USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1061 hydrogens (21 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 19 SER OG : rot -20:sc= 0.393 USER MOD Single : A 20 ASN : amide:sc= -0.0571 K(o=-0.057,f=-2!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot -100:sc= -0.0846 USER MOD Single : A 37 HIS : no HD1:sc= -9.8! C(o=-9.8!,f=-11!) USER MOD Single : A 49 LYS NZ :NH3+ -158:sc= -0.0219 (180deg=-0.249) USER MOD Single : B 19 SER OG : rot -22:sc= 0.394 USER MOD Single : B 20 ASN : amide:sc= -0.0433 K(o=-0.043,f=-1.9!) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 31 SER OG : rot -130:sc= 0 USER MOD Single : B 37 HIS : no HD1:sc= -9.69! C(o=-9.7!,f=-12!) USER MOD Single : B 49 LYS NZ :NH3+ -158:sc= -0.0198 (180deg=-0.242) USER MOD Single : C 19 SER OG : rot -40:sc= 0.376 USER MOD Single : C 20 ASN : amide:sc= -0.048 K(o=-0.048,f=-2!) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 180:sc= 0 USER MOD Single : C 31 SER OG : rot -120:sc= 0 USER MOD Single : C 37 HIS : no HD1:sc= -9.49! C(o=-9.5!,f=-11!) USER MOD Single : C 49 LYS NZ :NH3+ -157:sc= -0.0153 (180deg=-0.242) USER MOD Single : D 19 SER OG : rot -21:sc= 0.363 USER MOD Single : D 20 ASN : amide:sc= -0.0213 K(o=-0.021,f=-1.9!) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 180:sc= 0 USER MOD Single : D 31 SER OG : rot -120:sc= 0 USER MOD Single : D 37 HIS : no HD1:sc= -9.11! C(o=-9.1!,f=-11!) USER MOD Single : D 49 LYS NZ :NH3+ -159:sc= -0.0188 (180deg=-0.265) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -26.725 8.115 2.565 1.00 0.00 N ATOM 2 CA SER A 19 -25.606 8.403 3.507 1.00 0.00 C ATOM 3 C SER A 19 -24.286 7.997 2.863 1.00 0.00 C ATOM 4 O SER A 19 -23.214 8.222 3.427 1.00 0.00 O ATOM 5 CB SER A 19 -25.820 7.618 4.802 1.00 0.00 C ATOM 6 OG SER A 19 -26.204 6.286 4.486 1.00 0.00 O ATOM 0 HA SER A 19 -25.579 9.469 3.735 1.00 0.00 H new ATOM 0 HB2 SER A 19 -24.905 7.614 5.394 1.00 0.00 H new ATOM 0 HB3 SER A 19 -26.589 8.096 5.408 1.00 0.00 H new ATOM 0 HG SER A 19 -26.548 6.254 3.569 1.00 0.00 H new ATOM 14 N ASN A 20 -24.369 7.403 1.678 1.00 0.00 N ATOM 15 CA ASN A 20 -23.175 6.970 0.963 1.00 0.00 C ATOM 16 C ASN A 20 -22.300 8.169 0.609 1.00 0.00 C ATOM 17 O ASN A 20 -21.073 8.097 0.685 1.00 0.00 O ATOM 18 CB ASN A 20 -23.566 6.228 -0.314 1.00 0.00 C ATOM 19 CG ASN A 20 -24.166 4.869 0.034 1.00 0.00 C ATOM 20 OD1 ASN A 20 -23.987 4.378 1.149 1.00 0.00 O ATOM 21 ND2 ASN A 20 -24.866 4.227 -0.860 1.00 0.00 N ATOM 0 H ASN A 20 -25.246 7.211 1.194 1.00 0.00 H new ATOM 0 HA ASN A 20 -22.611 6.299 1.611 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -24.286 6.818 -0.881 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -22.691 6.096 -0.950 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -25.267 3.316 -0.636 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -25.013 4.636 -1.783 1.00 0.00 H new ATOM 28 N ASP A 21 -22.939 9.267 0.223 1.00 0.00 N ATOM 29 CA ASP A 21 -22.209 10.475 -0.145 1.00 0.00 C ATOM 30 C ASP A 21 -21.388 10.983 1.036 1.00 0.00 C ATOM 31 O ASP A 21 -20.243 11.403 0.873 1.00 0.00 O ATOM 32 CB ASP A 21 -23.191 11.561 -0.588 1.00 0.00 C ATOM 33 CG ASP A 21 -23.785 11.207 -1.947 1.00 0.00 C ATOM 34 OD1 ASP A 21 -23.235 10.340 -2.605 1.00 0.00 O ATOM 35 OD2 ASP A 21 -24.784 11.807 -2.308 1.00 0.00 O ATOM 0 H ASP A 21 -23.954 9.346 0.157 1.00 0.00 H new ATOM 0 HA ASP A 21 -21.535 10.235 -0.967 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -23.987 11.665 0.149 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -22.681 12.523 -0.645 1.00 0.00 H new ATOM 40 N SER A 22 -21.979 10.939 2.225 1.00 0.00 N ATOM 41 CA SER A 22 -21.290 11.397 3.426 1.00 0.00 C ATOM 42 C SER A 22 -20.018 10.592 3.653 1.00 0.00 C ATOM 43 O SER A 22 -18.969 11.150 3.981 1.00 0.00 O ATOM 44 CB SER A 22 -22.207 11.254 4.641 1.00 0.00 C ATOM 45 OG SER A 22 -21.663 11.987 5.730 1.00 0.00 O ATOM 0 H SER A 22 -22.926 10.594 2.383 1.00 0.00 H new ATOM 0 HA SER A 22 -21.025 12.446 3.291 1.00 0.00 H new ATOM 0 HB2 SER A 22 -23.205 11.622 4.403 1.00 0.00 H new ATOM 0 HB3 SER A 22 -22.311 10.203 4.911 1.00 0.00 H new ATOM 0 HG SER A 22 -22.250 11.898 6.510 1.00 0.00 H new ATOM 51 N SER A 23 -20.109 9.276 3.477 1.00 0.00 N ATOM 52 CA SER A 23 -18.955 8.399 3.663 1.00 0.00 C ATOM 53 C SER A 23 -18.968 7.282 2.632 1.00 0.00 C ATOM 54 O SER A 23 -19.855 6.429 2.638 1.00 0.00 O ATOM 55 CB SER A 23 -18.981 7.797 5.068 1.00 0.00 C ATOM 56 OG SER A 23 -19.003 8.849 6.023 1.00 0.00 O ATOM 0 H SER A 23 -20.967 8.794 3.207 1.00 0.00 H new ATOM 0 HA SER A 23 -18.047 8.988 3.536 1.00 0.00 H new ATOM 0 HB2 SER A 23 -19.858 7.161 5.189 1.00 0.00 H new ATOM 0 HB3 SER A 23 -18.106 7.166 5.223 1.00 0.00 H new ATOM 0 HG SER A 23 -19.021 8.470 6.927 1.00 0.00 H new ATOM 62 N ASP A 24 -17.979 7.298 1.743 1.00 0.00 N ATOM 63 CA ASP A 24 -17.887 6.279 0.697 1.00 0.00 C ATOM 64 C ASP A 24 -17.163 5.038 1.225 1.00 0.00 C ATOM 65 O ASP A 24 -16.344 5.129 2.140 1.00 0.00 O ATOM 66 CB ASP A 24 -17.136 6.847 -0.522 1.00 0.00 C ATOM 67 CG ASP A 24 -16.090 7.853 -0.066 1.00 0.00 C ATOM 68 OD1 ASP A 24 -16.472 8.835 0.550 1.00 0.00 O ATOM 69 OD2 ASP A 24 -14.923 7.632 -0.340 1.00 0.00 O ATOM 0 H ASP A 24 -17.236 7.997 1.723 1.00 0.00 H new ATOM 0 HA ASP A 24 -18.895 5.993 0.396 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -16.658 6.038 -1.074 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -17.840 7.325 -1.203 1.00 0.00 H new ATOM 74 N PRO A 25 -17.444 3.889 0.659 1.00 0.00 N ATOM 75 CA PRO A 25 -16.796 2.604 1.067 1.00 0.00 C ATOM 76 C PRO A 25 -15.302 2.588 0.740 1.00 0.00 C ATOM 77 O PRO A 25 -14.551 1.771 1.271 1.00 0.00 O ATOM 78 CB PRO A 25 -17.561 1.539 0.257 1.00 0.00 C ATOM 79 CG PRO A 25 -18.117 2.272 -0.922 1.00 0.00 C ATOM 80 CD PRO A 25 -18.417 3.686 -0.430 1.00 0.00 C ATOM 0 HA PRO A 25 -16.846 2.436 2.143 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -16.899 0.732 -0.057 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -18.355 1.087 0.851 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -17.402 2.288 -1.745 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -19.020 1.787 -1.293 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -18.289 4.422 -1.224 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -19.443 3.777 -0.073 1.00 0.00 H new ATOM 88 N LEU A 26 -14.882 3.492 -0.137 1.00 0.00 N ATOM 89 CA LEU A 26 -13.481 3.560 -0.529 1.00 0.00 C ATOM 90 C LEU A 26 -12.604 3.878 0.680 1.00 0.00 C ATOM 91 O LEU A 26 -11.530 3.299 0.848 1.00 0.00 O ATOM 92 CB LEU A 26 -13.294 4.639 -1.607 1.00 0.00 C ATOM 93 CG LEU A 26 -13.686 4.077 -2.977 1.00 0.00 C ATOM 94 CD1 LEU A 26 -15.133 3.586 -2.928 1.00 0.00 C ATOM 95 CD2 LEU A 26 -13.555 5.175 -4.033 1.00 0.00 C ATOM 0 H LEU A 26 -15.485 4.181 -0.586 1.00 0.00 H new ATOM 0 HA LEU A 26 -13.183 2.592 -0.932 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -13.906 5.510 -1.373 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -12.257 4.973 -1.624 1.00 0.00 H new ATOM 0 HG LEU A 26 -13.028 3.246 -3.233 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -15.415 3.186 -3.902 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -15.227 2.805 -2.174 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -15.791 4.417 -2.674 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -13.834 4.777 -5.009 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -14.214 6.005 -3.778 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -12.524 5.527 -4.066 1.00 0.00 H new ATOM 107 N VAL A 27 -13.063 4.800 1.517 1.00 0.00 N ATOM 108 CA VAL A 27 -12.300 5.179 2.698 1.00 0.00 C ATOM 109 C VAL A 27 -12.145 3.988 3.643 1.00 0.00 C ATOM 110 O VAL A 27 -11.042 3.681 4.104 1.00 0.00 O ATOM 111 CB VAL A 27 -13.013 6.323 3.424 1.00 0.00 C ATOM 112 CG1 VAL A 27 -12.275 6.644 4.727 1.00 0.00 C ATOM 113 CG2 VAL A 27 -13.035 7.564 2.529 1.00 0.00 C ATOM 0 H VAL A 27 -13.948 5.293 1.402 1.00 0.00 H new ATOM 0 HA VAL A 27 -11.309 5.505 2.384 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.036 6.023 3.652 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -12.784 7.459 5.242 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -12.264 5.761 5.366 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -11.251 6.941 4.501 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -13.543 8.377 3.047 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.013 7.864 2.297 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -13.565 7.336 1.604 1.00 0.00 H new ATOM 123 N VAL A 28 -13.257 3.316 3.923 1.00 0.00 N ATOM 124 CA VAL A 28 -13.238 2.159 4.810 1.00 0.00 C ATOM 125 C VAL A 28 -12.433 1.028 4.184 1.00 0.00 C ATOM 126 O VAL A 28 -11.631 0.377 4.856 1.00 0.00 O ATOM 127 CB VAL A 28 -14.667 1.687 5.093 1.00 0.00 C ATOM 128 CG1 VAL A 28 -14.626 0.402 5.926 1.00 0.00 C ATOM 129 CG2 VAL A 28 -15.419 2.772 5.870 1.00 0.00 C ATOM 0 H VAL A 28 -14.177 3.551 3.551 1.00 0.00 H new ATOM 0 HA VAL A 28 -12.768 2.449 5.750 1.00 0.00 H new ATOM 0 HB VAL A 28 -15.178 1.493 4.150 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -15.643 0.066 6.127 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -14.091 -0.372 5.375 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -14.115 0.596 6.869 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -16.436 2.436 6.072 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -14.907 2.965 6.813 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -15.449 3.688 5.279 1.00 0.00 H new ATOM 139 N ALA A 29 -12.654 0.798 2.894 1.00 0.00 N ATOM 140 CA ALA A 29 -11.944 -0.258 2.185 1.00 0.00 C ATOM 141 C ALA A 29 -10.448 0.017 2.175 1.00 0.00 C ATOM 142 O ALA A 29 -9.638 -0.896 2.314 1.00 0.00 O ATOM 143 CB ALA A 29 -12.458 -0.360 0.746 1.00 0.00 C ATOM 0 H ALA A 29 -13.314 1.325 2.322 1.00 0.00 H new ATOM 0 HA ALA A 29 -12.124 -1.201 2.701 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -11.922 -1.152 0.223 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -13.524 -0.589 0.756 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -12.295 0.588 0.233 1.00 0.00 H new ATOM 149 N ALA A 30 -10.082 1.284 2.015 1.00 0.00 N ATOM 150 CA ALA A 30 -8.673 1.657 1.987 1.00 0.00 C ATOM 151 C ALA A 30 -7.966 1.175 3.250 1.00 0.00 C ATOM 152 O ALA A 30 -6.911 0.544 3.178 1.00 0.00 O ATOM 153 CB ALA A 30 -8.543 3.176 1.875 1.00 0.00 C ATOM 0 H ALA A 30 -10.733 2.062 1.904 1.00 0.00 H new ATOM 0 HA ALA A 30 -8.206 1.186 1.122 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -7.488 3.450 1.854 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -9.024 3.516 0.958 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -9.024 3.647 2.733 1.00 0.00 H new ATOM 159 N SER A 31 -8.551 1.475 4.403 1.00 0.00 N ATOM 160 CA SER A 31 -7.963 1.060 5.675 1.00 0.00 C ATOM 161 C SER A 31 -7.904 -0.462 5.773 1.00 0.00 C ATOM 162 O SER A 31 -6.913 -1.027 6.236 1.00 0.00 O ATOM 163 CB SER A 31 -8.786 1.615 6.835 1.00 0.00 C ATOM 164 OG SER A 31 -8.784 3.035 6.772 1.00 0.00 O ATOM 0 H SER A 31 -9.423 1.998 4.486 1.00 0.00 H new ATOM 0 HA SER A 31 -6.948 1.453 5.727 1.00 0.00 H new ATOM 0 HB2 SER A 31 -9.808 1.238 6.785 1.00 0.00 H new ATOM 0 HB3 SER A 31 -8.369 1.281 7.785 1.00 0.00 H new ATOM 0 HG SER A 31 -8.130 3.390 7.410 1.00 0.00 H new ATOM 170 N ILE A 32 -8.975 -1.115 5.335 1.00 0.00 N ATOM 171 CA ILE A 32 -9.046 -2.573 5.376 1.00 0.00 C ATOM 172 C ILE A 32 -7.978 -3.186 4.478 1.00 0.00 C ATOM 173 O ILE A 32 -7.331 -4.159 4.849 1.00 0.00 O ATOM 174 CB ILE A 32 -10.432 -3.051 4.928 1.00 0.00 C ATOM 175 CG1 ILE A 32 -11.472 -2.623 5.966 1.00 0.00 C ATOM 176 CG2 ILE A 32 -10.435 -4.580 4.808 1.00 0.00 C ATOM 177 CD1 ILE A 32 -12.876 -2.869 5.415 1.00 0.00 C ATOM 0 H ILE A 32 -9.803 -0.661 4.949 1.00 0.00 H new ATOM 0 HA ILE A 32 -8.871 -2.894 6.403 1.00 0.00 H new ATOM 0 HB ILE A 32 -10.673 -2.611 3.960 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -11.330 -3.183 6.890 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -11.345 -1.568 6.209 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -11.421 -4.918 4.489 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -9.691 -4.889 4.074 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -10.195 -5.021 5.775 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -13.616 -2.564 6.155 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -13.015 -2.290 4.502 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -13.000 -3.929 5.194 1.00 0.00 H new ATOM 189 N ILE A 33 -7.802 -2.612 3.295 1.00 0.00 N ATOM 190 CA ILE A 33 -6.812 -3.125 2.358 1.00 0.00 C ATOM 191 C ILE A 33 -5.410 -3.047 2.956 1.00 0.00 C ATOM 192 O ILE A 33 -4.626 -3.990 2.841 1.00 0.00 O ATOM 193 CB ILE A 33 -6.860 -2.312 1.056 1.00 0.00 C ATOM 194 CG1 ILE A 33 -8.151 -2.633 0.295 1.00 0.00 C ATOM 195 CG2 ILE A 33 -5.645 -2.643 0.175 1.00 0.00 C ATOM 196 CD1 ILE A 33 -8.386 -1.569 -0.779 1.00 0.00 C ATOM 0 H ILE A 33 -8.325 -1.801 2.964 1.00 0.00 H new ATOM 0 HA ILE A 33 -7.044 -4.169 2.148 1.00 0.00 H new ATOM 0 HB ILE A 33 -6.837 -1.251 1.303 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -8.080 -3.619 -0.164 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -8.995 -2.662 0.984 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -5.692 -2.059 -0.744 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.729 -2.399 0.713 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -5.651 -3.705 -0.069 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -9.304 -1.796 -1.321 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -8.475 -0.590 -0.308 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -7.546 -1.562 -1.474 1.00 0.00 H new ATOM 208 N GLY A 34 -5.096 -1.925 3.587 1.00 0.00 N ATOM 209 CA GLY A 34 -3.778 -1.752 4.182 1.00 0.00 C ATOM 210 C GLY A 34 -3.544 -2.756 5.306 1.00 0.00 C ATOM 211 O GLY A 34 -2.548 -3.479 5.305 1.00 0.00 O ATOM 0 H GLY A 34 -5.726 -1.130 3.700 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.012 -1.874 3.416 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.682 -0.738 4.571 1.00 0.00 H new ATOM 215 N ILE A 35 -4.465 -2.794 6.262 1.00 0.00 N ATOM 216 CA ILE A 35 -4.342 -3.714 7.386 1.00 0.00 C ATOM 217 C ILE A 35 -4.452 -5.162 6.920 1.00 0.00 C ATOM 218 O ILE A 35 -3.686 -6.020 7.347 1.00 0.00 O ATOM 219 CB ILE A 35 -5.436 -3.425 8.418 1.00 0.00 C ATOM 220 CG1 ILE A 35 -5.186 -2.057 9.053 1.00 0.00 C ATOM 221 CG2 ILE A 35 -5.416 -4.502 9.510 1.00 0.00 C ATOM 222 CD1 ILE A 35 -6.416 -1.635 9.858 1.00 0.00 C ATOM 0 H ILE A 35 -5.297 -2.205 6.282 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.362 -3.568 7.839 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.407 -3.429 7.924 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.311 -2.100 9.702 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.974 -1.319 8.280 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.196 -4.292 10.242 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -5.593 -5.479 9.061 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -4.445 -4.501 10.004 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.238 -0.660 10.311 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.281 -1.576 9.197 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -6.608 -2.369 10.641 1.00 0.00 H new ATOM 234 N LEU A 36 -5.420 -5.426 6.052 1.00 0.00 N ATOM 235 CA LEU A 36 -5.629 -6.781 5.557 1.00 0.00 C ATOM 236 C LEU A 36 -4.408 -7.278 4.794 1.00 0.00 C ATOM 237 O LEU A 36 -3.962 -8.412 4.979 1.00 0.00 O ATOM 238 CB LEU A 36 -6.857 -6.814 4.636 1.00 0.00 C ATOM 239 CG LEU A 36 -7.116 -8.250 4.149 1.00 0.00 C ATOM 240 CD1 LEU A 36 -7.395 -9.175 5.350 1.00 0.00 C ATOM 241 CD2 LEU A 36 -8.323 -8.252 3.200 1.00 0.00 C ATOM 0 H LEU A 36 -6.066 -4.730 5.680 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.792 -7.435 6.413 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.731 -6.440 5.169 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.698 -6.155 3.782 1.00 0.00 H new ATOM 0 HG LEU A 36 -6.235 -8.616 3.622 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -7.577 -10.189 4.994 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -6.533 -9.174 6.018 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -8.272 -8.817 5.889 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -8.511 -9.268 2.852 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.202 -7.881 3.728 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -8.115 -7.608 2.345 1.00 0.00 H new ATOM 253 N HIS A 37 -3.869 -6.421 3.935 1.00 0.00 N ATOM 254 CA HIS A 37 -2.702 -6.779 3.143 1.00 0.00 C ATOM 255 C HIS A 37 -1.511 -7.039 4.048 1.00 0.00 C ATOM 256 O HIS A 37 -0.724 -7.953 3.807 1.00 0.00 O ATOM 257 CB HIS A 37 -2.372 -5.655 2.161 1.00 0.00 C ATOM 258 CG HIS A 37 -1.185 -6.056 1.330 1.00 0.00 C ATOM 259 ND1 HIS A 37 -1.263 -6.219 -0.041 1.00 0.00 N ATOM 260 CD2 HIS A 37 0.112 -6.343 1.665 1.00 0.00 C ATOM 261 CE1 HIS A 37 -0.045 -6.591 -0.475 1.00 0.00 C ATOM 262 NE2 HIS A 37 0.831 -6.678 0.524 1.00 0.00 N ATOM 0 H HIS A 37 -4.221 -5.478 3.771 1.00 0.00 H new ATOM 0 HA HIS A 37 -2.925 -7.688 2.584 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -3.229 -5.454 1.519 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -2.157 -4.734 2.703 1.00 0.00 H new ATOM 0 HD2 HIS A 37 0.515 -6.313 2.666 1.00 0.00 H new ATOM 0 HE1 HIS A 37 0.193 -6.794 -1.509 1.00 0.00 H new ATOM 0 HE2 HIS A 37 1.816 -6.935 0.465 1.00 0.00 H new ATOM 270 N LEU A 38 -1.381 -6.228 5.089 1.00 0.00 N ATOM 271 CA LEU A 38 -0.273 -6.377 6.022 1.00 0.00 C ATOM 272 C LEU A 38 -0.310 -7.731 6.705 1.00 0.00 C ATOM 273 O LEU A 38 0.727 -8.345 6.908 1.00 0.00 O ATOM 274 CB LEU A 38 -0.312 -5.255 7.077 1.00 0.00 C ATOM 275 CG LEU A 38 0.468 -4.024 6.586 1.00 0.00 C ATOM 276 CD1 LEU A 38 0.102 -2.804 7.446 1.00 0.00 C ATOM 277 CD2 LEU A 38 1.990 -4.286 6.671 1.00 0.00 C ATOM 0 H LEU A 38 -2.023 -5.466 5.308 1.00 0.00 H new ATOM 0 HA LEU A 38 0.656 -6.306 5.456 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.346 -4.979 7.284 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.116 -5.614 8.013 1.00 0.00 H new ATOM 0 HG LEU A 38 0.203 -3.828 5.547 1.00 0.00 H new ATOM 0 HD11 LEU A 38 0.656 -1.933 7.096 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.968 -2.610 7.366 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.358 -3.003 8.487 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.531 -3.407 6.320 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.266 -4.494 7.705 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.247 -5.142 6.048 1.00 0.00 H new ATOM 289 N ILE A 39 -1.497 -8.188 7.060 1.00 0.00 N ATOM 290 CA ILE A 39 -1.620 -9.471 7.730 1.00 0.00 C ATOM 291 C ILE A 39 -1.112 -10.594 6.826 1.00 0.00 C ATOM 292 O ILE A 39 -0.395 -11.490 7.270 1.00 0.00 O ATOM 293 CB ILE A 39 -3.088 -9.715 8.079 1.00 0.00 C ATOM 294 CG1 ILE A 39 -3.529 -8.720 9.157 1.00 0.00 C ATOM 295 CG2 ILE A 39 -3.268 -11.142 8.599 1.00 0.00 C ATOM 296 CD1 ILE A 39 -5.053 -8.769 9.313 1.00 0.00 C ATOM 0 H ILE A 39 -2.378 -7.699 6.899 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.020 -9.459 8.640 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.696 -9.579 7.185 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.049 -8.960 10.106 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.214 -7.712 8.886 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.316 -11.310 8.846 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -2.958 -11.851 7.831 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.658 -11.284 9.491 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -5.363 -8.060 10.081 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -5.524 -8.507 8.366 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -5.357 -9.775 9.604 1.00 0.00 H new ATOM 308 N LEU A 40 -1.494 -10.549 5.560 1.00 0.00 N ATOM 309 CA LEU A 40 -1.063 -11.571 4.613 1.00 0.00 C ATOM 310 C LEU A 40 0.409 -11.394 4.250 1.00 0.00 C ATOM 311 O LEU A 40 1.164 -12.365 4.166 1.00 0.00 O ATOM 312 CB LEU A 40 -1.914 -11.498 3.350 1.00 0.00 C ATOM 313 CG LEU A 40 -3.397 -11.516 3.733 1.00 0.00 C ATOM 314 CD1 LEU A 40 -4.248 -11.404 2.466 1.00 0.00 C ATOM 315 CD2 LEU A 40 -3.733 -12.821 4.475 1.00 0.00 C ATOM 0 H LEU A 40 -2.095 -9.826 5.165 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.188 -12.546 5.083 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.682 -10.590 2.794 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.686 -12.339 2.696 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.611 -10.673 4.390 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.304 -11.417 2.735 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.015 -10.471 1.953 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.031 -12.245 1.807 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.789 -12.825 4.744 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.519 -13.672 3.829 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.129 -12.891 5.379 1.00 0.00 H new ATOM 327 N TRP A 41 0.807 -10.147 4.024 1.00 0.00 N ATOM 328 CA TRP A 41 2.187 -9.854 3.651 1.00 0.00 C ATOM 329 C TRP A 41 3.152 -10.103 4.809 1.00 0.00 C ATOM 330 O TRP A 41 4.186 -10.745 4.635 1.00 0.00 O ATOM 331 CB TRP A 41 2.298 -8.398 3.181 1.00 0.00 C ATOM 332 CG TRP A 41 3.740 -8.041 2.992 1.00 0.00 C ATOM 333 CD1 TRP A 41 4.470 -8.310 1.886 1.00 0.00 C ATOM 334 CD2 TRP A 41 4.616 -7.307 3.893 1.00 0.00 C ATOM 335 NE1 TRP A 41 5.756 -7.837 2.078 1.00 0.00 N ATOM 336 CE2 TRP A 41 5.889 -7.200 3.293 1.00 0.00 C ATOM 337 CE3 TRP A 41 4.436 -6.739 5.168 1.00 0.00 C ATOM 338 CZ2 TRP A 41 6.941 -6.554 3.929 1.00 0.00 C ATOM 339 CZ3 TRP A 41 5.496 -6.077 5.803 1.00 0.00 C ATOM 340 CH2 TRP A 41 6.744 -5.988 5.185 1.00 0.00 C ATOM 0 H TRP A 41 0.201 -9.329 4.091 1.00 0.00 H new ATOM 0 HA TRP A 41 2.465 -10.526 2.839 1.00 0.00 H new ATOM 0 HB2 TRP A 41 1.754 -8.264 2.246 1.00 0.00 H new ATOM 0 HB3 TRP A 41 1.841 -7.733 3.914 1.00 0.00 H new ATOM 0 HD1 TRP A 41 4.109 -8.811 1.000 1.00 0.00 H new ATOM 0 HE1 TRP A 41 6.513 -7.946 1.403 1.00 0.00 H new ATOM 0 HE3 TRP A 41 3.477 -6.813 5.659 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 7.907 -6.491 3.451 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 5.346 -5.633 6.776 1.00 0.00 H new ATOM 0 HH2 TRP A 41 7.557 -5.480 5.682 1.00 0.00 H new ATOM 351 N ILE A 42 2.814 -9.587 5.978 1.00 0.00 N ATOM 352 CA ILE A 42 3.665 -9.751 7.141 1.00 0.00 C ATOM 353 C ILE A 42 3.805 -11.228 7.482 1.00 0.00 C ATOM 354 O ILE A 42 4.862 -11.678 7.923 1.00 0.00 O ATOM 355 CB ILE A 42 3.066 -8.993 8.335 1.00 0.00 C ATOM 356 CG1 ILE A 42 4.117 -8.871 9.444 1.00 0.00 C ATOM 357 CG2 ILE A 42 1.835 -9.745 8.880 1.00 0.00 C ATOM 358 CD1 ILE A 42 3.604 -7.916 10.527 1.00 0.00 C ATOM 0 H ILE A 42 1.961 -9.054 6.146 1.00 0.00 H new ATOM 0 HA ILE A 42 4.652 -9.345 6.918 1.00 0.00 H new ATOM 0 HB ILE A 42 2.761 -8.000 8.005 1.00 0.00 H new ATOM 0 HG12 ILE A 42 4.323 -9.851 9.875 1.00 0.00 H new ATOM 0 HG13 ILE A 42 5.056 -8.501 9.032 1.00 0.00 H new ATOM 0 HG21 ILE A 42 1.419 -9.198 9.726 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.082 -9.827 8.096 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.132 -10.743 9.204 1.00 0.00 H new ATOM 0 HD11 ILE A 42 4.350 -7.828 11.317 1.00 0.00 H new ATOM 0 HD12 ILE A 42 3.421 -6.935 10.090 1.00 0.00 H new ATOM 0 HD13 ILE A 42 2.676 -8.306 10.946 1.00 0.00 H new ATOM 370 N LEU A 43 2.726 -11.976 7.280 1.00 0.00 N ATOM 371 CA LEU A 43 2.742 -13.398 7.579 1.00 0.00 C ATOM 372 C LEU A 43 3.778 -14.107 6.721 1.00 0.00 C ATOM 373 O LEU A 43 4.514 -14.965 7.200 1.00 0.00 O ATOM 374 CB LEU A 43 1.354 -14.008 7.327 1.00 0.00 C ATOM 375 CG LEU A 43 1.396 -15.530 7.551 1.00 0.00 C ATOM 376 CD1 LEU A 43 1.914 -15.844 8.965 1.00 0.00 C ATOM 377 CD2 LEU A 43 -0.014 -16.104 7.381 1.00 0.00 C ATOM 0 H LEU A 43 1.841 -11.625 6.915 1.00 0.00 H new ATOM 0 HA LEU A 43 3.004 -13.528 8.629 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.622 -13.554 7.995 1.00 0.00 H new ATOM 0 HB3 LEU A 43 1.033 -13.791 6.308 1.00 0.00 H new ATOM 0 HG LEU A 43 2.069 -15.981 6.822 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.939 -16.924 9.112 1.00 0.00 H new ATOM 0 HD12 LEU A 43 2.919 -15.438 9.083 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.252 -15.393 9.704 1.00 0.00 H new ATOM 0 HD21 LEU A 43 0.011 -17.182 7.539 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -0.684 -15.646 8.109 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -0.374 -15.893 6.374 1.00 0.00 H new ATOM 389 N ASP A 44 3.826 -13.750 5.446 1.00 0.00 N ATOM 390 CA ASP A 44 4.777 -14.367 4.532 1.00 0.00 C ATOM 391 C ASP A 44 6.208 -14.035 4.938 1.00 0.00 C ATOM 392 O ASP A 44 7.105 -14.873 4.842 1.00 0.00 O ATOM 393 CB ASP A 44 4.518 -13.882 3.107 1.00 0.00 C ATOM 394 CG ASP A 44 3.228 -14.499 2.575 1.00 0.00 C ATOM 395 OD1 ASP A 44 2.754 -15.447 3.180 1.00 0.00 O ATOM 396 OD2 ASP A 44 2.733 -14.014 1.573 1.00 0.00 O ATOM 0 H ASP A 44 3.224 -13.043 5.023 1.00 0.00 H new ATOM 0 HA ASP A 44 4.646 -15.448 4.576 1.00 0.00 H new ATOM 0 HB2 ASP A 44 4.445 -12.795 3.091 1.00 0.00 H new ATOM 0 HB3 ASP A 44 5.354 -14.154 2.463 1.00 0.00 H new ATOM 401 N ARG A 45 6.417 -12.801 5.387 1.00 0.00 N ATOM 402 CA ARG A 45 7.746 -12.357 5.800 1.00 0.00 C ATOM 403 C ARG A 45 8.015 -12.747 7.245 1.00 0.00 C ATOM 404 O ARG A 45 9.132 -12.600 7.739 1.00 0.00 O ATOM 405 CB ARG A 45 7.848 -10.836 5.654 1.00 0.00 C ATOM 406 CG ARG A 45 7.570 -10.433 4.200 1.00 0.00 C ATOM 407 CD ARG A 45 8.710 -10.897 3.286 1.00 0.00 C ATOM 408 NE ARG A 45 8.654 -10.183 2.017 1.00 0.00 N ATOM 409 CZ ARG A 45 9.217 -8.988 1.878 1.00 0.00 C ATOM 410 NH1 ARG A 45 9.817 -8.429 2.894 1.00 0.00 N ATOM 411 NH2 ARG A 45 9.168 -8.373 0.731 1.00 0.00 N ATOM 0 H ARG A 45 5.688 -12.093 5.474 1.00 0.00 H new ATOM 0 HA ARG A 45 8.488 -12.839 5.163 1.00 0.00 H new ATOM 0 HB2 ARG A 45 7.134 -10.349 6.319 1.00 0.00 H new ATOM 0 HB3 ARG A 45 8.841 -10.499 5.951 1.00 0.00 H new ATOM 0 HG2 ARG A 45 6.629 -10.872 3.869 1.00 0.00 H new ATOM 0 HG3 ARG A 45 7.459 -9.351 4.131 1.00 0.00 H new ATOM 0 HD2 ARG A 45 9.670 -10.720 3.770 1.00 0.00 H new ATOM 0 HD3 ARG A 45 8.634 -11.970 3.112 1.00 0.00 H new ATOM 0 HE ARG A 45 8.175 -10.608 1.223 1.00 0.00 H new ATOM 0 HH11 ARG A 45 9.853 -8.910 3.793 1.00 0.00 H new ATOM 0 HH12 ARG A 45 10.250 -7.511 2.789 1.00 0.00 H new ATOM 0 HH21 ARG A 45 8.697 -8.809 -0.062 1.00 0.00 H new ATOM 0 HH22 ARG A 45 9.601 -7.455 0.625 1.00 0.00 H new ATOM 425 N LEU A 46 6.988 -13.241 7.922 1.00 0.00 N ATOM 426 CA LEU A 46 7.146 -13.638 9.314 1.00 0.00 C ATOM 427 C LEU A 46 8.160 -14.772 9.434 1.00 0.00 C ATOM 428 O LEU A 46 9.050 -14.734 10.282 1.00 0.00 O ATOM 429 CB LEU A 46 5.797 -14.097 9.879 1.00 0.00 C ATOM 430 CG LEU A 46 5.944 -14.499 11.354 1.00 0.00 C ATOM 431 CD1 LEU A 46 6.449 -13.305 12.182 1.00 0.00 C ATOM 432 CD2 LEU A 46 4.583 -14.968 11.887 1.00 0.00 C ATOM 0 H LEU A 46 6.052 -13.375 7.539 1.00 0.00 H new ATOM 0 HA LEU A 46 7.507 -12.780 9.881 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.064 -13.295 9.785 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.422 -14.941 9.301 1.00 0.00 H new ATOM 0 HG LEU A 46 6.668 -15.310 11.437 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.549 -13.602 13.226 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.418 -12.983 11.802 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.738 -12.483 12.106 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.681 -15.255 12.934 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.859 -14.158 11.799 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.241 -15.825 11.307 1.00 0.00 H new ATOM 444 N PHE A 47 8.011 -15.781 8.582 1.00 0.00 N ATOM 445 CA PHE A 47 8.916 -16.926 8.601 1.00 0.00 C ATOM 446 C PHE A 47 10.234 -16.588 7.920 1.00 0.00 C ATOM 447 O PHE A 47 11.299 -17.029 8.354 1.00 0.00 O ATOM 448 CB PHE A 47 8.260 -18.118 7.905 1.00 0.00 C ATOM 449 CG PHE A 47 7.123 -18.633 8.759 1.00 0.00 C ATOM 450 CD1 PHE A 47 5.898 -17.958 8.764 1.00 0.00 C ATOM 451 CD2 PHE A 47 7.293 -19.783 9.541 1.00 0.00 C ATOM 452 CE1 PHE A 47 4.839 -18.431 9.551 1.00 0.00 C ATOM 453 CE2 PHE A 47 6.235 -20.255 10.328 1.00 0.00 C ATOM 454 CZ PHE A 47 5.009 -19.582 10.332 1.00 0.00 C ATOM 0 H PHE A 47 7.278 -15.830 7.874 1.00 0.00 H new ATOM 0 HA PHE A 47 9.124 -17.183 9.640 1.00 0.00 H new ATOM 0 HB2 PHE A 47 7.888 -17.821 6.924 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.994 -18.907 7.742 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.768 -17.072 8.161 1.00 0.00 H new ATOM 0 HD2 PHE A 47 8.239 -20.305 9.537 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.893 -17.909 9.555 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.366 -21.140 10.933 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.193 -19.949 10.937 1.00 0.00 H new ATOM 464 N PHE A 48 10.156 -15.808 6.844 1.00 0.00 N ATOM 465 CA PHE A 48 11.348 -15.423 6.093 1.00 0.00 C ATOM 466 C PHE A 48 11.867 -14.074 6.573 1.00 0.00 C ATOM 467 O PHE A 48 11.139 -13.080 6.584 1.00 0.00 O ATOM 468 CB PHE A 48 11.011 -15.338 4.599 1.00 0.00 C ATOM 469 CG PHE A 48 10.042 -16.442 4.231 1.00 0.00 C ATOM 470 CD1 PHE A 48 10.198 -17.735 4.754 1.00 0.00 C ATOM 471 CD2 PHE A 48 8.973 -16.164 3.367 1.00 0.00 C ATOM 472 CE1 PHE A 48 9.291 -18.742 4.408 1.00 0.00 C ATOM 473 CE2 PHE A 48 8.069 -17.175 3.024 1.00 0.00 C ATOM 474 CZ PHE A 48 8.228 -18.463 3.544 1.00 0.00 C ATOM 0 H PHE A 48 9.283 -15.432 6.474 1.00 0.00 H new ATOM 0 HA PHE A 48 12.120 -16.176 6.254 1.00 0.00 H new ATOM 0 HB2 PHE A 48 10.574 -14.366 4.370 1.00 0.00 H new ATOM 0 HB3 PHE A 48 11.921 -15.427 4.005 1.00 0.00 H new ATOM 0 HD1 PHE A 48 11.018 -17.952 5.423 1.00 0.00 H new ATOM 0 HD2 PHE A 48 8.848 -15.169 2.966 1.00 0.00 H new ATOM 0 HE1 PHE A 48 9.412 -19.737 4.809 1.00 0.00 H new ATOM 0 HE2 PHE A 48 7.247 -16.960 2.357 1.00 0.00 H new ATOM 0 HZ PHE A 48 7.529 -19.243 3.278 1.00 0.00 H new ATOM 484 N LYS A 49 13.135 -14.048 6.971 1.00 0.00 N ATOM 485 CA LYS A 49 13.755 -12.821 7.454 1.00 0.00 C ATOM 486 C LYS A 49 15.250 -12.823 7.162 1.00 0.00 C ATOM 487 O LYS A 49 15.941 -11.983 7.717 1.00 0.00 O ATOM 488 CB LYS A 49 13.521 -12.684 8.956 1.00 0.00 C ATOM 489 CG LYS A 49 14.059 -13.927 9.678 1.00 0.00 C ATOM 490 CD LYS A 49 13.895 -13.765 11.203 1.00 0.00 C ATOM 491 CE LYS A 49 15.119 -13.053 11.790 1.00 0.00 C ATOM 492 NZ LYS A 49 16.268 -14.002 11.822 1.00 0.00 N ATOM 493 OXT LYS A 49 15.682 -13.662 6.390 1.00 0.00 O ATOM 0 H LYS A 49 13.751 -14.861 6.968 1.00 0.00 H new ATOM 0 HA LYS A 49 13.303 -11.975 6.937 1.00 0.00 H new ATOM 0 HB2 LYS A 49 14.018 -11.790 9.331 1.00 0.00 H new ATOM 0 HB3 LYS A 49 12.457 -12.566 9.159 1.00 0.00 H new ATOM 0 HG2 LYS A 49 13.524 -14.814 9.339 1.00 0.00 H new ATOM 0 HG3 LYS A 49 15.110 -14.074 9.431 1.00 0.00 H new ATOM 0 HD2 LYS A 49 12.993 -13.194 11.421 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.774 -14.743 11.670 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.370 -12.179 11.188 1.00 0.00 H new ATOM 0 HE3 LYS A 49 14.899 -12.695 12.