USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 33 CYS SG : rot -88:sc= 0.459 USER MOD Set 1.2: B 37 GLN :FLIP amide:sc= -0.147! C(o=-6.2!,f=0.31!) USER MOD Set 2.1: A 30 GLN :FLIP amide:sc= -0.808 X(o=-3.9,f=-3.4) USER MOD Set 2.2: A 34 ASN : amide:sc= -2.6 X(o=-3.4,f=-3.9) USER MOD Single : A 4 SER OG : rot 180:sc= -0.0314 USER MOD Single : A 5 ASN : amide:sc= -0.0921 K(o=-0.092,f=-1.2!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 50:sc= 0.302 USER MOD Single : A 17 THR OG1 : rot -153:sc= -1.37 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 MET CE :methyl -145:sc= -1.78 (180deg=-2.67) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN :FLIP amide:sc= -0.283 F(o=-1.1,f=-0.28) USER MOD Single : A 33 CYS SG : rot 78:sc= 0.723 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 38 SER OG : rot 13:sc= 0.82 USER MOD Single : A 40 THR OG1 : rot 37:sc= 0.0751 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 30:sc= -1.3! USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 157:sc= -4.14! (180deg=-5.06!) USER MOD Single : A 59 ASN : amide:sc= -0.168 K(o=-0.17,f=-1!) USER MOD Single : B 4 SER OG : rot -170:sc= 0 USER MOD Single : B 5 ASN : amide:sc= -0.354 X(o=-0.35,f=0) USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 SER OG : rot 49:sc= 0.113 USER MOD Single : B 17 THR OG1 : rot 180:sc= -0.512 USER MOD Single : B 19 LYS NZ :NH3+ -160:sc= -0.0658 (180deg=-0.562) USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 25 MET CE :methyl -102:sc= 0 (180deg=-0.86) USER MOD Single : B 28 SER OG : rot 180:sc= 0.0856 USER MOD Single : B 30 GLN : amide:sc= -0.493 K(o=-0.49,f=-1.2) USER MOD Single : B 31 GLN : amide:sc= -0.151 K(o=-0.15,f=-2.4!) USER MOD Single : B 34 ASN : amide:sc= 0.028 X(o=0.028,f=-0.041) USER MOD Single : B 38 SER OG : rot 5:sc= 1.42 USER MOD Single : B 40 THR OG1 : rot 180:sc= -0.887 USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 TYR OH : rot 180:sc= -0.47 USER MOD Single : B 53 SER OG : rot -56:sc= 0.855 USER MOD Single : B 54 LYS NZ :NH3+ -160:sc= -0.14 (180deg=-0.755) USER MOD Single : B 59 ASN : amide:sc= 0 X(o=0,f=-0.0022) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU A 2 8.647 10.683 9.184 1.00 0.00 N ATOM 21 CA GLU A 2 7.383 10.090 9.713 1.00 0.00 C ATOM 22 C GLU A 2 6.299 10.160 8.629 1.00 0.00 C ATOM 23 O GLU A 2 5.713 11.197 8.385 1.00 0.00 O ATOM 24 CB GLU A 2 6.933 10.871 10.964 1.00 0.00 C ATOM 25 CG GLU A 2 6.122 9.957 11.911 1.00 0.00 C ATOM 26 CD GLU A 2 7.057 9.252 12.904 1.00 0.00 C ATOM 27 OE1 GLU A 2 8.259 9.314 12.707 1.00 0.00 O ATOM 28 OE2 GLU A 2 6.551 8.660 13.844 1.00 0.00 O ATOM 0 HA GLU A 2 7.549 9.048 9.987 1.00 0.00 H new ATOM 0 HB2 GLU A 2 7.805 11.265 11.487 1.00 0.00 H new ATOM 0 HB3 GLU A 2 6.326 11.726 10.667 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.384 10.548 12.453 1.00 0.00 H new ATOM 0 HG3 GLU A 2 5.573 9.216 11.330 1.00 0.00 H new ATOM 35 N LEU A 3 6.035 9.063 7.975 1.00 0.00 N ATOM 36 CA LEU A 3 4.998 9.055 6.903 1.00 0.00 C ATOM 37 C LEU A 3 3.629 9.390 7.500 1.00 0.00 C ATOM 38 O LEU A 3 2.850 10.117 6.916 1.00 0.00 O ATOM 39 CB LEU A 3 4.944 7.661 6.271 1.00 0.00 C ATOM 40 CG LEU A 3 6.229 7.396 5.471 1.00 0.00 C ATOM 41 CD1 LEU A 3 6.332 5.899 5.161 1.00 0.00 C ATOM 42 CD2 LEU A 3 6.221 8.191 4.150 1.00 0.00 C ATOM 0 H LEU A 3 6.495 8.167 8.137 1.00 0.00 H new ATOM 0 HA LEU A 3 5.252 9.799 6.148 1.00 0.00 H new ATOM 0 HB2 LEU A 3 4.827 6.905 7.047 1.00 0.00 H new ATOM 0 HB3 LEU A 3 4.076 7.583 5.617 1.00 0.00 H new ATOM 0 HG LEU A 3 7.085 7.715 6.066 1.00 0.00 H new ATOM 0 HD11 LEU A 3 7.242 5.707 4.593 1.00 0.00 H new ATOM 0 HD12 LEU A 3 6.360 5.335 6.094 1.00 0.00 H new ATOM 0 HD13 LEU A 3 5.467 5.588 4.575 1.00 0.00 H new ATOM 0 HD21 LEU A 3 7.139 7.990 3.599 1.00 0.00 H new ATOM 0 HD22 LEU A 3 5.363 7.889 3.549 1.00 0.00 H new ATOM 0 HD23 LEU A 3 6.155 9.257 4.367 1.00 0.00 H new ATOM 54 N SER A 4 3.322 8.857 8.651 1.00 0.00 N ATOM 55 CA SER A 4 1.995 9.136 9.271 1.00 0.00 C ATOM 56 C SER A 4 1.836 10.637 9.532 1.00 0.00 C ATOM 57 O SER A 4 0.783 11.201 9.310 1.00 0.00 O ATOM 58 CB SER A 4 1.889 8.382 10.598 1.00 0.00 C ATOM 59 OG SER A 4 2.939 8.801 11.460 1.00 0.00 O ATOM 0 H SER A 4 3.932 8.241 9.189 1.00 0.00 H new ATOM 0 HA SER A 4 1.210 8.808 8.590 1.00 0.00 H new ATOM 0 HB2 SER A 4 0.922 8.575 11.063 1.00 0.00 H new ATOM 0 HB3 SER A 4 1.951 7.308 10.425 1.00 0.00 H new ATOM 0 HG SER A 4 2.874 8.321 12.312 1.00 0.00 H new ATOM 65 N ASN A 5 2.862 11.290 10.013 1.00 0.00 N ATOM 66 CA ASN A 5 2.747 12.753 10.292 1.00 0.00 C ATOM 67 C ASN A 5 2.576 13.527 8.981 1.00 0.00 C ATOM 68 O ASN A 5 1.687 14.341 8.843 1.00 0.00 O ATOM 69 CB ASN A 5 4.017 13.235 11.006 1.00 0.00 C ATOM 70 CG ASN A 5 3.732 14.539 11.753 1.00 0.00 C ATOM 71 OD1 ASN A 5 2.672 14.710 12.321 1.00 0.00 O ATOM 72 ND2 ASN A 5 4.642 15.474 11.776 1.00 0.00 N ATOM 0 H ASN A 5 3.770 10.876 10.224 1.00 0.00 H new ATOM 0 HA ASN A 5 1.877 12.929 10.925 1.00 0.00 H new ATOM 0 HB2 ASN A 5 4.363 12.474 11.705 1.00 0.00 H new ATOM 0 HB3 ASN A 5 4.816 13.388 10.281 1.00 0.00 H new ATOM 0 HD21 ASN A 5 4.463 16.348 12.271 1.00 0.00 H new ATOM 0 HD22 ASN A 5 5.532 15.331 11.299 1.00 0.00 H new ATOM 79 N GLU A 6 3.416 13.270 8.015 1.00 0.00 N ATOM 80 CA GLU A 6 3.300 13.988 6.714 1.00 0.00 C ATOM 81 C GLU A 6 1.914 13.694 6.143 1.00 0.00 C ATOM 82 O GLU A 6 1.208 14.577 5.697 1.00 0.00 O ATOM 83 CB GLU A 6 4.449 13.491 5.789 1.00 0.00 C ATOM 84 CG GLU A 6 4.016 13.247 4.325 1.00 0.00 C ATOM 85 CD GLU A 6 3.637 14.568 3.653 1.00 0.00 C ATOM 86 OE1 GLU A 6 2.507 14.993 3.815 1.00 0.00 O ATOM 87 OE2 GLU A 6 4.484 15.129 2.981 1.00 0.00 O ATOM 0 H GLU A 6 4.178 12.594 8.071 1.00 0.00 H new ATOM 0 HA GLU A 6 3.399 15.069 6.818 1.00 0.00 H new ATOM 0 HB2 GLU A 6 5.255 14.225 5.801 1.00 0.00 H new ATOM 0 HB3 GLU A 6 4.855 12.565 6.196 1.00 0.00 H new ATOM 0 HG2 GLU A 6 4.827 12.771 3.774 1.00 0.00 H new ATOM 0 HG3 GLU A 6 3.168 12.562 4.299 1.00 0.00 H new ATOM 94 N LEU A 7 1.517 12.461 6.184 1.00 0.00 N ATOM 95 CA LEU A 7 0.174 12.093 5.670 1.00 0.00 C ATOM 96 C LEU A 7 -0.889 12.799 6.514 1.00 0.00 C ATOM 97 O LEU A 7 -1.864 13.317 6.004 1.00 0.00 O ATOM 98 CB LEU A 7 -0.002 10.579 5.785 1.00 0.00 C ATOM 99 CG LEU A 7 -1.305 10.145 5.106 1.00 0.00 C ATOM 100 CD1 LEU A 7 -1.231 10.404 3.586 1.00 0.00 C ATOM 101 CD2 LEU A 7 -1.530 8.653 5.376 1.00 0.00 C ATOM 0 H LEU A 7 2.067 11.685 6.553 1.00 0.00 H new ATOM 0 HA LEU A 7 0.072 12.394 4.627 1.00 0.00 H new ATOM 0 HB2 LEU A 7 0.844 10.071 5.323 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -0.015 10.286 6.835 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.136 10.723 5.510 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.164 10.091 3.118 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -1.074 11.467 3.405 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -0.403 9.837 3.160 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.455 8.332 4.897 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.695 8.080 4.972 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -1.600 8.484 6.451 1.00 0.00 H new ATOM 113 N LYS A 8 -0.702 12.821 7.808 1.00 0.00 N ATOM 114 CA LYS A 8 -1.688 13.486 8.707 1.00 0.00 C ATOM 115 C LYS A 8 -1.732 14.985 8.399 1.00 0.00 C ATOM 116 O LYS A 8 -2.774 15.606 8.456 1.00 0.00 O ATOM 117 CB LYS A 8 -1.268 13.273 10.166 1.00 0.00 C ATOM 118 CG LYS A 8 -2.345 13.837 11.097 1.00 0.00 C ATOM 119 CD LYS A 8 -1.957 13.566 12.553 1.00 0.00 C ATOM 120 CE LYS A 8 -3.040 14.116 13.484 1.00 0.00 C ATOM 121 NZ LYS A 8 -2.669 13.833 14.899 1.00 0.00 N ATOM 0 H LYS A 8 0.098 12.403 8.283 1.00 0.00 H new ATOM 0 HA LYS A 8 -2.677 13.056 8.546 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -1.123 12.211 10.362 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -0.314 13.765 10.356 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -2.457 14.909 10.933 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -3.309 13.378 10.875 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -1.835 12.495 12.714 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -0.998 14.034 12.778 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -3.152 15.190 13.334 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -4.002 13.659 13.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -3.405 14.207 15.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -2.583 12.806 15.