 O ATOM 695 ND2 ASN A 39 -8.233 -1.775 11.542 1.00 0.00 N ATOM 0 H ASN A 39 -5.725 -0.279 11.332 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.961 1.129 10.337 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -7.028 0.057 12.987 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -8.362 1.193 12.988 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -8.823 -2.562 11.271 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -7.219 -1.847 11.464 1.00 0.00 H new ATOM 702 N HIS A 40 -6.149 2.841 12.524 1.00 0.00 N ATOM 703 CA HIS A 40 -5.790 4.191 12.943 1.00 0.00 C ATOM 704 C HIS A 40 -5.630 5.110 11.735 1.00 0.00 C ATOM 705 O HIS A 40 -5.884 6.311 11.820 1.00 0.00 O ATOM 706 CB HIS A 40 -4.496 4.168 13.757 1.00 0.00 C ATOM 707 CG HIS A 40 -3.333 3.582 13.017 1.00 0.00 C ATOM 708 ND1 HIS A 40 -3.430 2.445 12.241 1.00 0.00 N ATOM 709 CD2 HIS A 40 -2.043 3.982 12.935 1.00 0.00 C ATOM 710 CE1 HIS A 40 -2.250 2.171 11.716 1.00 0.00 C ATOM 711 NE2 HIS A 40 -1.390 3.089 12.122 1.00 0.00 N ATOM 0 H HIS A 40 -5.740 2.100 13.093 1.00 0.00 H new ATOM 0 HA HIS A 40 -6.595 4.578 13.567 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -4.248 5.186 14.059 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -4.661 3.596 14.670 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -1.608 4.844 13.419 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -2.026 1.339 11.066 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -0.402 3.128 11.872 1.00 0.00 H new ATOM 719 N ILE A 41 -5.206 4.535 10.613 1.00 0.00 N ATOM 720 CA ILE A 41 -5.012 5.303 9.390 1.00 0.00 C ATOM 721 C ILE A 41 -6.261 5.269 8.515 1.00 0.00 C ATOM 722 O ILE A 41 -6.839 4.208 8.282 1.00 0.00 O ATOM 723 CB ILE A 41 -3.816 4.774 8.577 1.00 0.00 C ATOM 724 CG1 ILE A 41 -2.646 4.444 9.506 1.00 0.00 C ATOM 725 CG2 ILE A 41 -3.396 5.793 7.528 1.00 0.00 C ATOM 726 CD1 ILE A 41 -1.622 3.521 8.884 1.00 0.00 C ATOM 0 H ILE A 41 -4.991 3.542 10.527 1.00 0.00 H new ATOM 0 HA ILE A 41 -4.810 6.331 9.692 1.00 0.00 H new ATOM 0 HB ILE A 41 -4.119 3.860 8.066 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -2.155 5.371 9.802 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -3.033 3.984 10.415 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -2.550 5.404 6.962 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -4.229 5.983 6.851 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.108 6.723 8.019 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.822 3.331 9.599 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -2.098 2.579 8.613 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.207 3.988 7.991 1.00 0.00 H new ATOM 738 N ASN A 42 -6.673 6.438 8.034 1.00 0.00 N ATOM 739 CA ASN A 42 -7.853 6.542 7.184 1.00 0.00 C ATOM 740 C ASN A 42 -7.469 6.476 5.709 1.00 0.00 C ATOM 741 O ASN A 42 -6.784 7.360 5.195 1.00 0.00 O ATOM 742 CB ASN A 42 -8.600 7.846 7.471 1.00 0.00 C ATOM 743 CG ASN A 42 -8.559 8.225 8.939 1.00 0.00 C ATOM 744 OD1 ASN A 42 -8.666 7.368 9.816 1.00 0.00 O ATOM 745 ND2 ASN A 42 -8.404 9.515 9.212 1.00 0.00 N ATOM 0 H ASN A 42 -6.207 7.326 8.219 1.00 0.00 H new ATOM 0 HA ASN A 42 -8.507 5.699 7.408 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.163 8.650 6.879 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.638 7.744 7.154 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -8.369 9.831 10.181 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -8.319 10.190 8.452 1.00 0.00 H new ATOM 752 N VAL A 43 -7.914 5.422 5.033 1.00 0.00 N ATOM 753 CA VAL A 43 -7.619 5.240 3.618 1.00 0.00 C ATOM 754 C VAL A 43 -8.712 4.433 2.927 1.00 0.00 C ATOM 755 O VAL A 43 -9.730 4.101 3.535 1.00 0.00 O ATOM 756 CB VAL A 43 -6.266 4.534 3.412 1.00 0.00 C ATOM 757 CG1 VAL A 43 -5.152 5.299 4.110 1.00 0.00 C ATOM 758 CG2 VAL A 43 -6.334 3.099 3.913 1.00 0.00 C ATOM 0 H VAL A 43 -8.481 4.680 5.444 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.572 6.235 3.175 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.045 4.513 2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.204 4.785 3.953 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.090 6.307 3.700 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.362 5.354 5.178 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.370 2.614 3.760 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.577 3.096 4.975 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.104 2.558 3.363 1.00 0.00 H new ATOM 768 N GLU A 44 -8.494 4.119 1.653 1.00 0.00 N ATOM 769 CA GLU A 44 -9.462 3.350 0.880 1.00 0.00 C ATOM 770 C GLU A 44 -8.878 2.005 0.461 1.00 0.00 C ATOM 771 O GLU A 44 -7.756 1.932 -0.046 1.00 0.00 O ATOM 772 CB GLU A 44 -9.901 4.137 -0.357 1.00 0.00 C ATOM 773 CG GLU A 44 -10.895 5.245 -0.053 1.00 0.00 C ATOM 774 CD GLU A 44 -10.616 5.932 1.270 1.00 0.00 C ATOM 775 OE1 GLU A 44 -9.562 6.592 1.384 1.00 0.00 O ATOM 776 OE2 GLU A 44 -11.451 5.809 2.190 1.00 0.00 O ATOM 0 H GLU A 44 -7.656 4.385 1.135 1.00 0.00 H new ATOM 0 HA GLU A 44 -10.331 3.167 1.512 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -9.021 4.570 -0.833 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -10.346 3.449 -1.076 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -10.867 5.983 -0.854 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -11.903 4.830 -0.037 1.00 0.00 H new ATOM 783 N LEU A 45 -9.643 0.941 0.675 1.00 0.00 N ATOM 784 CA LEU A 45 -9.202 -0.404 0.321 1.00 0.00 C ATOM 785 C LEU A 45 -10.339 -1.201 -0.312 1.00 0.00 C ATOM 786 O LEU A 45 -11.510 -0.978 -0.007 1.00 0.00 O ATOM 787 CB LEU A 45 -8.679 -1.134 1.559 1.00 0.00 C ATOM 788 CG LEU A 45 -7.692 -0.356 2.430 1.00 0.00 C ATOM 789 CD1 LEU A 45 -7.465 -1.073 3.751 1.00 0.00 C ATOM 790 CD2 LEU A 45 -6.374 -0.158 1.694 1.00 0.00 C ATOM 0 H LEU A 45 -10.573 0.983 1.092 1.00 0.00 H new ATOM 0 HA LEU A 45 -8.396 -0.315 -0.407 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -9.532 -1.418 2.176 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -8.198 -2.057 1.236 1.00 0.00 H new ATOM 0 HG LEU A 45 -8.118 0.625 2.642 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.760 -0.504 4.357 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -8.412 -1.163 4.284 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -7.060 -2.067 3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -5.683 0.397 2.328 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -5.943 -1.129 1.452 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -6.551 0.400 0.775 1.00 0.00 H new ATOM 802 N SER A 46 -9.984 -2.132 -1.191 1.00 0.00 N ATOM 803 CA SER A 46 -10.974 -2.962 -1.867 1.00 0.00 C ATOM 804 C SER A 46 -10.427 -4.363 -2.120 1.00 0.00 C ATOM 805 O SER A 46 -9.224 -4.548 -2.307 1.00 0.00 O ATOM 806 CB SER A 46 -11.392 -2.318 -3.191 1.00 0.00 C ATOM 807 OG SER A 46 -11.355 -0.904 -3.104 1.00 0.00 O ATOM 0 H SER A 46 -9.018 -2.331 -1.452 1.00 0.00 H new ATOM 0 HA SER A 46 -11.847 -3.044 -1.219 1.00 0.00 H new ATOM 0 HB2 SER A 46 -10.729 -2.654 -3.988 1.00 0.00 H new ATOM 0 HB3 SER A 46 -12.398 -2.643 -3.456 1.00 0.00 H new ATOM 0 HG SER A 46 -11.625 -0.516 -3.963 1.00 0.00 H new ATOM 813 N LEU A 47 -11.319 -5.348 -2.125 1.00 0.00 N ATOM 814 CA LEU A 47 -10.928 -6.734 -2.356 1.00 0.00 C ATOM 815 C LEU A 47 -11.126 -7.120 -3.818 1.00 0.00 C ATOM 816 O LEU A 47 -12.134 -6.772 -4.432 1.00 0.00 O ATOM 817 CB LEU A 47 -11.737 -7.670 -1.455 1.00 0.00 C ATOM 818 CG LEU A 47 -11.060 -8.987 -1.076 1.00 0.00 C ATOM 819 CD1 LEU A 47 -11.649 -9.538 0.213 1.00 0.00 C ATOM 820 CD2 LEU A 47 -11.197 -10.001 -2.203 1.00 0.00 C ATOM 0 H LEU A 47 -12.318 -5.212 -1.972 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.870 -6.832 -2.114 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -11.985 -7.135 -0.538 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -12.678 -7.899 -1.955 1.00 0.00 H new ATOM 0 HG LEU A 47 -9.999 -8.795 -0.914 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -11.155 -10.476 0.467 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -11.499 -8.819 1.018 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -12.716 -9.715 0.079 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -10.709 -10.932 -1.916 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -12.253 -10.189 -2.397 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -10.727 -9.608 -3.105 1.00 0.00 H new ATOM 832 N LEU A 48 -10.156 -7.842 -4.370 1.00 0.00 N ATOM 833 CA LEU A 48 -10.224 -8.279 -5.760 1.00 0.00 C ATOM 834 C LEU A 48 -9.978 -9.780 -5.873 1.00 0.00 C ATOM 835 O LEU A 48 -9.032 -10.310 -5.291 1.00 0.00 O ATOM 836 CB LEU A 48 -9.201 -7.518 -6.604 1.00 0.00 C ATOM 837 CG LEU A 48 -9.064 -6.023 -6.308 1.00 0.00 C ATOM 838 CD1 LEU A 48 -8.010 -5.396 -7.207 1.00 0.00 C ATOM 839 CD2 LEU A 48 -10.402 -5.321 -6.481 1.00 0.00 C ATOM 0 H LEU A 48 -9.314 -8.137 -3.876 1.00 0.00 H new ATOM 0 HA LEU A 48 -11.226 -8.066 -6.133 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -8.226 -7.986 -6.466 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -9.466 -7.637 -7.655 1.00 0.00 H new ATOM 0 HG LEU A 48 -8.746 -5.904 -5.272 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -7.926 -4.333 -6.983 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -7.049 -5.880 -7.034 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -8.298 -5.525 -8.250 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -10.286 -4.259 -6.266 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -10.750 -5.448 -7.506 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -11.131 -5.752 -5.795 1.00 0.00 H new ATOM 851 N GLY A 49 -10.835 -10.460 -6.628 1.00 0.00 N ATOM 852 CA GLY A 49 -10.693 -11.893 -6.805 1.00 0.00 C ATOM 853 C GLY A 49 -11.325 -12.384 -8.093 1.00 0.00 C ATOM 854 O GLY A 49 -12.218 -13.232 -8.071 1.00 0.00 O ATOM 0 H GLY A 49 -11.625 -10.044 -7.120 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.635 -12.153 -6.801 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.151 -12.407 -5.960 1.00 0.00 H new ATOM 858 N LYS A 50 -10.863 -11.851 -9.218 1.00 0.00 N ATOM 859 CA LYS A 50 -11.390 -12.238 -10.521 1.00 0.00 C ATOM 860 C LYS A 50 -10.755 -13.541 -10.998 1.00 0.00 C ATOM 861 O LYS A 50 -11.454 -14.496 -11.337 1.00 0.00 O ATOM 862 CB LYS A 50 -11.136 -11.131 -11.547 1.00 0.00 C ATOM 863 CG LYS A 50 -12.249 -10.099 -11.614 1.00 0.00 C ATOM 864 CD LYS A 50 -13.472 -10.644 -12.331 1.00 0.00 C ATOM 865 CE LYS A 50 -14.514 -9.560 -12.561 1.00 0.00 C ATOM 866 NZ LYS A 50 -15.896 -10.114 -12.585 1.00 0.00 N ATOM 0 H LYS A 50 -10.124 -11.149 -9.254 1.00 0.00 H new ATOM 0 HA LYS A 50 -12.464 -12.392 -10.420 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -10.200 -10.629 -11.303 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -11.009 -11.581 -12.532 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -12.524 -9.793 -10.605 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -11.890 -9.209 -12.130 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -13.173 -11.072 -13.288 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -13.909 -11.451 -11.744 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -14.437 -8.810 -11.774 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -14.309 -9.054 -13.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -16.576 -9.343 -12.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -15.977 -10.811 -13.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -16.101 -10.575 -11.675 1.00 0.00 H new ATOM 880 N LYS A 51 -9.427 -13.573 -11.020 1.00 0.00 N ATOM 881 CA LYS A 51 -8.698 -14.760 -11.453 1.00 0.00 C ATOM 882 C LYS A 51 -7.809 -15.291 -10.333 1.00 0.00 C ATOM 883 O LYS A 51 -7.435 -16.463 -10.326 1.00 0.00 O ATOM 884 CB LYS A 51 -7.847 -14.440 -12.685 1.00 0.00 C ATOM 885 CG LYS A 51 -6.517 -13.784 -12.352 1.00 0.00 C ATOM 886 CD LYS A 51 -5.423 -14.818 -12.145 1.00 0.00 C ATOM 887 CE LYS A 51 -4.877 -15.325 -13.471 1.00 0.00 C ATOM 888 NZ LYS A 51 -3.628 -16.115 -13.291 1.00 0.00 N ATOM 0 H LYS A 51 -8.833 -12.791 -10.743 1.00 0.00 H new ATOM 0 HA LYS A 51 -9.426 -15.529 -11.711 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -7.660 -15.361 -13.236 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -8.412 -13.782 -13.346 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.232 -13.107 -13.158 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -6.623 -13.180 -11.451 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.614 -14.381 -11.560 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.817 -15.655 -11.568 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.630 -15.942 -13.961 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -4.680 -14.479 -14.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -3.288 -16.442 -14.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -2.901 -15.519 -12.