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 16.962 -13.683 12.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.927 -14.951 12.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 16.718 -14.034 10.885 1.00 0.00 H new TER 507 LYS A 49 ATOM 508 N SER B 19 -15.450 20.240 -11.553 1.00 0.00 N ATOM 509 CA SER B 19 -15.894 19.214 -10.567 1.00 0.00 C ATOM 510 C SER B 19 -14.675 18.480 -10.018 1.00 0.00 C ATOM 511 O SER B 19 -14.795 17.631 -9.136 1.00 0.00 O ATOM 512 CB SER B 19 -16.834 18.224 -11.256 1.00 0.00 C ATOM 513 OG SER B 19 -16.284 17.851 -12.512 1.00 0.00 O ATOM 0 HA SER B 19 -16.422 19.696 -9.744 1.00 0.00 H new ATOM 0 HB2 SER B 19 -16.974 17.342 -10.631 1.00 0.00 H new ATOM 0 HB3 SER B 19 -17.817 18.675 -11.396 1.00 0.00 H new ATOM 0 HG SER B 19 -15.651 18.538 -12.809 1.00 0.00 H new ATOM 521 N ASN B 20 -13.502 18.815 -10.547 1.00 0.00 N ATOM 522 CA ASN B 20 -12.265 18.183 -10.103 1.00 0.00 C ATOM 523 C ASN B 20 -11.997 18.507 -8.637 1.00 0.00 C ATOM 524 O ASN B 20 -11.527 17.657 -7.880 1.00 0.00 O ATOM 525 CB ASN B 20 -11.093 18.665 -10.959 1.00 0.00 C ATOM 526 CG ASN B 20 -11.196 18.074 -12.362 1.00 0.00 C ATOM 527 OD1 ASN B 20 -11.923 17.103 -12.575 1.00 0.00 O ATOM 528 ND2 ASN B 20 -10.508 18.603 -13.336 1.00 0.00 N ATOM 0 H ASN B 20 -13.382 19.516 -11.279 1.00 0.00 H new ATOM 0 HA ASN B 20 -12.370 17.104 -10.212 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -11.094 19.754 -11.013 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -10.150 18.370 -10.499 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -10.572 18.212 -14.276 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -9.907 19.407 -13.157 1.00 0.00 H new ATOM 535 N ASP B 21 -12.293 19.741 -8.246 1.00 0.00 N ATOM 536 CA ASP B 21 -12.075 20.170 -6.869 1.00 0.00 C ATOM 537 C ASP B 21 -12.917 19.335 -5.909 1.00 0.00 C ATOM 538 O ASP B 21 -12.452 18.947 -4.837 1.00 0.00 O ATOM 539 CB ASP B 21 -12.448 21.646 -6.718 1.00 0.00 C ATOM 540 CG ASP B 21 -11.413 22.521 -7.419 1.00 0.00 C ATOM 541 OD1 ASP B 21 -10.342 22.016 -7.714 1.00 0.00 O ATOM 542 OD2 ASP B 21 -11.707 23.683 -7.648 1.00 0.00 O ATOM 0 H ASP B 21 -12.682 20.458 -8.858 1.00 0.00 H new ATOM 0 HA ASP B 21 -11.021 20.032 -6.628 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -13.436 21.825 -7.143 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -12.503 21.909 -5.662 1.00 0.00 H new ATOM 547 N SER B 22 -14.158 19.063 -6.298 1.00 0.00 N ATOM 548 CA SER B 22 -15.055 18.275 -5.461 1.00 0.00 C ATOM 549 C SER B 22 -14.473 16.888 -5.215 1.00 0.00 C ATOM 550 O SER B 22 -14.511 16.380 -4.094 1.00 0.00 O ATOM 551 CB SER B 22 -16.419 18.144 -6.138 1.00 0.00 C ATOM 552 OG SER B 22 -17.338 17.553 -5.226 1.00 0.00 O ATOM 0 H SER B 22 -14.563 19.374 -7.181 1.00 0.00 H new ATOM 0 HA SER B 22 -15.172 18.784 -4.504 1.00 0.00 H new ATOM 0 HB2 SER B 22 -16.779 19.124 -6.452 1.00 0.00 H new ATOM 0 HB3 SER B 22 -16.335 17.533 -7.036 1.00 0.00 H new ATOM 0 HG SER B 22 -18.215 17.468 -5.655 1.00 0.00 H new ATOM 558 N SER B 23 -13.935 16.276 -6.268 1.00 0.00 N ATOM 559 CA SER B 23 -13.343 14.942 -6.155 1.00 0.00 C ATOM 560 C SER B 23 -12.104 14.840 -7.028 1.00 0.00 C ATOM 561 O SER B 23 -12.189 14.902 -8.254 1.00 0.00 O ATOM 562 CB SER B 23 -14.358 13.884 -6.584 1.00 0.00 C ATOM 563 OG SER B 23 -15.529 14.011 -5.788 1.00 0.00 O ATOM 0 H SER B 23 -13.896 16.678 -7.204 1.00 0.00 H new ATOM 0 HA SER B 23 -13.061 14.773 -5.116 1.00 0.00 H new ATOM 0 HB2 SER B 23 -14.605 14.006 -7.638 1.00 0.00 H new ATOM 0 HB3 SER B 23 -13.932 12.887 -6.470 1.00 0.00 H new ATOM 0 HG SER B 23 -16.184 13.335 -6.060 1.00 0.00 H new ATOM 569 N ASP B 24 -10.949 14.691 -6.388 1.00 0.00 N ATOM 570 CA ASP B 24 -9.687 14.588 -7.118 1.00 0.00 C ATOM 571 C ASP B 24 -9.439 13.140 -7.553 1.00 0.00 C ATOM 572 O ASP B 24 -9.919 12.201 -6.917 1.00 0.00 O ATOM 573 CB ASP B 24 -8.525 15.074 -6.229 1.00 0.00 C ATOM 574 CG ASP B 24 -8.818 14.756 -4.770 1.00 0.00 C ATOM 575 OD1 ASP B 24 -9.820 15.240 -4.271 1.00 0.00 O ATOM 576 OD2 ASP B 24 -8.037 14.035 -4.173 1.00 0.00 O ATOM 0 H ASP B 24 -10.859 14.639 -5.373 1.00 0.00 H new ATOM 0 HA ASP B 24 -9.746 15.216 -8.007 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -7.596 14.593 -6.535 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -8.384 16.148 -6.355 1.00 0.00 H new ATOM 581 N PRO B 25 -8.694 12.949 -8.615 1.00 0.00 N ATOM 582 CA PRO B 25 -8.363 11.587 -9.137 1.00 0.00 C ATOM 583 C PRO B 25 -7.473 10.806 -8.168 1.00 0.00 C ATOM 584 O PRO B 25 -7.356 9.583 -8.267 1.00 0.00 O ATOM 585 CB PRO B 25 -7.633 11.873 -10.464 1.00 0.00 C ATOM 586 CG PRO B 25 -7.089 13.260 -10.318 1.00 0.00 C ATOM 587 CD PRO B 25 -8.090 14.010 -9.443 1.00 0.00 C ATOM 0 HA PRO B 25 -9.249 10.965 -9.266 1.00 0.00 H new ATOM 0 HB2 PRO B 25 -6.834 11.152 -10.638 1.00 0.00 H new ATOM 0 HB3 PRO B 25 -8.315 11.804 -11.312 1.00 0.00 H new ATOM 0 HG2 PRO B 25 -6.101 13.246 -9.858 1.00 0.00 H new ATOM 0 HG3 PRO B 25 -6.981 13.742 -11.290 1.00 0.00 H new ATOM 0 HD2 PRO B 25 -7.599 14.766 -8.830 1.00 0.00 H new ATOM 0 HD3 PRO B 25 -8.840 14.525 -10.044 1.00 0.00 H new ATOM 595 N LEU B 26 -6.846 11.517 -7.240 1.00 0.00 N ATOM 596 CA LEU B 26 -5.967 10.875 -6.271 1.00 0.00 C ATOM 597 C LEU B 26 -6.747 9.879 -5.418 1.00 0.00 C ATOM 598 O LEU B 26 -6.269 8.780 -5.138 1.00 0.00 O ATOM 599 CB LEU B 26 -5.321 11.940 -5.370 1.00 0.00 C ATOM 600 CG LEU B 26 -4.127 12.576 -6.089 1.00 0.00 C ATOM 601 CD1 LEU B 26 -4.592 13.179 -7.413 1.00 0.00 C ATOM 602 CD2 LEU B 26 -3.531 13.676 -5.208 1.00 0.00 C ATOM 0 H LEU B 26 -6.928 12.529 -7.138 1.00 0.00 H new ATOM 0 HA LEU B 26 -5.188 10.336 -6.810 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -6.053 12.706 -5.115 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -4.994 11.487 -4.434 1.00 0.00 H new ATOM 0 HG LEU B 26 -3.371 11.815 -6.283 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -3.743 13.632 -7.925 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -5.018 12.396 -8.040 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -5.348 13.941 -7.220 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -2.681 14.130 -5.718 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -4.287 14.437 -5.015 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -3.200 13.246 -4.263 1.00 0.00 H new ATOM 614 N VAL B 27 -7.947 10.268 -5.007 1.00 0.00 N ATOM 615 CA VAL B 27 -8.771 9.394 -4.183 1.00 0.00 C ATOM 616 C VAL B 27 -9.128 8.118 -4.946 1.00 0.00 C ATOM 617 O VAL B 27 -8.974 7.007 -4.431 1.00 0.00 O ATOM 618 CB VAL B 27 -10.053 10.127 -3.782 1.00 0.00 C ATOM 619 CG1 VAL B 27 -10.964 9.179 -3.001 1.00 0.00 C ATOM 620 CG2 VAL B 27 -9.701 11.338 -2.912 1.00 0.00 C ATOM 0 H VAL B 27 -8.367 11.171 -5.227 1.00 0.00 H new ATOM 0 HA VAL B 27 -8.208 9.122 -3.290 1.00 0.00 H new ATOM 0 HB VAL B 27 -10.571 10.466 -4.679 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -11.876 9.703 -2.716 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -11.218 8.322 -3.625 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -10.448 8.835 -2.104 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -10.615 11.859 -2.627 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -9.180 11.003 -2.015 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -9.057 12.015 -3.474 1.00 0.00 H new ATOM 630 N VAL B 28 -9.598 8.286 -6.178 1.00 0.00 N ATOM 631 CA VAL B 28 -9.971 7.144 -7.004 1.00 0.00 C ATOM 632 C VAL B 28 -8.740 6.308 -7.336 1.00 0.00 C ATOM 633 O VAL B 28 -8.775 5.079 -7.269 1.00 0.00 O ATOM 634 CB VAL B 28 -10.636 7.624 -8.297 1.00 0.00 C ATOM 635 CG1 VAL B 28 -10.910 6.424 -9.207 1.00 0.00 C ATOM 636 CG2 VAL B 28 -11.957 8.323 -7.963 1.00 0.00 C ATOM 0 H VAL B 28 -9.729 9.194 -6.623 1.00 0.00 H new ATOM 0 HA VAL B 28 -10.677 6.528 -6.447 1.00 0.00 H new ATOM 0 HB VAL B 28 -9.974 8.323 -8.808 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -11.383 6.766 -10.127 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -9.970 5.926 -9.446 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -11.572 5.724 -8.697 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -12.431 8.665 -8.883 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -12.619 7.624 -7.452 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -11.763 9.178 -7.316 1.00 0.00 H new ATOM 646 N ALA B 29 -7.654 6.985 -7.693 1.00 0.00 N ATOM 647 CA ALA B 29 -6.417 6.295 -8.034 1.00 0.00 C ATOM 648 C ALA B 29 -5.893 5.517 -6.835 1.00 0.00 C ATOM 649 O ALA B 29 -5.385 4.409 -6.980 1.00 0.00 O ATOM 650 CB ALA B 29 -5.363 7.308 -8.489 1.00 0.00 C ATOM 0 H ALA B 29 -7.605 8.002 -7.753 1.00 0.00 H new ATOM 0 HA ALA B 29 -6.622 5.596 -8.845 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -4.441 6.785 -8.742 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -5.728 7.844 -9.365 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -5.169 8.017 -7.684 1.00 0.00 H new ATOM 656 N ALA B 30 -6.021 6.100 -5.650 1.00 0.00 N ATOM 657 CA ALA B 30 -5.549 5.442 -4.438 1.00 0.00 C ATOM 658 C ALA B 30 -6.185 4.063 -4.294 1.00 0.00 C ATOM 659 O ALA B 30 -5.491 3.071 -4.073 1.00 0.00 O ATOM 660 CB ALA B 30 -5.899 6.294 -3.217 1.00 0.00 C ATOM 0 H ALA B 30 -6.443 7.017 -5.502 1.00 0.00 H new ATOM 0 HA ALA B 30 -4.467 5.325 -4.506 1.00 0.00 H new ATOM 0 HB1 ALA B 30 -5.544 5.798 -2.314 1.00 0.00 H new ATOM 0 HB2 ALA B 30 -5.423 7.270 -3.306 1.00 0.00 H new ATOM 0 HB3 ALA B 30 -6.980 6.422 -3.160 1.00 0.00 H new ATOM 666 N SER B 31 -7.506 4.007 -4.423 1.00 0.00 N ATOM 667 CA SER B 31 -8.220 2.738 -4.308 1.00 0.00 C ATOM 668 C SER B 31 -7.784 1.770 -5.406 1.00 0.00 C ATOM 669 O SER B 31 -7.595 0.579 -5.159 1.00 0.00 O ATOM 670 CB SER B 31 -9.725 2.975 -4.404 1.00 0.00 C ATOM 671 OG SER B 31 -10.129 3.842 -3.353 1.00 0.00 O ATOM 0 H SER B 31 -8.100 4.816 -4.605 1.00 0.00 H new ATOM 0 HA SER B 31 -7.982 2.299 -3.339 1.00 0.00 H new ATOM 0 HB2 SER B 31 -9.975 3.414 -5.370 1.00 0.00 H new ATOM 0 HB3 SER B 31 -10.260 2.028 -4.336 1.00 0.00 H new ATOM 0 HG SER B 31 -10.899 3.454 -2.887 1.00 0.00 H new ATOM 677 N ILE B 32 -7.630 2.294 -6.617 1.00 0.00 N ATOM 678 CA ILE B 32 -7.219 1.476 -7.753 1.00 0.00 C ATOM 679 C ILE B 32 -5.820 0.914 -7.529 1.00 0.00 C ATOM 680 O ILE B 32 -5.558 -0.247 -7.819 1.00 0.00 O ATOM 681 CB ILE B 32 -7.242 2.304 -9.042 1.00 0.00 C ATOM 682 CG1 ILE B 32 -8.688 2.665 -9.383 1.00 0.00 C ATOM 683 CG2 ILE B 32 -6.635 1.485 -10.190 1.00 0.00 C ATOM 684 CD1 ILE B 32 -8.705 3.698 -10.512 1.00 0.00 C ATOM 0 H ILE B 32 -7.783 3.278 -6.837 1.00 0.00 H new ATOM 0 HA ILE B 32 -7.921 0.648 -7.848 1.00 0.00 H new ATOM 0 HB ILE B 32 -6.660 3.215 -8.901 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -9.235 1.772 -9.685 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -9.191 3.065 -8.503 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -6.652 2.075 -11.106 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -5.605 1.224 -9.946 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -7.216 0.574 -10.334 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -9.736 3.955 -10.755 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -8.173 4.594 -10.193 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -8.218 3.281 -11.394 1.00 0.00 H new ATOM 696 N ILE B 33 -4.925 1.748 -7.015 1.00 0.00 N ATOM 697 CA ILE B 33 -3.557 1.312 -6.770 1.00 0.00 C ATOM 698 C ILE B 33 -3.527 0.160 -5.767 1.00 0.00 C ATOM 699 O ILE B 33 -2.808 -0.819 -5.959 1.00 0.00 O ATOM 700 CB ILE B 33 -2.729 2.486 -6.225 1.00 0.00 C ATOM 701 CG1 ILE B 33 -2.492 3.510 -7.342 1.00 0.00 C ATOM 702 CG2 ILE B 33 -1.381 1.982 -5.687 1.00 0.00 C ATOM 703 CD1 ILE B 33 -2.022 4.830 -6.726 1.00 0.00 C ATOM 0 H ILE B 33 -5.118 2.717 -6.763 1.00 0.00 H new ATOM 0 HA ILE B 33 -3.132 0.966 -7.712 1.00 0.00 H new ATOM 0 HB ILE B 33 -3.277 2.958 -5.410 1.00 0.00 H new ATOM 0 HG12 ILE B 33 -1.745 3.136 -8.042 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -3.410 3.666 -7.909 1.00 0.00 H new ATOM 0 HG21 ILE B 33 -0.804 2.824 -5.304 1.00 0.00 H new ATOM 0 HG22 ILE B 33 -1.555 1.266 -4.884 1.00 0.00 H new ATOM 0 HG23 ILE B 33 -0.826 1.498 -6.491 1.00 0.00 H new ATOM 0 HD11 ILE B 33 -1.852 5.561 -7.517 1.00 0.00 H new ATOM 0 HD12 ILE B 33 -2.785 5.205 -6.043 1.00 0.00 H new ATOM 0 HD13 ILE B 33 -1.094 4.666 -6.179 1.00 0.00 H new ATOM 715 N GLY B 34 -4.301 0.286 -4.698 1.00 0.00 N ATOM 716 CA GLY B 34 -4.332 -0.754 -3.681 1.00 0.00 C ATOM 717 C GLY B 34 -4.869 -2.064 -4.246 1.00 0.00 C ATOM 718 O GLY B 34 -4.229 -3.109 -4.132 1.00 0.00 O ATOM 0 H GLY B 34 -4.907 1.086 -4.514 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -3.328 -0.910 -3.286 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -4.956 -0.432 -2.847 1.00 0.00 H new ATOM 722 N ILE B 35 -6.046 -2.002 -4.857 1.00 0.00 N ATOM 723 CA ILE B 35 -6.657 -3.193 -5.433 1.00 0.00 C ATOM 724 C ILE B 35 -5.831 -3.717 -6.603 1.00 0.00 C ATOM 725 O ILE B 35 -5.606 -4.916 -6.727 1.00 0.00 O ATOM 726 CB ILE B 35 -8.075 -2.871 -5.915 1.00 0.00 C ATOM 727 CG1 ILE B 35 -8.964 -2.569 -4.707 1.00 0.00 C ATOM 728 CG2 ILE B 35 -8.648 -4.071 -6.678 1.00 0.00 C ATOM 729 CD1 ILE B 35 -10.291 -1.978 -5.184 1.00 0.00 C ATOM 0 H ILE B 35 -6.592 -1.148 -4.966 1.00 0.00 H new ATOM 0 HA ILE B 35 -6.697 -3.962 -4.661 1.00 0.00 H new ATOM 0 HB ILE B 35 -8.043 -2.005 -6.576 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -9.144 -3.481 -4.138 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -8.462 -1.870 -4.039 