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -1.760 14.289 15.117 1.00 0.00 H new ATOM 135 N VAL A 9 -0.610 15.573 8.076 1.00 0.00 N ATOM 136 CA VAL A 9 -0.596 17.033 7.770 1.00 0.00 C ATOM 137 C VAL A 9 -1.501 17.311 6.562 1.00 0.00 C ATOM 138 O VAL A 9 -2.294 18.231 6.575 1.00 0.00 O ATOM 139 CB VAL A 9 0.843 17.472 7.455 1.00 0.00 C ATOM 140 CG1 VAL A 9 0.845 18.884 6.855 1.00 0.00 C ATOM 141 CG2 VAL A 9 1.675 17.472 8.745 1.00 0.00 C ATOM 0 H VAL A 9 0.295 15.106 8.011 1.00 0.00 H new ATOM 0 HA VAL A 9 -0.964 17.592 8.630 1.00 0.00 H new ATOM 0 HB VAL A 9 1.274 16.775 6.737 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.870 19.185 6.636 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.261 18.889 5.935 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.406 19.583 7.567 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.695 17.783 8.520 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.234 18.164 9.462 1.00 0.00 H new ATOM 0 HG23 VAL A 9 1.687 16.468 9.170 1.00 0.00 H new ATOM 151 N GLU A 10 -1.394 16.528 5.522 1.00 0.00 N ATOM 152 CA GLU A 10 -2.253 16.757 4.330 1.00 0.00 C ATOM 153 C GLU A 10 -3.709 16.459 4.707 1.00 0.00 C ATOM 154 O GLU A 10 -4.624 17.139 4.283 1.00 0.00 O ATOM 155 CB GLU A 10 -1.794 15.827 3.206 1.00 0.00 C ATOM 156 CG GLU A 10 -0.331 16.139 2.841 1.00 0.00 C ATOM 157 CD GLU A 10 -0.258 17.351 1.905 1.00 0.00 C ATOM 158 OE1 GLU A 10 -1.200 17.560 1.158 1.00 0.00 O ATOM 159 OE2 GLU A 10 0.752 18.036 1.932 1.00 0.00 O ATOM 0 H GLU A 10 -0.749 15.741 5.449 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.175 17.790 3.992 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -1.887 14.787 3.520 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.432 15.954 2.332 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.242 16.337 3.747 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.123 15.273 2.360 1.00 0.00 H new ATOM 166 N ARG A 11 -3.929 15.465 5.526 1.00 0.00 N ATOM 167 CA ARG A 11 -5.320 15.142 5.953 1.00 0.00 C ATOM 168 C ARG A 11 -5.910 16.373 6.640 1.00 0.00 C ATOM 169 O ARG A 11 -7.029 16.775 6.375 1.00 0.00 O ATOM 170 CB ARG A 11 -5.266 13.954 6.926 1.00 0.00 C ATOM 171 CG ARG A 11 -6.659 13.650 7.514 1.00 0.00 C ATOM 172 CD ARG A 11 -6.746 12.168 7.936 1.00 0.00 C ATOM 173 NE ARG A 11 -7.680 12.023 9.095 1.00 0.00 N ATOM 174 CZ ARG A 11 -8.958 11.824 8.910 1.00 0.00 C ATOM 175 NH1 ARG A 11 -9.453 11.777 7.703 1.00 0.00 N ATOM 176 NH2 ARG A 11 -9.742 11.673 9.943 1.00 0.00 N ATOM 0 H ARG A 11 -3.205 14.863 5.917 1.00 0.00 H new ATOM 0 HA ARG A 11 -5.944 14.875 5.100 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -4.887 13.073 6.408 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -4.568 14.174 7.734 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -6.847 14.293 8.374 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -7.430 13.872 6.776 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -7.094 11.562 7.099 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -5.757 11.799 8.207 1.00 0.00 H new ATOM 0 HE ARG A 11 -7.313 12.080 10.045 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -8.841 11.896 6.896 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -10.452 11.621 7.567 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -9.356 11.711 10.886 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -10.741 11.517 9.807 1.00 0.00 H new ATOM 190 N ILE A 12 -5.143 16.994 7.494 1.00 0.00 N ATOM 191 CA ILE A 12 -5.614 18.227 8.181 1.00 0.00 C ATOM 192 C ILE A 12 -5.731 19.354 7.151 1.00 0.00 C ATOM 193 O ILE A 12 -6.664 20.134 7.165 1.00 0.00 O ATOM 194 CB ILE A 12 -4.615 18.619 9.270 1.00 0.00 C ATOM 195 CG1 ILE A 12 -4.646 17.566 10.379 1.00 0.00 C ATOM 196 CG2 ILE A 12 -4.996 19.983 9.851 1.00 0.00 C ATOM 197 CD1 ILE A 12 -3.465 17.779 11.327 1.00 0.00 C ATOM 0 H ILE A 12 -4.201 16.696 7.747 1.00 0.00 H new ATOM 0 HA ILE A 12 -6.586 18.049 8.640 1.00 0.00 H new ATOM 0 HB ILE A 12 -3.613 18.677 8.844 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -5.584 17.633 10.931 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -4.601 16.567 9.946 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -4.282 20.260 10.627 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -4.981 20.733 9.060 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -5.996 19.929 10.281 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -3.491 17.027 12.115 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -2.532 17.690 10.771 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -3.529 18.772 11.771 1.00 0.00 H new ATOM 209 N ARG A 13 -4.772 19.451 6.268 1.00 0.00 N ATOM 210 CA ARG A 13 -4.795 20.533 5.242 1.00 0.00 C ATOM 211 C ARG A 13 -6.124 20.490 4.488 1.00 0.00 C ATOM 212 O ARG A 13 -6.763 21.504 4.284 1.00 0.00 O ATOM 213 CB ARG A 13 -3.644 20.304 4.257 1.00 0.00 C ATOM 214 CG ARG A 13 -3.426 21.554 3.403 1.00 0.00 C ATOM 215 CD ARG A 13 -2.245 21.320 2.460 1.00 0.00 C ATOM 216 NE ARG A 13 -1.051 20.912 3.256 1.00 0.00 N ATOM 217 CZ ARG A 13 0.072 20.638 2.652 1.00 0.00 C ATOM 218 NH1 ARG A 13 0.170 20.787 1.359 1.00 0.00 N ATOM 219 NH2 ARG A 13 1.101 20.228 3.341 1.00 0.00 N ATOM 0 H ARG A 13 -3.970 18.823 6.214 1.00 0.00 H new ATOM 0 HA ARG A 13 -4.684 21.504 5.724 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -2.731 20.063 4.802 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.868 19.451 3.616 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.325 21.779 2.830 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -3.232 22.416 4.042 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -2.493 20.547 1.733 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -2.028 22.228 1.898 1.00 0.00 H new ATOM 0 HE ARG A 13 -1.113 20.847 4.272 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -0.631 21.118 0.822 1.00 0.00 H new ATOM 0 HH12 ARG A 13 1.048 20.573 0.886 1.00 0.00 H new ATOM 0 HH21 ARG A 13 1.028 20.121 4.353 1.00 0.00 H new ATOM 0 HH22 ARG A 13 1.979 20.014 2.868 1.00 0.00 H new ATOM 233 N LEU A 14 -6.557 19.325 4.086 1.00 0.00 N ATOM 234 CA LEU A 14 -7.859 19.216 3.361 1.00 0.00 C ATOM 235 C LEU A 14 -8.949 18.855 4.368 1.00 0.00 C ATOM 236 O LEU A 14 -10.111 18.744 4.028 1.00 0.00 O ATOM 237 CB LEU A 14 -7.763 18.124 2.293 1.00 0.00 C ATOM 238 CG LEU A 14 -6.623 18.450 1.319 1.00 0.00 C ATOM 239 CD1 LEU A 14 -6.496 17.323 0.288 1.00 0.00 C ATOM 240 CD2 LEU A 14 -6.907 19.782 0.601 1.00 0.00 C ATOM 0 H LEU A 14 -6.066 18.442 4.228 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.097 20.164 2.878 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -7.587 17.157 2.763 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -8.706 18.048 1.752 1.00 0.00 H new ATOM 0 HG LEU A 14 -5.690 18.541 1.876 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.687 17.553 -0.405 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.280 16.385 0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -7.431 17.229 -0.265 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -6.092 20.005 -0.088 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -7.841 19.704 0.045 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -6.989 20.582 1.337 1.00 0.00 H new ATOM 252 N SER A 15 -8.578 18.670 5.610 1.00 0.00 N ATOM 253 CA SER A 15 -9.583 18.316 6.655 1.00 0.00 C ATOM 254 C SER A 15 -10.533 17.240 6.120 1.00 0.00 C ATOM 255 O SER A 15 -11.639 17.524 5.706 1.00 0.00 O ATOM 256 CB SER A 15 -10.381 19.565 7.034 1.00 0.00 C ATOM 257 OG SER A 15 -10.691 20.301 5.858 1.00 0.00 O ATOM 0 H SER A 15 -7.618 18.750 5.945 1.00 0.00 H new ATOM 0 HA SER A 15 -9.069 17.930 7.535 1.00 0.00 H new ATOM 0 HB2 SER A 15 -11.298 19.282 7.551 1.00 0.00 H new ATOM 0 HB3 SER A 15 -9.805 20.183 7.722 1.00 0.00 H new ATOM 0 HG SER A 15 -11.076 19.699 5.187 1.00 0.00 H new ATOM 263 N LEU A 16 -10.108 16.005 6.122 1.00 0.00 N ATOM 264 CA LEU A 16 -10.986 14.910 5.608 1.00 0.00 C ATOM 265 C LEU A 16 -11.838 14.354 6.748 1.00 0.00 C ATOM 266 O LEU A 16 -11.501 14.476 7.909 1.00 0.00 O ATOM 267 CB LEU A 16 -10.123 13.788 5.031 1.00 0.00 C ATOM 268 CG LEU A 16 -9.287 14.326 3.865 1.00 0.00 C ATOM 269 CD1 LEU A 16 -8.329 13.232 3.386 1.00 0.00 C ATOM 270 CD2 LEU A 16 -10.208 14.761 2.708 1.00 0.00 C ATOM 0 H LEU A 16 -9.192 15.706 6.457 1.00 0.00 H new ATOM 0 HA LEU A 16 -11.636 15.309 4.829 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.469 13.385 5.804 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.756 12.969 4.690 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.715 15.192 4.199 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.731 13.609 2.556 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.671 12.941 4.204 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.902 12.366 3.056 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.603 15.142 1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.790 13.906 2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -10.883 15.544 3.055 1.00 0.00 H new ATOM 282 N THR A 17 -12.942 13.737 6.421 1.00 0.00 N ATOM 283 CA THR A 17 -13.828 13.162 7.476 1.00 0.00 C ATOM 284 C THR A 17 -13.545 11.665 7.607 1.00 0.00 C ATOM 285 O THR A 17 -13.549 10.934 6.636 1.00 0.00 O ATOM 286 CB THR A 17 -15.291 13.364 7.070 1.00 0.00 C ATOM 287 OG1 THR A 17 -15.452 13.018 5.702 1.00 0.00 O ATOM 288 CG2 THR A 17 -15.682 14.826 7.277 1.00 0.00 C ATOM 0 H THR A 17 -13.270 13.606 5.464 1.00 0.00 H new ATOM 0 HA THR A 17 -13.638 13.658 8.428 1.00 0.00 H new ATOM 0 HB THR A 17 -15.930 12.729 7.684 1.00 0.00 H new ATOM 0 HG1 THR A 17 -16.206 13.518 5.325 1.00 0.00 H new ATOM 0 HG21 THR A 17 -16.723 14.969 6.988 1.00 0.00 H new ATOM 0 HG22 THR A 17 -15.558 15.091 8.327 1.00 0.00 H new ATOM 0 HG23 THR A 17 -15.045 15.463 6.664 1.00 0.00 H new ATOM 296 N ALA A 18 -13.301 11.202 8.801 1.00 0.00 N ATOM 297 CA ALA A 18 -13.021 9.752 8.994 1.00 0.00 C ATOM 298 C ALA A 18 -14.265 8.941 8.627 1.00 0.00 C ATOM 299 O ALA A 18 -14.174 7.861 8.080 1.00 0.00 O ATOM 300 CB ALA A 18 -12.656 9.494 10.456 1.00 0.00 C ATOM 0 H ALA A 18 -13.283 11.765 9.651 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.190 9.453 8.355 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -12.451 8.433 10.598 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -11.770 10.073 10.718 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.486 9.792 11.096 1.00 0.00 H new ATOM 306 N LYS A 19 -15.428 9.449 8.933 1.00 0.00 N ATOM 307 CA LYS A 19 -16.673 8.705 8.612 1.00 0.00 C ATOM 308 C LYS A 19 -16.806 8.534 7.095 1.00 0.00 C ATOM 309 O LYS A 19 -17.098 7.461 6.607 1.00 0.00 O ATOM 310 CB LYS A 19 -17.864 9.509 9.127 1.00 0.00 C ATOM 311 CG LYS A 19 -17.835 9.555 10.654 1.00 0.00 C ATOM 312 CD LYS A 19 -19.018 10.384 11.157 1.00 0.00 C ATOM 313 CE LYS A 19 -18.998 10.431 12.685 1.00 0.00 C ATOM 314 NZ LYS A 19 -20.151 11.242 13.167 1.00 0.00 N ATOM 0 H LYS A 19 -15.567 10.349 9.392 1.00 0.00 H new ATOM 0 HA LYS A 19 -16.642 7.721 9.081 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -17.834 10.521 8.723 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -18.795 9.057 8.785 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -17.885 8.545 11.061 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -16.898 9.992 10.998 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -18.966 11.394 10.751 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -19.955 9.949 10.809 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -19.053 9.421 13.092 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -18.061 10.865 13.