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -3.821 -16.936 -12.683 1.00 0.00 H new ATOM 902 N LYS A 52 -7.477 -14.421 -9.385 1.00 0.00 N ATOM 903 CA LYS A 52 -6.635 -14.802 -8.257 1.00 0.00 C ATOM 904 C LYS A 52 -6.775 -13.805 -7.112 1.00 0.00 C ATOM 905 O LYS A 52 -7.249 -12.684 -7.304 1.00 0.00 O ATOM 906 CB LYS A 52 -5.172 -14.891 -8.694 1.00 0.00 C ATOM 907 CG LYS A 52 -4.244 -15.421 -7.613 1.00 0.00 C ATOM 908 CD LYS A 52 -3.030 -16.112 -8.209 1.00 0.00 C ATOM 909 CE LYS A 52 -1.950 -15.112 -8.590 1.00 0.00 C ATOM 910 NZ LYS A 52 -1.041 -15.650 -9.640 1.00 0.00 N ATOM 0 H LYS A 52 -7.778 -13.447 -9.376 1.00 0.00 H new ATOM 0 HA LYS A 52 -6.963 -15.780 -7.905 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -5.102 -15.536 -9.570 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -4.832 -13.901 -8.999 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -3.919 -14.598 -6.976 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -4.787 -16.121 -6.978 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -2.628 -16.827 -7.491 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -3.329 -16.679 -9.090 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -2.415 -14.194 -8.948 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -1.369 -14.851 -7.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.319 -14.938 -9.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.577 -16.512 -9.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.591 -15.876 -10.493 1.00 0.00 H new ATOM 924 N LYS A 53 -6.358 -14.216 -5.920 1.00 0.00 N ATOM 925 CA LYS A 53 -6.434 -13.359 -4.743 1.00 0.00 C ATOM 926 C LYS A 53 -5.609 -12.091 -4.941 1.00 0.00 C ATOM 927 O LYS A 53 -4.379 -12.135 -4.952 1.00 0.00 O ATOM 928 CB LYS A 53 -5.943 -14.112 -3.505 1.00 0.00 C ATOM 929 CG LYS A 53 -6.814 -15.297 -3.127 1.00 0.00 C ATOM 930 CD LYS A 53 -6.733 -15.598 -1.640 1.00 0.00 C ATOM 931 CE LYS A 53 -7.962 -16.353 -1.157 1.00 0.00 C ATOM 932 NZ LYS A 53 -9.197 -15.528 -1.262 1.00 0.00 N ATOM 0 H LYS A 53 -5.963 -15.140 -5.743 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.476 -13.075 -4.597 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -4.926 -14.462 -3.683 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.900 -13.421 -2.663 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -7.849 -15.091 -3.401 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -6.502 -16.174 -3.694 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -5.839 -16.187 -1.435 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.635 -14.666 -1.084 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -8.083 -17.264 -1.744 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -7.816 -16.659 -0.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -9.912 -15.887 -0.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -8.974 -14.539 -1.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -9.569 -15.581 -2.232 1.00 0.00 H new ATOM 946 N ARG A 54 -6.295 -10.962 -5.094 1.00 0.00 N ATOM 947 CA ARG A 54 -5.625 -9.682 -5.290 1.00 0.00 C ATOM 948 C ARG A 54 -6.172 -8.630 -4.331 1.00 0.00 C ATOM 949 O ARG A 54 -7.375 -8.575 -4.072 1.00 0.00 O ATOM 950 CB ARG A 54 -5.797 -9.209 -6.735 1.00 0.00 C ATOM 951 CG ARG A 54 -4.769 -9.787 -7.692 1.00 0.00 C ATOM 952 CD ARG A 54 -5.319 -9.890 -9.107 1.00 0.00 C ATOM 953 NE ARG A 54 -4.376 -10.537 -10.015 1.00 0.00 N ATOM 954 CZ ARG A 54 -3.343 -9.913 -10.569 1.00 0.00 C ATOM 955 NH1 ARG A 54 -3.120 -8.633 -10.308 1.00 0.00 N ATOM 956 NH2 ARG A 54 -2.529 -10.571 -11.386 1.00 0.00 N ATOM 0 H ARG A 54 -7.314 -10.908 -5.086 1.00 0.00 H new ATOM 0 HA ARG A 54 -4.564 -9.820 -5.084 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -6.795 -9.480 -7.080 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -5.735 -8.121 -6.762 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -3.878 -9.160 -7.692 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -4.464 -10.775 -7.346 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -6.253 -10.452 -9.093 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -5.553 -8.892 -9.478 1.00 0.00 H new ATOM 0 HE ARG A 54 -4.519 -11.523 -10.236 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -3.743 -8.125 -9.680 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -2.326 -8.156 -10.735 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -2.697 -11.556 -11.588 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -1.736 -10.091 -11.811 1.00 0.00 H new ATOM 970 N LEU A 55 -5.281 -7.797 -3.805 1.00 0.00 N ATOM 971 CA LEU A 55 -5.673 -6.746 -2.871 1.00 0.00 C ATOM 972 C LEU A 55 -5.506 -5.368 -3.504 1.00 0.00 C ATOM 973 O LEU A 55 -4.421 -5.013 -3.966 1.00 0.00 O ATOM 974 CB LEU A 55 -4.842 -6.836 -1.591 1.00 0.00 C ATOM 975 CG LEU A 55 -4.808 -5.579 -0.722 1.00 0.00 C ATOM 976 CD1 LEU A 55 -6.167 -5.333 -0.086 1.00 0.00 C ATOM 977 CD2 LEU A 55 -3.730 -5.697 0.345 1.00 0.00 C ATOM 0 H LEU A 55 -4.282 -7.828 -4.009 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.725 -6.888 -2.623 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.227 -7.659 -0.989 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.818 -7.092 -1.864 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.569 -4.727 -1.358 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.124 -4.434 0.529 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.916 -5.202 -0.867 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.437 -6.186 0.537 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -3.720 -4.793 0.954 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -3.938 -6.559 0.979 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.758 -5.823 -0.132 1.00 0.00 H new ATOM 989 N ARG A 56 -6.586 -4.594 -3.517 1.00 0.00 N ATOM 990 CA ARG A 56 -6.559 -3.254 -4.091 1.00 0.00 C ATOM 991 C ARG A 56 -6.304 -2.206 -3.012 1.00 0.00 C ATOM 992 O ARG A 56 -7.090 -2.058 -2.077 1.00 0.00 O ATOM 993 CB ARG A 56 -7.878 -2.955 -4.807 1.00 0.00 C ATOM 994 CG ARG A 56 -7.734 -1.995 -5.976 1.00 0.00 C ATOM 995 CD ARG A 56 -9.071 -1.731 -6.649 1.00 0.00 C ATOM 996 NE ARG A 56 -8.962 -0.736 -7.712 1.00 0.00 N ATOM 997 CZ ARG A 56 -8.601 -1.026 -8.957 1.00 0.00 C ATOM 998 NH1 ARG A 56 -8.316 -2.276 -9.294 1.00 0.00 N ATOM 999 NH2 ARG A 56 -8.525 -0.065 -9.868 1.00 0.00 N ATOM 0 H ARG A 56 -7.491 -4.872 -3.137 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.744 -3.212 -4.814 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -8.306 -3.891 -5.167 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.584 -2.537 -4.090 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.310 -1.054 -5.625 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.035 -2.408 -6.703 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.459 -2.662 -7.062 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.790 -1.389 -5.905 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.175 0.236 -7.486 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -8.374 -3.018 -8.597 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -8.039 -2.496 -10.251 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -8.744 0.898 -9.613 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -8.248 -0.289 -10.824 1.00 0.00 H new ATOM 1013 N VAL A 57 -5.199 -1.479 -3.149 1.00 0.00 N ATOM 1014 CA VAL A 57 -4.840 -0.445 -2.187 1.00 0.00 C ATOM 1015 C VAL A 57 -5.094 0.946 -2.756 1.00 0.00 C ATOM 1016 O VAL A 57 -4.530 1.320 -3.785 1.00 0.00 O ATOM 1017 CB VAL A 57 -3.362 -0.555 -1.769 1.00 0.00 C ATOM 1018 CG1 VAL A 57 -2.982 0.591 -0.844 1.00 0.00 C ATOM 1019 CG2 VAL A 57 -3.095 -1.897 -1.105 1.00 0.00 C ATOM 0 H VAL A 57 -4.537 -1.588 -3.918 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.469 -0.596 -1.310 1.00 0.00 H new ATOM 0 HB VAL A 57 -2.743 -0.488 -2.664 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -1.934 0.496 -0.559 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -3.134 1.540 -1.359 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -3.605 0.559 0.050 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -2.046 -1.958 -0.816 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -3.722 -1.995 -0.219 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -3.326 -2.701 -1.804 1.00 0.00 H new ATOM 1029 N ASP A 58 -5.945 1.710 -2.080 1.00 0.00 N ATOM 1030 CA ASP A 58 -6.272 3.062 -2.517 1.00 0.00 C ATOM 1031 C ASP A 58 -6.033 4.069 -1.396 1.00 0.00 C ATOM 1032 O ASP A 58 -6.217 3.759 -0.219 1.00 0.00 O ATOM 1033 CB ASP A 58 -7.727 3.133 -2.981 1.00 0.00 C ATOM 1034 CG ASP A 58 -8.133 4.530 -3.409 1.00 0.00 C ATOM 1035 OD1 ASP A 58 -7.271 5.258 -3.946 1.00 0.00 O ATOM 1036 OD2 ASP A 58 -9.309 4.896 -3.206 1.00 0.00 O ATOM 0 H ASP A 58 -6.421 1.416 -1.227 1.00 0.00 H new ATOM 0 HA ASP A 58 -5.619 3.314 -3.353 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -7.873 2.445 -3.813 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.379 2.800 -2.174 1.00 0.00 H new ATOM 1041 N LYS A 59 -5.621 5.276 -1.769 1.00 0.00 N ATOM 1042 CA LYS A 59 -5.357 6.330 -0.796 1.00 0.00 C ATOM 1043 C LYS A 59 -6.140 7.593 -1.136 1.00 0.00 C ATOM 1044 O LYS A 59 -6.707 7.709 -2.223 1.00 0.00 O ATOM 1045 CB LYS A 59 -3.859 6.642 -0.747 1.00 0.00 C ATOM 1046 CG LYS A 59 -3.100 5.822 0.283 1.00 0.00 C ATOM 1047 CD LYS A 59 -3.497 6.201 1.700 1.00 0.00 C ATOM 1048 CE LYS A 59 -2.614 7.313 2.247 1.00 0.00 C ATOM 1049 NZ LYS A 59 -3.205 8.659 2.008 1.00 0.00 N ATOM 0 H LYS A 59 -5.463 5.549 -2.739 1.00 0.00 H new ATOM 0 HA LYS A 59 -5.681 5.977 0.183 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.427 6.463 -1.732 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -3.724 7.701 -0.527 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -3.295 4.762 0.121 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -2.029 5.973 0.152 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -4.539 6.522 1.714 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -3.424 5.326 2.346 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -2.466 7.166 3.317 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -1.631 7.260 1.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.817 9.336 2.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -2.973 8.974 1.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.238 8.609 2.116 1.00 0.00 H new ATOM 1063 N TRP A 60 -6.164 8.538 -0.203 1.00 0.00 N ATOM 1064 CA TRP A 60 -6.877 9.795 -0.406 1.00 0.00 C ATOM 1065 C TRP A 60 -6.580 10.371 -1.785 1.00 0.00 C ATOM 1066 O TRP A 60 -5.438 10.715 -2.091 1.00 0.00 O ATOM 1067 CB TRP A 60 -6.491 10.803 0.677 1.00 0.00 C ATOM 1068 CG TRP A 60 -7.006 10.441 2.037 1.00 0.00 C ATOM 1069 CD1 TRP A 60 -7.352 9.195 2.478 1.00 0.00 C ATOM 1070 CD2 TRP A 60 -7.235 11.334 3.132 1.00 0.00 C ATOM 1071 NE1 TRP A 60 -7.782 9.260 3.781 1.00 0.00 N ATOM 1072 CE2 TRP A 60 -7.719 10.561 4.206 1.00 0.00 C ATOM 1073 CE3 TRP A 60 -7.078 12.711 3.312 1.00 0.00 C ATOM 1074 CZ2 TRP A 60 -8.046 11.120 5.438 1.00 0.00 C ATOM 1075 CZ3 TRP A 60 -7.403 13.265 4.535 1.00 0.00 C ATOM 1076 CH2 TRP A 60 -7.882 12.471 5.585 1.00 0.00 C ATOM 0 H TRP A 60 -5.698 8.458 0.701 1.00 0.00 H new ATOM 0 HA TRP A 60 -7.946 9.594 -0.340 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -5.405 10.884 0.717 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -6.874 11.786 0.401 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -7.296 8.292 1.889 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -8.097 8.468 4.341 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -6.709 13.331 2.509 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -8.416 10.510 6.249 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -7.286 14.328 4.684 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -8.127 12.934 6.529 1.00 0.00 H new ATOM 1087 N TRP A 61 -7.613 10.476 -2.612 1.00 0.00 N ATOM 1088 CA TRP A 61 -7.462 11.013 -3.961 1.00 0.00 C ATOM 1089 C TRP A 61 -7.124 12.499 -3.920 1.00 0.00 C ATOM 1090 O TRP A 61 -7.937 13.318 -3.491 1.00 0.00 O ATOM 1091 CB TRP A 61 -8.741 10.790 -4.768 1.00 0.00 C ATOM 1092 CG TRP A 61 -9.501 9.567 -4.350 1.00 0.00 C ATOM 1093 CD1 TRP A 61 -9.147 8.267 -4.573 1.00 0.00 C ATOM 1094 CD2 TRP A 61 -10.744 9.530 -3.640 1.00 0.00 C ATOM 1095 NE1 TRP A 61 -10.094 7.424 -4.044 1.00 0.00 N ATOM 1096 CE2 TRP A 61 -11.085 8.174 -3.467 1.00 0.00 C ATOM 1097 CE3 TRP A 61 -11.601 10.510 -3.134 1.00 0.00 C ATOM 1098 CZ2 TRP A 61 -12.245 7.778 -2.808 1.00 0.00 C ATOM 1099 CZ3 TRP A 61 -12.753 10.115 -2.481 1.00 0.00 C ATOM 1100 CH2 TRP A 61 -13.067 8.758 -2.322 1.00 0.00 C ATOM 0 H TRP A 61 -8.565 10.197 -2.373 1.00 0.00 H new ATOM 0 HA TRP A 61 -6.640 10.486 -4.445 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -9.385 11.663 -4.663 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -8.486 10.707 -5.824 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -8.254 7.948 -5.089 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -10.064 6.405 -4.076 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -11.367 11.558 -3.251 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -12.488 6.733 -2.684 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -13.423 10.865 -2.086 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -13.975 8.481 -1.806 1.00 0.00 H new ATOM 1111 N GLY A 62 -5.921 12.842 -4.369 1.00 0.00 N ATOM 1112 CA GLY A 62 -5.499 14.230 -4.375 1.00 0.00 C ATOM 1113 C GLY A 62 -4.037 14.390 -4.742 1.00 0.00 C ATOM 1114 O GLY A 62 -3.619 14.014 -5.836 1.00 0.00 O ATOM 0 H GLY A 62 -5.231 12.183 -4.729 