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -9.657 -3.837 -7.019 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -8.016 -4.291 -7.538 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -8.679 -4.939 -6.020 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -10.924 -1.763 -4.323 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -10.102 -1.056 -5.734 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -10.794 -2.693 -5.835 1.00 0.00 H new ATOM 741 N LEU B 36 -5.396 -2.809 -7.465 1.00 0.00 N ATOM 742 CA LEU B 36 -4.615 -3.201 -8.633 1.00 0.00 C ATOM 743 C LEU B 36 -3.305 -3.863 -8.216 1.00 0.00 C ATOM 744 O LEU B 36 -2.912 -4.892 -8.768 1.00 0.00 O ATOM 745 CB LEU B 36 -4.315 -1.969 -9.497 1.00 0.00 C ATOM 746 CG LEU B 36 -3.535 -2.381 -10.757 1.00 0.00 C ATOM 747 CD1 LEU B 36 -4.370 -3.365 -11.600 1.00 0.00 C ATOM 748 CD2 LEU B 36 -3.214 -1.131 -11.585 1.00 0.00 C ATOM 0 H LEU B 36 -5.567 -1.807 -7.381 1.00 0.00 H new ATOM 0 HA LEU B 36 -5.199 -3.919 -9.208 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -5.247 -1.479 -9.781 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.737 -1.245 -8.923 1.00 0.00 H new ATOM 0 HG LEU B 36 -2.608 -2.872 -10.461 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -3.808 -3.650 -12.489 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -4.590 -4.254 -11.009 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -5.303 -2.888 -11.898 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -2.661 -1.419 -12.479 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -4.142 -0.639 -11.875 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -2.610 -0.446 -10.990 1.00 0.00 H new ATOM 760 N HIS B 37 -2.637 -3.264 -7.239 1.00 0.00 N ATOM 761 CA HIS B 37 -1.373 -3.795 -6.756 1.00 0.00 C ATOM 762 C HIS B 37 -1.579 -5.167 -6.133 1.00 0.00 C ATOM 763 O HIS B 37 -0.757 -6.066 -6.301 1.00 0.00 O ATOM 764 CB HIS B 37 -0.765 -2.843 -5.727 1.00 0.00 C ATOM 765 CG HIS B 37 0.558 -3.388 -5.267 1.00 0.00 C ATOM 766 ND1 HIS B 37 1.751 -2.724 -5.486 1.00 0.00 N ATOM 767 CD2 HIS B 37 0.890 -4.541 -4.609 1.00 0.00 C ATOM 768 CE1 HIS B 37 2.736 -3.479 -4.969 1.00 0.00 C ATOM 769 NE2 HIS B 37 2.266 -4.597 -4.420 1.00 0.00 N ATOM 0 H HIS B 37 -2.949 -2.414 -6.769 1.00 0.00 H new ATOM 0 HA HIS B 37 -0.690 -3.892 -7.600 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -0.631 -1.854 -6.164 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.439 -2.728 -4.878 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.188 -5.295 -4.285 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.782 -3.211 -4.996 1.00 0.00 H new ATOM 0 HE2 HIS B 37 2.800 -5.335 -3.960 1.00 0.00 H new ATOM 777 N LEU B 38 -2.680 -5.319 -5.413 1.00 0.00 N ATOM 778 CA LEU B 38 -2.982 -6.586 -4.764 1.00 0.00 C ATOM 779 C LEU B 38 -3.137 -7.700 -5.784 1.00 0.00 C ATOM 780 O LEU B 38 -2.691 -8.813 -5.549 1.00 0.00 O ATOM 781 CB LEU B 38 -4.266 -6.463 -3.923 1.00 0.00 C ATOM 782 CG LEU B 38 -3.935 -6.002 -2.494 1.00 0.00 C ATOM 783 CD1 LEU B 38 -5.217 -5.523 -1.792 1.00 0.00 C ATOM 784 CD2 LEU B 38 -3.302 -7.163 -1.692 1.00 0.00 C ATOM 0 H LEU B 38 -3.375 -4.587 -5.264 1.00 0.00 H new ATOM 0 HA LEU B 38 -2.147 -6.835 -4.109 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -4.947 -5.753 -4.391 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -4.780 -7.424 -3.891 1.00 0.00 H new ATOM 0 HG LEU B 38 -3.223 -5.179 -2.545 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -4.978 -5.197 -0.780 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -5.647 -4.691 -2.349 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -5.936 -6.341 -1.749 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -3.072 -6.824 -0.682 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -4.002 -7.997 -1.645 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -2.385 -7.487 -2.184 1.00 0.00 H new ATOM 796 N ILE B 39 -3.768 -7.400 -6.904 1.00 0.00 N ATOM 797 CA ILE B 39 -3.969 -8.409 -7.928 1.00 0.00 C ATOM 798 C ILE B 39 -2.624 -8.910 -8.454 1.00 0.00 C ATOM 799 O ILE B 39 -2.420 -10.111 -8.634 1.00 0.00 O ATOM 800 CB ILE B 39 -4.778 -7.805 -9.076 1.00 0.00 C ATOM 801 CG1 ILE B 39 -6.203 -7.511 -8.597 1.00 0.00 C ATOM 802 CG2 ILE B 39 -4.827 -8.784 -10.250 1.00 0.00 C ATOM 803 CD1 ILE B 39 -6.934 -6.661 -9.640 1.00 0.00 C ATOM 0 H ILE B 39 -4.146 -6.479 -7.127 1.00 0.00 H new ATOM 0 HA ILE B 39 -4.510 -9.252 -7.497 1.00 0.00 H new ATOM 0 HB ILE B 39 -4.303 -6.879 -9.401 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -6.741 -8.444 -8.433 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -6.175 -6.987 -7.642 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -5.405 -8.347 -11.064 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -3.814 -8.990 -10.594 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -5.297 -9.713 -9.929 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -7.947 -6.454 -9.295 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -6.400 -5.721 -9.783 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -6.976 -7.202 -10.586 1.00 0.00 H new ATOM 815 N LEU B 40 -1.711 -7.985 -8.706 1.00 0.00 N ATOM 816 CA LEU B 40 -0.392 -8.357 -9.209 1.00 0.00 C ATOM 817 C LEU B 40 0.456 -8.992 -8.108 1.00 0.00 C ATOM 818 O LEU B 40 1.151 -9.983 -8.335 1.00 0.00 O ATOM 819 CB LEU B 40 0.320 -7.126 -9.753 1.00 0.00 C ATOM 820 CG LEU B 40 -0.599 -6.402 -10.745 1.00 0.00 C ATOM 821 CD1 LEU B 40 0.106 -5.146 -11.264 1.00 0.00 C ATOM 822 CD2 LEU B 40 -0.939 -7.333 -11.921 1.00 0.00 C ATOM 0 H LEU B 40 -1.853 -6.984 -8.574 1.00 0.00 H new ATOM 0 HA LEU B 40 -0.526 -9.087 -10.007 1.00 0.00 H new ATOM 0 HB2 LEU B 40 0.589 -6.457 -8.935 1.00 0.00 H new ATOM 0 HB3 LEU B 40 1.248 -7.417 -10.246 1.00 0.00 H new ATOM 0 HG LEU B 40 -1.523 -6.119 -10.241 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -0.544 -4.629 -11.969 1.00 0.00 H new ATOM 0 HD12 LEU B 40 0.333 -4.485 -10.428 1.00 0.00 H new ATOM 0 HD13 LEU B 40 1.032 -5.429 -11.765 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -1.592 -6.812 -12.621 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -0.021 -7.626 -12.430 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -1.445 -8.222 -11.546 1.00 0.00 H new ATOM 834 N TRP B 41 0.401 -8.406 -6.918 1.00 0.00 N ATOM 835 CA TRP B 41 1.178 -8.908 -5.792 1.00 0.00 C ATOM 836 C TRP B 41 0.662 -10.261 -5.305 1.00 0.00 C ATOM 837 O TRP B 41 1.442 -11.190 -5.094 1.00 0.00 O ATOM 838 CB TRP B 41 1.145 -7.891 -4.645 1.00 0.00 C ATOM 839 CG TRP B 41 1.774 -8.489 -3.427 1.00 0.00 C ATOM 840 CD1 TRP B 41 3.102 -8.523 -3.171 1.00 0.00 C ATOM 841 CD2 TRP B 41 1.121 -9.093 -2.272 1.00 0.00 C ATOM 842 NE1 TRP B 41 3.305 -9.157 -1.960 1.00 0.00 N ATOM 843 CE2 TRP B 41 2.114 -9.512 -1.363 1.00 0.00 C ATOM 844 CE3 TRP B 41 -0.227 -9.325 -1.935 1.00 0.00 C ATOM 845 CZ2 TRP B 41 1.787 -10.138 -0.166 1.00 0.00 C ATOM 846 CZ3 TRP B 41 -0.555 -9.944 -0.720 1.00 0.00 C ATOM 847 CH2 TRP B 41 0.451 -10.350 0.159 1.00 0.00 C ATOM 0 H TRP B 41 -0.170 -7.587 -6.709 1.00 0.00 H new ATOM 0 HA TRP B 41 2.205 -9.049 -6.130 1.00 0.00 H new ATOM 0 HB2 TRP B 41 1.677 -6.985 -4.934 1.00 0.00 H new ATOM 0 HB3 TRP B 41 0.116 -7.602 -4.431 1.00 0.00 H new ATOM 0 HD1 TRP B 41 3.876 -8.121 -3.808 1.00 0.00 H new ATOM 0 HE1 TRP B 41 4.224 -9.340 -1.557 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -1.011 -9.025 -2.615 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 2.567 -10.459 0.509 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -1.591 -10.107 -0.463 1.00 0.00 H new ATOM 0 HH2 TRP B 41 0.192 -10.829 1.092 1.00 0.00 H new ATOM 858 N ILE B 42 -0.643 -10.361 -5.120 1.00 0.00 N ATOM 859 CA ILE B 42 -1.239 -11.597 -4.646 1.00 0.00 C ATOM 860 C ILE B 42 -0.993 -12.714 -5.650 1.00 0.00 C ATOM 861 O ILE B 42 -0.797 -13.870 -5.274 1.00 0.00 O ATOM 862 CB ILE B 42 -2.749 -11.401 -4.442 1.00 0.00 C ATOM 863 CG1 ILE B 42 -3.310 -12.569 -3.621 1.00 0.00 C ATOM 864 CG2 ILE B 42 -3.469 -11.337 -5.803 1.00 0.00 C ATOM 865 CD1 ILE B 42 -4.757 -12.267 -3.227 1.00 0.00 C ATOM 0 H ILE B 42 -1.307 -9.605 -5.290 1.00 0.00 H new ATOM 0 HA ILE B 42 -0.781 -11.870 -3.695 1.00 0.00 H new ATOM 0 HB ILE B 42 -2.915 -10.464 -3.910 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -3.265 -13.490 -4.202 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -2.704 -12.724 -2.729 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -4.538 -11.198 -5.643 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -3.077 -10.501 -6.383 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -3.302 -12.266 -6.347 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -5.156 -13.097 -2.644 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -4.789 -11.355 -2.630 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -5.359 -12.133 -4.126 1.00 0.00 H new ATOM 877 N LEU B 43 -1.010 -12.361 -6.929 1.00 0.00 N ATOM 878 CA LEU B 43 -0.797 -13.346 -7.977 1.00 0.00 C ATOM 879 C LEU B 43 0.587 -13.964 -7.844 1.00 0.00 C ATOM 880 O LEU B 43 0.756 -15.173 -7.987 1.00 0.00 O ATOM 881 CB LEU B 43 -0.943 -12.693 -9.359 1.00 0.00 C ATOM 882 CG LEU B 43 -0.620 -13.714 -10.465 1.00 0.00 C ATOM 883 CD1 LEU B 43 -1.517 -14.954 -10.320 1.00 0.00 C ATOM 884 CD2 LEU B 43 -0.854 -13.065 -11.834 1.00 0.00 C ATOM 0 H LEU B 43 -1.167 -11.410 -7.262 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.548 -14.129 -7.874 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -1.958 -12.317 -9.486 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -0.273 -11.837 -9.437 1.00 0.00 H new ATOM 0 HG LEU B 43 0.422 -14.022 -10.377 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -1.279 -15.669 -11.108 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.346 -15.415 -9.347 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -2.563 -14.658 -10.402 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -0.627 -13.784 -12.621 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -1.896 -12.754 -11.916 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -0.206 -12.195 -11.940 1.00 0.00 H new ATOM 896 N ASP B 44 1.579 -13.128 -7.577 1.00 0.00 N ATOM 897 CA ASP B 44 2.944 -13.610 -7.434 1.00 0.00 C ATOM 898 C ASP B 44 3.068 -14.533 -6.226 1.00 0.00 C ATOM 899 O ASP B 44 3.779 -15.537 -6.267 1.00 0.00 O ATOM 900 CB ASP B 44 3.899 -12.429 -7.279 1.00 0.00 C ATOM 901 CG ASP B 44 4.034 -11.691 -8.608 1.00 0.00 C ATOM 902 OD1 ASP B 44 3.634 -12.250 -9.617 1.00 0.00 O ATOM 903 OD2 ASP B 44 4.533 -10.579 -8.597 1.00 0.00 O ATOM 0 H ASP B 44 1.466 -12.121 -7.456 1.00 0.00 H new ATOM 0 HA ASP B 44 3.205 -14.173 -8.330 1.00 0.00 H new ATOM 0 HB2 ASP B 44 3.529 -11.749 -6.512 1.00 0.00 H new ATOM 0 HB3 ASP B 44 4.876 -12.781 -6.948 1.00 0.00 H new ATOM 908 N ARG B 45 2.372 -14.181 -5.151 1.00 0.00 N ATOM 909 CA ARG B 45 2.410 -14.977 -3.927 1.00 0.00 C ATOM 910 C ARG B 45 1.412 -16.122 -4.001 1.00 0.00 C ATOM 911 O ARG B 45 1.393 -16.999 -3.137 1.00 0.00 O ATOM 912 CB ARG B 45 2.079 -14.090 -2.726 1.00 0.00 C ATOM 913 CG ARG B 45 3.075 -12.925 -2.648 1.00 0.00 C ATOM 914 CD ARG B 45 4.469 -13.433 -2.263 1.00 0.00 C ATOM 915 NE ARG B 45 5.296 -12.324 -1.801 1.00 0.00 N ATOM 916 CZ ARG B 45 5.251 -11.916 -0.539 1.00 0.00 C ATOM 917 NH1 ARG B 45 4.449 -12.503 0.307 1.00 0.00 N ATOM 918 NH2 ARG B 45 6.010 -10.932 -0.146 1.00 0.00 N ATOM 0 H ARG B 45 1.777 -13.354 -5.100 1.00 0.00 H new ATOM 0 HA ARG B 45 3.412 -15.392 -3.814 1.00 0.00 H new ATOM 0 HB2 ARG B 45 1.063 -13.706 -2.815 1.00 0.00 H new ATOM 0 HB3 ARG B 45 2.119 -14.676 -1.808 1.00 0.00 H new ATOM 0 HG2 ARG B 45 3.121 -12.414 -3.609 1.00 0.00 H new ATOM 0 HG3 ARG B 45 2.733 -12.195 -1.915 1.00 0.00 H new ATOM 0 HD2 ARG B 45 4.387 -14.186 -1.480 1.00 0.00 H new ATOM 0 HD3 ARG B 45 4.939 -13.915 -3.121 1.00 0.00 H new ATOM 0 HE ARG B 45 5.919 -11.855 -2.458 1.00 0.00 H new ATOM 0 HH11 ARG B 45 3.858 -13.275 -0.002 1.00 0.00 H new ATOM 0 HH12 ARG B 45 4.414 -12.190 1.277 1.00 0.00 H new ATOM 0 HH21 ARG B 45 6.638 -10.476 -0.808 1.00 0.00 H new ATOM 0 HH22 ARG B 45 5.976 -10.618 0.824 1.00 0.00 H new ATOM 932 N LEU B 46 0.580 -16.111 -5.031 1.00 0.00 N ATOM 933 CA LEU B 46 -0.415 -17.161 -5.186 1.00 0.00 C ATOM 934 C LEU B 46 0.261 -18.518 -5.360 1.00 0.00 C ATOM 935 O LEU B 46 -0.116 -19.498 -4.717 1.00 0.00 O ATOM 936 CB LEU B 46 -1.297 -16.869 -6.407 1.00 0.00 C ATOM 937 CG LEU B 46 -2.364 -17.962 -6.572 1.00 0.00 C ATOM 938 CD1 LEU B 46 -3.254 -18.026 -5.319 1.00 0.00 C ATOM 939 CD2 LEU B 46 -3.218 -17.648 -7.807 1.00 0.00 C ATOM 0 H LEU B 46 0.572 -15.399 -5.761 1.00 0.00 H new ATOM 0 HA LEU B 46 -1.032 -17.186 -4.288 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -1.778 -15.897 -6.292 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -0.680 -16.816 -7.304 1.00 0.00 H new ATOM 0 HG LEU B 46 -1.877 -18.928 -6.701 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -4.007 -18.804 -5.447 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -2.640 -18.255 -4.448 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.747 -17.065 -5.173 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -3.978 -18.420 -7.930 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.702 -16.680 -7.678 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -2.582 -17.621 -8.692 1.00 0.00 H new ATOM 951 N PHE B 47 1.258 -18.566 -6.236 1.00 0.00 N ATOM 952 CA PHE B 47 1.981 -19.807 -6.492 1.00 0.00 C ATOM 953 C PHE B 47 2.984 -20.091 -5.385 1.00 0.00 C ATOM 954 O PHE B 47 3.186 -21.240 -4.995 1.00 0.00 O ATOM 955 CB PHE B 47 2.699 -19.722 -7.839 1.00 0.00 C ATOM 956 CG PHE B 47 1.678 -19.745 -8.953 1.00 0.00 C ATOM 957 CD1 PHE B 47 0.957 -18.586 -9.262 1.00 0.00 C ATOM 958 CD2 PHE B 47 1.455 -20.922 -9.681 1.00 0.00 C ATOM 959 CE1 PHE B 47 0.013 -18.603 -10.295 1.00 0.00 C ATOM 960 CE2 PHE B 47 0.510 -20.938 -10.714 1.00 0.00 C ATOM 961 CZ PHE B 47 -0.211 -19.777 -11.022 1.00 0.00 C ATOM 0 H PHE B 47 1.583 -17.766 -6.778 1.00 0.00 H new ATOM 0 HA PHE B 47 1.261 -20.625 -6.517 1.00 0.00 H new ATOM 0 HB2 PHE B 47 3.291 -18.808 -7.891 1.00 0.00 H new ATOM 0 HB3 PHE B 47 3.392 -20.557 -7.948 1.00 0.00 H new ATOM 0 HD1 PHE B 47 1.129 -17.678 -8.703 1.00 0.00 H new ATOM 0 HD2 PHE B 47 2.012 -21.817 -9.445 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -0.544 -17.708 -10.531 1.00 0.00 H new ATOM 0 HE2 PHE B 47 0.337 -21.845 -11.273 1.00 0.00 H new ATOM 0 HZ PHE B 47 -0.939 -19.788 -11.820 1.00 0.00 H new ATOM 971 N PHE B 48 3.619 -19.033 -4.884 1.00 0.00 N ATOM 972 CA PHE B 48 4.616 -19.171 -3.826 1.00 0.00 C ATOM 973 C PHE B 48 3.976 -18.965 -2.462 1.00 0.00 C ATOM 974 O PHE B 48 3.353 -17.935 -2.200 1.00 0.00 O ATOM 975 CB PHE B 48 5.730 -18.134 -4.029 1.00 0.00 C ATOM 976 CG PHE B 48 6.012 -17.970 -5.507 1.00 0.00 C ATOM 977 CD1 PHE B 48 6.053 -19.086 -6.356 1.00 0.00 C ATOM 978 CD2 PHE B 48 6.225 -16.688 -6.032 1.00 0.00 C ATOM 979 CE1 PHE B 48 6.310 -18.918 -7.721 1.00 0.00 C ATOM 980 CE2 PHE B 48 6.481 -16.522 -7.397 1.00 0.00 C ATOM 981 CZ PHE B 48 6.523 -17.637 -8.242 1.00 0.00 C ATOM 0 H PHE B 48 3.461 -18.074 -5.193 1.00 0.00 H new ATOM 0 HA PHE B 48 5.036 -20.176 -3.871 1.00 0.00 H new ATOM 0 HB2 PHE B 48 5.433 -17.178 -3.597 1.00 0.00 H new ATOM 0 HB3 PHE B 48 6.634 -18.451 -3.510 1.00 0.00 H new ATOM 0 HD1 PHE B 48 5.886 -20.075 -5.956 1.00 0.00 H new ATOM 0 HD2 PHE B 48 6.191 -15.827 -5.381 1.00 0.00 H new ATOM 0 HE1 PHE B 48 6.344 -19.778 -8.373 1.00 0.00 H new ATOM 0 HE2 PHE B 48 6.646 -15.533 -7.799 1.00 0.00 H new ATOM 0 HZ PHE B 48 6.720 -17.509 -9.296 1.00 0.00 H new ATOM 991 N LYS B 49 4.134 -19.957 -1.592 1.00 0.00 N ATOM 992 CA LYS B 49 3.570 -19.886 -0.250 1.00 0.00 C ATOM 993 C LYS B 49 4.425 -20.677 0.735 1.00 0.00 C ATOM 994 O LYS B 49 3.960 -20.909 1.839 1.00 0.00 O ATOM 995 CB LYS B 49 2.148 -20.443 -0.260 1.00 0.00 C ATOM 996 CG LYS B 49 2.157 -21.876 -0.811 1.00 0.00 C ATOM 997 CD LYS B 49 0.737 -22.472 -0.756 1.00 0.00 C ATOM 998 CE LYS B 49 0.499 -23.137 0.604 1.00 0.00 C ATOM 999 NZ LYS B 49 1.241 -24.425 0.656 1.00 0.00 N ATOM 1000 OXT LYS B 49 5.532 -21.037 0.371 1.00 0.00 O ATOM 0 H LYS B 49 4.646 -20.816 -1.791 1.00 0.00 H new ATOM 0 HA LYS B 49 3.552 -18.843 0.065 1.00 0.00 H new ATOM 0 HB2 LYS B 49 1.737 -20.434 0.749 1.00 0.00 H new ATOM 0 HB3 LYS B 49 1.504 -19.812 -0.872 1.00 0.00 H new ATOM 0 HG2 LYS B 49 2.521 -21.877 -1.838 1.00 0.00 H new ATOM 0 HG3 LYS B 49 2.842 -22.493 -0.230 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -0.002 -21.688 -0.921 1.00 0.00 H new ATOM 0 HD3 LYS B 49 0.609 -23.203 -1.555 1.00 0.00 H new ATOM 0 HE2 LYS B 49 0.832 -22.479 1.407 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -0.566 -23.311 0.756 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 0.813 -25.043 1.375 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 1.194 -24.890 -0.273 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 2.235 -24.243 0.903 1.00 0.00 H new TER 1014 LYS B 49 ATOM 1015 N SER C 19 -3.738 27.347 4.194 1.00 0.00 N ATOM 1016 CA SER C 19 -4.382 26.497 3.153 1.00 0.00 C ATOM 1017 C SER C 19 -4.097 25.030 3.447 1.00 0.00 C ATOM 1018 O SER C 19 -4.591 24.139 2.755 1.00 0.00 O ATOM 1019 CB SER C 19 -3.826 26.872 1.777 1.00 0.00 C ATOM 1020 OG SER C 19 -2.414 27.001 1.862 1.00 0.00 O ATOM 0 HA SER C 19 -5.460 26.659 3.161 1.00 0.00 H new ATOM 0 HB2 SER C 19 -4.090 26.109 1.045 1.00 0.00 H new ATOM 0 HB3 SER C 19 -4.269 27.808 1.436 1.00 0.00 H new ATOM 0 HG SER C 19 -2.176 27.444 2.703 1.00 0.00 H new ATOM 1028 N ASN C 20 -3.296 24.784 4.479 1.00 0.00 N ATOM 1029 CA ASN C 20 -2.951 23.420 4.860 1.00 0.00 C ATOM 1030 C ASN C 20 -4.197 22.654 5.290 1.00 0.00 C ATOM 1031 O ASN C 20 -4.346 21.471 4.982 1.00 0.00 O ATOM 1032 CB ASN C 20 -1.935 23.436 6.003 1.00 0.00 C ATOM 1033 CG ASN C 20 -0.579 23.913 5.491 1.00 0.00 C ATOM 1034 OD1 ASN C 20 -0.338 23.915 4.283 1.00 0.00 O ATOM 1035 ND2 ASN C 20 0.325 24.314 6.341 1.00 0.00 N ATOM 0 H ASN C 20 -2.876 25.507 5.063 1.00 0.00 H new ATOM 0 HA ASN C 20 -2.513 22.921 3.996 1.00 0.00 H new ATOM 0 HB2 ASN C 20 -2.283 24.093 6.800 1.00 0.00 H new ATOM 0 HB3 ASN C 20 -1.841 22.438 6.430 1.00 0.00 H new ATOM 0 HD21 ASN C 20 1.235 24.631 6.006 1.00 0.00 H new ATOM 0 HD22 ASN C 20 0.122 24.311 7.341 1.00 0.00 H new ATOM 1042 N ASP C 21 -5.085 23.334 6.006 1.00 0.00 N ATOM 1043 CA ASP C 21 -6.314 22.707 6.479 1.00 0.00 C ATOM 1044 C ASP C 21 -7.160 22.235 5.300 1.00 0.00 C ATOM 1045 O ASP C 21 -7.737 21.149 5.334 1.00 0.00 O ATOM 1046 CB ASP C 21 -7.118 23.702 7.316 1.00 0.00 C ATOM 1047 CG ASP C 21 -6.429 23.937 8.655 1.00 0.00 C ATOM 1048 OD1 ASP C 21 -5.568 23.146 9.004 1.00 0.00 O ATOM 1049 OD2 ASP C 21 -6.773 24.904 9.315 1.00 0.00 O ATOM 0 H ASP C 21 -4.979 24.313 6.271 1.00 0.00 H new ATOM 0 HA ASP C 21 -6.049 21.846 7.092 1.00 0.00 H new ATOM 0 HB2 ASP C 21 -7.217 24.645 6.778 1.00 0.00 H new ATOM 0 HB3 ASP C 21 -8.126 23.321 7.479 1.00 0.00 H new ATOM 1054 N SER C 22 -7.226 23.057 4.258 1.00 0.00 N ATOM 1055 CA SER C 22 -8.004 22.710 3.075 1.00 0.00 C ATOM 1056 C SER C 22 -7.485 21.420 2.449 1.00 0.00 C ATOM 1057 O SER C 22 -8.266 20.549 2.067 1.00 0.00 O ATOM 1058 CB SER C 22 -7.925 23.841 2.049 1.00 0.00 C ATOM 1059 OG SER C 22 -8.921 23.645 1.055 1.00 0.00 O ATOM 0 H SER C 22 -6.755 23.960 4.208 1.00 0.00 H new ATOM 0 HA SER C 22 -9.041 22.562 3.377 1.00 0.00 H new ATOM 0 HB2 SER C 22 -8.070 24.803 2.540 1.00 0.00 H new ATOM 0 HB3 SER C 22 -6.937 23.863 1.590 1.00 0.00 H new ATOM 0 HG SER C 22 -8.873 24.370 0.397 1.00 0.00 H new ATOM 1065 N SER C 23 -6.164 21.301 2.349 1.00 0.00 N ATOM 1066 CA SER C 23 -5.548 20.108 1.769 1.00 0.00 C ATOM 1067 C SER C 23 -4.281 19.750 2.528 1.00 0.00 C ATOM 1068 O SER C 23 -3.301 20.493 2.504 1.00 0.00 O ATOM 1069 CB SER C 23 -5.213 20.356 0.301 1.00 0.00 C ATOM 1070 OG SER C 23 -6.398 20.723 -0.393 1.00 0.00 O ATOM 0 H SER C 23 -5.501 22.011 2.660 1.00 0.00 H new ATOM 0 HA SER C 23 -6.253 19.280 1.843 1.00 0.00 H new ATOM 0 HB2 SER C 23 -4.467 21.146 0.214 1.00 0.00 H new ATOM 0 HB3 SER C 23 -4.781 19.459 -0.142 1.00 0.00 H new ATOM 0 HG SER C 23 -6.188 20.885 -1.336 1.00 0.00 H new ATOM 1076 N ASP C 24 -4.311 18.607 3.204 1.00 0.00 N ATOM 1077 CA ASP C 24 -3.155 18.157 3.978 1.00 0.00 C ATOM 1078 C ASP C 24 -2.169 17.406 3.077 1.00 0.00 C ATOM 1079 O ASP C 24 -2.562 16.820 2.067 1.00 0.00 O ATOM 1080 CB ASP C 24 -3.618 17.242 5.129 1.00 0.00 C ATOM 1081 CG ASP C 24 -4.855 16.460 4.709 1.00 0.00 C ATOM 1082 OD1 ASP C 24 -5.839 17.091 4.363 1.00 0.00 O ATOM 1083 OD2 ASP C 24 -4.802 15.242 4.742 1.00 0.00 O ATOM 0 H ASP C 24 -5.114 17.979 3.234 1.00 0.00 H new ATOM 0 HA ASP C 24 -2.652 19.029 4.395 1.00 0.00 H new ATOM 0 HB2 ASP C 24 -2.818 16.554 5.401 1.00 0.00 H new ATOM 0 HB3 ASP C 24 -3.839 17.840 6.013 1.00 0.00 H new ATOM 1088 N PRO C 25 -0.908 17.404 3.433 1.00 0.00 N ATOM 1089 CA PRO C 25 0.154 16.697 2.653 1.00 0.00 C ATOM 1090 C PRO C 25 -0.029 15.179 2.687 1.00 0.00 C ATOM 1091 O PRO C 25 0.539 14.458 1.867 1.00 0.00 O ATOM 1092 CB PRO C 25 1.461 17.123 3.348 1.00 0.00 C ATOM 1093 CG PRO C 25 1.057 17.506 4.736 1.00 0.00 C ATOM 1094 CD PRO C 25 -0.350 18.085 4.615 1.00 0.00 C ATOM 0 HA PRO C 25 0.134 16.956 1.594 1.00 0.00 H new ATOM 0 HB2 PRO C 25 2.185 16.309 3.359 1.00 0.00 H new ATOM 0 HB3 PRO C 25 1.929 17.959 2.829 1.00 0.00 H new ATOM 0 HG2 PRO C 25 1.068 16.641 5.399 1.00 0.00 H new ATOM 0 HG3 PRO C 25 1.746 18.238 5.156 1.00 0.00 H new ATOM 0 HD2 PRO C 25 -0.943 17.887 5.508 1.00 0.00 H new ATOM 0 HD3 PRO C 25 -0.328 19.166 4.481 1.00 0.00 H new ATOM 1102 N LEU C 26 -0.819 14.701 3.641 1.00 0.00 N ATOM 1103 CA LEU C 26 -1.054 13.270 3.771 1.00 0.00 C ATOM 1104 C LEU C 26 -1.729 12.722 2.517 1.00 0.00 C ATOM 1105 O LEU C 26 -1.379 11.645 2.034 1.00 0.00 O ATOM 1106 CB LEU C 26 -1.940 13.000 4.999 1.00 0.00 C ATOM 1107 CG LEU C 26 -1.085 13.012 6.269 1.00 0.00 C ATOM 1108 CD1 LEU C 26 -0.370 14.359 6.386 1.00 0.00 C ATOM 1109 CD2 LEU C 26 -1.984 12.803 7.490 1.00 0.00 C ATOM 0 H LEU C 26 -1.303 15.278 4.329 1.00 0.00 H new ATOM 0 HA LEU C 26 -0.095 12.768 3.897 1.00 0.00 H new ATOM 0 HB2 LEU C 26 -2.721 13.757 5.069 1.00 0.00 H new ATOM 0 HB3 LEU C 26 -2.438 12.036 4.894 1.00 0.00 H new ATOM 0 HG LEU C 26 -0.347 12.211 6.220 1.00 0.00 H new ATOM 0 HD11 LEU C 26 0.240 14.370 7.290 1.00 0.00 H new ATOM 0 HD12 LEU C 26 0.269 14.509 5.516 1.00 0.00 H new ATOM 0 HD13 LEU C 26 -1.108 15.160 6.436 1.00 0.00 H new ATOM 0 HD21 LEU C 26 -1.376 12.811 8.395 1.00 0.00 H new ATOM 0 HD22 LEU C 26 -2.721 13.604 7.541 1.00 0.00 H new ATOM 0 HD23 LEU C 26 -2.496 11.844 7.405 1.00 0.00 H new ATOM 1121 N VAL C 27 -2.697 13.463 1.994 1.00 0.00 N ATOM 1122 CA VAL C 27 -3.407 13.027 0.800 1.00 0.00 C ATOM 1123 C VAL C 27 -2.449 12.926 -0.387 1.00 0.00 C ATOM 1124 O VAL C 27 -2.422 11.917 -1.097 1.00 0.00 O ATOM 1125 CB VAL C 27 -4.524 14.022 0.473 1.00 0.00 C ATOM 1126 CG1 VAL C 27 -5.201 13.622 -0.838 1.00 0.00 C ATOM 1127 CG2 VAL C 27 -5.556 14.023 1.603 1.00 0.00 C ATOM 0 H VAL C 27 -3.006 14.358 2.373 1.00 0.00 H new ATOM 0 HA VAL C 27 -3.836 12.043 0.989 1.00 0.00 H new ATOM 0 HB VAL C 27 -4.099 15.020 0.370 1.00 0.00 H new ATOM 0 HG11 VAL C 27 -5.996 14.332 -1.068 1.00 0.00 H new ATOM 0 HG12 VAL C 27 -4.466 13.626 -1.643 1.00 0.00 H new ATOM 0 HG13 VAL C 27 -5.625 12.623 -0.739 1.00 0.00 H new ATOM 0 HG21 VAL C 27 -6.351 14.732 1.369 1.00 0.00 H new ATOM 0 HG22 VAL C 27 -5.980 13.024 1.710 1.00 0.00 H new ATOM 0 HG23 VAL C 27 -5.073 14.314 2.536 1.00 0.00 H new ATOM 1137 N VAL C 28 -1.660 13.975 -0.591 1.00 0.00 N ATOM 1138 CA VAL C 28 -0.702 13.996 -1.690 1.00 0.00 C ATOM 1139 C VAL C 28 0.370 12.934 -1.477 1.00 0.00 C ATOM 1140 O VAL C 28 0.741 12.216 -2.404 1.00 0.00 O ATOM 1141 CB VAL C 28 -0.050 15.378 -1.796 1.00 0.00 C ATOM 1142 CG1 VAL C 28 1.037 15.351 -2.875 1.00 0.00 C ATOM 1143 CG2 VAL C 28 -1.113 16.414 -2.173 1.00 0.00 C ATOM 0 H VAL C 28 -1.664 14.816 -0.014 1.00 0.00 H new ATOM 0 HA VAL C 28 -1.233 13.781 -2.617 1.00 0.00 H new ATOM 0 HB VAL C 28 0.396 15.643 -0.837 1.00 0.00 H new ATOM 0 HG11 VAL C 28 1.500 16.335 -2.950 1.00 0.00 H new ATOM 0 HG12 VAL C 28 1.794 14.613 -2.611 1.00 0.00 H new ATOM 0 HG13 VAL C 28 0.591 15.086 -3.834 1.00 0.00 H new ATOM 0 HG21 VAL C 28 -0.651 17.398 -2.249 1.00 0.00 H new ATOM 0 HG22 VAL C 28 -1.558 16.147 -3.132 1.00 0.00 H new ATOM 0 HG23 VAL C 28 -1.888 16.435 -1.407 1.00 0.00 H new ATOM 1153 N ALA C 29 0.863 12.841 -0.247 1.00 0.00 N ATOM 1154 CA ALA C 29 1.891 11.865 0.079 1.00 0.00 C ATOM 1155 C ALA C 29 1.369 10.450 -0.131 1.00 0.00 C ATOM 1156 O ALA C 29 2.086 9.579 -0.616 1.00 0.00 O ATOM 1157 CB ALA C 29 2.335 12.037 1.534 1.00 0.00 C ATOM 0 H ALA C 29 0.569 13.426 0.535 1.00 0.00 H new ATOM 0 HA ALA C 29 2.743 12.029 -0.581 1.00 0.00 H new ATOM 0 HB1 ALA C 29 3.105 11.302 1.769 1.00 0.00 H new ATOM 0 HB2 ALA C 29 2.736 13.041 1.676 1.00 0.00 H new ATOM 0 HB3 ALA C 29 1.481 11.891 2.195 1.00 0.00 H new ATOM 1163 N ALA C 30 0.112 10.225 0.232 1.00 0.00 N ATOM 1164 CA ALA C 30 -0.487 8.906 0.076 1.00 0.00 C ATOM 1165 C ALA C 30 -0.368 8.429 -1.368 1.00 0.00 C ATOM 1166 O ALA C 30 0.079 7.312 -1.629 1.00 0.00 O ATOM 1167 CB ALA C 30 -1.961 8.955 0.478 1.00 0.00 C ATOM 0 H ALA C 30 -0.506 10.931 0.632 1.00 0.00 H new ATOM 0 HA ALA C 30 0.045 8.207 0.721 1.00 0.00 H new ATOM 0 HB1 ALA C 30 -2.404 7.966 0.359 1.00 0.00 H new ATOM 0 HB2 ALA C 30 -2.044 9.267 1.519 1.00 0.00 H new ATOM 0 HB3 ALA C 30 -2.488 9.667 -0.157 1.00 0.00 H new ATOM 1173 N SER C 31 -0.771 9.282 -2.304 1.00 0.00 N ATOM 1174 CA SER C 31 -0.701 8.933 -3.721 1.00 0.00 C ATOM 1175 C SER C 31 0.745 8.693 -4.148 1.00 0.00 C ATOM 1176 O SER C 31 1.037 7.758 -4.893 1.00 0.00 O ATOM 1177 CB SER C 31 -1.303 10.054 -4.564 1.00 0.00 C ATOM 1178 OG SER C 31 -2.663 10.237 -4.196 1.00 0.00 O ATOM 0 H SER C 31 -1.146 10.211 -2.112 1.00 0.00 H new ATOM 0 HA SER C 31 -1.269 8.015 -3.876 1.00 0.00 H new ATOM 0 HB2 SER C 31 -0.745 10.978 -4.413 1.00 0.00 H new ATOM 0 HB3 SER C 31 -1.231 9.808 -5.623 1.00 0.00 H new ATOM 0 HG SER C 31 -3.236 10.085 -4.976 1.00 0.00 H new ATOM 1184 N ILE C 32 1.642 9.550 -3.671 1.00 0.00 N ATOM 1185 CA ILE C 32 3.058 9.433 -4.006 1.00 0.00 C ATOM 1186 C ILE C 32 3.627 8.124 -3.470 1.00 0.00 C ATOM 1187 O ILE C 32 4.393 7.449 -4.151 1.00 0.00 O ATOM 1188 CB ILE C 32 3.842 10.613 -3.424 1.00 0.00 C ATOM 1189 CG1 ILE C 32 3.425 11.898 -4.141 1.00 0.00 C ATOM 1190 CG2 ILE C 32 5.345 10.383 -3.628 1.00 0.00 C ATOM 1191 CD1 ILE C 32 4.005 13.107 -3.404 1.00 0.00 C ATOM 0 H ILE C 32 1.416 10.330 -3.054 1.00 0.00 H new ATOM 0 HA ILE C 32 3.154 9.442 -5.092 1.00 0.00 H new ATOM 0 HB ILE C 32 3.630 10.700 -2.358 1.00 0.00 H new ATOM 0 HG12 ILE C 32 3.779 11.883 -5.172 1.00 0.00 H new ATOM 0 HG13 ILE C 32 2.338 11.969 -4.179 1.00 0.00 H new ATOM 0 HG21 ILE C 32 5.901 11.224 -3.213 1.00 0.00 H new ATOM 0 HG22 ILE C 32 5.644 9.465 -3.123 1.00 0.00 H new ATOM 0 HG23 ILE C 32 5.559 10.297 -4.693 1.00 0.00 H new ATOM 0 HD11 ILE C 32 3.707 14.022 -3.916 1.00 0.00 H new ATOM 0 HD12 ILE C 32 3.629 13.124 -2.381 1.00 0.00 H new ATOM 0 HD13 ILE C 32 5.093 13.037 -3.389 1.00 0.00 H new ATOM 1203 N ILE C 33 3.256 7.777 -2.246 1.00 0.00 N ATOM 1204 CA ILE C 33 3.748 6.549 -1.637 1.00 0.00 C ATOM 1205 C ILE C 33 3.325 5.331 -2.455 1.00 0.00 C ATOM 1206 O ILE C 33 4.124 4.425 -2.688 1.00 0.00 O ATOM 1207 CB ILE C 33 3.199 6.422 -0.209 1.00 0.00 C ATOM 1208 CG1 ILE C 33 3.865 7.466 0.694 1.00 0.00 C ATOM 1209 CG2 ILE C 33 3.471 5.013 0.341 1.00 0.00 C ATOM 1210 CD1 ILE C 33 3.064 7.600 1.991 1.00 0.00 C ATOM 0 H ILE C 33 2.623 8.321 -1.660 1.00 0.00 H new ATOM 0 HA ILE C 33 4.837 6.591 -1.610 1.00 0.00 H new ATOM 0 HB ILE C 33 2.122 6.592 -0.228 1.00 0.00 H new ATOM 0 HG12 ILE C 33 4.890 7.170 0.916 1.00 0.00 H new ATOM 0 HG13 ILE C 33 3.914 8.427 0.183 1.00 0.00 H new ATOM 0 HG21 ILE C 33 3.077 4.936 1.354 1.00 0.00 H new ATOM 0 HG22 ILE C 33 2.984 4.274 -0.295 1.00 0.00 H new ATOM 0 HG23 ILE C 33 4.545 4.829 0.354 1.00 0.00 H new ATOM 0 HD11 ILE C 33 3.536 8.342 2.635 1.00 0.00 H new ATOM 0 HD12 ILE C 33 2.047 7.915 1.759 1.00 0.00 H new ATOM 0 HD13 ILE C 33 3.038 6.638 2.504 1.00 0.00 H new ATOM 1222 N GLY C 34 2.071 5.313 -2.882 1.00 0.00 N ATOM 1223 CA GLY C 34 1.569 4.189 -3.661 1.00 0.00 C ATOM 1224 C GLY C 34 2.300 4.072 -4.993 1.00 0.00 C ATOM 1225 O GLY C 34 2.833 3.014 -5.329 1.00 0.00 O ATOM 0 H GLY C 34 1.390 6.052 -2.706 1.00 0.00 H new ATOM 0 HA2 GLY C 34 1.691 3.266 -3.094 1.00 0.00 H new ATOM 0 HA3 GLY C 34 0.501 4.315 -3.839 1.00 0.00 H new ATOM 1229 N ILE C 35 2.323 5.163 -5.751 1.00 0.00 N ATOM 1230 CA ILE C 35 2.991 5.164 -7.047 1.00 0.00 C ATOM 1231 C ILE C 35 4.496 4.978 -6.883 1.00 0.00 C ATOM 1232 O ILE C 35 5.119 4.214 -7.614 1.00 0.00 O ATOM 1233 CB ILE C 35 2.718 6.483 -7.773 1.00 0.00 C ATOM 1234 CG1 ILE C 35 1.235 6.563 -8.139 1.00 0.00 C ATOM 1235 CG2 ILE C 35 3.562 6.556 -9.052 1.00 0.00 C ATOM 1236 CD1 ILE C 35 0.899 7.981 -8.601 1.00 0.00 C ATOM 0 H ILE C 35 1.891 6.050 -5.493 1.00 0.00 H new ATOM 0 HA ILE C 35 2.598 4.333 -7.633 1.00 0.00 H new ATOM 0 HB ILE C 35 2.981 7.315 -7.120 1.00 0.00 H new ATOM 0 HG12 ILE C 35 1.005 5.848 -8.929 1.00 0.00 H new ATOM 0 HG13 ILE C 35 0.622 6.295 -7.278 1.00 0.00 H new ATOM 0 HG21 ILE C 35 3.364 7.497 -9.565 1.00 0.00 H new ATOM 0 HG22 ILE C 35 4.619 6.499 -8.794 1.00 0.00 H new ATOM 0 HG23 ILE C 35 3.303 5.724 -9.707 1.00 0.00 H new ATOM 0 HD11 ILE C 35 -0.158 8.038 -8.862 1.00 0.00 H new ATOM 0 HD12 ILE C 35 1.113 8.686 -7.797 1.00 0.00 H new ATOM 0 HD13 ILE C 35 1.502 8.232 -9.474 1.00 0.00 H new ATOM 1248 N LEU C 36 5.074 5.691 -5.927 1.00 0.00 N ATOM 1249 CA LEU C 36 6.512 5.609 -5.698 1.00 0.00 C ATOM 1250 C LEU C 36 6.919 4.195 -5.295 1.00 0.00 C ATOM 1251 O LEU C 36 