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -20.141 11.276 14.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -20.079 12.208 12.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -21.039 10.809 12.844 1.00 0.00 H new ATOM 328 N SER A 20 -16.596 9.583 6.346 1.00 0.00 N ATOM 329 CA SER A 20 -16.716 9.475 4.864 1.00 0.00 C ATOM 330 C SER A 20 -15.650 8.520 4.323 1.00 0.00 C ATOM 331 O SER A 20 -15.920 7.676 3.491 1.00 0.00 O ATOM 332 CB SER A 20 -16.525 10.857 4.236 1.00 0.00 C ATOM 333 OG SER A 20 -17.014 10.836 2.902 1.00 0.00 O ATOM 0 H SER A 20 -16.347 10.508 6.696 1.00 0.00 H new ATOM 0 HA SER A 20 -17.704 9.090 4.612 1.00 0.00 H new ATOM 0 HB2 SER A 20 -17.055 11.611 4.818 1.00 0.00 H new ATOM 0 HB3 SER A 20 -15.470 11.131 4.245 1.00 0.00 H new ATOM 0 HG SER A 20 -16.895 11.720 2.496 1.00 0.00 H new ATOM 339 N VAL A 21 -14.439 8.656 4.783 1.00 0.00 N ATOM 340 CA VAL A 21 -13.347 7.769 4.292 1.00 0.00 C ATOM 341 C VAL A 21 -13.635 6.313 4.679 1.00 0.00 C ATOM 342 O VAL A 21 -13.490 5.410 3.879 1.00 0.00 O ATOM 343 CB VAL A 21 -12.025 8.224 4.918 1.00 0.00 C ATOM 344 CG1 VAL A 21 -10.922 7.205 4.612 1.00 0.00 C ATOM 345 CG2 VAL A 21 -11.637 9.586 4.340 1.00 0.00 C ATOM 0 H VAL A 21 -14.157 9.345 5.480 1.00 0.00 H new ATOM 0 HA VAL A 21 -13.284 7.831 3.206 1.00 0.00 H new ATOM 0 HB VAL A 21 -12.146 8.302 5.998 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.986 7.537 5.061 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -11.199 6.235 5.024 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.796 7.118 3.533 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -10.697 9.914 4.782 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.520 9.503 3.259 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.417 10.313 4.566 1.00 0.00 H new ATOM 355 N ALA A 22 -14.028 6.076 5.902 1.00 0.00 N ATOM 356 CA ALA A 22 -14.309 4.676 6.339 1.00 0.00 C ATOM 357 C ALA A 22 -15.503 4.105 5.568 1.00 0.00 C ATOM 358 O ALA A 22 -15.522 2.942 5.216 1.00 0.00 O ATOM 359 CB ALA A 22 -14.624 4.670 7.835 1.00 0.00 C ATOM 0 H ALA A 22 -14.167 6.790 6.617 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.433 4.060 6.138 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.830 3.650 8.159 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.770 5.061 8.388 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -15.497 5.295 8.026 1.00 0.00 H new ATOM 365 N GLU A 23 -16.506 4.902 5.312 1.00 0.00 N ATOM 366 CA GLU A 23 -17.698 4.383 4.577 1.00 0.00 C ATOM 367 C GLU A 23 -17.294 3.997 3.145 1.00 0.00 C ATOM 368 O GLU A 23 -17.640 2.940 2.654 1.00 0.00 O ATOM 369 CB GLU A 23 -18.781 5.486 4.543 1.00 0.00 C ATOM 370 CG GLU A 23 -20.186 4.867 4.647 1.00 0.00 C ATOM 371 CD GLU A 23 -20.513 4.568 6.114 1.00 0.00 C ATOM 372 OE1 GLU A 23 -19.888 3.683 6.671 1.00 0.00 O ATOM 373 OE2 GLU A 23 -21.382 5.234 6.653 1.00 0.00 O ATOM 0 H GLU A 23 -16.553 5.886 5.578 1.00 0.00 H new ATOM 0 HA GLU A 23 -18.091 3.500 5.080 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.623 6.184 5.365 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -18.697 6.058 3.619 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -20.926 5.551 4.232 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -20.234 3.950 4.060 1.00 0.00 H new ATOM 380 N GLU A 24 -16.566 4.849 2.477 1.00 0.00 N ATOM 381 CA GLU A 24 -16.139 4.547 1.079 1.00 0.00 C ATOM 382 C GLU A 24 -15.097 3.423 1.090 1.00 0.00 C ATOM 383 O GLU A 24 -15.150 2.503 0.296 1.00 0.00 O ATOM 384 CB GLU A 24 -15.527 5.812 0.470 1.00 0.00 C ATOM 385 CG GLU A 24 -16.569 6.941 0.464 1.00 0.00 C ATOM 386 CD GLU A 24 -17.516 6.768 -0.726 1.00 0.00 C ATOM 387 OE1 GLU A 24 -17.189 7.265 -1.791 1.00 0.00 O ATOM 388 OE2 GLU A 24 -18.544 6.135 -0.556 1.00 0.00 O ATOM 0 H GLU A 24 -16.246 5.747 2.841 1.00 0.00 H new ATOM 0 HA GLU A 24 -16.997 4.228 0.488 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -14.651 6.116 1.043 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -15.189 5.611 -0.547 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -17.135 6.930 1.395 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -16.070 7.908 0.405 1.00 0.00 H new ATOM 395 N MET A 25 -14.151 3.492 1.988 1.00 0.00 N ATOM 396 CA MET A 25 -13.103 2.433 2.060 1.00 0.00 C ATOM 397 C MET A 25 -13.742 1.102 2.461 1.00 0.00 C ATOM 398 O MET A 25 -13.377 0.054 1.965 1.00 0.00 O ATOM 399 CB MET A 25 -12.050 2.831 3.095 1.00 0.00 C ATOM 400 CG MET A 25 -11.151 3.928 2.522 1.00 0.00 C ATOM 401 SD MET A 25 -9.936 4.425 3.769 1.00 0.00 S ATOM 402 CE MET A 25 -8.685 3.170 3.405 1.00 0.00 C ATOM 0 H MET A 25 -14.059 4.239 2.677 1.00 0.00 H new ATOM 0 HA MET A 25 -12.630 2.323 1.084 1.00 0.00 H new ATOM 0 HB2 MET A 25 -12.536 3.184 4.005 1.00 0.00 H new ATOM 0 HB3 MET A 25 -11.451 1.963 3.370 1.00 0.00 H new ATOM 0 HG2 MET A 25 -10.643 3.567 1.628 1.00 0.00 H new ATOM 0 HG3 MET A 25 -11.752 4.786 2.222 1.00 0.00 H new ATOM 0 HE1 MET A 25 -8.194 2.867 4.330 1.00 0.00 H new ATOM 0 HE2 MET A 25 -9.161 2.304 2.946 1.00 0.00 H new ATOM 0 HE3 MET A 25 -7.945 3.582 2.720 1.00 0.00 H new ATOM 412 N GLY A 26 -14.691 1.132 3.359 1.00 0.00 N ATOM 413 CA GLY A 26 -15.352 -0.135 3.797 1.00 0.00 C ATOM 414 C GLY A 26 -14.594 -0.723 4.991 1.00 0.00 C ATOM 415 O GLY A 26 -14.560 -1.923 5.181 1.00 0.00 O ATOM 0 H GLY A 26 -15.038 1.979 3.809 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -16.389 0.060 4.072 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -15.369 -0.851 2.975 1.00 0.00 H new ATOM 419 N ILE A 27 -13.988 0.119 5.795 1.00 0.00 N ATOM 420 CA ILE A 27 -13.224 -0.369 6.992 1.00 0.00 C ATOM 421 C ILE A 27 -13.745 0.329 8.251 1.00 0.00 C ATOM 422 O ILE A 27 -14.450 1.317 8.185 1.00 0.00 O ATOM 423 CB ILE A 27 -11.731 -0.069 6.811 1.00 0.00 C ATOM 424 CG1 ILE A 27 -11.518 1.435 6.611 1.00 0.00 C ATOM 425 CG2 ILE A 27 -11.201 -0.824 5.592 1.00 0.00 C ATOM 426 CD1 ILE A 27 -10.019 1.734 6.546 1.00 0.00 C ATOM 0 H ILE A 27 -13.989 1.132 5.673 1.00 0.00 H new ATOM 0 HA ILE A 27 -13.361 -1.445 7.094 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.194 -0.391 7.703 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.005 1.763 5.693 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -11.975 1.990 7.430 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -10.140 -0.610 5.464 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -11.340 -1.895 5.739 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.745 -0.506 4.702 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -9.867 2.804 6.404 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -9.545 1.421 7.476 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -9.575 1.191 5.712 1.00 0.00 H new ATOM 438 N SER A 28 -13.408 -0.188 9.401 1.00 0.00 N ATOM 439 CA SER A 28 -13.887 0.424 10.670 1.00 0.00 C ATOM 440 C SER A 28 -13.156 1.744 10.926 1.00 0.00 C ATOM 441 O SER A 28 -12.038 1.946 10.495 1.00 0.00 O ATOM 442 CB SER A 28 -13.612 -0.539 11.830 1.00 0.00 C ATOM 443 OG SER A 28 -14.558 -1.599 11.792 1.00 0.00 O ATOM 0 H SER A 28 -12.818 -1.012 9.515 1.00 0.00 H new ATOM 0 HA SER A 28 -14.957 0.618 10.592 1.00 0.00 H new ATOM 0 HB2 SER A 28 -12.600 -0.936 11.756 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.678 -0.010 12.781 1.00 0.00 H new ATOM 0 HG SER A 28 -14.385 -2.219 12.531 1.00 0.00 H new ATOM 449 N ARG A 29 -13.785 2.635 11.638 1.00 0.00 N ATOM 450 CA ARG A 29 -13.146 3.943 11.952 1.00 0.00 C ATOM 451 C ARG A 29 -11.897 3.700 12.796 1.00 0.00 C ATOM 452 O ARG A 29 -10.897 4.374 12.649 1.00 0.00 O ATOM 453 CB ARG A 29 -14.152 4.814 12.713 1.00 0.00 C ATOM 454 CG ARG A 29 -15.171 5.390 11.722 1.00 0.00 C ATOM 455 CD ARG A 29 -16.398 5.919 12.467 1.00 0.00 C ATOM 456 NE ARG A 29 -17.213 4.772 12.960 1.00 0.00 N ATOM 457 CZ ARG A 29 -17.893 4.047 12.110 1.00 0.00 C ATOM 458 NH1 ARG A 29 -17.828 4.304 10.833 1.00 0.00 N ATOM 459 NH2 ARG A 29 -18.634 3.061 12.537 1.00 0.00 N ATOM 0 H ARG A 29 -14.723 2.512 12.020 1.00 0.00 H new ATOM 0 HA ARG A 29 -12.854 4.456 11.036 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -14.661 4.222 13.474 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -13.634 5.621 13.231 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -14.713 6.194 11.145 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -15.473 4.620 11.012 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -16.087 6.544 13.304 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -16.996 6.546 11.806 1.00 0.00 H new ATOM 0 HE ARG A 29 -17.240 4.554 13.956 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -17.246 5.071 10.496 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -18.359 3.738 10.171 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -18.683 2.855 