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -6.111 14.790 -5.082 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -5.673 14.664 -3.390 1.00 0.00 H new ATOM 1118 N ASN A 63 -3.255 14.951 -3.824 1.00 0.00 N ATOM 1119 CA ASN A 63 -1.832 15.162 -4.057 1.00 0.00 C ATOM 1120 C ASN A 63 -1.150 13.862 -4.475 1.00 0.00 C ATOM 1121 O ASN A 63 -1.789 12.812 -4.554 1.00 0.00 O ATOM 1122 CB ASN A 63 -1.164 15.718 -2.797 1.00 0.00 C ATOM 1123 CG ASN A 63 0.041 16.583 -3.116 1.00 0.00 C ATOM 1124 OD1 ASN A 63 1.183 16.171 -2.915 1.00 0.00 O ATOM 1125 ND2 ASN A 63 -0.211 17.788 -3.614 1.00 0.00 N ATOM 0 H ASN A 63 -3.584 15.267 -2.912 1.00 0.00 H new ATOM 0 HA ASN A 63 -1.726 15.885 -4.866 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.889 16.304 -2.233 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -0.855 14.891 -2.157 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.559 18.415 -3.847 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -1.175 18.087 -3.764 1.00 0.00 H new ATOM 1132 N ARG A 64 0.149 13.941 -4.741 1.00 0.00 N ATOM 1133 CA ARG A 64 0.917 12.771 -5.151 1.00 0.00 C ATOM 1134 C ARG A 64 1.405 11.987 -3.936 1.00 0.00 C ATOM 1135 O ARG A 64 2.414 11.284 -4.001 1.00 0.00 O ATOM 1136 CB ARG A 64 2.109 13.194 -6.012 1.00 0.00 C ATOM 1137 CG ARG A 64 2.610 12.098 -6.938 1.00 0.00 C ATOM 1138 CD ARG A 64 3.809 12.560 -7.751 1.00 0.00 C ATOM 1139 NE ARG A 64 4.967 12.842 -6.907 1.00 0.00 N ATOM 1140 CZ ARG A 64 5.171 14.008 -6.304 1.00 0.00 C ATOM 1141 NH1 ARG A 64 4.298 14.995 -6.450 1.00 0.00 N ATOM 1142 NH2 ARG A 64 6.249 14.188 -5.551 1.00 0.00 N ATOM 0 H ARG A 64 0.692 14.802 -4.680 1.00 0.00 H new ATOM 0 HA ARG A 64 0.264 12.126 -5.738 1.00 0.00 H new ATOM 0 HB2 ARG A 64 1.826 14.061 -6.609 1.00 0.00 H new ATOM 0 HB3 ARG A 64 2.924 13.508 -5.360 1.00 0.00 H new ATOM 0 HG2 ARG A 64 2.883 11.221 -6.351 1.00 0.00 H new ATOM 0 HG3 ARG A 64 1.808 11.794 -7.611 1.00 0.00 H new ATOM 0 HD2 ARG A 64 4.070 11.793 -8.480 1.00 0.00 H new ATOM 0 HD3 ARG A 64 3.543 13.456 -8.312 1.00 0.00 H new ATOM 0 HE ARG A 64 5.657 12.103 -6.773 1.00 0.00 H new ATOM 0 HH11 ARG A 64 3.467 14.860 -7.026 1.00 0.00 H new ATOM 0 HH12 ARG A 64 4.457 15.889 -5.986 1.00 0.00 H new ATOM 0 HH21 ARG A 64 6.922 13.431 -5.435 1.00 0.00 H new ATOM 0 HH22 ARG A 64 6.404 15.084 -5.089 1.00 0.00 H new ATOM 1156 N LYS A 65 0.684 12.115 -2.828 1.00 0.00 N ATOM 1157 CA LYS A 65 1.042 11.419 -1.597 1.00 0.00 C ATOM 1158 C LYS A 65 0.629 9.952 -1.662 1.00 0.00 C ATOM 1159 O LYS A 65 1.273 9.091 -1.065 1.00 0.00 O ATOM 1160 CB LYS A 65 0.378 12.093 -0.394 1.00 0.00 C ATOM 1161 CG LYS A 65 0.609 11.362 0.917 1.00 0.00 C ATOM 1162 CD LYS A 65 1.884 11.829 1.599 1.00 0.00 C ATOM 1163 CE LYS A 65 1.694 13.181 2.270 1.00 0.00 C ATOM 1164 NZ LYS A 65 2.627 13.368 3.415 1.00 0.00 N ATOM 0 H LYS A 65 -0.152 12.694 -2.757 1.00 0.00 H new ATOM 0 HA LYS A 65 2.125 11.469 -1.482 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.756 13.111 -0.304 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.694 12.166 -0.575 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -0.240 11.526 1.580 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.667 10.289 0.731 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.191 11.093 2.342 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.687 11.895 0.865 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.852 13.974 1.539 1.00 0.00 H new ATOM 0 HE3 LYS A 65 0.666 13.271 2.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.466 14.301 3.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.459 12.626 4.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.609 13.308 3.076 1.00 0.00 H new ATOM 1178 N GLU A 66 -0.447 9.676 -2.392 1.00 0.00 N ATOM 1179 CA GLU A 66 -0.943 8.312 -2.535 1.00 0.00 C ATOM 1180 C GLU A 66 0.137 7.397 -3.102 1.00 0.00 C ATOM 1181 O GLU A 66 0.126 6.186 -2.870 1.00 0.00 O ATOM 1182 CB GLU A 66 -2.175 8.287 -3.441 1.00 0.00 C ATOM 1183 CG GLU A 66 -1.857 8.513 -4.909 1.00 0.00 C ATOM 1184 CD GLU A 66 -3.047 9.029 -5.693 1.00 0.00 C ATOM 1185 OE1 GLU A 66 -3.998 8.248 -5.912 1.00 0.00 O ATOM 1186 OE2 GLU A 66 -3.030 10.214 -6.086 1.00 0.00 O ATOM 0 H GLU A 66 -0.992 10.378 -2.893 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.220 7.948 -1.546 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -2.677 7.326 -3.331 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -2.876 9.053 -3.108 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -1.036 9.225 -4.993 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -1.514 7.577 -5.351 1.00 0.00 H new ATOM 1193 N LEU A 67 1.069 7.981 -3.846 1.00 0.00 N ATOM 1194 CA LEU A 67 2.158 7.219 -4.447 1.00 0.00 C ATOM 1195 C LEU A 67 3.133 6.729 -3.381 1.00 0.00 C ATOM 1196 O LEU A 67 3.490 5.551 -3.348 1.00 0.00 O ATOM 1197 CB LEU A 67 2.898 8.074 -5.477 1.00 0.00 C ATOM 1198 CG LEU A 67 2.352 8.029 -6.905 1.00 0.00 C ATOM 1199 CD1 LEU A 67 1.135 8.930 -7.039 1.00 0.00 C ATOM 1200 CD2 LEU A 67 3.430 8.432 -7.901 1.00 0.00 C ATOM 0 H LEU A 67 1.093 8.981 -4.048 1.00 0.00 H new ATOM 0 HA LEU A 67 1.728 6.351 -4.947 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.884 9.109 -5.137 1.00 0.00 H new ATOM 0 HB3 LEU A 67 3.941 7.759 -5.498 1.00 0.00 H new ATOM 0 HG LEU A 67 2.047 7.006 -7.125 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.760 8.885 -8.062 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.357 8.596 -6.352 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.414 9.956 -6.799 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.024 8.394 -8.912 1.00 0.00 H new ATOM 0 HD22 LEU A 67 3.766 9.446 -7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.273 7.745 -7.823 1.00 0.00 H new ATOM 1212 N ALA A 68 3.558 7.639 -2.511 1.00 0.00 N ATOM 1213 CA ALA A 68 4.488 7.298 -1.443 1.00 0.00 C ATOM 1214 C ALA A 68 3.859 6.315 -0.460 1.00 0.00 C ATOM 1215 O ALA A 68 4.499 5.355 -0.030 1.00 0.00 O ATOM 1216 CB ALA A 68 4.941 8.557 -0.717 1.00 0.00 C ATOM 0 H ALA A 68 3.273 8.618 -2.525 1.00 0.00 H new ATOM 0 HA ALA A 68 5.357 6.817 -1.891 1.00 0.00 H new ATOM 0 HB1 ALA A 68 5.636 8.288 0.079 1.00 0.00 H new ATOM 0 HB2 ALA A 68 5.437 9.225 -1.421 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.075 9.061 -0.288 1.00 0.00 H new ATOM 1222 N THR A 69 2.601 6.563 -0.107 1.00 0.00 N ATOM 1223 CA THR A 69 1.886 5.702 0.826 1.00 0.00 C ATOM 1224 C THR A 69 1.653 4.318 0.229 1.00 0.00 C ATOM 1225 O THR A 69 1.751 3.306 0.924 1.00 0.00 O ATOM 1226 CB THR A 69 0.529 6.310 1.227 1.00 0.00 C ATOM 1227 OG1 THR A 69 0.724 7.617 1.780 1.00 0.00 O ATOM 1228 CG2 