7.904 3.651 -5.798 1.00 0.00 O ATOM 1252 CB LEU C 36 6.920 6.592 -4.593 1.00 0.00 C ATOM 1253 CG LEU C 36 8.444 6.548 -4.382 1.00 0.00 C ATOM 1254 CD1 LEU C 36 9.172 6.956 -5.676 1.00 0.00 C ATOM 1255 CD2 LEU C 36 8.824 7.508 -3.246 1.00 0.00 C ATOM 0 H LEU C 36 4.577 6.327 -5.303 1.00 0.00 H new ATOM 0 HA LEU C 36 7.021 5.867 -6.627 1.00 0.00 H new ATOM 0 HB2 LEU C 36 6.611 7.602 -4.862 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.409 6.339 -3.664 1.00 0.00 H new ATOM 0 HG LEU C 36 8.742 5.533 -4.120 1.00 0.00 H new ATOM 0 HD11 LEU C 36 10.249 6.921 -5.514 1.00 0.00 H new ATOM 0 HD12 LEU C 36 8.903 6.268 -6.477 1.00 0.00 H new ATOM 0 HD13 LEU C 36 8.880 7.969 -5.954 1.00 0.00 H new ATOM 0 HD21 LEU C 36 9.903 7.481 -3.092 1.00 0.00 H new ATOM 0 HD22 LEU C 36 8.520 8.521 -3.509 1.00 0.00 H new ATOM 0 HD23 LEU C 36 8.319 7.205 -2.329 1.00 0.00 H new ATOM 1267 N HIS C 37 6.152 3.606 -4.387 1.00 0.00 N ATOM 1268 CA HIS C 37 6.440 2.260 -3.918 1.00 0.00 C ATOM 1269 C HIS C 37 6.323 1.265 -5.063 1.00 0.00 C ATOM 1270 O HIS C 37 7.115 0.330 -5.169 1.00 0.00 O ATOM 1271 CB HIS C 37 5.473 1.879 -2.798 1.00 0.00 C ATOM 1272 CG HIS C 37 5.807 0.499 -2.303 1.00 0.00 C ATOM 1273 ND1 HIS C 37 6.229 0.258 -1.008 1.00 0.00 N ATOM 1274 CD2 HIS C 37 5.797 -0.723 -2.923 1.00 0.00 C ATOM 1275 CE1 HIS C 37 6.457 -1.062 -0.893 1.00 0.00 C ATOM 1276 NE2 HIS C 37 6.204 -1.707 -2.032 1.00 0.00 N ATOM 0 H HIS C 37 5.330 4.037 -3.963 1.00 0.00 H new ATOM 0 HA HIS C 37 7.460 2.235 -3.534 1.00 0.00 H new ATOM 0 HB2 HIS C 37 5.542 2.598 -1.981 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.446 1.909 -3.162 1.00 0.00 H new ATOM 0 HD2 HIS C 37 5.515 -0.895 -3.951 1.00 0.00 H new ATOM 0 HE1 HIS C 37 6.803 -1.541 0.011 1.00 0.00 H new ATOM 0 HE2 HIS C 37 6.291 -2.708 -2.210 1.00 0.00 H new ATOM 1284 N LEU C 38 5.330 1.474 -5.914 1.00 0.00 N ATOM 1285 CA LEU C 38 5.115 0.585 -7.046 1.00 0.00 C ATOM 1286 C LEU C 38 6.310 0.585 -7.980 1.00 0.00 C ATOM 1287 O LEU C 38 6.687 -0.457 -8.493 1.00 0.00 O ATOM 1288 CB LEU C 38 3.847 0.999 -7.818 1.00 0.00 C ATOM 1289 CG LEU C 38 2.606 0.305 -7.235 1.00 0.00 C ATOM 1290 CD1 LEU C 38 1.337 1.011 -7.735 1.00 0.00 C ATOM 1291 CD2 LEU C 38 2.576 -1.181 -7.663 1.00 0.00 C ATOM 0 H LEU C 38 4.665 2.244 -5.844 1.00 0.00 H new ATOM 0 HA LEU C 38 4.985 -0.425 -6.657 1.00 0.00 H new ATOM 0 HB2 LEU C 38 3.722 2.081 -7.769 1.00 0.00 H new ATOM 0 HB3 LEU C 38 3.955 0.738 -8.871 1.00 0.00 H new ATOM 0 HG LEU C 38 2.648 0.360 -6.147 1.00 0.00 H new ATOM 0 HD11 LEU C 38 0.458 0.517 -7.320 1.00 0.00 H new ATOM 0 HD12 LEU C 38 1.351 2.053 -7.417 1.00 0.00 H new ATOM 0 HD13 LEU C 38 1.300 0.964 -8.823 1.00 0.00 H new ATOM 0 HD21 LEU C 38 1.692 -1.663 -7.244 1.00 0.00 H new ATOM 0 HD22 LEU C 38 2.543 -1.246 -8.751 1.00 0.00 H new ATOM 0 HD23 LEU C 38 3.471 -1.683 -7.296 1.00 0.00 H new ATOM 1303 N ILE C 39 6.895 1.747 -8.200 1.00 0.00 N ATOM 1304 CA ILE C 39 8.038 1.839 -9.089 1.00 0.00 C ATOM 1305 C ILE C 39 9.199 1.002 -8.553 1.00 0.00 C ATOM 1306 O ILE C 39 9.863 0.283 -9.300 1.00 0.00 O ATOM 1307 CB ILE C 39 8.468 3.301 -9.206 1.00 0.00 C ATOM 1308 CG1 ILE C 39 7.388 4.093 -9.947 1.00 0.00 C ATOM 1309 CG2 ILE C 39 9.787 3.395 -9.976 1.00 0.00 C ATOM 1310 CD1 ILE C 39 7.675 5.594 -9.825 1.00 0.00 C ATOM 0 H ILE C 39 6.603 2.630 -7.782 1.00 0.00 H new ATOM 0 HA ILE C 39 7.758 1.457 -10.071 1.00 0.00 H new ATOM 0 HB ILE C 39 8.605 3.715 -8.207 1.00 0.00 H new ATOM 0 HG12 ILE C 39 7.365 3.801 -10.997 1.00 0.00 H new ATOM 0 HG13 ILE C 39 6.406 3.865 -9.531 1.00 0.00 H new ATOM 0 HG21 ILE C 39 10.088 4.440 -10.056 1.00 0.00 H new ATOM 0 HG22 ILE C 39 10.558 2.835 -9.447 1.00 0.00 H new ATOM 0 HG23 ILE C 39 9.656 2.978 -10.974 1.00 0.00 H new ATOM 0 HD11 ILE C 39 6.905 6.156 -10.353 1.00 0.00 H new ATOM 0 HD12 ILE C 39 7.676 5.880 -8.773 1.00 0.00 H new ATOM 0 HD13 ILE C 39 8.649 5.815 -10.262 1.00 0.00 H new ATOM 1322 N LEU C 40 9.448 1.104 -7.256 1.00 0.00 N ATOM 1323 CA LEU C 40 10.532 0.346 -6.645 1.00 0.00 C ATOM 1324 C LEU C 40 10.170 -1.133 -6.529 1.00 0.00 C ATOM 1325 O LEU C 40 10.993 -2.011 -6.794 1.00 0.00 O ATOM 1326 CB LEU C 40 10.836 0.907 -5.259 1.00 0.00 C ATOM 1327 CG LEU C 40 11.040 2.421 -5.357 1.00 0.00 C ATOM 1328 CD1 LEU C 40 11.306 2.987 -3.960 1.00 0.00 C ATOM 1329 CD2 LEU C 40 12.231 2.733 -6.280 1.00 0.00 C ATOM 0 H LEU C 40 8.923 1.696 -6.612 1.00 0.00 H new ATOM 0 HA LEU C 40 11.412 0.437 -7.281 1.00 0.00 H new ATOM 0 HB2 LEU C 40 10.017 0.683 -4.576 1.00 0.00 H new ATOM 0 HB3 LEU C 40 11.729 0.434 -4.851 1.00 0.00 H new ATOM 0 HG LEU C 40 10.143 2.880 -5.772 1.00 0.00 H new ATOM 0 HD11 LEU C 40 11.452 4.065 -4.026 1.00 0.00 H new ATOM 0 HD12 LEU C 40 10.455 2.775 -3.313 1.00 0.00 H new ATOM 0 HD13 LEU C 40 12.201 2.525 -3.544 1.00 0.00 H new ATOM 0 HD21 LEU C 40 12.369 3.812 -6.344 1.00 0.00 H new ATOM 0 HD22 LEU C 40 13.134 2.275 -5.876 1.00 0.00 H new ATOM 0 HD23 LEU C 40 12.035 2.333 -7.275 1.00 0.00 H new ATOM 1341 N TRP C 41 8.936 -1.400 -6.119 1.00 0.00 N ATOM 1342 CA TRP C 41 8.477 -2.774 -5.953 1.00 0.00 C ATOM 1343 C TRP C 41 8.343 -3.493 -7.294 1.00 0.00 C ATOM 1344 O TRP C 41 8.810 -4.620 -7.451 1.00 0.00 O ATOM 1345 CB TRP C 41 7.134 -2.788 -5.215 1.00 0.00 C ATOM 1346 CG TRP C 41 6.572 -4.174 -5.221 1.00 0.00 C ATOM 1347 CD1 TRP C 41 6.903 -5.152 -4.348 1.00 0.00 C ATOM 1348 CD2 TRP C 41 5.549 -4.734 -6.093 1.00 0.00 C ATOM 1349 NE1 TRP C 41 6.188 -6.292 -4.664 1.00 0.00 N ATOM 1350 CE2 TRP C 41 5.330 -6.078 -5.722 1.00 0.00 C ATOM 1351 CE3 TRP C 41 4.802 -4.215 -7.168 1.00 0.00 C ATOM 1352 CZ2 TRP C 41 4.406 -6.877 -6.390 1.00 0.00 C ATOM 1353 CZ3 TRP C 41 3.864 -5.016 -7.833 1.00 0.00 C ATOM 1354 CH2 TRP C 41 3.668 -6.342 -7.444 1.00 0.00 C ATOM 0 H TRP C 41 8.239 -0.689 -5.897 1.00 0.00 H new ATOM 0 HA TRP C 41 9.225 -3.307 -5.365 1.00 0.00 H new ATOM 0 HB2 TRP C 41 7.268 -2.443 -4.190 1.00 0.00 H new ATOM 0 HB3 TRP C 41 6.437 -2.100 -5.694 1.00 0.00 H new ATOM 0 HD1 TRP C 41 7.610 -5.058 -3.537 1.00 0.00 H new ATOM 0 HE1 TRP C 41 6.283 -7.182 -4.175 1.00 0.00 H new ATOM 0 HE3 TRP C 41 4.953 -3.193 -7.482 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 4.262 -7.905 -6.093 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 3.290 -4.605 -8.650 1.00 0.00 H new ATOM 0 HH2 TRP C 41 2.943 -6.954 -7.960 1.00 0.00 H new ATOM 1365 N ILE C 42 7.697 -2.843 -8.246 1.00 0.00 N ATOM 1366 CA ILE C 42 7.499 -3.438 -9.556 1.00 0.00 C ATOM 1367 C ILE C 42 8.845 -3.694 -10.222 1.00 0.00 C ATOM 1368 O ILE C 42 9.015 -4.678 -10.940 1.00 0.00 O ATOM 1369 CB ILE C 42 6.653 -2.500 -10.431 1.00 0.00 C ATOM 1370 CG1 ILE C 42 6.152 -3.262 -11.663 1.00 0.00 C ATOM 1371 CG2 ILE C 42 7.493 -1.289 -10.885 1.00 0.00 C ATOM 1372 CD1 ILE C 42 5.125 -2.406 -12.408 1.00 0.00 C ATOM 0 H ILE C 42 7.303 -1.909 -8.138 1.00 0.00 H new ATOM 0 HA ILE C 42 6.976 -4.387 -9.439 1.00 0.00 H new ATOM 0 HB ILE C 42 5.804 -2.144 -9.847 1.00 0.00 H new ATOM 0 HG12 ILE C 42 6.988 -3.501 -12.321 1.00 0.00 H new ATOM 0 HG13 ILE C 42 5.703 -4.208 -11.361 1.00 0.00 H new ATOM 0 HG21 ILE C 42 6.881 -0.633 -11.504 1.00 0.00 H new ATOM 0 HG22 ILE C 42 7.843 -0.740 -10.010 1.00 0.00 H new ATOM 0 HG23 ILE C 42 8.350 -1.636 -11.462 1.00 0.00 H new ATOM 0 HD11 ILE C 42 4.768 -2.947 -13.284 1.00 0.00 H new ATOM 0 HD12 ILE C 42 4.285 -2.189 -11.748 1.00 0.00 H new ATOM 0 HD13 ILE C 42 5.590 -1.472 -12.723 1.00 0.00 H new ATOM 1384 N LEU C 43 9.792 -2.795 -9.984 1.00 0.00 N ATOM 1385 CA LEU C 43 11.113 -2.933 -10.576 1.00 0.00 C ATOM 1386 C LEU C 43 11.776 -4.216 -10.092 1.00 0.00 C ATOM 1387 O LEU C 43 12.395 -4.939 -10.869 1.00 0.00 O ATOM 1388 CB LEU C 43 11.990 -1.727 -10.208 1.00 0.00 C ATOM 1389 CG LEU C 43 13.415 -1.920 -10.753 1.00 0.00 C ATOM 1390 CD1 LEU C 43 13.375 -2.157 -12.271 1.00 0.00 C ATOM 1391 CD2 LEU C 43 14.247 -0.669 -10.448 1.00 0.00 C ATOM 0 H LEU C 43 9.671 -1.973 -9.392 1.00 0.00 H new ATOM 0 HA LEU C 43 11.003 -2.975 -11.660 1.00 0.00 H new ATOM 0 HB2 LEU C 43 11.557 -0.815 -10.618 1.00 0.00 H new ATOM 0 HB3 LEU C 43 12.020 -1.607 -9.125 1.00 0.00 H new ATOM 0 HG LEU C 43 13.867 -2.788 -10.274 1.00 0.00 H new ATOM 0 HD11 LEU C 43 14.390 -2.292 -12.645 1.00 0.00 H new ATOM 0 HD12 LEU C 43 12.788 -3.050 -12.484 1.00 0.00 H new ATOM 0 HD13 LEU C 43 12.919 -1.297 -12.762 1.00 0.00 H new ATOM 0 HD21 LEU C 43 15.258 -0.802 -10.833 1.00 0.00 H new ATOM 0 HD22 LEU C 43 13.789 0.198 -10.924 1.00 0.00 H new ATOM 0 HD23 LEU C 43 14.287 -0.512 -9.370 1.00 0.00 H new ATOM 1403 N ASP C 44 11.648 -4.490 -8.802 1.00 0.00 N ATOM 1404 CA ASP C 44 12.246 -5.689 -8.232 1.00 0.00 C ATOM 1405 C ASP C 44 11.604 -6.942 -8.815 1.00 0.00 C ATOM 1406 O ASP C 44 12.279 -7.942 -9.066 1.00 0.00 O ATOM 1407 CB ASP C 44 12.079 -5.681 -6.713 1.00 0.00 C ATOM 1408 CG ASP C 44 12.999 -4.634 -6.093 1.00 0.00 C ATOM 1409 OD1 ASP C 44 13.886 -4.167 -6.788 1.00 0.00 O ATOM 1410 OD2 ASP C 44 12.801 -4.315 -4.934 1.00 0.00 O ATOM 0 H ASP C 44 11.142 -3.906 -8.136 1.00 0.00 H new ATOM 0 HA ASP C 44 13.307 -5.696 -8.480 1.00 0.00 H new ATOM 0 HB2 ASP C 44 11.042 -5.465 -6.454 1.00 0.00 H new ATOM 0 HB3 ASP C 44 12.311 -6.666 -6.308 1.00 0.00 H new ATOM 1415 N ARG C 45 10.293 -6.885 -9.023 1.00 0.00 N ATOM 1416 CA ARG C 45 9.559 -8.021 -9.571 1.00 0.00 C ATOM 1417 C ARG C 45 9.631 -8.021 -11.090 1.00 0.00 C ATOM 1418 O ARG C 45 9.204 -8.975 -11.741 1.00 0.00 O ATOM 1419 CB ARG C 45 8.096 -7.950 -9.129 1.00 0.00 C ATOM 1420 CG ARG C 45 8.015 -7.938 -7.597 1.00 0.00 C ATOM 1421 CD ARG C 45 8.432 -9.298 -7.025 1.00 0.00 C ATOM 1422 NE ARG C 45 7.974 -9.423 -5.647 1.00 0.00 N ATOM 1423 CZ ARG C 45 6.745 -9.839 -5.368 1.00 0.00 C ATOM 1424 NH1 ARG C 45 5.922 -10.133 -6.337 1.00 0.00 N ATOM 1425 NH2 ARG C 45 6.363 -9.958 -4.130 1.00 0.00 N ATOM 0 H ARG C 45 9.718 -6.067 -8.821 1.00 0.00 H new ATOM 0 HA ARG C 45 10.011 -8.940 -9.198 1.00 0.00 H new ATOM 0 HB2 ARG C 45 7.628 -7.053 -9.534 1.00 0.00 H new ATOM 0 HB3 ARG C 45 7.545 -8.803 -9.525 1.00 0.00 H new ATOM 0 HG2 ARG C 45 8.662 -7.156 -7.199 1.00 0.00 H new ATOM 0 HG3 ARG C 45 6.998 -7.701 -7.283 1.00 0.00 H new ATOM 0 HD2 ARG C 45 8.011 -10.101 -7.631 1.00 0.00 H new ATOM 0 HD3 ARG C 45 9.516 -9.402 -7.067 1.00 0.00 H new ATOM 0 HE ARG C 45 8.609 -9.187 -4.884 1.00 0.00 H new ATOM 0 HH11 ARG C 45 6.224 -10.043 -7.307 1.00 0.00 H new ATOM 0 HH12 ARG C 45 4.977 -10.453 -6.124 1.00 0.00 H new ATOM 0 HH21 ARG C 45 7.008 -9.731 -3.373 1.00 0.00 H new ATOM 0 HH22 ARG C 45 5.418 -10.278 -3.916 1.00 0.00 H new ATOM 1439 N LEU C 46 10.167 -6.949 -11.655 1.00 0.00 N ATOM 1440 CA LEU C 46 10.275 -6.854 -13.104 1.00 0.00 C ATOM 1441 C LEU C 46 11.174 -7.960 -13.646 1.00 0.00 C ATOM 1442 O LEU C 46 10.830 -8.634 -14.616 1.00 0.00 O ATOM 1443 CB LEU C 46 10.851 -5.487 -13.494 1.00 0.00 C ATOM 1444 CG LEU C 46 10.952 -5.366 -15.021 1.00 0.00 C ATOM 1445 CD1 LEU C 46 9.561 -5.523 -15.660 1.00 0.00 C ATOM 1446 CD2 LEU C 46 11.541 -3.996 -15.380 1.00 0.00 C ATOM 0 H LEU C 46 10.529 -6.145 -11.143 1.00 0.00 H new ATOM 0 HA LEU C 46 9.280 -6.966 -13.534 1.00 0.00 H new ATOM 0 HB2 LEU C 46 10.217 -4.692 -13.101 1.00 0.00 H new ATOM 0 HB3 LEU C 46 11.837 -5.359 -13.046 1.00 0.00 H new ATOM 0 HG LEU C 46 11.600 -6.154 -15.403 1.00 0.00 H new ATOM 0 HD11 LEU C 46 9.646 -5.435 -16.743 1.00 0.00 H new ATOM 0 HD12 LEU C 46 9.152 -6.501 -15.406 1.00 0.00 H new ATOM 0 HD13 LEU C 46 8.898 -4.744 -15.284 1.00 0.00 H new ATOM 0 HD21 LEU C 46 11.615 -3.904 -16.464 1.00 0.00 H new ATOM 0 HD22 LEU C 46 10.894 -3.209 -14.993 1.00 0.00 H new ATOM 0 HD23 LEU C 46 12.533 -3.900 -14.939 1.00 0.00 H new ATOM 1458 N PHE C 47 12.331 -8.135 -13.016 1.00 0.00 N ATOM 1459 CA PHE C 47 13.279 -9.157 -13.443 1.00 0.00 C ATOM 1460 C PHE C 47 12.845 -10.534 -12.963 1.00 0.00 C ATOM 1461 O PHE C 47 13.005 -11.529 -13.670 1.00 0.00 O ATOM 1462 CB PHE C 47 14.674 -8.834 -12.906 1.00 0.00 C ATOM 1463 CG PHE C 47 15.215 -7.616 -13.624 1.00 0.00 C ATOM 1464 CD1 PHE C 47 14.772 -6.340 -13.260 1.00 0.00 C ATOM 1465 CD2 PHE C 47 16.161 -7.764 -14.647 1.00 0.00 C ATOM 1466 CE1 PHE C 47 15.272 -5.210 -13.918 1.00 0.00 C ATOM 1467 CE2 PHE C 47 16.661 -6.633 -15.305 1.00 0.00 C ATOM 1468 CZ PHE C 47 16.217 -5.358 -14.940 1.00 0.00 C ATOM 0 H PHE C 47 12.634 -7.585 -12.212 1.00 0.00 H new ATOM 0 HA PHE C 47 13.305 -9.165 -14.533 1.00 0.00 H new ATOM 0 HB2 PHE C 47 14.629 -8.648 -11.833 1.00 0.00 H new ATOM 0 HB3 PHE C 47 15.340 -9.684 -13.055 1.00 0.00 H new ATOM 0 HD1 PHE C 47 14.044 -6.227 -12.471 1.00 0.00 H new ATOM 0 HD2 PHE C 47 16.504 -8.749 -14.928 1.00 0.00 H new ATOM 0 HE1 PHE C 47 14.929 -4.225 -13.637 1.00 0.00 H new ATOM 0 HE2 PHE C 47 17.389 -6.746 -16.094 1.00 0.00 H new ATOM 0 HZ PHE C 47 16.604 -4.487 -15.447 1.00 0.00 H new ATOM 1478 N PHE C 48 12.303 -10.587 -11.748 1.00 0.00 N ATOM 1479 CA PHE C 48 11.858 -11.851 -11.165 1.00 0.00 C ATOM 1480 C PHE C 48 10.377 -12.069 -11.439 1.00 0.00 C ATOM 1481 O PHE C 48 9.538 -11.230 -11.108 1.00 0.00 O ATOM 1482 CB PHE C 48 12.102 -11.833 -9.651 1.00 0.00 C ATOM 1483 CG PHE C 48 13.403 -11.121 -9.351 1.00 0.00 C ATOM 1484 CD1 PHE C 48 14.537 -11.331 -10.153 1.00 0.00 C ATOM 1485 CD2 PHE C 48 13.473 -10.235 -8.266 1.00 0.00 C ATOM 1486 CE1 PHE C 48 15.729 -10.663 -9.865 1.00 0.00 C ATOM 1487 CE2 PHE C 48 14.669 -9.566 -7.983 1.00 0.00 C ATOM 1488 CZ PHE C 48 15.796 -9.780 -8.782 1.00 0.00 C ATOM 0 H PHE C 48 12.162 -9.773 -11.150 1.00 0.00 H new ATOM 0 HA PHE C 48 12.424 -12.665 -11.618 1.00 0.00 H new ATOM 0 HB2 PHE C 48 11.277 -11.331 -9.146 1.00 0.00 H new ATOM 0 HB3 PHE C 48 12.137 -12.852 -9.267 1.00 0.00 H new ATOM 0 HD1 PHE C 48 14.487 -12.009 -10.992 1.00 0.00 H new ATOM 0 HD2 PHE C 48 12.603 -10.069 -7.648 1.00 0.00 H new ATOM 0 HE1 PHE C 48 16.601 -10.828 -10.480 1.00 0.00 H new ATOM 0 HE2 PHE C 48 14.721 -8.884 -7.147 1.00 0.00 H new ATOM 0 HZ PHE C 48 16.719 -9.263 -8.563 1.00 0.00 H new ATOM 1498 N LYS C 49 10.062 -13.209 -12.045 1.00 0.00 N ATOM 1499 CA LYS C 49 8.680 -13.542 -12.365 1.00 0.00 C ATOM 1500 C LYS C 49 8.475 -15.051 -12.365 1.00 0.00 C ATOM 1501 O LYS C 49 7.445 -15.489 -12.848 1.00 0.00 O ATOM 1502 CB LYS C 49 8.317 -12.972 -13.736 1.00 0.00 C ATOM 1503 CG LYS C 49 9.296 -13.503 -14.792 1.00 0.00 C ATOM 1504 CD LYS C 49 8.892 -12.994 -16.190 1.00 0.00 C ATOM 1505 CE LYS C 49 7.886 -13.960 -16.828 1.00 0.00 C ATOM 1506 NZ LYS C 49 8.601 -15.189 -17.268 1.00 0.00 N ATOM 1507 OXT LYS C 49 9.353 -15.747 -11.882 1.00 0.00 O ATOM 0 H LYS C 49 10.743 -13.915 -12.323 1.00 0.00 H new ATOM 0 HA LYS C 49 8.033 -13.105 -11.605 1.00 0.00 H new ATOM 0 HB2 LYS C 49 7.297 -13.252 -13.998 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.352 -11.883 -13.709 1.00 0.00 H new ATOM 0 HG2 LYS C 49 10.309 -13.178 -14.556 1.00 0.00 H new ATOM 0 HG3 LYS C 49 9.300 -14.593 -14.780 1.00 0.00 H new ATOM 0 HD2 LYS C 49 8.454 -11.999 -16.111 1.00 0.00 H new ATOM 0 HD3 LYS C 49 9.775 -12.905 -16.823 1.00 0.00 H new ATOM 0 HE2 LYS C 49 7.105 -14.216 -16.112 1.00 0.00 H new ATOM 0 HE3 LYS C 49 7.396 -13.485 -17.678 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 8.055 -15.659 -18.018 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 9.540 -14.932 -17.633 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 8.709 -15.836 -16.461 1.00 0.00 H new TER 1521 LYS C 49 ATOM 1522 N SER D 19 -14.886 15.358 17.914 1.00 0.00 N ATOM 1523 CA SER D 19 -13.976 15.850 16.842 1.00 0.00 C ATOM 1524 C SER D 19 -13.575 14.684 15.942 1.00 0.00 C ATOM 1525 O SER D 19 -12.889 14.870 14.938 1.00 0.00 O ATOM 1526 CB SER D 19 -12.730 16.467 17.478 1.00 0.00 C ATOM 1527 OG SER D 19 -12.260 15.614 18.514 1.00 0.00 O ATOM 0 HA SER D 19 -14.487 16.605 16.245 1.00 0.00 H new ATOM 0 HB2 SER D 19 -11.954 16.606 16.725 1.00 0.00 H new ATOM 0 HB3 SER D 19 -12.963 17.453 17.881 1.00 0.00 H new ATOM 0 HG SER D 19 -12.987 15.028 18.810 1.00 0.00 H new ATOM 1535 N ASN D 20 -14.013 13.486 16.309 1.00 0.00 N ATOM 1536 CA ASN D 20 -13.699 12.294 15.530 1.00 0.00 C ATOM 1537 C ASN D 20 -14.311 12.390 14.137 1.00 0.00 C ATOM 1538 O ASN D 20 -13.698 11.982 13.150 1.00 0.00 O ATOM 1539 CB ASN D 20 -14.230 11.046 16.238 1.00 0.00 C ATOM 1540 CG ASN D 20 -13.401 10.764 17.487 1.00 0.00 C ATOM 1541 OD1 ASN D 20 -12.289 11.275 17.623 1.00 0.00 O ATOM 1542 ND2 ASN D 20 -13.876 9.973 18.409 1.00 0.00 N ATOM 0 H ASN D 20 -14.584 13.314 17.137 1.00 0.00 H new ATOM 0 HA ASN D 20 -12.615 12.221 15.436 1.00 0.00 H new ATOM 0 HB2 ASN D 20 -15.276 11.189 16.510 1.00 0.00 H new ATOM 0 HB3 ASN D 20 -14.190 10.190 15.564 1.00 0.00 H new ATOM 0 HD21 ASN D 20 -13.326 9.776 19.245 1.00 0.00 H new ATOM 0 HD22 ASN D 20 -14.797 9.551 18.294 1.00 0.00 H new ATOM 1549 N ASP D 21 -15.523 12.926 14.064 1.00 0.00 N ATOM 1550 CA ASP D 21 -16.211 13.066 12.788 1.00 0.00 C ATOM 1551 C ASP D 21 -15.417 13.965 11.846 1.00 0.00 C ATOM 1552 O ASP D 21 -15.311 13.689 10.651 1.00 0.00 O ATOM 1553 CB ASP D 21 -17.601 13.666 13.008 1.00 0.00 C ATOM 1554 CG ASP D 21 -18.518 12.641 13.665 1.00 0.00 C ATOM 1555 OD1 ASP D 21 -18.163 11.473 13.667 1.00 0.00 O ATOM 1556 OD2 ASP D 21 -19.563 13.036 14.156 1.00 0.00 O ATOM 0 H ASP D 21 -16.047 13.269 14.869 1.00 0.00 H new ATOM 0 HA ASP D 21 -16.305 12.077 12.339 1.00 0.00 H new ATOM 0 HB2 ASP D 21 -17.527 14.554 13.636 1.00 0.00 H new ATOM 0 HB3 ASP D 21 -18.023 13.984 12.055 1.00 0.00 H new ATOM 1561 N SER D 22 -14.862 15.043 12.390 1.00 0.00 N ATOM 1562 CA SER D 22 -14.086 15.978 11.583 1.00 0.00 C ATOM 1563 C SER D 22 -12.885 15.272 10.963 1.00 0.00 C ATOM 1564 O SER D 22 -12.572 15.473 9.790 1.00 0.00 O ATOM 1565 CB SER D 22 -13.602 17.140 12.449 1.00 0.00 C ATOM 1566 OG SER D 22 -12.987 18.116 11.619 1.00 0.00 O ATOM 0 H SER D 22 -14.934 15.290 13.377 1.00 0.00 H new ATOM 0 HA SER D 22 -14.725 16.361 10.787 1.00 0.00 H new ATOM 0 HB2 SER D 22 -14.440 17.580 12.989 1.00 0.00 H new ATOM 0 HB3 SER D 22 -12.894 16.782 13.196 1.00 0.00 H new ATOM 0 HG SER D 22 -12.676 18.865 12.170 1.00 0.00 H new ATOM 1572 N SER D 23 -12.212 14.440 11.759 1.00 0.00 N ATOM 1573 CA SER D 23 -11.041 13.703 11.277 1.00 0.00 C ATOM 1574 C SER D 23 -11.019 12.304 11.874 1.00 0.00 C ATOM 1575 O SER D 23 -10.862 12.137 13.082 1.00 0.00 O ATOM 1576 CB SER D 23 -9.763 14.443 11.663 1.00 0.00 C ATOM 1577 OG SER D 23 -9.805 15.757 11.124 1.00 0.00 O ATOM 0 H SER D 23 -12.454 14.260 12.733 1.00 0.00 H new ATOM 0 HA SER D 23 -11.100 13.627 10.191 1.00 0.00 H new ATOM 0 HB2 SER D 23 -9.666 14.485 12.748 1.00 0.00 H new ATOM 0 HB3 SER D 23 -8.891 13.909 11.285 1.00 0.00 H new ATOM 0 HG SER D 23 -8.987 16.238 11.370 1.00 0.00 H new ATOM 1583 N ASP D 24 -11.182 11.301 11.016 1.00 0.00 N ATOM 1584 CA ASP D 24 -11.185 9.912 11.470 1.00 0.00 C ATOM 1585 C ASP D 24 -9.752 9.374 11.554 1.00 0.00 C ATOM 1586 O ASP D 24 -8.865 9.840 10.839 1.00 0.00 O ATOM 1587 CB ASP D 24 -12.014 9.045 10.502 1.00 0.00 C ATOM 1588 CG ASP D 24 -11.897 9.591 9.086 1.00 0.00 C ATOM 1589 OD1 ASP D 24 -12.271 10.734 8.881 1.00 0.00 O ATOM 1590 OD2 ASP D 24 -11.438 8.858 8.227 1.00 0.00 O ATOM 0 H ASP D 24 -11.313 11.421 10.012 1.00 0.00 H new ATOM 0 HA ASP D 24 -11.633 9.870 12.463 1.00 0.00 H new ATOM 0 HB2 ASP D 24 -11.663 8.013 10.533 1.00 0.00 H new ATOM 0 HB3 ASP D 24 -13.059 9.036 10.812 1.00 0.00 H new ATOM 1595 N PRO D 25 -9.521 8.403 12.403 1.00 0.00 N ATOM 1596 CA PRO D 25 -8.173 7.778 12.571 1.00 0.00 C ATOM 1597 C PRO D 25 -7.737 7.011 11.321 1.00 0.00 C ATOM 1598 O PRO D 25 -6.558 6.703 11.150 1.00 0.00 O ATOM 1599 CB PRO D 25 -8.357 6.833 13.775 1.00 0.00 C ATOM 1600 CG PRO D 25 -9.822 6.537 13.817 1.00 0.00 C ATOM 1601 CD PRO D 25 -10.517 7.794 13.303 1.00 0.00 C ATOM 0 HA PRO D 25 -7.390 8.519 12.729 1.00 0.00 H new ATOM 0 HB2 PRO D 25 -7.774 5.920 13.653 1.00 0.00 H new ATOM 0 HB3 PRO D 25 -8.023 7.303 14.700 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -10.064 5.675 13.196 1.00 0.00 H new ATOM 0 HG3 PRO D 25 -10.144 6.300 14.831 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -11.440 7.553 12.775 1.00 0.00 H new ATOM 0 HD3 PRO D 25 -10.783 8.466 14.119 1.00 0.00 H new ATOM 1609 N LEU D 26 -8.697 6.703 10.455 1.00 0.00 N ATOM 1610 CA LEU D 26 -8.395 5.965 9.237 1.00 0.00 C ATOM 1611 C LEU D 26 -7.433 6.758 8.356 1.00 0.00 C ATOM 1612 O LEU D 26 -6.500 6.197 7.781 1.00 0.00 O ATOM 1613 CB LEU D 26 -9.696 5.682 8.467 1.00 0.00 C ATOM 1614 CG LEU D 26 -10.404 4.468 9.071 1.00 0.00 C ATOM 1615 CD1 LEU D 26 -10.684 4.726 10.551 1.00 0.00 C ATOM 1616 CD2 LEU D 26 -11.726 4.233 8.336 1.00 0.00 C ATOM 0 H LEU D 26 -9.680 6.950 10.573 1.00 0.00 H new ATOM 0 HA LEU D 26 -7.921 5.021 9.507 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -10.350 6.553 8.508 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -9.474 5.499 7.416 1.00 0.00 H new ATOM 0 HG LEU D 26 -9.769 3.588 8.969 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -11.189 3.861 10.982 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -9.743 4.896 11.075 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -11.320 5.605 10.653 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -12.232 3.368 8.765 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -12.361 5.113 8.439 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -11.528 4.050 7.280 1.00 0.00 H new ATOM 1628 N VAL D 27 -7.666 8.058 8.251 1.00 0.00 N ATOM 1629 CA VAL D 27 -6.810 8.905 7.430 1.00 0.00 C ATOM 1630 C VAL D 27 -5.380 8.909 7.973 1.00 0.00 C ATOM 1631 O VAL D 27 -4.417 8.713 7.227 1.00 0.00 O ATOM 1632 CB VAL D 27 -7.359 10.334 7.418 1.00 0.00 C ATOM 1633 CG1 VAL D 27 -6.402 11.246 6.650 1.00 0.00 C ATOM 1634 CG2 VAL D 27 -8.733 10.349 6.745 1.00 0.00 C ATOM 0 H VAL D 27 -8.431 8.546 8.717 1.00 0.00 H new ATOM 0 HA VAL D 27 -6.798 8.509 6.415 1.00 0.00 H new ATOM 0 HB VAL D 27 -7.454 10.693 8.443 1.00 0.00 H new ATOM 0 HG11 VAL D 27 -6.795 12.263 6.643 1.00 0.00 H new ATOM 0 HG12 VAL D 27 -5.425 11.238 7.134 1.00 0.00 H new ATOM 0 HG13 VAL D 27 -6.302 10.888 5.625 1.00 0.00 H new ATOM 0 HG21 VAL D 27 -9.123 11.367 6.737 1.00 0.00 H new ATOM 0 HG22 VAL D 27 -8.640 9.988 5.721 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -9.416 9.703 7.297 1.00 0.00 H new ATOM 1644 N VAL D 28 -5.253 9.126 9.277 1.00 0.00 N ATOM 1645 CA VAL D 28 -3.941 9.151 9.914 1.00 0.00 C ATOM 1646 C VAL D 28 -3.294 7.774 9.844 1.00 0.00 C ATOM 1647 O VAL D 28 -2.107 7.648 9.542 1.00 0.00 O ATOM 1648 CB VAL D 28 -4.070 9.590 11.374 1.00 0.00 C ATOM 1649 CG1 VAL D 28 -2.705 9.496 12.059 1.00 0.00 C ATOM 1650 CG2 VAL D 28 -4.566 11.039 11.428 1.00 0.00 C ATOM 0 H VAL D 28 -6.036 9.286 9.910 1.00 0.00 H new ATOM 0 HA VAL D 28 -3.312 9.865 9.383 1.00 0.00 H new ATOM 0 HB VAL D 28 -4.780 8.941 11.887 1.00 0.00 H new ATOM 0 HG11 VAL D 28 -2.798 9.809 13.099 1.00 0.00 H new ATOM 0 HG12 VAL D 28 -2.348 8.467 12.020 1.00 0.00 H new ATOM 0 HG13 VAL D 28 -1.995 10.145 11.547 1.00 0.00 H new ATOM 0 HG21 VAL D 28 -4.659 11.353 12.468 1.00 0.00 H new ATOM 0 HG22 VAL D 28 -3.855 11.686 10.915 1.00 0.00 H new ATOM 0 HG23 VAL D 28 -5.538 11.109 10.940 1.00 0.00 H new ATOM 1660 N ALA D 29 -4.082 6.742 10.125 1.00 0.00 N ATOM 1661 CA ALA D 29 -3.577 5.377 10.092 1.00 0.00 C ATOM 1662 C ALA D 29 -3.120 5.011 8.687 1.00 0.00 C ATOM 1663 O ALA D 29 -2.112 4.334 8.511 1.00 0.00 O ATOM 1664 CB ALA D 29 -4.666 4.404 10.549 1.00 0.00 C ATOM 0 H ALA D 29 -5.067 6.825 10.377 1.00 0.00 H new ATOM 0 HA ALA D 29 -2.725 5.308 10.768 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -4.279 3.385 10.521 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -4.969 4.649 11.567 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -5.527 4.483 9.885 1.00 0.00 H new ATOM 1670 N ALA D 30 -3.863 5.467 7.687 1.00 0.00 N ATOM 1671 CA ALA D 30 -3.516 5.172 6.302 1.00 0.00 C ATOM 1672 C ALA D 30 -2.089 5.619 6.000 1.00 0.00 C ATOM 1673 O ALA D 30 -1.289 4.853 5.465 1.00 0.00 O ATOM 1674 CB ALA D 30 -4.486 5.887 5.362 1.00 0.00 C ATOM 0 H ALA D 30 -4.701 6.036 7.806 1.00 0.00 H new ATOM 0 HA ALA D 30 -3.586 4.095 6.149 1.00 0.00 H new ATOM 0 HB1 ALA D 30 -4.222 5.663 4.328 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -5.502 5.546 5.559 1.00 0.00 H new ATOM 0 HB3 ALA D 30 -4.426 6.963 5.527 1.00 0.00 H new ATOM 1680 N SER D 31 -1.776 6.863 6.347 1.00 0.00 N ATOM 1681 CA SER D 31 -0.437 7.396 6.108 1.00 0.00 C ATOM 1682 C SER D 31 0.609 6.606 6.891 1.00 0.00 C ATOM 1683 O SER D 31 1.686 6.304 6.379 1.00 0.00 O ATOM 1684 CB SER D 31 -0.380 8.865 6.520 1.00 0.00 C ATOM 1685 OG SER D 31 -1.327 9.602 5.757 1.00 0.00 O ATOM 0 H SER D 31 -2.422 7.516 6.790 1.00 0.00 H new ATOM 0 HA SER D 31 -0.219 7.306 5.044 1.00 0.00 H new ATOM 0 HB2 SER D 31 -0.595 8.965 7.584 1.00 0.00 H new ATOM 0 HB3 SER D 31 0.622 9.262 6.359 1.00 0.00 H new ATOM 0 HG SER D 31 -0.864 10.295 5.242 1.00 0.00 H new ATOM 1691 N ILE D 32 0.277 6.277 8.135 1.00 0.00 N ATOM 1692 CA ILE D 32 1.189 5.525 8.991 1.00 0.00 C ATOM 1693 C ILE D 32 1.445 4.139 8.410 1.00 0.00 C ATOM 1694 O ILE D 32 2.574 3.659 8.407 1.00 0.00 O ATOM 1695 CB ILE D 32 0.608 5.393 10.401 1.00 0.00 C ATOM 1696 CG1 ILE D 32 0.574 6.774 11.063 1.00 0.00 C ATOM 1697 CG2 ILE D 32 1.488 4.453 11.235 1.00 0.00 C ATOM 1698 CD1 ILE D 32 -0.233 6.700 12.361 1.00 0.00 C ATOM 0 H ILE D 32 -0.613 6.518 8.572 1.00 0.00 H new ATOM 0 HA ILE D 32 2.133 6.067 9.043 1.00 0.00 H new ATOM 0 HB ILE D 32 -0.402 4.986 10.342 1.00 0.00 H new ATOM 0 HG12 ILE D 32 1.588 7.113 11.272 1.00 0.00 H new ATOM 0 HG13 ILE D 32 0.127 7.502 10.386 1.00 0.00 H new ATOM 0 HG21 ILE D 32 1.073 4.361 12.238 1.00 0.00 H new ATOM 0 HG22 ILE D 32 1.520 3.471 10.764 1.00 0.00 H new ATOM 0 HG23 ILE D 32 2.498 4.859 11.296 1.00 0.00 H new ATOM 0 HD11 ILE D 32 -0.257 7.683 12.831 1.00 0.00 H new ATOM 0 HD12 ILE D 32 -1.251 6.379 12.139 1.00 0.00 H new ATOM 0 HD13 ILE D 32 0.233 5.985 13.039 1.00 0.00 H new ATOM 1710 N ILE D 33 0.389 3.500 7.922 1.00 0.00 N ATOM 1711 CA ILE D 33 0.523 2.167 7.351 1.00 0.00 C ATOM 1712 C ILE D 33 1.462 2.185 6.147 1.00 0.00 C ATOM 1713 O ILE D 33 2.313 1.308 6.002 1.00 0.00 O ATOM 1714 CB ILE D 33 -0.856 1.647 6.918 1.00 0.00 C ATOM 1715 CG1 ILE D 33 -1.701 1.333 8.157 1.00 0.00 C ATOM 1716 CG2 ILE D 33 -0.704 0.380 6.061 1.00 0.00 C ATOM 1717 CD1 ILE D 33 -3.171 1.201 7.749 1.00 0.00 C ATOM 0 H ILE D 33 -0.558 3.878 7.910 1.00 0.00 H new ATOM 0 HA ILE D 33 0.943 1.508 8.111 1.00 0.00 H new ATOM 0 HB ILE D 33 -1.351 2.416 6.325 1.00 0.00 H new ATOM 0 HG12 ILE D 33 -1.356 0.409 8.621 1.00 0.00 H new ATOM 0 HG13 ILE D 33 -1.587 2.124 8.898 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -1.689 0.023 5.762 1.00 0.00 H new ATOM 0 HG22 ILE D 33 -0.116 0.610 5.173 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -0.199 -0.393 6.640 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -3.774 0.978 8.629 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -3.511 2.136 7.304 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -3.276 0.395 7.023 1.00 0.00 H new ATOM 1729 N GLY D 34 1.300 3.179 5.285 1.00 0.00 N ATOM 1730 CA GLY D 34 2.140 3.278 4.102 1.00 0.00 C ATOM 1731 C GLY D 34 3.601 3.492 4.477 1.00 0.00 C ATOM 1732 O GLY D 34 4.481 2.752 4.039 1.00 0.00 O ATOM 0 H GLY D 34 0.604 3.919 5.381 1.00 0.00 H new ATOM 0 HA2 GLY D 34 2.044 2.369 3.508 1.00 0.00 H new ATOM 0 HA3 GLY D 34 1.798 4.104 3.478 1.00 0.00 H new ATOM 1736 N ILE D 35 3.856 4.512 5.292 1.00 0.00 N ATOM 1737 CA ILE D 35 5.219 4.810 5.716 1.00 0.00 C ATOM 1738 C ILE D 35 5.777 3.690 6.586 1.00 0.00 C ATOM 1739 O ILE D 35 6.919 3.275 6.420 1.00 0.00 O ATOM 1740 CB ILE D 35 5.242 6.126 6.499 1.00 0.00 C ATOM 1741 CG1 ILE D 35 4.909 7.283 5.558 1.00 0.00 C ATOM 1742 CG2 ILE D 35 6.636 6.346 7.101 1.00 0.00 C ATOM 1743 CD1 ILE D 35 4.649 8.548 6.377 1.00 0.00 C ATOM 0 H ILE D 35 3.145 5.139 5.668 1.00 0.00 H new ATOM 0 HA ILE D 35 5.842 4.900 4.826 1.00 0.00 H new ATOM 0 HB ILE D 35 4.505 6.081 7.301 1.00 0.00 H new ATOM 0 HG12 ILE D 35 5.732 7.449 4.864 1.00 0.00 H new ATOM 0 HG13 ILE D 35 4.032 7.038 4.959 1.00 0.00 H new ATOM 0 HG21 ILE D 35 6.648 7.283 7.657 1.00 0.00 H new ATOM 0 HG22 ILE D 35 6.876 5.522 7.773 1.00 0.00 H new ATOM 0 HG23 ILE D 35 7.375 6.389 6.301 1.00 0.00 H new ATOM 0 HD11 ILE D 35 4.411 9.373 5.706 1.00 0.00 H new ATOM 0 HD12 ILE D 35 3.811 8.378 7.053 1.00 0.00 H new ATOM 0 HD13 ILE D 35 5.539 8.796 6.956 1.00 0.00 H new ATOM 1755 N LEU D 36 4.967 3.218 7.523 1.00 0.00 N ATOM 1756 CA LEU D 36 5.407 2.162 8.429 1.00 0.00 C ATOM 1757 C LEU D 36 5.741 0.890 7.658 1.00 0.00 C ATOM 1758 O LEU D 36 6.764 0.250 7.906 1.00 0.00 O ATOM 1759 CB LEU D 36 4.306 1.865 9.455 1.00 0.00 C ATOM 1760 CG LEU D 36 4.780 0.786 10.444 1.00 0.00 C ATOM 1761 CD1 LEU D 36 6.023 1.278 11.212 1.00 0.00 C ATOM 1762 CD2 LEU D 36 3.649 0.473 11.433 1.00 0.00 C ATOM 0 H LEU D 36 4.013 3.543 7.677 1.00 0.00 H new ATOM 0 HA LEU D 36 6.305 2.504 8.943 1.00 0.00 H new ATOM 0 HB2 LEU D 36 4.047 2.776 9.995 1.00 0.00 H new ATOM 0 HB3 LEU D 36 3.403 1.530 8.944 1.00 0.00 H new ATOM 0 HG LEU D 36 5.044 -0.116 9.892 1.00 0.00 H new ATOM 0 HD11 LEU D 36 6.349 0.506 11.909 1.00 0.00 H new ATOM 0 HD12 LEU D 36 6.825 1.492 10.506 1.00 0.00 H new ATOM 0 HD13 LEU D 36 5.774 2.184 11.765 1.00 0.00 H new ATOM 0 HD21 LEU D 36 3.981 -0.291 12.136 1.00 0.00 H new ATOM 0 HD22 LEU D 36 3.383 1.378 11.980 1.00 0.00 H new ATOM 0 HD23 LEU D 36 2.778 0.110 10.887 1.00 0.00 H new ATOM 1774 N HIS D 37 4.872 0.533 6.723 1.00 0.00 N ATOM 1775 CA HIS D 37 5.076 -0.664 5.922 1.00 0.00 C ATOM 1776 C HIS D 37 6.337 -0.528 5.083 1.00 0.00 C ATOM 1777 O HIS D 37 7.090 -1.486 4.917 1.00 0.00 O ATOM 1778 CB HIS D 37 3.872 -0.898 5.014 1.00 0.00 C ATOM 1779 CG HIS D 37 4.083 -2.157 4.223 1.00 0.00 C ATOM 1780 ND1 