13.535 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -19.164 2.496 11.873 1.00 0.00 H new ATOM 473 N GLN A 30 -11.939 2.733 13.669 1.00 0.00 N ATOM 474 CA GLN A 30 -10.745 2.442 14.504 1.00 0.00 C ATOM 475 C GLN A 30 -9.591 2.033 13.584 1.00 0.00 C ATOM 476 O GLN A 30 -8.455 2.411 13.794 1.00 0.00 O ATOM 477 CB GLN A 30 -11.070 1.297 15.470 1.00 0.00 C ATOM 478 CG GLN A 30 -9.880 1.041 16.402 1.00 0.00 C ATOM 479 CD GLN A 30 -9.658 2.261 17.295 1.00 0.00 C ATOM 480 OE1 GLN A 30 -8.440 2.648 17.558 1.00 0.00 O flip ATOM 481 NE2 GLN A 30 -10.602 2.869 17.757 1.00 0.00 N flip ATOM 0 H GLN A 30 -12.747 2.134 13.839 1.00 0.00 H new ATOM 0 HA GLN A 30 -10.462 3.324 15.078 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -11.954 1.546 16.057 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -11.304 0.392 14.909 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -10.067 0.159 17.014 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -8.983 0.838 15.816 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -11.554 2.566 17.551 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -10.443 3.683 18.351 1.00 0.00 H new ATOM 490 N GLN A 31 -9.872 1.267 12.562 1.00 0.00 N ATOM 491 CA GLN A 31 -8.791 0.839 11.629 1.00 0.00 C ATOM 492 C GLN A 31 -8.204 2.065 10.928 1.00 0.00 C ATOM 493 O GLN A 31 -7.003 2.203 10.802 1.00 0.00 O ATOM 494 CB GLN A 31 -9.369 -0.113 10.580 1.00 0.00 C ATOM 495 CG GLN A 31 -9.705 -1.453 11.233 1.00 0.00 C ATOM 496 CD GLN A 31 -8.408 -2.179 11.591 1.00 0.00 C ATOM 497 OE1 GLN A 31 -7.417 -2.173 10.741 1.00 0.00 O flip ATOM 498 NE2 GLN A 31 -8.294 -2.759 12.653 1.00 0.00 N flip ATOM 0 H GLN A 31 -10.804 0.920 12.334 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.008 0.331 12.193 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -10.264 0.321 10.135 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -8.651 -0.260 9.773 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -10.305 -1.294 12.129 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.301 -2.062 10.554 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.068 -2.764 13.317 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -7.424 -3.241 12.880 1.00 0.00 H new ATOM 507 N LEU A 32 -9.039 2.955 10.467 1.00 0.00 N ATOM 508 CA LEU A 32 -8.522 4.167 9.774 1.00 0.00 C ATOM 509 C LEU A 32 -7.696 4.996 10.764 1.00 0.00 C ATOM 510 O LEU A 32 -6.641 5.504 10.437 1.00 0.00 O ATOM 511 CB LEU A 32 -9.706 4.998 9.259 1.00 0.00 C ATOM 512 CG LEU A 32 -9.211 6.229 8.477 1.00 0.00 C ATOM 513 CD1 LEU A 32 -8.541 5.795 7.165 1.00 0.00 C ATOM 514 CD2 LEU A 32 -10.409 7.131 8.161 1.00 0.00 C ATOM 0 H LEU A 32 -10.055 2.895 10.540 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.893 3.876 8.932 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.336 4.383 8.617 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -10.323 5.319 10.098 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.482 6.768 9.081 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.196 6.676 6.624 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.691 5.150 7.387 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -9.260 5.251 6.552 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -10.069 8.006 7.607 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -11.132 6.579 7.560 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.879 7.450 9.091 1.00 0.00 H new ATOM 526 N CYS A 33 -8.171 5.137 11.972 1.00 0.00 N ATOM 527 CA CYS A 33 -7.422 5.931 12.987 1.00 0.00 C ATOM 528 C CYS A 33 -6.069 5.268 13.265 1.00 0.00 C ATOM 529 O CYS A 33 -5.082 5.931 13.515 1.00 0.00 O ATOM 530 CB CYS A 33 -8.233 5.990 14.283 1.00 0.00 C ATOM 531 SG CYS A 33 -9.769 6.907 13.996 1.00 0.00 S ATOM 0 H CYS A 33 -9.049 4.735 12.300 1.00 0.00 H new ATOM 0 HA CYS A 33 -7.259 6.940 12.609 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -8.459 4.981 14.629 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -7.650 6.473 15.067 1.00 0.00 H new ATOM 0 HG CYS A 33 -10.623 6.142 13.382 1.00 0.00 H new ATOM 537 N ASN A 34 -6.018 3.964 13.233 1.00 0.00 N ATOM 538 CA ASN A 34 -4.729 3.263 13.505 1.00 0.00 C ATOM 539 C ASN A 34 -3.694 3.653 12.448 1.00 0.00 C ATOM 540 O ASN A 34 -2.536 3.865 12.750 1.00 0.00 O ATOM 541 CB ASN A 34 -4.949 1.750 13.444 1.00 0.00 C ATOM 542 CG ASN A 34 -6.035 1.344 14.441 1.00 0.00 C ATOM 543 OD1 ASN A 34 -6.765 0.400 14.211 1.00 0.00 O ATOM 544 ND2 ASN A 34 -6.173 2.020 15.546 1.00 0.00 N ATOM 0 H ASN A 34 -6.810 3.354 13.031 1.00 0.00 H new ATOM 0 HA ASN A 34 -4.370 3.549 14.494 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -5.240 1.456 12.436 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -4.019 1.229 13.672 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -6.894 1.757 16.218 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -5.560 2.812 15.739 1.00 0.00 H new ATOM 551 N ILE A 35 -4.096 3.737 11.209 1.00 0.00 N ATOM 552 CA ILE A 35 -3.127 4.100 10.133 1.00 0.00 C ATOM 553 C ILE A 35 -2.623 5.526 10.350 1.00 0.00 C ATOM 554 O ILE A 35 -1.444 5.802 10.241 1.00 0.00 O ATOM 555 CB ILE A 35 -3.818 4.025 8.771 1.00 0.00 C ATOM 556 CG1 ILE A 35 -4.445 2.637 8.590 1.00 0.00 C ATOM 557 CG2 ILE A 35 -2.786 4.274 7.657 1.00 0.00 C ATOM 558 CD1 ILE A 35 -5.357 2.638 7.358 1.00 0.00 C ATOM 0 H ILE A 35 -5.052 3.570 10.895 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.289 3.403 10.163 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.598 4.784 8.718 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.663 1.886 8.475 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.017 2.367 9.478 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.279 4.221 6.686 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.343 5.262 7.785 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.004 3.516 7.709 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.800 1.650 7.233 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.148 3.376 7.491 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.772 2.888 6.473 1.00 0.00 H new ATOM 570 N GLU A 36 -3.505 6.438 10.650 1.00 0.00 N ATOM 571 CA GLU A 36 -3.073 7.845 10.865 1.00 0.00 C ATOM 572 C GLU A 36 -2.137 7.899 12.072 1.00 0.00 C ATOM 573 O GLU A 36 -1.335 8.802 12.209 1.00 0.00 O ATOM 574 CB GLU A 36 -4.302 8.722 11.115 1.00 0.00 C ATOM 575 CG GLU A 36 -3.886 10.194 11.144 1.00 0.00 C ATOM 576 CD GLU A 36 -5.131 11.074 11.280 1.00 0.00 C ATOM 577 OE1 GLU A 36 -6.043 10.901 10.487 1.00 0.00 O ATOM 578 OE2 GLU A 36 -5.151 11.904 12.172 1.00 0.00 O ATOM 0 H GLU A 36 -4.505 6.269 10.755 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.548 8.213 9.983 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -5.043 8.559 10.332 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -4.771 8.448 12.060 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.207 10.375 11.977 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.346 10.448 10.232 1.00 0.00 H new ATOM 585 N GLN A 37 -2.227 6.930 12.945 1.00 0.00 N ATOM 586 CA GLN A 37 -1.338 6.910 14.145 1.00 0.00 C ATOM 587 C GLN A 37 -0.093 6.077 13.834 1.00 0.00 C ATOM 588 O GLN A 37 0.829 6.004 14.622 1.00 0.00 O ATOM 589 CB GLN A 37 -2.091 6.283 15.320 1.00 0.00 C ATOM 590 CG GLN A 37 -3.214 7.223 15.761 1.00 0.00 C ATOM 591 CD GLN A 37 -4.000 6.583 16.907 1.00 0.00 C ATOM 592 OE1 GLN A 37 -3.422 6.099 17.860 1.00 0.00 O ATOM 593 NE2 GLN A 37 -5.303 6.560 16.852 1.00 0.00 N ATOM 0 H GLN A 37 -2.880 6.149 12.879 1.00 0.00 H new ATOM 0 HA GLN A 37 -1.042 7.927 14.403 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -2.503 5.317 15.029 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.407 6.101 16.149 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -2.798 8.178 16.081 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.879 7.430 14.922 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -5.787 6.967 16.051 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -5.838 6.135 17.610 1.00 0.00 H new ATOM 602 N SER A 38 -0.056 5.453 12.686 1.00 0.00 N ATOM 603 CA SER A 38 1.133 4.628 12.318 1.00 0.00 C ATOM 604 C SER A 38 0.975 4.120 10.880 1.00 0.00 C ATOM 605 O SER A 38 0.044 3.404 10.566 1.00 0.00 O ATOM 606 CB SER A 38 1.248 3.436 13.275 1.00 0.00 C ATOM 607 OG SER A 38 1.819 3.872 14.502 1.00 0.00 O ATOM 0 H SER A 38 -0.798 5.479 11.987 1.00 0.00 H new ATOM 0 HA SER A 38 2.034 5.236 12.391 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.264 3.001 13.453 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.866 2.656 12.830 1.00 0.00 H new ATOM 0 HG SER A 38 1.817 4.851 14.534 1.00 0.00 H new ATOM 613 N GLU A 39 1.889 4.478 10.011 1.00 0.00 N ATOM 614 CA GLU A 39 1.826 4.022 8.588 1.00 0.00 C ATOM 615 C GLU A 39 3.003 3.085 8.320 1.00 0.00 C ATOM 616 O GLU A 39 4.150 3.425 8.538 1.00 0.00 O ATOM 617 CB GLU A 39 1.905 5.237 7.648 1.00 0.00 C ATOM 618 CG GLU A 39 1.308 4.879 6.279 1.00 0.00 C ATOM 619 CD GLU A 39 2.025 3.654 5.707 1.00 0.00 C ATOM 620 OE1 GLU A 39 3.107 3.821 5.170 1.00 0.00 O ATOM 621 OE2 GLU A 39 1.479 2.568 5.817 1.00 0.00 O ATOM 0 H GLU A 39 2.686 5.075 10.231 1.00 0.00 H new ATOM 0 HA GLU A 39 0.887 3.498 8.409 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.364 6.079 8.081 1.00 0.00 H new ATOM 0 HB3 GLU A 39 2.942 5.551 7.531 1.00 0.00 H new ATOM 0 HG2 GLU A 39 0.242 4.675 6.379 1.00 0.00 H new ATOM 0 HG3 GLU A 39 1.408 5.723 5.596 1.00 0.00 H new ATOM 628 N THR A 40 2.724 1.910 7.841 1.00 0.00 N ATOM 629 CA THR A 40 3.812 0.931 7.542 1.00 0.00 C ATOM 630 C THR A 40 4.152 0.995 6.050 1.00 0.00 C ATOM 631 O THR A 40 3.278 