THR A 69 -0.184 5.427 2.239 1.00 0.00 C ATOM 0 H THR A 69 2.057 7.353 -0.454 1.00 0.00 H new ATOM 0 HA THR A 69 2.511 5.612 1.714 1.00 0.00 H new ATOM 0 HB THR A 69 -0.091 6.381 0.333 1.00 0.00 H new ATOM 0 HG1 THR A 69 0.384 7.638 2.699 1.00 0.00 H new ATOM 0 HG21 THR A 69 -1.140 5.878 2.506 1.00 0.00 H new ATOM 0 HG22 THR A 69 -0.356 4.442 1.805 1.00 0.00 H new ATOM 0 HG23 THR A 69 0.432 5.327 3.132 1.00 0.00 H new ATOM 1236 N VAL A 70 1.345 4.281 -1.063 1.00 0.00 N ATOM 1237 CA VAL A 70 1.099 3.020 -1.754 1.00 0.00 C ATOM 1238 C VAL A 70 2.348 2.146 -1.762 1.00 0.00 C ATOM 1239 O VAL A 70 2.268 0.930 -1.585 1.00 0.00 O ATOM 1240 CB VAL A 70 0.642 3.256 -3.206 1.00 0.00 C ATOM 1241 CG1 VAL A 70 0.798 1.986 -4.028 1.00 0.00 C ATOM 1242 CG2 VAL A 70 -0.797 3.748 -3.238 1.00 0.00 C ATOM 0 H VAL A 70 1.260 5.109 -1.653 1.00 0.00 H new ATOM 0 HA VAL A 70 0.305 2.510 -1.209 1.00 0.00 H new ATOM 0 HB VAL A 70 1.275 4.026 -3.647 1.00 0.00 H new ATOM 0 HG11 VAL A 70 0.470 2.172 -5.051 1.00 0.00 H new ATOM 0 HG12 VAL A 70 1.845 1.681 -4.032 1.00 0.00 H new ATOM 0 HG13 VAL A 70 0.191 1.193 -3.591 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -1.103 3.910 -4.272 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -1.447 3.003 -2.779 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -0.874 4.685 -2.686 1.00 0.00 H new ATOM 1252 N ARG A 71 3.501 2.773 -1.966 1.00 0.00 N ATOM 1253 CA ARG A 71 4.768 2.051 -1.998 1.00 0.00 C ATOM 1254 C ARG A 71 5.094 1.465 -0.627 1.00 0.00 C ATOM 1255 O ARG A 71 5.519 0.314 -0.516 1.00 0.00 O ATOM 1256 CB ARG A 71 5.897 2.980 -2.449 1.00 0.00 C ATOM 1257 CG ARG A 71 6.093 3.013 -3.956 1.00 0.00 C ATOM 1258 CD ARG A 71 7.314 3.833 -4.340 1.00 0.00 C ATOM 1259 NE ARG A 71 8.475 3.504 -3.518 1.00 0.00 N ATOM 1260 CZ ARG A 71 8.723 4.061 -2.339 1.00 0.00 C ATOM 1261 NH1 ARG A 71 7.895 4.971 -1.845 1.00 0.00 N ATOM 1262 NH2 ARG A 71 9.801 3.709 -1.650 1.00 0.00 N ATOM 0 H ARG A 71 3.585 3.779 -2.112 1.00 0.00 H new ATOM 0 HA ARG A 71 4.674 1.232 -2.711 1.00 0.00 H new ATOM 0 HB2 ARG A 71 5.688 3.990 -2.096 1.00 0.00 H new ATOM 0 HB3 ARG A 71 6.827 2.663 -1.977 1.00 0.00 H new ATOM 0 HG2 ARG A 71 6.203 1.996 -4.332 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.207 3.434 -4.430 1.00 0.00 H new ATOM 0 HD2 ARG A 71 7.552 3.659 -5.389 1.00 0.00 H new ATOM 0 HD3 ARG A 71 7.085 4.894 -4.236 1.00 0.00 H new ATOM 0 HE ARG A 71 9.132 2.807 -3.869 1.00 0.00 H new ATOM 0 HH11 ARG A 71 7.065 5.245 -2.371 1.00 0.00 H new ATOM 0 HH12 ARG A 71 8.088 5.398 -0.939 1.00 0.00 H new ATOM 0 HH21 ARG A 71 10.441 3.009 -2.026 1.00 0.00 H new ATOM 0 HH22 ARG A 71 9.990 4.138 -0.744 1.00 0.00 H new ATOM 1276 N THR A 72 4.892 2.264 0.416 1.00 0.00 N ATOM 1277 CA THR A 72 5.166 1.826 1.779 1.00 0.00 C ATOM 1278 C THR A 72 4.245 0.681 2.183 1.00 0.00 C ATOM 1279 O THR A 72 4.704 -0.355 2.668 1.00 0.00 O ATOM 1280 CB THR A 72 5.001 2.982 2.784 1.00 0.00 C ATOM 1281 OG1 THR A 72 5.844 4.078 2.413 1.00 0.00 O ATOM 1282 CG2 THR A 72 5.346 2.526 4.194 1.00 0.00 C ATOM 0 H THR A 72 4.539 3.218 0.343 1.00 0.00 H new ATOM 0 HA THR A 72 6.200 1.482 1.799 1.00 0.00 H new ATOM 0 HB THR A 72 3.960 3.303 2.767 1.00 0.00 H new ATOM 0 HG1 THR A 72 5.467 4.531 1.630 1.00 0.00 H new ATOM 0 HG21 THR A 72 5.222 3.359 4.886 1.00 0.00 H new ATOM 0 HG22 THR A 72 4.684 1.711 4.485 1.00 0.00 H new ATOM 0 HG23 THR A 72 6.380 2.181 4.222 1.00 0.00 H new ATOM 1290 N ILE A 73 2.946 0.872 1.981 1.00 0.00 N ATOM 1291 CA ILE A 73 1.962 -0.147 2.323 1.00 0.00 C ATOM 1292 C ILE A 73 2.160 -1.406 1.486 1.00 0.00 C ATOM 1293 O ILE A 73 2.150 -2.521 2.010 1.00 0.00 O ATOM 1294 CB ILE A 73 0.525 0.368 2.122 1.00 0.00 C ATOM 1295 CG1 ILE A 73 0.225 1.504 3.101 1.00 0.00 C ATOM 1296 CG2 ILE A 73 -0.474 -0.766 2.296 1.00 0.00 C ATOM 1297 CD1 ILE A 73 -1.178 2.055 2.977 1.00 0.00 C ATOM 0 H ILE A 73 2.550 1.723 1.582 1.00 0.00 H new ATOM 0 HA ILE A 73 2.110 -0.387 3.376 1.00 0.00 H new ATOM 0 HB ILE A 73 0.433 0.755 1.107 1.00 0.00 H new ATOM 0 HG12 ILE A 73 0.377 1.145 4.119 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.939 2.311 2.938 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.485 -0.386 2.151 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.271 -1.546 1.562 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -0.383 -1.180 3.300 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.319 2.857 3.702 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -1.328 2.445 1.970 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -1.899 1.261 3.170 1.00 0.00 H new ATOM 1309 N CYS A 74 2.343 -1.221 0.183 1.00 0.00 N ATOM 1310 CA CYS A 74 2.546 -2.343 -0.728 1.00 0.00 C ATOM 1311 C CYS A 74 3.782 -3.146 -0.335 1.00 0.00 C ATOM 1312 O CYS A 74 3.795 -4.372 -0.434 1.00 0.00 O ATOM 1313 CB CYS A 74 2.684 -1.841 -2.165 1.00 0.00 C ATOM 1314 SG CYS A 74 1.111 -1.451 -2.966 1.00 0.00 S ATOM 0 H CYS A 74 2.355 -0.305 -0.266 1.00 0.00 H new ATOM 0 HA CYS A 74 1.675 -2.996 -0.661 1.00 0.00 H new ATOM 0 HB2 CYS A 74 3.312 -0.950 -2.168 1.00 0.00 H new ATOM 0 HB3 CYS A 74 3.202 -2.598 -2.755 1.00 0.00 H new ATOM 0 HG CYS A 74 1.336 -0.956 -4.147 1.00 0.00 H new ATOM 1320 N SER A 75 4.820 -2.444 0.110 1.00 0.00 N ATOM 1321 CA SER A 75 6.063 -3.091 0.512 1.00 0.00 C ATOM 1322 C SER A 75 5.851 -3.952 1.754 1.00 0.00 C ATOM 1323 O SER A 75 6.386 -5.056 1.857 1.00 0.00 O ATOM 1324 CB SER A 75 7.144 -2.043 0.783 1.00 0.00 C ATOM 1325 OG SER A 75 8.301 -2.637 1.345 1.00 0.00 O ATOM 0 H SER A 75 4.824 -1.428 0.201 1.00 0.00 H new ATOM 0 HA SER A 75 6.388 -3.736 -0.305 1.00 0.00 H new ATOM 0 HB2 SER A 75 7.406 -1.538 -0.147 1.00 0.00 H new ATOM 0 HB3 SER A 75 6.756 -1.283 1.461 1.00 0.00 H new ATOM 0 HG SER A 75 8.977 -1.947 1.507 1.00 0.00 H new ATOM 1331 N HIS A 76 5.065 -3.438 2.695 1.00 0.00 N ATOM 1332 CA HIS A 76 4.780 -4.159 3.930 1.00 0.00 C ATOM 1333 C HIS A 76 4.076 -5.481 3.639 1.00 0.00 C ATOM 1334 O HIS A 76 4.450 -6.526 4.171 1.00 0.00 O ATOM 1335 CB HIS A 76 3.918 -3.303 4.858 1.00 0.00 C ATOM 1336 CG HIS A 76 4.645 -2.128 5.437 1.00 0.00 C ATOM 1337 ND1 HIS A 76 5.860 -2.237 6.080 1.00 0.00 N ATOM 1338 CD2 HIS A 76 4.323 -0.814 5.464 1.00 0.00 C ATOM 1339 CE1 HIS A 76 6.252 -1.040 6.480 1.00 0.00 C ATOM 1340 NE2 HIS A 76 5.338 -0.159 6.118 1.00 0.00 N ATOM 0 H HIS A 76 4.615 -2.525 2.626 1.00 0.00 H new ATOM 0 HA HIS A 76 5.729 -4.374 4.422 1.00 0.00 H new ATOM 0 HB2 HIS A 76 3.049 -2.946 4.306 1.00 0.00 H new ATOM 0 HB3 HIS A 76 3.545 -3.926 5.671 1.00 0.00 H new ATOM 0 HD1 HIS A 76 6.375 -3.105 6.224 1.00 0.00 H new ATOM 0 HD2 HIS A 76 