HIS D 37 3.259 -3.259 4.349 1.00 0.00 N ATOM 1781 CD2 HIS D 37 5.033 -2.507 3.297 1.00 0.00 C ATOM 1782 CE1 HIS D 37 3.725 -4.212 3.521 1.00 0.00 C ATOM 1783 NE2 HIS D 37 4.802 -3.802 2.854 1.00 0.00 N ATOM 0 H HIS D 37 4.023 1.053 6.502 1.00 0.00 H new ATOM 0 HA HIS D 37 5.188 -1.517 6.592 1.00 0.00 H new ATOM 0 HB2 HIS D 37 2.963 -0.978 5.610 1.00 0.00 H new ATOM 0 HB3 HIS D 37 3.739 -0.051 4.342 1.00 0.00 H new ATOM 0 HD2 HIS D 37 5.839 -1.871 2.963 1.00 0.00 H new ATOM 0 HE1 HIS D 37 3.280 -5.190 3.411 1.00 0.00 H new ATOM 0 HE2 HIS D 37 5.341 -4.327 2.165 1.00 0.00 H new ATOM 1791 N LEU D 38 6.560 0.666 4.556 1.00 0.00 N ATOM 1792 CA LEU D 38 7.731 0.913 3.728 1.00 0.00 C ATOM 1793 C LEU D 38 9.010 0.689 4.511 1.00 0.00 C ATOM 1794 O LEU D 38 9.970 0.149 3.980 1.00 0.00 O ATOM 1795 CB LEU D 38 7.700 2.349 3.174 1.00 0.00 C ATOM 1796 CG LEU D 38 6.944 2.398 1.836 1.00 0.00 C ATOM 1797 CD1 LEU D 38 6.587 3.853 1.496 1.00 0.00 C ATOM 1798 CD2 LEU D 38 7.812 1.795 0.708 1.00 0.00 C ATOM 0 H LEU D 38 5.951 1.474 4.685 1.00 0.00 H new ATOM 0 HA LEU D 38 7.710 0.208 2.897 1.00 0.00 H new ATOM 0 HB2 LEU D 38 7.219 3.012 3.894 1.00 0.00 H new ATOM 0 HB3 LEU D 38 8.718 2.713 3.036 1.00 0.00 H new ATOM 0 HG LEU D 38 6.029 1.813 1.926 1.00 0.00 H new ATOM 0 HD11 LEU D 38 6.051 3.884 0.547 1.00 0.00 H new ATOM 0 HD12 LEU D 38 5.956 4.266 2.283 1.00 0.00 H new ATOM 0 HD13 LEU D 38 7.500 4.443 1.416 1.00 0.00 H new ATOM 0 HD21 LEU D 38 7.265 1.836 -0.234 1.00 0.00 H new ATOM 0 HD22 LEU D 38 8.736 2.365 0.616 1.00 0.00 H new ATOM 0 HD23 LEU D 38 8.048 0.758 0.946 1.00 0.00 H new ATOM 1810 N ILE D 39 9.026 1.109 5.762 1.00 0.00 N ATOM 1811 CA ILE D 39 10.216 0.944 6.579 1.00 0.00 C ATOM 1812 C ILE D 39 10.548 -0.539 6.745 1.00 0.00 C ATOM 1813 O ILE D 39 11.706 -0.945 6.639 1.00 0.00 O ATOM 1814 CB ILE D 39 9.972 1.572 7.951 1.00 0.00 C ATOM 1815 CG1 ILE D 39 9.860 3.093 7.806 1.00 0.00 C ATOM 1816 CG2 ILE D 39 11.132 1.233 8.890 1.00 0.00 C ATOM 1817 CD1 ILE D 39 9.348 3.700 9.116 1.00 0.00 C ATOM 0 H ILE D 39 8.241 1.561 6.231 1.00 0.00 H new ATOM 0 HA ILE D 39 11.056 1.436 6.089 1.00 0.00 H new ATOM 0 HB ILE D 39 9.045 1.176 8.367 1.00 0.00 H new ATOM 0 HG12 ILE D 39 10.832 3.516 7.553 1.00 0.00 H new ATOM 0 HG13 ILE D 39 9.182 3.341 6.989 1.00 0.00 H new ATOM 0 HG21 ILE D 39 10.953 1.683 9.867 1.00 0.00 H new ATOM 0 HG22 ILE D 39 11.209 0.151 8.998 1.00 0.00 H new ATOM 0 HG23 ILE D 39 12.062 1.623 8.476 1.00 0.00 H new ATOM 0 HD11 ILE D 39 9.270 4.782 9.009 1.00 0.00 H new ATOM 0 HD12 ILE D 39 8.367 3.286 9.350 1.00 0.00 H new ATOM 0 HD13 ILE D 39 10.043 3.464 9.922 1.00 0.00 H new ATOM 1829 N LEU D 40 9.532 -1.341 7.014 1.00 0.00 N ATOM 1830 CA LEU D 40 9.741 -2.775 7.188 1.00 0.00 C ATOM 1831 C LEU D 40 10.019 -3.454 5.849 1.00 0.00 C ATOM 1832 O LEU D 40 10.893 -4.318 5.744 1.00 0.00 O ATOM 1833 CB LEU D 40 8.511 -3.403 7.834 1.00 0.00 C ATOM 1834 CG LEU D 40 8.142 -2.616 9.097 1.00 0.00 C ATOM 1835 CD1 LEU D 40 6.883 -3.223 9.721 1.00 0.00 C ATOM 1836 CD2 LEU D 40 9.301 -2.668 10.106 1.00 0.00 C ATOM 0 H LEU D 40 8.565 -1.033 7.116 1.00 0.00 H new ATOM 0 HA LEU D 40 10.607 -2.917 7.834 1.00 0.00 H new ATOM 0 HB2 LEU D 40 7.676 -3.399 7.133 1.00 0.00 H new ATOM 0 HB3 LEU D 40 8.711 -4.444 8.086 1.00 0.00 H new ATOM 0 HG LEU D 40 7.952 -1.576 8.832 1.00 0.00 H new ATOM 0 HD11 LEU D 40 6.617 -2.666 10.620 1.00 0.00 H new ATOM 0 HD12 LEU D 40 6.062 -3.172 9.006 1.00 0.00 H new ATOM 0 HD13 LEU D 40 7.072 -4.264 9.982 1.00 0.00 H new ATOM 0 HD21 LEU D 40 9.030 -2.106 11.000 1.00 0.00 H new ATOM 0 HD22 LEU D 40 9.502 -3.705 10.376 1.00 0.00 H new ATOM 0 HD23 LEU D 40 10.193 -2.230 9.658 1.00 0.00 H new ATOM 1848 N TRP D 41 9.261 -3.064 4.831 1.00 0.00 N ATOM 1849 CA TRP D 41 9.419 -3.651 3.505 1.00 0.00 C ATOM 1850 C TRP D 41 10.741 -3.244 2.858 1.00 0.00 C ATOM 1851 O TRP D 41 11.472 -4.086 2.338 1.00 0.00 O ATOM 1852 CB TRP D 41 8.246 -3.238 2.609 1.00 0.00 C ATOM 1853 CG TRP D 41 8.509 -3.674 1.203 1.00 0.00 C ATOM 1854 CD1 TRP D 41 8.267 -4.910 0.711 1.00 0.00 C ATOM 1855 CD2 TRP D 41 9.008 -2.883 0.085 1.00 0.00 C ATOM 1856 NE1 TRP D 41 8.638 -4.941 -0.619 1.00 0.00 N ATOM 1857 CE2 TRP D 41 9.086 -3.713 -1.052 1.00 0.00 C ATOM 1858 CE3 TRP D 41 9.408 -1.540 -0.047 1.00 0.00 C ATOM 1859 CZ2 TRP D 41 9.541 -3.233 -2.275 1.00 0.00 C ATOM 1860 CZ3 TRP D 41 9.855 -1.053 -1.283 1.00 0.00 C ATOM 1861 CH2 TRP D 41 9.923 -1.900 -2.392 1.00 0.00 C ATOM 0 H TRP D 41 8.536 -2.349 4.896 1.00 0.00 H new ATOM 0 HA TRP D 41 9.428 -4.735 3.620 1.00 0.00 H new ATOM 0 HB2 TRP D 41 7.322 -3.687 2.973 1.00 0.00 H new ATOM 0 HB3 TRP D 41 8.111 -2.157 2.646 1.00 0.00 H new ATOM 0 HD1 TRP D 41 7.852 -5.737 1.267 1.00 0.00 H new ATOM 0 HE1 TRP D 41 8.586 -5.772 -1.208 1.00 0.00 H new ATOM 0 HE3 TRP D 41 9.370 -0.882 0.808 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 9.598 -3.891 -3.129 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 10.148 -0.018 -1.379 1.00 0.00 H new ATOM 0 HH2 TRP D 41 10.272 -1.520 -3.341 1.00 0.00 H new ATOM 1872 N ILE D 42 11.033 -1.955 2.885 1.00 0.00 N ATOM 1873 CA ILE D 42 12.259 -1.453 2.286 1.00 0.00 C ATOM 1874 C ILE D 42 13.467 -2.062 2.983 1.00 0.00 C ATOM 1875 O ILE D 42 14.489 -2.334 2.352 1.00 0.00 O ATOM 1876 CB ILE D 42 12.304 0.078 2.403 1.00 0.00 C ATOM 1877 CG1 ILE D 42 13.396 0.630 1.479 1.00 0.00 C ATOM 1878 CG2 ILE D 42 12.607 0.493 3.858 1.00 0.00 C ATOM 1879 CD1 ILE D 42 13.286 2.156 1.417 1.00 0.00 C ATOM 0 H ILE D 42 10.443 -1.241 3.312 1.00 0.00 H new ATOM 0 HA ILE D 42 12.281 -1.733 1.233 1.00 0.00 H new ATOM 0 HB ILE D 42 11.335 0.483 2.112 1.00 0.00 H new ATOM 0 HG12 ILE D 42 14.380 0.340 1.847 1.00 0.00 H new ATOM 0 HG13 ILE D 42 13.291 0.206 0.480 1.00 0.00 H new ATOM 0 HG21 ILE D 42 12.636 1.580 3.928 1.00 0.00 H new ATOM 0 HG22 ILE D 42 11.828 0.108 4.516 1.00 0.00 H new ATOM 0 HG23 ILE D 42 13.571 0.084 4.160 1.00 0.00 H new ATOM 0 HD11 ILE D 42 14.062 2.550 0.761 1.00 0.00 H new ATOM 0 HD12 ILE D 42 12.306 2.435 1.029 1.00 0.00 H new ATOM 0 HD13 ILE D 42 13.412 2.571 2.417 1.00 0.00 H new ATOM 1891 N LEU D 43 13.344 -2.267 4.288 1.00 0.00 N ATOM 1892 CA LEU D 43 14.440 -2.835 5.059 1.00 0.00 C ATOM 1893 C LEU D 43 14.767 -4.234 4.558 1.00 0.00 C ATOM 1894 O LEU D 43 15.932 -4.599 4.419 1.00 0.00 O ATOM 1895 CB LEU D 43 14.068 -2.891 6.548 1.00 0.00 C ATOM 1896 CG LEU D 43 15.187 -3.581 7.348 1.00 0.00 C ATOM 1897 CD1 LEU D 43 16.525 -2.858 7.117 1.00 0.00 C ATOM 1898 CD2 LEU D 43 14.836 -3.548 8.840 1.00 0.00 C ATOM 0 H LEU D 43 12.507 -2.051 4.829 1.00 0.00 H new ATOM 0 HA LEU D 43 15.317 -2.199 4.935 1.00 0.00 H new ATOM 0 HB2 LEU D 43 13.907 -1.882 6.929 1.00 0.00 H new ATOM 0 HB3 LEU D 43 13.131 -3.433 6.676 1.00 0.00 H new ATOM 0 HG LEU D 43 15.282 -4.614 7.015 1.00 0.00 H new ATOM 0 HD11 LEU D 43 17.310 -3.354 7.688 1.00 0.00 H new ATOM 0 HD12 LEU D 43 16.775 -2.885 6.056 1.00 0.00 H new ATOM 0 HD13 LEU D 43 16.439 -1.821 7.443 1.00 0.00 H new ATOM 0 HD21 LEU D 43 15.626 -4.036 9.411 1.00 0.00 H new ATOM 0 HD22 LEU D 43 14.738 -2.513 9.168 1.00 0.00 H new ATOM 0 HD23 LEU D 43 13.894 -4.071 9.004 1.00 0.00 H new ATOM 1910 N ASP D 44 13.733 -5.020 4.294 1.00 0.00 N ATOM 1911 CA ASP D 44 13.933 -6.380 3.814 1.00 0.00 C ATOM 1912 C ASP D 44 14.599 -6.375 2.442 1.00 0.00 C ATOM 1913 O ASP D 44 15.446 -7.218 2.147 1.00 0.00 O ATOM 1914 CB ASP D 44 12.591 -7.106 3.736 1.00 0.00 C ATOM 1915 CG ASP D 44 12.086 -7.418 5.141 1.00 0.00 C ATOM 1916 OD1 ASP D 44 12.872 -7.318 6.070 1.00 0.00 O ATOM 1917 OD2 ASP D 44 10.920 -7.750 5.270 1.00 0.00 O ATOM 0 H ASP D 44 12.757 -4.744 4.402 1.00 0.00 H new ATOM 0 HA ASP D 44 14.586 -6.901 4.514 1.00 0.00 H new ATOM 0 HB2 ASP D 44 11.864 -6.489 3.208 1.00 0.00 H new ATOM 0 HB3 ASP D 44 12.700 -8.029 3.166 1.00 0.00 H new ATOM 1922 N ARG D 45 14.203 -5.422 1.605 1.00 0.00 N ATOM 1923 CA ARG D 45 14.760 -5.313 0.260 1.00 0.00 C ATOM 1924 C ARG D 45 16.060 -4.525 0.280 1.00 0.00 C ATOM 1925 O ARG D 45 16.765 -4.448 -0.723 1.00 0.00 O ATOM 1926 CB ARG D 45 13.755 -4.614 -0.658 1.00 0.00 C ATOM 1927 CG ARG D 45 12.434 -5.397 -0.678 1.00 0.00 C ATOM 1928 CD ARG D 45 12.615 -6.735 -1.405 1.00 0.00 C ATOM 1929 NE ARG D 45 11.315 -7.284 -1.771 1.00 0.00 N ATOM 1930 CZ ARG D 45 10.711 -6.922 -2.896 1.00 0.00 C ATOM 1931 NH1 ARG D 45 11.275 -6.051 -3.689 1.00 0.00 N ATOM 1932 NH2 ARG D 45 9.555 -7.437 -3.209 1.00 0.00 N ATOM 0 H ARG D 45 13.502 -4.717 1.832 1.00 0.00 H new ATOM 0 HA ARG D 45 14.964 -6.317 -0.113 1.00 0.00 H new ATOM 0 HB2 ARG D 45 13.579 -3.596 -0.311 1.00 0.00 H new ATOM 0 HB3 ARG D 45 14.160 -4.541 -1.667 1.00 0.00 H new ATOM 0 HG2 ARG D 45 12.093 -5.574 0.342 1.00 0.00 H new ATOM 0 HG3 ARG D 45 11.663 -4.808 -1.174 1.00 0.00 H new ATOM 0 HD2 ARG D 45 13.224 -6.593 -2.298 1.00 0.00 H new ATOM 0 HD3 ARG D 45 13.148 -7.437 -0.764 1.00 0.00 H new ATOM 0 HE ARG D 45 10.862 -7.957 -1.153 1.00 0.00 H new ATOM 0 HH11 ARG D 45 12.180 -5.649 -3.444 1.00 0.00 H new ATOM 0 HH12 ARG D 45 10.811 -5.773 -4.554 1.00 0.00 H new ATOM 0 HH21 ARG D 45 9.115 -8.118 -2.589 1.00 0.00 H new ATOM 0 HH22 ARG D 45 9.090 -7.159 -4.073 1.00 0.00 H new ATOM 1946 N LEU D 46 16.374 -3.939 1.425 1.00 0.00 N ATOM 1947 CA LEU D 46 17.597 -3.158 1.542 1.00 0.00 C ATOM 1948 C LEU D 46 18.820 -4.041 1.313 1.00 0.00 C ATOM 1949 O LEU D 46 19.728 -3.679 0.567 1.00 0.00 O ATOM 1950 CB LEU D 46 17.678 -2.522 2.935 1.00 0.00 C ATOM 1951 CG LEU D 46 18.954 -1.677 3.064 1.00 0.00 C ATOM 1952 CD1 LEU D 46 18.959 -0.560 2.007 1.00 0.00 C ATOM 1953 CD2 LEU D 46 19.012 -1.065 4.469 1.00 0.00 C ATOM 0 H LEU D 46 15.810 -3.987 2.274 1.00 0.00 H new ATOM 0 HA LEU D 46 17.581 -2.375 0.784 1.00 0.00 H new ATOM 0 HB2 LEU D 46 16.802 -1.898 3.108 1.00 0.00 H new ATOM 0 HB3 LEU D 46 17.671 -3.300 3.698 1.00 0.00 H new ATOM 0 HG LEU D 46 19.826 -2.312 2.904 1.00 0.00 H new ATOM 0 HD11 LEU D 46 19.868 0.033 2.108 1.00 0.00 H new ATOM 0 HD12 LEU D 46 18.922 -1.001 1.011 1.00 0.00 H new ATOM 0 HD13 LEU D 46 18.090 0.082 2.152 1.00 0.00 H new ATOM 0 HD21 LEU D 46 19.916 -0.464 4.567 1.00 0.00 H new ATOM 0 HD22 LEU D 46 18.137 -0.434 4.627 1.00 0.00 H new ATOM 0 HD23 LEU D 46 19.024 -1.862 5.213 1.00 0.00 H new ATOM 1965 N PHE D 47 18.836 -5.197 1.968 1.00 0.00 N ATOM 1966 CA PHE D 47 19.953 -6.125 1.835 1.00 0.00 C ATOM 1967 C PHE D 47 19.859 -6.905 0.532 1.00 0.00 C ATOM 1968 O PHE D 47 20.872 -7.186 -0.109 1.00 0.00 O ATOM 1969 CB PHE D 47 19.971 -7.092 3.019 1.00 0.00 C ATOM 1970 CG PHE D 47 20.366 -6.340 4.271 1.00 0.00 C ATOM 1971 CD1 PHE D 47 19.424 -5.541 4.931 1.00 0.00 C ATOM 1972 CD2 PHE D 47 21.670 -6.444 4.775 1.00 0.00 C ATOM 1973 CE1 PHE D 47 19.783 -4.845 6.091 1.00 0.00 C ATOM 1974 CE2 PHE D 47 22.028 -5.747 5.937 1.00 0.00 C ATOM 1975 CZ PHE D 47 21.086 -4.950 6.595 1.00 0.00 C ATOM 0 H PHE D 47 18.094 -5.512 2.592 1.00 0.00 H new ATOM 0 HA PHE D 47 20.878 -5.548 1.824 1.00 0.00 H new ATOM 0 HB2 PHE D 47 18.988 -7.546 3.148 1.00 0.00 H new ATOM 0 HB3 PHE D 47 20.674 -7.903 2.831 1.00 0.00 H new ATOM 0 HD1 PHE D 47 18.419 -5.462 4.544 1.00 0.00 H new ATOM 0 HD2 PHE D 47 22.398 -7.060 4.268 1.00 0.00 H new ATOM 0 HE1 PHE D 47 19.056 -4.227 6.597 1.00 0.00 H new ATOM 0 HE2 PHE D 47 23.033 -5.826 6.325 1.00 0.00 H new ATOM 0 HZ PHE D 47 21.363 -4.415 7.492 1.00 0.00 H new ATOM 1985 N PHE D 48 18.636 -7.261 0.147 1.00 0.00 N ATOM 1986 CA PHE D 48 18.412 -8.023 -1.079 1.00 0.00 C ATOM 1987 C PHE D 48 18.100 -7.086 -2.238 1.00 0.00 C ATOM 1988 O PHE D 48 17.174 -6.277 -2.168 1.00 0.00 O ATOM 1989 CB PHE D 48 17.242 -8.993 -0.876 1.00 0.00 C ATOM 1990 CG PHE D 48 17.283 -9.556 0.529 1.00 0.00 C ATOM 1991 CD1 PHE D 48 18.502 -9.932 1.114 1.00 0.00 C ATOM 1992 CD2 PHE D 48 16.091 -9.694 1.255 1.00 0.00 C ATOM 1993 CE1 PHE D 48 18.524 -10.445 2.416 1.00 0.00 C ATOM 1994 CE2 PHE D 48 16.118 -10.208 2.556 1.00 0.00 C ATOM 1995 CZ PHE D 48 17.334 -10.582 3.136 1.00 0.00 C ATOM 0 H PHE D 48 17.787 -7.035 0.665 1.00 0.00 H new ATOM 0 HA PHE D 48 19.317 -8.583 -1.313 1.00 0.00 H new ATOM 0 HB2 PHE D 48 16.296 -8.477 -1.044 1.00 0.00 H new ATOM 0 HB3 PHE D 48 17.298 -9.802 -1.604 1.00 0.00 H new ATOM 0 HD1 PHE D 48 19.423 -9.826 0.560 1.00 0.00 H new ATOM 0 HD2 PHE D 48 15.151 -9.403 0.809 1.00 0.00 H new ATOM 0 HE1 PHE D 48 19.462 -10.736 2.865 1.00 0.00 H new ATOM 0 HE2 PHE D 48 15.199 -10.316 3.113 1.00 0.00 H new ATOM 0 HZ PHE D 48 17.354 -10.977 4.141 1.00 0.00 H new ATOM 2005 N LYS D 49 18.881 -7.204 -3.305 1.00 0.00 N ATOM 2006 CA LYS D 49 18.687 -6.367 -4.482 1.00 0.00 C ATOM 2007 C LYS D 49 19.136 -7.097 -5.742 1.00 0.00 C ATOM 2008 O LYS D 49 19.239 -6.450 -6.772 1.00 0.00 O ATOM 2009 CB LYS D 49 19.481 -5.071 -4.326 1.00 0.00 C ATOM 2010 CG LYS D 49 20.961 -5.397 -4.082 1.00 0.00 C ATOM 2011 CD LYS D 49 21.781 -4.096 -3.997 1.00 0.00 C ATOM 2012 CE LYS D 49 22.241 -3.673 -5.397 1.00 0.00 C ATOM 2013 NZ LYS D 49 23.342 -4.568 -5.842 1.00 0.00 N ATOM 2014 OXT LYS D 49 19.371 -8.291 -5.659 1.00 0.00 O ATOM 0 H LYS D 49 19.651 -7.868 -3.379 1.00 0.00 H new ATOM 0 HA LYS D 49 17.626 -6.137 -4.575 1.00 0.00 H new ATOM 0 HB2 LYS D 49 19.376 -4.459 -5.222 1.00 0.00 H new ATOM 0 HB3 LYS D 49 19.085 -4.489 -3.494 1.00 0.00 H new ATOM 0 HG2 LYS D 49 21.069 -5.965 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS D 49 21.341 -6.024 -4.888 1.00 0.00 H new ATOM 0 HD2 LYS D 49 21.179 -3.306 -3.549 1.00 0.00 H new ATOM 0 HD3 LYS D 49 22.646 -4.243 -3.350 1.00 0.00 H new ATOM 0 HE2 LYS D 49 21.408 -3.726 -6.098 1.00 0.00 H new ATOM 0 HE3 LYS D 49 22.581 -2.638 -5.384 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 23.889 -4.099 -6.592 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 23.967 -4.777 -5.037 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 22.942 -5.455 -6.208 1.00 0.00 H new TER 2028 LYS D 49 HETATM 2029 S 3LW C 100 -5.040 3.866 -0.163 1.00 0.00 S HETATM 2030 BR 3LW C 100 -4.358 1.315 -1.502 1.00 0.00 BR HETATM 2031 C1 3LW C 100 -4.059 2.799 -0.357 1.00 0.00 C HETATM 2032 C2 3LW C 100 -2.943 2.993 0.359 1.00 0.00 C HETATM 2033 N2 3LW C 100 -5.719 6.548 0.460 1.00 0.00 N HETATM 2034 C3 3LW C 100 -3.079 4.124 1.047 1.00 0.00 C HETATM 2035 C5 3LW C 100 -4.754 5.944 1.379 1.00 0.00 C HETATM 2036 C10 3LW C 100 -6.612 7.610 0.977 1.00 0.00 C HETATM 2037 C12 3LW C 100 -4.265 4.678 0.787 1.00 0.00 C HETATM 2038 C61 3LW C 100 -7.523 7.097 2.138 1.00 0.00 C HETATM 2039 C62 3LW C 100 -7.557 8.135 -0.139 1.00 0.00 C HETATM 2040 C63 3LW C 100 -5.820 8.842 1.513 1.00 0.00 C HETATM 2041 C71 3LW C 100 -8.460 8.207 2.654 1.00 0.00 C HETATM 2042 C72 3LW C 100 -8.501 9.243 0.389 1.00 0.00 C HETATM 2043 C73 3LW C 100 -6.770 9.940 2.037 1.00 0.00 C HETATM 2044 C81 3LW C 100 -9.369 8.688 1.523 1.00 0.00 C HETATM 2045 C82 3LW C 100 -7.675 10.427 0.903 1.00 0.00 C HETATM 2046 C83 3LW C 100 -7.629 9.383 3.179 1.00 0.00 C