1.020 5.208 1.00 0.00 O ATOM 632 CB THR A 40 3.328 -0.481 7.890 1.00 0.00 C ATOM 633 OG1 THR A 40 2.124 -0.752 7.188 1.00 0.00 O ATOM 634 CG2 THR A 40 3.076 -0.584 9.395 1.00 0.00 C ATOM 0 H THR A 40 1.781 1.578 7.640 1.00 0.00 H new ATOM 0 HA THR A 40 4.697 1.172 8.131 1.00 0.00 H new ATOM 0 HB THR A 40 4.090 -1.206 7.603 1.00 0.00 H new ATOM 0 HG1 THR A 40 2.165 -0.343 6.298 1.00 0.00 H new ATOM 0 HG21 THR A 40 2.732 -1.589 9.638 1.00 0.00 H new ATOM 0 HG22 THR A 40 4.001 -0.376 9.934 1.00 0.00 H new ATOM 0 HG23 THR A 40 2.316 0.140 9.687 1.00 0.00 H new ATOM 642 N ALA A 41 5.421 1.021 5.719 1.00 0.00 N ATOM 643 CA ALA A 41 5.842 1.085 4.280 1.00 0.00 C ATOM 644 C ALA A 41 6.530 -0.232 3.892 1.00 0.00 C ATOM 645 O ALA A 41 7.729 -0.369 4.047 1.00 0.00 O ATOM 646 CB ALA A 41 6.835 2.229 4.097 1.00 0.00 C ATOM 0 H ALA A 41 6.190 1.001 6.388 1.00 0.00 H new ATOM 0 HA ALA A 41 4.966 1.246 3.652 1.00 0.00 H new ATOM 0 HB1 ALA A 41 7.144 2.279 3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 41 6.363 3.169 4.382 1.00 0.00 H new ATOM 0 HB3 ALA A 41 7.709 2.057 4.726 1.00 0.00 H new ATOM 652 N PRO A 42 5.794 -1.205 3.408 1.00 0.00 N ATOM 653 CA PRO A 42 6.378 -2.521 3.022 1.00 0.00 C ATOM 654 C PRO A 42 7.119 -2.470 1.680 1.00 0.00 C ATOM 655 O PRO A 42 6.964 -1.548 0.903 1.00 0.00 O ATOM 656 CB PRO A 42 5.156 -3.445 2.957 1.00 0.00 C ATOM 657 CG PRO A 42 4.024 -2.548 2.567 1.00 0.00 C ATOM 658 CD PRO A 42 4.336 -1.170 3.168 1.00 0.00 C ATOM 0 HA PRO A 42 7.136 -2.858 3.729 1.00 0.00 H new ATOM 0 HB2 PRO A 42 5.300 -4.242 2.227 1.00 0.00 H new ATOM 0 HB3 PRO A 42 4.969 -3.923 3.918 1.00 0.00 H new ATOM 0 HG2 PRO A 42 3.933 -2.487 1.483 1.00 0.00 H new ATOM 0 HG3 PRO A 42 3.076 -2.931 2.946 1.00 0.00 H new ATOM 0 HD2 PRO A 42 4.063 -0.366 2.485 1.00 0.00 H new ATOM 0 HD3 PRO A 42 3.783 -1.004 4.093 1.00 0.00 H new ATOM 666 N VAL A 43 7.929 -3.460 1.412 1.00 0.00 N ATOM 667 CA VAL A 43 8.690 -3.487 0.133 1.00 0.00 C ATOM 668 C VAL A 43 7.711 -3.450 -1.041 1.00 0.00 C ATOM 669 O VAL A 43 8.064 -3.093 -2.148 1.00 0.00 O ATOM 670 CB VAL A 43 9.522 -4.772 0.067 1.00 0.00 C ATOM 671 CG1 VAL A 43 10.601 -4.742 1.152 1.00 0.00 C ATOM 672 CG2 VAL A 43 8.614 -5.984 0.292 1.00 0.00 C ATOM 0 H VAL A 43 8.096 -4.255 2.029 1.00 0.00 H new ATOM 0 HA VAL A 43 9.351 -2.622 0.080 1.00 0.00 H new ATOM 0 HB VAL A 43 9.992 -4.845 -0.914 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.192 -5.657 1.103 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.251 -3.882 0.995 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.130 -4.666 2.132 1.00 0.00 H new ATOM 0 HG21 VAL A 43 9.207 -6.897 0.245 1.00 0.00 H new ATOM 0 HG22 VAL A 43 8.142 -5.908 1.272 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.845 -6.011 -0.480 1.00 0.00 H new ATOM 682 N VAL A 44 6.481 -3.815 -0.807 1.00 0.00 N ATOM 683 CA VAL A 44 5.474 -3.801 -1.906 1.00 0.00 C ATOM 684 C VAL A 44 5.319 -2.374 -2.436 1.00 0.00 C ATOM 685 O VAL A 44 5.288 -2.145 -3.629 1.00 0.00 O ATOM 686 CB VAL A 44 4.131 -4.291 -1.362 1.00 0.00 C ATOM 687 CG1 VAL A 44 3.050 -4.144 -2.435 1.00 0.00 C ATOM 688 CG2 VAL A 44 4.249 -5.762 -0.957 1.00 0.00 C ATOM 0 H VAL A 44 6.129 -4.123 0.099 1.00 0.00 H new ATOM 0 HA VAL A 44 5.803 -4.454 -2.714 1.00 0.00 H new ATOM 0 HB VAL A 44 3.858 -3.693 -0.493 1.00 0.00 H new ATOM 0 HG11 VAL A 44 2.096 -4.495 -2.041 1.00 0.00 H new ATOM 0 HG12 VAL A 44 2.961 -3.096 -2.721 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.322 -4.737 -3.309 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.292 -6.111 -0.569 1.00 0.00 H new ATOM 0 HG22 VAL A 44 4.527 -6.358 -1.827 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.012 -5.867 -0.186 1.00 0.00 H new ATOM 698 N VAL A 45 5.216 -1.411 -1.559 1.00 0.00 N ATOM 699 CA VAL A 45 5.058 0.000 -2.017 1.00 0.00 C ATOM 700 C VAL A 45 6.289 0.421 -2.826 1.00 0.00 C ATOM 701 O VAL A 45 6.175 1.006 -3.884 1.00 0.00 O ATOM 702 CB VAL A 45 4.902 0.910 -0.798 1.00 0.00 C ATOM 703 CG1 VAL A 45 4.897 2.372 -1.245 1.00 0.00 C ATOM 704 CG2 VAL A 45 3.580 0.592 -0.097 1.00 0.00 C ATOM 0 H VAL A 45 5.234 -1.540 -0.547 1.00 0.00 H new ATOM 0 HA VAL A 45 4.173 0.083 -2.648 1.00 0.00 H new ATOM 0 HB VAL A 45 5.733 0.744 -0.113 1.00 0.00 H new ATOM 0 HG11 VAL A 45 4.786 3.018 -0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 45 5.836 2.601 -1.750 1.00 0.00 H new ATOM 0 HG13 VAL A 45 4.066 2.540 -1.930 1.00 0.00 H new ATOM 0 HG21 VAL A 45 3.465 1.239 0.773 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.753 0.760 -0.787 1.00 0.00 H new ATOM 0 HG23 VAL A 45 3.579 -0.450 0.223 1.00 0.00 H new ATOM 714 N LYS A 46 7.465 0.122 -2.343 1.00 0.00 N ATOM 715 CA LYS A 46 8.695 0.501 -3.096 1.00 0.00 C ATOM 716 C LYS A 46 8.712 -0.226 -4.442 1.00 0.00 C ATOM 717 O LYS A 46 9.128 0.317 -5.446 1.00 0.00 O ATOM 718 CB LYS A 46 9.937 0.123 -2.288 1.00 0.00 C ATOM 719 CG LYS A 46 10.048 1.048 -1.075 1.00 0.00 C ATOM 720 CD LYS A 46 11.305 0.699 -0.275 1.00 0.00 C ATOM 721 CE LYS A 46 11.491 1.706 0.865 1.00 0.00 C ATOM 722 NZ LYS A 46 10.587 1.352 1.996 1.00 0.00 N ATOM 0 H LYS A 46 7.627 -0.367 -1.462 1.00 0.00 H new ATOM 0 HA LYS A 46 8.697 1.578 -3.265 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.872 -0.916 -1.964 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.829 0.208 -2.908 1.00 0.00 H new ATOM 0 HG2 LYS A 46 10.089 2.087 -1.401 1.00 0.00 H new ATOM 0 HG3 LYS A 46 9.164 0.946 -0.445 1.00 0.00 H new ATOM 0 HD2 LYS A 46 11.222 -0.310 0.129 1.00 0.00 H new ATOM 0 HD3 LYS A 46 12.178 0.710 -0.928 1.00 0.00 H new ATOM 0 HE2 LYS A 46 12.528 1.704 1.200 1.00 0.00 H new ATOM 0 HE3 LYS A 46 11.272 2.714 0.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 10.714 2.036 2.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 9.599 1.376 1.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 10.816 0.397 2.338 1.00 0.00 H new ATOM 736 N TYR A 47 8.260 -1.447 -4.470 1.00 0.00 N ATOM 737 CA TYR A 47 8.245 -2.210 -5.752 1.00 0.00 C ATOM 738 C TYR A 47 7.467 -1.398 -6.788 1.00 0.00 C ATOM 739 O TYR A 47 7.863 -1.272 -7.934 1.00 0.00 O ATOM 740 CB TYR A 47 7.531 -3.547 -5.523 1.00 0.00 C ATOM 741 CG TYR A 47 7.716 -4.463 -6.717 1.00 0.00 C ATOM 742 CD1 TYR A 47 7.022 -4.223 -7.913 1.00 0.00 C ATOM 743 CD2 TYR A 47 8.584 -5.560 -6.624 1.00 0.00 C ATOM 744 CE1 TYR A 47 7.197 -5.080 -9.008 1.00 0.00 C ATOM 745 CE2 TYR A 47 8.753 -6.414 -7.721 1.00 0.00 C ATOM 746 CZ TYR A 47 8.063 -6.173 -8.911 1.00 0.00 C ATOM 747 OH TYR A 47 8.233 -7.015 -9.991 1.00 0.00 O ATOM 0 H TYR A 47 7.899 -1.952 -3.661 1.00 0.00 H new ATOM 0 HA TYR A 47 9.262 -2.390 -6.101 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.924 -4.026 -4.626 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.469 -3.373 -5.352 1.00 0.00 H new ATOM 0 HD1 TYR A 47 6.353 -3.378 -7.989 1.00 0.00 H new ATOM 0 HD2 TYR A 47 9.122 -5.746 -5.706 1.00 0.00 H new ATOM 0 HE1 TYR A 47 6.662 -4.896 -9.928 1.00 0.00 H new ATOM 0 HE2 TYR A 47 9.419 -7.261 -7.646 1.00 0.00 H new ATOM 0 HH TYR A 47 8.106 -6.511 -10.822 1.00 0.00 H new ATOM 757 N ILE A 48 6.352 -0.851 -6.389 1.00 0.00 N ATOM 758 CA ILE A 48 5.526 -0.053 -7.333 1.00 0.00 C ATOM 759 C ILE A 48 6.328 1.158 -7.809 1.00 0.00 C ATOM 760 O ILE A 48 6.348 1.477 -8.981 1.00 0.00 O ATOM 761 CB ILE A 48 4.270 0.425 -6.604 1.00 0.00 C ATOM 762 CG1 ILE A 48 3.394 -0.782 -6.261 1.00 0.00 C ATOM 763 CG2 ILE A 48 3.480 1.377 -7.500 1.00 0.00 C ATOM 764 CD1 ILE A 48 2.276 -0.353 -5.306 1.00 0.00 C ATOM 0 H ILE A 48 5.977 -0.924 -5.443 1.00 0.00 H new ATOM 0 HA ILE A 48 5.248 -0.663 -8.192 1.00 0.00 H new ATOM 0 HB ILE A 48 4.562 0.945 -5.691 1.00 0.00 H new ATOM 0 HG12 ILE A 48 2.967 -1.204 -7.171 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.999 -1.564 -5.801 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.586 1.714 -6.975 1.00 0.00 H new ATOM 0 HG22 ILE A 48 4.099 2.238 -7.751 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.190 0.859 -8.414 1.00 0.00 H new ATOM 0 HD11 ILE A 48 1.654 -1.215 -5.064 1.00 0.00 H new ATOM 0 HD12 ILE A 48 2.713 0.048 -4.391 1.00 0.00 H new ATOM 0 HD13 ILE A 48 1.665 0.413 -5.782 1.00 0.00 H new ATOM 776 N ALA A 49 6.993 1.832 -6.912 1.00 0.00 N ATOM 777 CA ALA A 49 7.794 3.018 -7.322 1.00 0.00 C ATOM 778 C ALA A 49 8.880 2.576 -8.299 1.00 0.00 C ATOM 779 O ALA A 49 9.279 3.316 -9.178 1.00 0.00 O ATOM 780 CB ALA A 49 8.443 3.653 -6.091 1.00 0.00 C ATOM 0 H ALA A 49 7.016 1.613 -5.916 1.00 0.00 H new ATOM 0 HA ALA A 49 7.143 3.749 -7.801 1.00 0.00 H new ATOM 0 HB1 ALA A 49 9.028 4.521 -6.395 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.668 3.965 -5.391 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.096 2.926 -5.608 1.00 0.00 H new ATOM 786 N PHE A 50 9.362 1.374 -8.151 1.00 0.00 N ATOM 787 CA PHE A 50 10.423 0.885 -9.068 1.00 0.00 C ATOM 788 C PHE A 50 9.877 0.904 -10.498 1.00 0.00 C ATOM 789 O PHE A 50 10.530 1.352 -11.420 1.00 0.00 O ATOM 790 CB PHE A 50 10.823 -0.546 -8.670 1.00 0.00 C ATOM 791 CG PHE A 50 12.233 -0.828 -9.137 1.00 0.00 C ATOM 792 CD1 PHE A 50 13.302 -0.144 -8.545 1.00 0.00 C ATOM 793 CD2 PHE A 50 12.477 -1.760 -10.153 1.00 0.00 C ATOM 794 CE1 PHE A 50 14.611 -0.391 -8.965 1.00 0.00 C ATOM 795 CE2 PHE A 50 13.791 -2.007 -10.574 1.00 0.00 C ATOM 796 CZ PHE A 50 14.857 -1.322 -9.980 1.00 0.00 C ATOM 0 H PHE A 50 9.066 0.711 -7.435 1.00 0.00 H new ATOM 0 HA PHE A 50 11.304 1.524 -9.005 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.757 -0.665 -7.589 1.00 0.00 H new ATOM 0 HB3 PHE A 50 10.132 -1.264 -9.113 1.00 0.00 H new ATOM 0 HD1 PHE A 50 13.114 0.576 -7.762 1.00 0.00 H new ATOM 0 HD2 PHE A 50 11.654 -2.288 -10.612 1.00 0.00 H new ATOM 0 HE1 PHE A 50 15.434 0.137 -8.506 1.00 0.00 H new ATOM 0 HE2 PHE A 50 13.981 -2.726 -11.357 1.00 0.00 H new ATOM 0 HZ PHE A 50 15.869 -1.512 -10.305 1.00 0.00 H new ATOM 806 N LEU A 51 8.678 0.424 -10.683 1.00 0.00 N ATOM 807 CA LEU A 51 8.076 0.415 -12.048 1.00 0.00 C ATOM 808 C LEU A 51 7.929 1.856 -12.546 1.00 0.00 C ATOM 809 O LEU A 51 8.114 2.141 -13.713 1.00 0.00 O ATOM 810 CB LEU A 51 6.695 -0.241 -11.992 1.00 0.00 C ATOM 811 CG LEU A 51 6.793 -1.598 -11.290 1.00 0.00 C ATOM 812 CD1 LEU A 51 5.397 -2.223 -11.189 1.00 0.00 C ATOM 813 CD2 LEU A 51 7.719 -2.531 -12.084 1.00 0.00 C ATOM 0 H LEU A 51 8.088 0.037 -9.947 1.00 0.00 H new ATOM 0 HA LEU A 51 8.720 -0.145 -12.726 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.997 0.405 -11.459 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.303 -0.371 -13.001 1.00 0.00 H new ATOM 0 HG LEU A 51 7.202 -1.456 -10.290 1.00 0.00 H new ATOM 0 HD11 LEU A 51 5.466 -3.189 -10.689 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.744 -1.564 -10.616 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.987 -2.361 -12.189 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.784 -3.495 -11.579 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.318 -2.674 -13.088 1.00 0.00 H new ATOM 0 HD23 LEU A 51 8.713 -2.088 -12.150 1.00 0.00 H new ATOM 825 N ARG A 52 7.585 2.763 -11.672 1.00 0.00 N ATOM 826 CA ARG A 52 7.411 4.184 -12.093 1.00 0.00 C ATOM 827 C ARG A 52 8.725 4.713 -12.669 1.00 0.00 C ATOM 828 O ARG A 52 8.733 5.541 -13.558 1.00 0.00 O ATOM 829 CB ARG A 52 7.025 5.032 -10.883 1.00 0.00 C ATOM 830 CG ARG A 52 5.690 4.544 -10.317 1.00 0.00 C ATOM 831 CD ARG A 52 5.244 5.458 -9.162 1.00 0.00 C ATOM 832 NE ARG A 52 6.449 6.044 -8.486 1.00 0.00 N ATOM 833 CZ ARG A 52 6.849 7.265 -8.756 1.00 0.00 C ATOM 834 NH1 ARG A 52 6.225 7.994 -9.644 1.00 0.00 N ATOM 835 NH2 ARG A 52 7.890 7.753 -8.139 1.00 0.00 N ATOM 0 H ARG A 52 7.417 2.581 -10.683 1.00 0.00 H new ATOM 0 HA ARG A 52 6.628 4.239 -12.849 1.00 0.00 H new ATOM 0 HB2 ARG A 52 7.800 4.968 -10.119 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.948 6.080 -11.171 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.933 4.539 -11.101 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.789 3.518 -9.963 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.605 6.255 -9.542 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.652 4.890 -8.444 1.00 0.00 H new ATOM 0 HE ARG A 52 6.965 5.485 -7.806 1.00 0.00 H new ATOM 0 HH11 ARG A 52 5.416 7.616 -10.137 1.00 0.00 H new ATOM 0 HH12 ARG A 52 6.547 8.941 -9.844 1.00 0.00 H new ATOM 0 HH21 ARG A 52 8.387 7.187 -7.452 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.206 8.701 -8.344 1.00 0.00 H new ATOM 849 N SER A 53 9.838 4.253 -12.165 1.00 0.00 N ATOM 850 CA SER A 53 11.145 4.744 -12.686 1.00 0.00 C ATOM 851 C SER A 53 11.188 4.550 -14.207 1.00 0.00 C ATOM 852 O SER A 53 11.706 5.378 -14.931 1.00 0.00 O ATOM 853 CB SER A 53 12.284 3.957 -12.036 1.00 0.00 C ATOM 854 OG SER A 53 12.200 4.089 -10.622 1.00 0.00 O ATOM 0 H SER A 53 9.899 3.561 -11.418 1.00 0.00 H new ATOM 0 HA SER A 53 11.259 5.802 -12.449 1.00 0.00 H new ATOM 0 HB2 SER A 53 12.223 2.906 -12.319 1.00 0.00 H new ATOM 0 HB3 SER A 53 13.246 4.327 -12.391 1.00 0.00 H new ATOM 0 HG SER A 53 12.928 3.584 -10.203 1.00 0.00 H new ATOM 860 N LYS A 54 10.656 3.462 -14.696 1.00 0.00 N ATOM 861 CA LYS A 54 10.673 3.214 -16.164 1.00 0.00 C ATOM 862 C LYS A 54 9.483 3.921 -16.820 1.00 0.00 C ATOM 863 O LYS A 54 9.305 3.873 -18.021 1.00 0.00 O ATOM 864 CB LYS A 54 10.553 1.715 -16.389 1.00 0.00 C ATOM 865 CG LYS A 54 11.744 1.024 -15.729 1.00 0.00 C ATOM 866 CD LYS A 54 11.613 -0.493 -15.870 1.00 0.00 C ATOM 867 CE LYS A 54 10.548 -1.032 -14.906 1.00 0.00 C ATOM 868 NZ LYS A 54 10.684 -2.508 -14.812 1.00 0.00 N ATOM 0 H LYS A 54 10.210 2.733 -14.139 1.00 0.00 H new ATOM 0 HA LYS A 54 11.596 3.595 -16.600 1.00 0.00 H new ATOM 0 HB2 LYS A 54 9.619 1.343 -15.967 1.00 0.00 H new ATOM 0 HB3 LYS A 54 10.531 1.494 -17.456 1.00 0.00 H new ATOM 0 HG2 LYS A 54 12.672 1.361 -16.190 1.00 0.00 H new ATOM 0 HG3 LYS A 54 11.795 1.296 -14.675 1.00 0.00 H new ATOM 0 HD2 LYS A 54 11.346 -0.747 -16.896 1.00 0.00 H new ATOM 0 HD3 LYS A 54 12.572 -0.968 -15.664 1.00 0.00 H new ATOM 0 HE2 LYS A 54 10.667 -0.579 -13.922 1.00 0.00 H new ATOM 0 HE3 LYS A 54 9.551 -0.767 -15.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 10.269 -2.839 -13.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 10.188 -2.954 -15.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 11.691 -2.767 -14.843 1.00 0.00 H new ATOM 882 N GLY A 55 8.675 4.590 -16.041 1.00 0.00 N ATOM 883 CA GLY A 55 7.506 5.315 -16.619 1.00 0.00 C ATOM 884 C GLY A 55 6.325 4.360 -16.825 1.00 0.00 C ATOM 885 O GLY A 55 5.482 4.587 -17.671 1.00 0.00 O ATOM 0 H GLY A 55 8.774 4.666 -15.029 1.00 0.00 H new ATOM 0 HA2 GLY A 55 7.211 6.128 -15.955 1.00 0.00 H new ATOM 0 HA3 GLY A 55 7.786 5.766 -17.571 1.00 0.00 H new ATOM 889 N VAL A 56 6.243 3.301 -16.062 1.00 0.00 N ATOM 890 CA VAL A 56 5.097 2.355 -16.231 1.00 0.00 C ATOM 891 C VAL A 56 3.816 3.047 -15.752 1.00 0.00 C ATOM 892 O VAL A 56 3.785 3.665 -14.706 1.00 0.00 O ATOM 893 CB VAL A 56 5.351 1.076 -15.419 1.00 0.00 C ATOM 894 CG1 VAL A 56 4.127 0.150 -15.502 1.00 0.00 C ATOM 895 CG2 VAL A 56 6.573 0.351 -15.995 1.00 0.00 C ATOM 0 H VAL A 56 6.913 3.051 -15.335 1.00 0.00 H new ATOM 0 HA VAL A 56 4.992 2.079 -17.280 1.00 0.00 H new ATOM 0 HB VAL A 56 5.530 1.340 -14.377 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.315 -0.755 -14.924 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.254 0.664 -15.099 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.942 -0.117 -16.543 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.759 -0.558 -15.423 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.385 0.092 -17.037 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.445 1.003 -15.935 1.00 0.00 H new ATOM 905 N ASP A 57 2.768 2.968 -16.525 1.00 0.00 N ATOM 906 CA ASP A 57 1.494 3.644 -16.139 1.00 0.00 C ATOM 907 C ASP A 57 0.740 2.804 -15.108 1.00 0.00 C ATOM 908 O ASP A 57 -0.078 1.972 -15.444 1.00 0.00 O ATOM 909 CB ASP A 57 0.622 3.807 -17.385 1.00 0.00 C ATOM 910 CG ASP A 57 1.436 4.475 -18.495 1.00 0.00 C ATOM 911 OD1 ASP A 57 1.733 5.649 -18.360 1.00 0.00 O ATOM 912 OD2 ASP A 57 1.751 3.798 -19.460 1.00 0.00 O ATOM 0 H ASP A 57 2.738 2.463 -17.411 1.00 0.00 H new ATOM 0 HA ASP A 57 1.722 4.618 -15.706 1.00 0.00 H new ATOM 0 HB2 ASP A 57 0.262 2.834 -17.719 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -0.256 4.409 -17.151 1.00 0.00 H new ATOM 917 N LEU A 58 1.001 3.031 -13.851 1.00 0.00 N ATOM 918 CA LEU A 58 0.292 2.266 -12.785 1.00 0.00 C ATOM 919 C LEU A 58 -1.016 2.979 -12.435 1.00 0.00 C ATOM 920 O LEU A 58 -1.938 2.389 -11.905 1.00 0.00 O ATOM 921 CB LEU A 58 1.191 2.162 -11.536 1.00 0.00 C ATOM 922 CG LEU A 58 1.292 3.511 -10.792 1.00 0.00 C ATOM 923 CD1 LEU A 58 2.162 3.324 -9.551 1.00 0.00 C ATOM 924 CD2 LEU A 58 1.934 4.569 -11.694 1.00 0.00 C ATOM 0 H LEU A 58 1.677 3.716 -13.514 1.00 0.00 H new ATOM 0 HA LEU A 58 0.068 1.261 -13.142 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.792 1.404 -10.862 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.188 1.834 -11.831 1.00 0.00 H new ATOM 0 HG LEU A 58 0.292 3.842 -10.512 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.241 4.270 -9.016 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.710 2.576 -8.899 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.156 2.992 -9.850 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.999 5.515 -11.156 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.935 4.245 -11.980 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.326 4.701 -12.589 1.00 0.00 H new ATOM 936 N ASN A 59 -1.097 4.249 -12.719 1.00 0.00 N ATOM 937 CA ASN A 59 -2.332 5.017 -12.397 1.00 0.00 C ATOM 938 C ASN A 59 -3.489 4.494 -13.255 1.00 0.00 C ATOM 939 O ASN A 59 -4.606 4.363 -12.800 1.00 0.00 O ATOM 940 CB ASN A 59 -2.092 6.512 -12.696 1.00 0.00 C ATOM 941 CG ASN A 59 -0.597 6.825 -12.584 1.00 0.00 C ATOM 942 OD1 ASN A 59 0.116 6.781 -13.567 1.00 0.00 O ATOM 943 ND2 ASN A 59 -0.087 7.136 -11.429 1.00 0.00 N ATOM 0 H ASN A 59 -0.356 4.791 -13.163 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.582 4.896 -11.343 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -2.451 6.755 -13.696 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.656 7.128 -11.996 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.909 7.342 -11.350 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.683 7.174 -10.602 1.00 0.00 H new ATOM 950 N ALA A 60 -3.222 4.207 -14.499 1.00 0.00 N ATOM 951 CA ALA A 60 -4.297 3.706 -15.398 1.00 0.00 C ATOM 952 C ALA A 60 -4.821 2.363 -14.890 1.00 0.00 C ATOM 953 O ALA A 60 -6.012 2.164 -14.758 1.00 0.00 O ATOM 954 CB ALA A 60 -3.730 3.526 -16.807 1.00 0.00 C ATOM 0 H ALA A 60 -2.303 4.298 -14.932 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.115 4.426 -15.415 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -4.513 3.159 -17.470 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.361 4.483 -17.176 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.911 2.807 -16.781 1.00 0.00 H new ATOM 960 N LEU A 61 -3.947 1.436 -14.609 1.00 0.00 N ATOM 961 CA LEU A 61 -4.412 0.110 -14.119 1.00 0.00 C ATOM 962 C LEU A 61 -5.108 0.283 -12.767 1.00 0.00 C ATOM 963 O LEU A 61 -6.154 -0.283 -12.518 1.00 0.00 O ATOM 964 