3.433 -0.364 5.049 1.00 0.00 H new ATOM 0 HE1 HIS A 76 7.165 -0.820 7.013 1.00 0.00 H new ATOM 1348 N VAL A 77 3.055 -5.427 2.790 1.00 0.00 N ATOM 1349 CA VAL A 77 2.299 -6.620 2.426 1.00 0.00 C ATOM 1350 C VAL A 77 3.168 -7.609 1.659 1.00 0.00 C ATOM 1351 O VAL A 77 3.198 -8.798 1.974 1.00 0.00 O ATOM 1352 CB VAL A 77 1.067 -6.265 1.572 1.00 0.00 C ATOM 1353 CG1 VAL A 77 0.287 -7.519 1.212 1.00 0.00 C ATOM 1354 CG2 VAL A 77 0.182 -5.266 2.303 1.00 0.00 C ATOM 0 H VAL A 77 2.732 -4.570 2.341 1.00 0.00 H new ATOM 0 HA VAL A 77 1.966 -7.080 3.357 1.00 0.00 H new ATOM 0 HB VAL A 77 1.409 -5.802 0.646 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -0.579 -7.248 0.609 1.00 0.00 H new ATOM 0 HG12 VAL A 77 0.927 -8.195 0.645 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -0.046 -8.014 2.124 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -0.683 -5.026 1.685 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -0.154 -5.699 3.246 1.00 0.00 H new ATOM 0 HG23 VAL A 77 0.748 -4.356 2.503 1.00 0.00 H new ATOM 1364 N GLN A 78 3.876 -7.108 0.651 1.00 0.00 N ATOM 1365 CA GLN A 78 4.746 -7.950 -0.163 1.00 0.00 C ATOM 1366 C GLN A 78 5.838 -8.586 0.690 1.00 0.00 C ATOM 1367 O GLN A 78 6.167 -9.759 0.521 1.00 0.00 O ATOM 1368 CB GLN A 78 5.375 -7.129 -1.290 1.00 0.00 C ATOM 1369 CG GLN A 78 4.381 -6.704 -2.360 1.00 0.00 C ATOM 1370 CD GLN A 78 3.847 -7.875 -3.158 1.00 0.00 C ATOM 1371 OE1 GLN A 78 2.835 -8.546 -2.621 1.00 0.00 O flip ATOM 1372 NE2 GLN A 78 4.338 -8.174 -4.248 1.00 0.00 N flip ATOM 0 H GLN A 78 3.864 -6.125 0.379 1.00 0.00 H new ATOM 0 HA GLN A 78 4.140 -8.745 -0.597 1.00 0.00 H new ATOM 0 HB2 GLN A 78 5.841 -6.240 -0.865 1.00 0.00 H new ATOM 0 HB3 GLN A 78 6.169 -7.713 -1.755 1.00 0.00 H new ATOM 0 HG2 GLN A 78 3.549 -6.180 -1.890 1.00 0.00 H new ATOM 0 HG3 GLN A 78 4.861 -5.997 -3.037 1.00 0.00 H new ATOM 0 HE21 GLN A 78 5.115 -7.631 -4.623 1.00 0.00 H new ATOM 0 HE22 GLN A 78 3.967 -8.965 -4.775 1.00 0.00 H new ATOM 1381 N ASN A 79 6.399 -7.803 1.606 1.00 0.00 N ATOM 1382 CA ASN A 79 7.457 -8.290 2.484 1.00 0.00 C ATOM 1383 C ASN A 79 6.935 -9.391 3.404 1.00 0.00 C ATOM 1384 O ASN A 79 7.637 -10.362 3.684 1.00 0.00 O ATOM 1385 CB ASN A 79 8.025 -7.140 3.319 1.00 0.00 C ATOM 1386 CG ASN A 79 9.426 -7.431 3.823 1.00 0.00 C ATOM 1387 OD1 ASN A 79 9.922 -8.551 3.703 1.00 0.00 O ATOM 1388 ND2 ASN A 79 10.071 -6.420 4.394 1.00 0.00 N ATOM 0 H ASN A 79 6.139 -6.829 1.760 1.00 0.00 H new ATOM 0 HA ASN A 79 8.250 -8.705 1.862 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.039 -6.230 2.718 1.00 0.00 H new ATOM 0 HB3 ASN A 79 7.368 -6.951 4.168 1.00 0.00 H new ATOM 0 HD21 ASN A 79 11.016 -6.556 4.754 1.00 0.00 H new ATOM 0 HD22 ASN A 79 9.622 -5.508 4.473 1.00 0.00 H new ATOM 1395 N MET A 80 5.701 -9.230 3.869 1.00 0.00 N ATOM 1396 CA MET A 80 5.086 -10.211 4.756 1.00 0.00 C ATOM 1397 C MET A 80 4.932 -11.557 4.054 1.00 0.00 C ATOM 1398 O MET A 80 5.266 -12.601 4.615 1.00 0.00 O ATOM 1399 CB MET A 80 3.720 -9.713 5.233 1.00 0.00 C ATOM 1400 CG MET A 80 3.805 -8.554 6.214 1.00 0.00 C ATOM 1401 SD MET A 80 2.267 -7.620 6.321 1.00 0.00 S ATOM 1402 CE MET A 80 1.458 -8.455 7.683 1.00 0.00 C ATOM 0 H MET A 80 5.107 -8.431 3.647 1.00 0.00 H new ATOM 0 HA MET A 80 5.739 -10.343 5.619 1.00 0.00 H new ATOM 0 HB2 MET A 80 3.133 -9.404 4.368 1.00 0.00 H new ATOM 0 HB3 MET A 80 3.185 -10.538 5.703 1.00 0.00 H new ATOM 0 HG2 MET A 80 4.062 -8.937 7.201 1.00 0.00 H new ATOM 0 HG3 MET A 80 4.611 -7.886 5.912 1.00 0.00 H new ATOM 0 HE1 MET A 80 0.690 -7.806 8.103 1.00 0.00 H new ATOM 0 HE2 MET A 80 0.999 -9.376 7.324 1.00 0.00 H new ATOM 0 HE3 MET A 80 2.193 -8.692 8.452 1.00 0.00 H new ATOM 1412 N ILE A 81 4.425 -11.524 2.827 1.00 0.00 N ATOM 1413 CA ILE A 81 4.229 -12.742 2.050 1.00 0.00 C ATOM 1414 C ILE A 81 5.546 -13.481 1.844 1.00 0.00 C ATOM 1415 O ILE A 81 5.641 -14.684 2.092 1.00 0.00 O ATOM 1416 CB ILE A 81 3.603 -12.438 0.675 1.00 0.00 C ATOM 1417 CG1 ILE A 81 2.268 -11.712 0.848 1.00 0.00 C ATOM 1418 CG2 ILE A 81 3.415 -13.722 -0.117 1.00 0.00 C ATOM 1419 CD1 ILE A 81 1.804 -10.995 -0.401 1.00 0.00 C ATOM 0 H ILE A 81 4.143 -10.668 2.349 1.00 0.00 H new ATOM 0 HA ILE A 81 3.547 -13.373 2.620 1.00 0.00 H new ATOM 0 HB ILE A 81 4.279 -11.788 0.120 1.00 0.00 H new ATOM 0 HG12 ILE A 81 1.507 -12.433 1.147 1.00 0.00 H new ATOM 0 HG13 ILE A 81 2.359 -10.990 1.659 1.00 0.00 H new ATOM 0 HG21 ILE A 81 2.972 -13.490 -1.086 1.00 0.00 H new ATOM 0 HG22 ILE A 81 4.382 -14.203 -0.266 1.00 0.00 H new ATOM 0 HG23 ILE A 81 2.756 -14.395 0.432 1.00 0.00 H new ATOM 0 HD11 ILE A 81 0.851 -10.503 -0.205 1.00 0.00 H new ATOM 0 HD12 ILE A 81 2.545 -10.250 -0.689 1.00 0.00 H new ATOM 0 HD13 ILE A 81 1.681 -11.716 -1.210 1.00 0.00 H new ATOM 1431 N LYS A 82 6.561 -12.754 1.389 1.00 0.00 N ATOM 1432 CA LYS A 82 7.876 -13.340 1.153 1.00 0.00 C ATOM 1433 C LYS A 82 8.492 -13.839 2.455 1.00 0.00 C ATOM 1434 O LYS A 82 9.203 -14.843 2.473 1.00 0.00 O ATOM 1435 CB LYS A 82 8.803 -12.313 0.498 1.00 0.00 C ATOM 1436 CG LYS A 82 10.277 -12.573 0.757 1.00 0.00 C ATOM 1437 CD LYS A 82 11.159 -11.710 -0.130 1.00 0.00 C ATOM 1438 CE LYS A 82 11.179 -12.221 -1.563 1.00 0.00 C ATOM 1439 NZ LYS A 82 11.785 -11.232 -2.496 1.00 0.00 N ATOM 0 H LYS A 82 6.499 -11.758 1.176 1.00 0.00 H new ATOM 0 HA LYS A 82 7.752 -14.190 0.482 1.00 0.00 H new ATOM 0 HB2 LYS A 82 8.626 -12.310 -0.578 1.00 0.00 H new ATOM 0 HB3 LYS A 82 8.548 -11.319 0.865 1.00 0.00 H new ATOM 0 HG2 LYS A 82 10.505 -12.372 1.804 1.00 0.00 H new ATOM 0 HG3 LYS A 82 10.499 -13.625 0.579 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.797 -10.682 -0.114 1.00 0.00 H new ATOM 0 HD3 LYS A 82 12.174 -11.697 0.267 1.00 0.00 H new ATOM 0 HE2 LYS A 82 11.741 -13.154 -1.608 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.161 -12.446 -1.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.780 -11.618 -3.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 11.234 -10.350 -2.