CB LEU A 61 -3.205 -0.816 -13.943 1.00 0.00 C ATOM 965 CG LEU A 61 -2.576 -1.130 -15.308 1.00 0.00 C ATOM 966 CD1 LEU A 61 -1.249 -1.866 -15.092 1.00 0.00 C ATOM 967 CD2 LEU A 61 -3.526 -2.002 -16.156 1.00 0.00 C ATOM 0 H LEU A 61 -2.936 1.539 -14.697 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.108 -0.320 -14.840 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.467 -0.345 -13.294 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.514 -1.740 -13.455 1.00 0.00 H new ATOM 0 HG LEU A 61 -2.399 -0.196 -15.842 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.797 -2.092 -16.058 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -0.573 -1.236 -14.514 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.432 -2.794 -14.551 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.063 -2.214 -17.120 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.723 -2.939 -15.634 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.464 -1.470 -16.314 1.00 0.00 H new ATOM 979 N PHE A 62 -4.530 1.060 -11.892 1.00 0.00 N ATOM 980 CA PHE A 62 -5.148 1.271 -10.551 1.00 0.00 C ATOM 981 C PHE A 62 -6.474 2.030 -10.692 1.00 0.00 C ATOM 982 O PHE A 62 -7.467 1.668 -10.100 1.00 0.00 O ATOM 983 CB PHE A 62 -4.179 2.080 -9.668 1.00 0.00 C ATOM 984 CG PHE A 62 -3.201 1.147 -8.982 1.00 0.00 C ATOM 985 CD1 PHE A 62 -2.443 0.249 -9.742 1.00 0.00 C ATOM 986 CD2 PHE A 62 -3.064 1.171 -7.586 1.00 0.00 C ATOM 987 CE1 PHE A 62 -1.550 -0.624 -9.109 1.00 0.00 C ATOM 988 CE2 PHE A 62 -2.174 0.297 -6.955 1.00 0.00 C ATOM 989 CZ PHE A 62 -1.417 -0.601 -7.716 1.00 0.00 C ATOM 0 H PHE A 62 -3.654 1.559 -12.048 1.00 0.00 H new ATOM 0 HA PHE A 62 -5.345 0.303 -10.091 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.638 2.804 -10.277 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -4.739 2.645 -8.923 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -2.547 0.229 -10.817 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -3.647 1.865 -6.998 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.964 -1.315 -9.696 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -2.071 0.315 -5.880 1.00 0.00 H new ATOM 0 HZ PHE A 62 -0.730 -1.276 -7.228 1.00 0.00 H new ATOM 999 N ASP A 63 -6.487 3.087 -11.457 1.00 0.00 N ATOM 1000 CA ASP A 63 -7.737 3.885 -11.614 1.00 0.00 C ATOM 1001 C ASP A 63 -8.817 3.034 -12.290 1.00 0.00 C ATOM 1002 O ASP A 63 -9.993 3.171 -12.021 1.00 0.00 O ATOM 1003 CB ASP A 63 -7.429 5.122 -12.460 1.00 0.00 C ATOM 1004 CG ASP A 63 -6.457 6.022 -11.691 1.00 0.00 C ATOM 1005 OD1 ASP A 63 -5.714 5.497 -10.877 1.00 0.00 O ATOM 1006 OD2 ASP A 63 -6.469 7.218 -11.932 1.00 0.00 O ATOM 0 H ASP A 63 -5.684 3.434 -11.982 1.00 0.00 H new ATOM 0 HA ASP A 63 -8.105 4.195 -10.636 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.994 4.826 -13.415 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -8.348 5.664 -12.683 1.00 0.00 H new ATOM 1011 N ARG A 64 -8.421 2.148 -13.156 1.00 0.00 N ATOM 1012 CA ARG A 64 -9.405 1.269 -13.842 1.00 0.00 C ATOM 1013 C ARG A 64 -10.061 0.342 -12.812 1.00 0.00 C ATOM 1014 O ARG A 64 -11.259 0.135 -12.820 1.00 0.00 O ATOM 1015 CB ARG A 64 -8.641 0.454 -14.907 1.00 0.00 C ATOM 1016 CG ARG A 64 -9.409 -0.808 -15.350 1.00 0.00 C ATOM 1017 CD ARG A 64 -10.716 -0.414 -16.038 1.00 0.00 C ATOM 1018 NE ARG A 64 -10.426 0.494 -17.187 1.00 0.00 N ATOM 1019 CZ ARG A 64 -9.788 0.053 -18.238 1.00 0.00 C ATOM 1020 NH1 ARG A 64 -9.432 -1.201 -18.318 1.00 0.00 N ATOM 1021 NH2 ARG A 64 -9.512 0.869 -19.217 1.00 0.00 N ATOM 0 H ARG A 64 -7.448 1.993 -13.421 1.00 0.00 H new ATOM 0 HA ARG A 64 -10.191 1.853 -14.320 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -8.453 1.084 -15.776 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -7.669 0.163 -14.508 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -8.794 -1.397 -16.031 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -9.620 -1.437 -14.485 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -11.237 -1.305 -16.389 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -11.377 0.082 -15.327 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.729 1.467 -17.151 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -9.652 -1.843 -17.557 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -8.934 -1.538 -19.142 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -9.794 1.848 -19.160 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -9.014 0.529 -20.040 1.00 0.00 H new ATOM 1035 N ILE A 65 -9.276 -0.240 -11.946 1.00 0.00 N ATOM 1036 CA ILE A 65 -9.839 -1.186 -10.940 1.00 0.00 C ATOM 1037 C ILE A 65 -10.569 -0.444 -9.815 1.00 0.00 C ATOM 1038 O ILE A 65 -11.781 -0.490 -9.727 1.00 0.00 O ATOM 1039 CB ILE A 65 -8.700 -2.015 -10.341 1.00 0.00 C ATOM 1040 CG1 ILE A 65 -8.035 -2.832 -11.452 1.00 0.00 C ATOM 1041 CG2 ILE A 65 -9.260 -2.963 -9.278 1.00 0.00 C ATOM 1042 CD1 ILE A 65 -6.733 -3.444 -10.932 1.00 0.00 C ATOM 0 H ILE A 65 -8.267 -0.101 -11.892 1.00 0.00 H new ATOM 0 HA ILE A 65 -10.560 -1.830 -11.443 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.967 -1.351 -9.883 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -8.708 -3.619 -11.791 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.831 -2.195 -12.313 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -8.448 -3.553 -8.852 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -9.739 -2.383 -8.489 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -9.992 -3.630 -9.734 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.262 -4.025 -11.725 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.058 -2.649 -10.615 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.950 -4.095 -10.085 1.00 0.00 H new ATOM 1282 N GLU B 2 -7.684 -9.814 -10.630 1.00 0.00 N ATOM 1283 CA GLU B 2 -6.735 -9.668 -9.486 1.00 0.00 C ATOM 1284 C GLU B 2 -5.683 -8.597 -9.808 1.00 0.00 C ATOM 1285 O GLU B 2 -5.020 -8.643 -10.825 1.00 0.00 O ATOM 1286 CB GLU B 2 -6.037 -11.013 -9.223 1.00 0.00 C ATOM 1287 CG GLU B 2 -6.973 -11.951 -8.450 1.00 0.00 C ATOM 1288 CD GLU B 2 -8.133 -12.382 -9.351 1.00 0.00 C ATOM 1289 OE1 GLU B 2 -7.881 -12.689 -10.504 1.00 0.00 O ATOM 1290 OE2 GLU B 2 -9.253 -12.402 -8.869 1.00 0.00 O ATOM 0 HA GLU B 2 -7.290 -9.365 -8.598 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -5.748 -11.473 -10.168 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -5.121 -10.851 -8.655 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -6.423 -12.827 -8.106 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -7.357 -11.447 -7.563 1.00 0.00 H new ATOM 1297 N LEU B 3 -5.528 -7.634 -8.936 1.00 0.00 N ATOM 1298 CA LEU B 3 -4.522 -6.555 -9.163 1.00 0.00 C ATOM 1299 C LEU B 3 -3.109 -7.148 -9.143 1.00 0.00 C ATOM 1300 O LEU B 3 -2.263 -6.785 -9.936 1.00 0.00 O ATOM 1301 CB LEU B 3 -4.665 -5.497 -8.058 1.00 0.00 C ATOM 1302 CG LEU B 3 -3.613 -4.363 -8.240 1.00 0.00 C ATOM 1303 CD1 LEU B 3 -4.248 -2.999 -7.934 1.00 0.00 C ATOM 1304 CD2 LEU B 3 -2.431 -4.572 -7.277 1.00 0.00 C ATOM 0 H LEU B 3 -6.060 -7.549 -8.070 1.00 0.00 H new ATOM 0 HA LEU B 3 -4.692 -6.092 -10.135 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -5.670 -5.075 -8.080 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -4.537 -5.965 -7.082 1.00 0.00 H new ATOM 0 HG LEU B 3 -3.262 -4.390 -9.271 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -3.504 -2.214 -8.064 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -5.082 -2.825 -8.614 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -4.610 -2.989 -6.906 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -1.703 -3.772 -7.415 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -2.793 -4.560 -6.249 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -1.958 -5.532 -7.484 1.00 0.00 H new ATOM 1316 N SER B 4 -2.847 -8.057 -8.241 1.00 0.00 N ATOM 1317 CA SER B 4 -1.488 -8.668 -8.167 1.00 0.00 C ATOM 1318 C SER B 4 -1.156 -9.310 -9.515 1.00 0.00 C ATOM 1319 O SER B 4 -0.038 -9.240 -9.988 1.00 0.00 O ATOM 1320 CB SER B 4 -1.467 -9.735 -7.072 1.00 0.00 C ATOM 1321 OG SER B 4 -0.160 -10.285 -6.976 1.00 0.00 O ATOM 0 H SER B 4 -3.516 -8.402 -7.553 1.00 0.00 H new ATOM 0 HA SER B 4 -0.750 -7.900 -7.934 1.00 0.00 H new ATOM 0 HB2 SER B 4 -1.761 -9.299 -6.117 1.00 0.00 H new ATOM 0 HB3 SER B 4 -2.188 -10.520 -7.299 1.00 0.00 H new ATOM 0 HG SER B 4 -0.178 -11.072 -6.392 1.00 0.00 H new ATOM 1327 N ASN B 5 -2.121 -9.927 -10.138 1.00 0.00 N ATOM 1328 CA ASN B 5 -1.877 -10.566 -11.463 1.00 0.00 C ATOM 1329 C ASN B 5 -1.441 -9.497 -12.469 1.00 0.00 C ATOM 1330 O ASN B 5 -0.568 -9.719 -13.286 1.00 0.00 O ATOM 1331 CB ASN B 5 -3.171 -11.233 -11.940 1.00 0.00 C ATOM 1332 CG ASN B 5 -3.028 -11.679 -13.399 1.00 0.00 C ATOM 1333 OD1 ASN B 5 -3.952 -11.543 -14.178 1.00 0.00 O ATOM 1334 ND2 ASN B 5 -1.905 -12.203 -13.807 1.00 0.00 N ATOM 0 H ASN B 5 -3.074 -10.017 -9.785 1.00 0.00 H new ATOM 0 HA ASN B 5 -1.091 -11.317 -11.376 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -3.400 -12.092 -11.310 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -4.004 -10.537 -11.845 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -1.803 -12.498 -14.778 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -1.129 -12.318 -13.155 1.00 0.00 H new ATOM 1341 N GLU B 6 -2.043 -8.342 -12.419 1.00 0.00 N ATOM 1342 CA GLU B 6 -1.669 -7.260 -13.371 1.00 0.00 C ATOM 1343 C GLU B 6 -0.178 -6.944 -13.208 1.00 0.00 C ATOM 1344 O GLU B 6 0.545 -6.780 -14.173 1.00 0.00 O ATOM 1345 CB GLU B 6 -2.487 -6.007 -13.044 1.00 0.00 C ATOM 1346 CG GLU B 6 -3.984 -6.328 -13.127 1.00 0.00 C ATOM 1347 CD GLU B 6 -4.407 -6.448 -14.591 1.00 