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.765 -11.036 -2.206 1.00 0.00 H new ATOM 1453 N GLY A 83 8.214 -13.131 3.547 1.00 0.00 N ATOM 1454 CA GLY A 83 8.748 -13.519 4.839 1.00 0.00 C ATOM 1455 C GLY A 83 8.082 -14.764 5.391 1.00 0.00 C ATOM 1456 O GLY A 83 8.666 -15.479 6.206 1.00 0.00 O ATOM 0 H GLY A 83 7.628 -12.296 3.559 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.820 -13.694 4.748 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.618 -12.698 5.544 1.00 0.00 H new ATOM 1460 N VAL A 84 6.856 -15.025 4.947 1.00 0.00 N ATOM 1461 CA VAL A 84 6.111 -16.192 5.403 1.00 0.00 C ATOM 1462 C VAL A 84 6.149 -17.307 4.364 1.00 0.00 C ATOM 1463 O VAL A 84 5.698 -18.425 4.619 1.00 0.00 O ATOM 1464 CB VAL A 84 4.644 -15.837 5.706 1.00 0.00 C ATOM 1465 CG1 VAL A 84 4.566 -14.725 6.740 1.00 0.00 C ATOM 1466 CG2 VAL A 84 3.916 -15.441 4.429 1.00 0.00 C ATOM 0 H VAL A 84 6.358 -14.444 4.272 1.00 0.00 H new ATOM 0 HA VAL A 84 6.590 -16.537 6.319 1.00 0.00 H new ATOM 0 HB VAL A 84 4.153 -16.719 6.118 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.521 -14.488 6.941 1.00 0.00 H new ATOM 0 HG12 VAL A 84 5.048 -15.051 7.662 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.073 -13.838 6.359 1.00 0.00 H new ATOM 0 HG21 VAL A 84 2.880 -15.193 4.662 1.00 0.00 H new ATOM 0 HG22 VAL A 84 4.405 -14.574 3.985 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.940 -16.272 3.724 1.00 0.00 H new ATOM 1476 N THR A 85 6.690 -16.997 3.189 1.00 0.00 N ATOM 1477 CA THR A 85 6.786 -17.973 2.111 1.00 0.00 C ATOM 1478 C THR A 85 8.239 -18.344 1.834 1.00 0.00 C ATOM 1479 O THR A 85 8.523 -19.406 1.277 1.00 0.00 O ATOM 1480 CB THR A 85 6.147 -17.441 0.814 1.00 0.00 C ATOM 1481 OG1 THR A 85 6.741 -16.188 0.453 1.00 0.00 O ATOM 1482 CG2 THR A 85 4.645 -17.266 0.982 1.00 0.00 C ATOM 0 H THR A 85 7.068 -16.078 2.961 1.00 0.00 H new ATOM 0 HA THR A 85 6.243 -18.860 2.437 1.00 0.00 H new ATOM 0 HB THR A 85 6.325 -18.169 0.023 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.095 -15.466 0.599 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.216 -16.889 0.053 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.192 -18.227 1.228 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.449 -16.556 1.786 1.00 0.00 H new ATOM 1490 N LEU A 86 9.154 -17.465 2.225 1.00 0.00 N ATOM 1491 CA LEU A 86 10.579 -17.701 2.019 1.00 0.00 C ATOM 1492 C LEU A 86 11.353 -17.532 3.323 1.00 0.00 C ATOM 1493 O LEU A 86 12.382 -18.173 3.532 1.00 0.00 O ATOM 1494 CB LEU A 86 11.126 -16.743 0.960 1.00 0.00 C ATOM 1495 CG LEU A 86 10.240 -16.518 -0.265 1.00 0.00 C ATOM 1496 CD1 LEU A 86 10.920 -15.582 -1.252 1.00 0.00 C ATOM 1497 CD2 LEU A 86 9.901 -17.844 -0.929 1.00 0.00 C ATOM 0 H LEU A 86 8.935 -16.582 2.687 1.00 0.00 H new ATOM 0 HA LEU A 86 10.706 -18.727 1.673 1.00 0.00 H new ATOM 0 HB2 LEU A 86 11.310 -15.778 1.432 1.00 0.00 H new ATOM 0 HB3 LEU A 86 12.091 -17.121 0.621 1.00 0.00 H new ATOM 0 HG LEU A 86 9.311 -16.052 0.063 1.00 0.00 H new ATOM 0 HD11 LEU A 86 10.274 -15.434 -2.117 1.00 0.00 H new ATOM 0 HD12 LEU A 86 11.109 -14.622 -0.772 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.865 -16.018 -1.575 1.00 0.00 H new ATOM 0 HD21 LEU A 86 9.270 -17.664 -1.799 1.00 0.00 H new ATOM 0 HD22 LEU A 86 10.820 -18.339 -1.243 1.00 0.00 H new ATOM 0 HD23 LEU A 86 9.370 -18.480 -0.221 1.00 0.00 H new ATOM 1509 N GLY A 87 10.848 -16.667 4.197 1.00 0.00 N ATOM 1510 CA GLY A 87 11.504 -16.431 5.471 1.00 0.00 C ATOM 1511 C GLY A 87 12.213 -15.093 5.518 1.00 0.00 C ATOM 1512 O GLY A 87 11.996 -14.300 6.434 1.00 0.00 O ATOM 0 H GLY A 87 9.997 -16.125 4.046 1.00 0.00 H new ATOM 0 HA2 GLY A 87 10.765 -16.475 6.271 1.00 0.00 H new ATOM 0 HA3 GLY A 87 12.224 -17.227 5.658 1.00 0.00 H new ATOM 1516 N SER A 88 13.066 -14.840 4.530 1.00 0.00 N ATOM 1517 CA SER A 88 13.814 -13.590 4.465 1.00 0.00 C ATOM 1518 C SER A 88 12.909 -12.400 4.767 1.00 0.00 C ATOM 1519 O SER A 88 11.694 -12.466 4.583 1.00 0.00 O ATOM 1520 CB SER A 88 14.452 -13.424 3.085 1.00 0.00 C ATOM 1521 OG SER A 88 15.585 -12.576 3.146 1.00 0.00 O ATOM 0 H SER A 88 13.256 -15.485 3.763 1.00 0.00 H new ATOM 0 HA SER A 88 14.601 -13.626 5.218 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.744 -14.399 2.696 1.00 0.00 H new ATOM 0 HB3 SER A 88 13.721 -13.010 2.390 1.00 0.00 H new ATOM 0 HG SER A 88 15.976 -12.487 2.252 1.00 0.00 H new ATOM 1527 N GLY A 89 13.511 -11.310 5.232 1.00 0.00 N ATOM 1528 CA GLY A 89 12.746 -10.119 5.552 1.00 0.00 C ATOM 1529 C GLY A 89 12.920 -9.688 6.995 1.00 0.00 C ATOM 1530 O GLY A 89 13.900 -9.037 7.357 1.00 0.00 O ATOM 0 H GLY A 89 14.515 -11.230 5.393 1.00 0.00 H new ATOM 0 HA2 GLY A 89 13.053 -9.306 4.894 1.00 0.00 H new ATOM 0 HA3 GLY A 89 11.690 -10.306 5.357 1.00 0.00 H new ATOM 1534 N PRO A 90 11.950 -10.055 7.846 1.00 0.00 N ATOM 1535 CA PRO A 90 11.977 -9.712 9.271 1.00 0.00 C ATOM 1536 C PRO A 90 13.062 -10.468 10.029 1.00 0.00 C ATOM 1537 O PRO A 90 13.205 -11.682 9.881 1.00 0.00 O ATOM 1538 CB PRO A 90 10.589 -10.132 9.763 1.00 0.00 C ATOM 1539 CG PRO A 90 10.157 -11.197 8.816 1.00 0.00 C ATOM 1540 CD PRO A 90 10.753 -10.832 7.483 1.00 0.00 C ATOM 0 HA PRO A 90 12.201 -8.657 9.432 1.00 0.00 H new ATOM 0 HB2 PRO A 90 10.628 -10.505 10.787 1.00 0.00 H new ATOM 0 HB3 PRO A 90 9.895 -9.291 9.756 1.00 0.00 H new ATOM 0 HG2 PRO A 90 10.505 -12.176 9.144 1.00 0.00 H new ATOM 0 HG3 PRO A 90 9.070 -11.249 8.756 1.00 0.00 H new ATOM 0 HD2 PRO A 90 11.010 -11.718 6.902 1.00 0.00 H new ATOM 0 HD3 PRO A 90 10.060 -10.245 6.880 1.00 0.00 H new ATOM 1548 N SER A 91 13.824 -9.745 10.843 1.00 0.00 N ATOM 1549 CA SER A 91 14.899 -10.347 11.622 1.00 0.00 C ATOM 1550 C SER A 91 14.456 -11.679 12.219 1.00 0.00 C ATOM 1551 O SER A 91 13.805 -11.717 13.263 1.00 0.00 O ATOM 1552 CB SER A 91 15.344 -9.398 12.736 1.00 0.00 C ATOM 1553 OG SER A 91 16.237 -10.042 13.628 1.00 0.00 O ATOM 0 H SER A 91 13.716 -8.740 10.980 1.00 0.00 H new ATOM 0 HA SER A 91 15.740 -10.530 10.954 1.00 0.00 H new ATOM 0 HB2 SER A 91 15.827 -8.523 12.301 1.00 0.00 H new ATOM 0 HB3 SER A 91 14.472 -9.041 13.284 1.00 0.00 H new ATOM 0 HG SER A 91 16.508 -9.414 14.330 1.00 0.00 H new ATOM 1559 N SER A 92 14.814 -12.770 11.549 1.00 0.00 N ATOM 1560 CA SER A 92 14.451 -14.104 12.011 1.00 0.00 C ATOM 1561 C SER A 92 14.683 -14.242 13.511 1.00 0.00 C ATOM 1562 O SER A 92 15.722 -13.833 14.031 1.00 0.00 O ATOM 1563 CB SER A 92 15.258 -15.164 11.259 1.00 0.00 C ATOM 1564 OG SER A 92 14.531 -16.375 11.146 1.00 0.00 O ATOM 0 H SER A 92 15.355 -12.756 10.684 1.00 0.00 H new ATOM 0 HA SER A 92 13.390 -14.254 11.810 1.00 0.00 H new ATOM 0 HB2 SER A 92 15.512 -14.795 10.265 1.00 0.00 H new ATOM 0 HB3 SER A 92 16.197 -15.348 11.780 1.00 0.00 H new ATOM 0 HG SER A 92 15.068 -17.035 10.660 1.00 0.00 H new ATOM 1570 N GLY A 93 13.707 -14.821 14.205 1.00 0.00 N ATOM 1571 CA GLY A 93 13.823 -15.002 15.640 1.00 0.00 C ATOM 1572 C GLY A 93 13.013 -13.987 16.420 1.00 0.00 C ATOM 1573 O GLY A 93 12.021 -14.334 17.060 1.00 0.00 O ATOM 0 H GLY A 93 12.838 -15.168 13.798 1.00 0.00 H new ATOM 0 HA2 GLY A 93 13.492 -16.006 15.904 1.00 0.00 H new ATOM 0 HA3 GLY A 93 14.871 -14.925 15.929 1.00 0.00 H new TER 1577 GLY A 93