0.00 C ATOM 1348 OE1 GLU B 6 -4.380 -5.441 -15.277 1.00 0.00 O ATOM 1349 OE2 GLU B 6 -4.768 -7.541 -14.997 1.00 0.00 O ATOM 0 H GLU B 6 -2.781 -8.100 -11.757 1.00 0.00 H new ATOM 0 HA GLU B 6 -1.869 -7.577 -14.394 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -2.237 -5.649 -12.045 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -2.238 -5.207 -13.741 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -4.196 -7.259 -12.600 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -4.561 -5.545 -12.635 1.00 0.00 H new ATOM 1356 N LEU B 7 0.288 -6.861 -11.990 1.00 0.00 N ATOM 1357 CA LEU B 7 1.729 -6.555 -11.761 1.00 0.00 C ATOM 1358 C LEU B 7 2.591 -7.675 -12.354 1.00 0.00 C ATOM 1359 O LEU B 7 3.616 -7.425 -12.956 1.00 0.00 O ATOM 1360 CB LEU B 7 2.006 -6.435 -10.251 1.00 0.00 C ATOM 1361 CG LEU B 7 1.617 -5.040 -9.738 1.00 0.00 C ATOM 1362 CD1 LEU B 7 0.094 -4.896 -9.722 1.00 0.00 C ATOM 1363 CD2 LEU B 7 2.154 -4.857 -8.316 1.00 0.00 C ATOM 0 H LEU B 7 -0.267 -6.992 -11.145 1.00 0.00 H new ATOM 0 HA LEU B 7 1.976 -5.610 -12.245 1.00 0.00 H new ATOM 0 HB2 LEU B 7 1.443 -7.197 -9.711 1.00 0.00 H new ATOM 0 HB3 LEU B 7 3.062 -6.619 -10.054 1.00 0.00 H new ATOM 0 HG LEU B 7 2.043 -4.284 -10.397 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -0.174 -3.904 -9.357 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -0.295 -5.028 -10.732 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -0.336 -5.653 -9.066 1.00 0.00 H new ATOM 0 HD21 LEU B 7 1.880 -3.868 -7.948 1.00 0.00 H new ATOM 0 HD22 LEU B 7 1.725 -5.618 -7.664 1.00 0.00 H new ATOM 0 HD23 LEU B 7 3.240 -4.954 -8.322 1.00 0.00 H new ATOM 1375 N LYS B 8 2.194 -8.908 -12.188 1.00 0.00 N ATOM 1376 CA LYS B 8 3.014 -10.018 -12.746 1.00 0.00 C ATOM 1377 C LYS B 8 3.075 -9.885 -14.266 1.00 0.00 C ATOM 1378 O LYS B 8 4.080 -10.174 -14.884 1.00 0.00 O ATOM 1379 CB LYS B 8 2.408 -11.379 -12.380 1.00 0.00 C ATOM 1380 CG LYS B 8 2.440 -11.580 -10.856 1.00 0.00 C ATOM 1381 CD LYS B 8 2.365 -13.075 -10.519 1.00 0.00 C ATOM 1382 CE LYS B 8 1.051 -13.665 -11.030 1.00 0.00 C ATOM 1383 NZ LYS B 8 0.924 -15.071 -10.553 1.00 0.00 N ATOM 0 H LYS B 8 1.347 -9.191 -11.696 1.00 0.00 H new ATOM 0 HA LYS B 8 4.017 -9.958 -12.323 1.00 0.00 H new ATOM 0 HB2 LYS B 8 1.381 -11.437 -12.741 1.00 0.00 H new ATOM 0 HB3 LYS B 8 2.964 -12.177 -12.872 1.00 0.00 H new ATOM 0 HG2 LYS B 8 3.354 -11.152 -10.444 1.00 0.00 H new ATOM 0 HG3 LYS B 8 1.605 -11.053 -10.394 1.00 0.00 H new ATOM 0 HD2 LYS B 8 3.207 -13.600 -10.970 1.00 0.00 H new ATOM 0 HD3 LYS B 8 2.441 -13.217 -9.441 1.00 0.00 H new ATOM 0 HE2 LYS B 8 0.209 -13.071 -10.674 1.00 0.00 H new ATOM 0 HE3 LYS B 8 1.025 -13.635 -12.119 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 0.031 -15.476 -10.899 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 1.721 -15.633 -10.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 0.931 -15.087 -9.513 1.00 0.00 H new ATOM 1397 N VAL B 9 2.004 -9.460 -14.881 1.00 0.00 N ATOM 1398 CA VAL B 9 2.014 -9.326 -16.363 1.00 0.00 C ATOM 1399 C VAL B 9 3.098 -8.330 -16.780 1.00 0.00 C ATOM 1400 O VAL B 9 3.866 -8.591 -17.680 1.00 0.00 O ATOM 1401 CB VAL B 9 0.652 -8.816 -16.840 1.00 0.00 C ATOM 1402 CG1 VAL B 9 0.712 -8.506 -18.341 1.00 0.00 C ATOM 1403 CG2 VAL B 9 -0.410 -9.887 -16.580 1.00 0.00 C ATOM 0 H VAL B 9 1.129 -9.202 -14.424 1.00 0.00 H new ATOM 0 HA VAL B 9 2.219 -10.298 -16.811 1.00 0.00 H new ATOM 0 HB VAL B 9 0.395 -7.907 -16.296 1.00 0.00 H new ATOM 0 HG11 VAL B 9 -0.259 -8.143 -18.677 1.00 0.00 H new ATOM 0 HG12 VAL B 9 1.468 -7.742 -18.525 1.00 0.00 H new ATOM 0 HG13 VAL B 9 0.970 -9.412 -18.890 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -1.381 -9.526 -16.919 1.00 0.00 H new ATOM 0 HG22 VAL B 9 -0.151 -10.796 -17.123 1.00 0.00 H new ATOM 0 HG23 VAL B 9 -0.455 -10.103 -15.513 1.00 0.00 H new ATOM 1413 N GLU B 10 3.175 -7.193 -16.137 1.00 0.00 N ATOM 1414 CA GLU B 10 4.214 -6.195 -16.514 1.00 0.00 C ATOM 1415 C GLU B 10 5.605 -6.789 -16.258 1.00 0.00 C ATOM 1416 O GLU B 10 6.531 -6.583 -17.018 1.00 0.00 O ATOM 1417 CB GLU B 10 4.014 -4.948 -15.656 1.00 0.00 C ATOM 1418 CG GLU B 10 2.599 -4.408 -15.883 1.00 0.00 C ATOM 1419 CD GLU B 10 2.326 -3.254 -14.916 1.00 0.00 C ATOM 1420 OE1 GLU B 10 3.274 -2.771 -14.319 1.00 0.00 O ATOM 1421 OE2 GLU B 10 1.171 -2.887 -14.775 1.00 0.00 O ATOM 0 H GLU B 10 2.564 -6.915 -15.369 1.00 0.00 H new ATOM 0 HA GLU B 10 4.130 -5.936 -17.570 1.00 0.00 H new ATOM 0 HB2 GLU B 10 4.161 -5.188 -14.603 1.00 0.00 H new ATOM 0 HB3 GLU B 10 4.753 -4.190 -15.916 1.00 0.00 H new ATOM 0 HG2 GLU B 10 2.491 -4.066 -16.912 1.00 0.00 H new ATOM 0 HG3 GLU B 10 1.868 -5.202 -15.732 1.00 0.00 H new ATOM 1428 N ARG B 11 5.751 -7.538 -15.196 1.00 0.00 N ATOM 1429 CA ARG B 11 7.072 -8.166 -14.889 1.00 0.00 C ATOM 1430 C ARG B 11 7.469 -9.082 -16.045 1.00 0.00 C ATOM 1431 O ARG B 11 8.583 -9.051 -16.533 1.00 0.00 O ATOM 1432 CB ARG B 11 6.920 -8.987 -13.600 1.00 0.00 C ATOM 1433 CG ARG B 11 8.153 -9.872 -13.357 1.00 0.00 C ATOM 1434 CD ARG B 11 9.433 -9.035 -13.425 1.00 0.00 C ATOM 1435 NE ARG B 11 10.520 -9.727 -12.659 1.00 0.00 N ATOM 1436 CZ ARG B 11 10.808 -9.375 -11.426 1.00 0.00 C ATOM 1437 NH1 ARG B 11 10.139 -8.425 -10.827 1.00 0.00 N ATOM 1438 NH2 ARG B 11 11.767 -9.987 -10.785 1.00 0.00 N ATOM 0 H ARG B 11 5.010 -7.743 -14.526 1.00 0.00 H new ATOM 0 HA ARG B 11 7.842 -7.406 -14.758 1.00 0.00 H new ATOM 0 HB2 ARG B 11 6.778 -8.316 -12.753 1.00 0.00 H new ATOM 0 HB3 ARG B 11 6.028 -9.611 -13.666 1.00 0.00 H new ATOM 0 HG2 ARG B 11 8.077 -10.353 -12.382 1.00 0.00 H new ATOM 0 HG3 ARG B 11 8.191 -10.667 -14.102 1.00 0.00 H new ATOM 0 HD2 ARG B 11 9.736 -8.896 -14.463 1.00 0.00 H new ATOM 0 HD3 ARG B 11 9.255 -8.043 -13.010 1.00 0.00 H new ATOM 0 HE ARG B 11 11.044 -10.482 -13.101 1.00 0.00 H new ATOM 0 HH11 ARG B 11 9.383 -7.947 -11.317 1.00 0.00 H new ATOM 0 HH12 ARG B 11 10.373 -8.162 -9.870 1.00 0.00 H new ATOM 0 HH21 ARG B 11 12.289 -10.735 -11.241 1.00 0.00 H new ATOM 0 HH22 ARG B 11 11.994 -9.717 -9.828 1.00 0.00 H new ATOM 1452 N ILE B 12 6.549 -9.888 -16.488 1.00 0.00 N ATOM 1453 CA ILE B 12 6.822 -10.816 -17.617 1.00 0.00 C ATOM 1454 C ILE B 12 6.865 -10.020 -18.925 1.00 0.00 C ATOM 1455 O ILE B 12 7.613 -10.331 -19.833 1.00 0.00 O ATOM 1456 CB ILE B 12 5.714 -11.873 -17.670 1.00 0.00 C ATOM 1457 CG1 ILE B 12 5.643 -12.599 -16.315 1.00 0.00 C ATOM 1458 CG2 ILE B 12 6.032 -12.884 -18.774 1.00 0.00 C ATOM 1459 CD1 ILE B 12 4.328 -13.376 -16.201 1.00 0.00 C ATOM 0 H ILE B 12 5.604 -9.944 -16.109 1.00 0.00 H new ATOM 0 HA ILE B 12 7.782 -11.312 -17.476 1.00 0.00 H new ATOM 0 HB ILE B 12 4.757 -11.394 -17.879 1.00 0.00 H new ATOM 0 HG12 ILE B 12 6.487 -13.281 -16.215 1.00 0.00 H new ATOM 0 HG13 ILE B 12 5.719 -11.877 -15.502 1.00 0.00 H new ATOM 0 HG21 ILE B 12 5.246 -13.638 -18.815 1.00 0.00 H new ATOM 0 HG22 ILE B 12 6.091 -12.369 -19.733 1.00 0.00 H new ATOM 0 HG23 ILE B 12 6.986 -13.366 -18.562 1.00 0.00 H new ATOM 0 HD11 ILE B 12 4.289 -13.886 -15.238 1.00 0.00 H new ATOM 0 HD12 ILE B 12 3.489 -12.685 -16.280 1.00 0.00 H new ATOM 0 HD13 ILE B 12 4.269 -14.111 -17.003 1.00 0.00 H new ATOM 1471 N ARG B 13 6.051 -9.004 -19.032 1.00 0.00 N ATOM 1472 CA ARG B 13 6.017 -8.189 -20.280 1.00 0.00 C ATOM 1473 C ARG B 13 7.407 -7.611 -20.547 1.00 0.00 C ATOM 1474 O ARG B 13 7.911 -7.660 -21.652 1.00 0.00 O ATOM 1475 CB ARG B 13 5.030 -7.031 -20.093 1.00 0.00 C ATOM 1476 CG ARG B 13 4.702 -6.399 -21.444 1.00 0.00 C ATOM 1477 CD ARG B 13 3.736 -5.230 -21.236 1.00 0.00 C ATOM 1478 NE ARG B 13 3.145 -4.847 -22.547 1.00 0.00 N ATOM 1479 CZ ARG B 13 2.591 -3.676 -22.703 1.00 0.00 C ATOM 1480 NH1 ARG B 13 2.602 -2.810 -21.726 1.00 0.00 N ATOM 1481 NH2 ARG B 13 2.030 -3.370 -23.840 1.00 0.00 N ATOM 0 H ARG B 13 5.404 -8.702 -18.303 1.00 0.00 H new ATOM 0 HA ARG B 13 5.709 -8.815 -21.117 1.00 0.00 H new ATOM 0 HB2 ARG B 13 4.117 -7.394 -19.621 1.00 0.00 H new ATOM 0 HB3 ARG B 13 5.458 -6.282 -19.426 1.00 0.00 H new ATOM 0 HG2 ARG B 13 5.615 -6.050 -21.926 1.00 0.00 H new ATOM 0 HG3 ARG B 13 4.256 -7.141 -22.106 1.00 0.00 H new ATOM 0 HD2 ARG B 13 2.949 -5.513 -20.537 1.00 0.00 H new ATOM 0 HD3 ARG B 13 4.262 -4.381 -20.798 1.00 0.00 H new ATOM 0 HE ARG B 13 3.173 -5.503 -23.327 1.00 0.00 H new ATOM 0 HH11 ARG B 13 3.044 -3.048 -20.838 1.00 0.00 H new ATOM 0 HH12 ARG B 13 2.168 -1.895 -21.850 1.00 0.00 H new ATOM 0 HH21 ARG B 13 2.025 -4.045 -24.604 1.00 0.00 H new ATOM 0 HH22 ARG B 13 1.596 -2.455 -23.965 1.00 0.00 H new ATOM 1495 N LEU B 14 8.027 -7.060 -19.539 1.00 0.00 N ATOM 1496 CA LEU B 14 9.386 -6.469 -19.715 1.00 0.00 C ATOM 1497 C LEU B 14 10.435 -7.485 -19.258 1.00 0.00 C ATOM 1498 O LEU B 14 11.622 -7.225 -19.307 1.00 0.00 O ATOM 1499 CB LEU B 14 9.492 -5.198 -18.864 1.00 0.00 C ATOM 1500 CG LEU B 14 8.376 -4.218 -19.256 1.00 0.00 C ATOM 1501 CD1 LEU B 14 8.436 -2.989 -18.344 1.00 0.00 C ATOM 1502 CD2 LEU B 14 8.548 -3.781 -20.722 1.00 0.00 C ATOM 0 H LEU B 14 7.648 -6.993 -18.594 1.00 0.00 H new ATOM 0 HA LEU B 14 9.554 -6.220 -20.763 1.00 0.00 H new ATOM 0 HB2 LEU B 14 9.414 -5.449 -17.806 1.00 0.00 H new ATOM 0 HB3 LEU B 14 10.466 -4.732 -19.009 1.00 0.00 H new ATOM 0 HG LEU B 14 7.410 -4.711 -19.144 1.00 0.00 H new ATOM 0 HD11 LEU B 14 7.645 -2.292 -18.620 1.00 0.00 H new ATOM 0 HD12 LEU B 14 8.302 -3.298 -17.307 1.00 0.00 H new ATOM 0 HD13 LEU B 14 9.404 -2.501 -18.454 1.00 0.00 H new ATOM 0 HD21 LEU B 14 7.752 -3.086 -20.990 1.00 0.00 H new ATOM 0 HD22 LEU B 14 9.514 -3.291 -20.845 1.00 0.00 H new ATOM 0 HD23 LEU B 14 8.500 -4.656 -21.370 1.00 0.00 H new ATOM 1514 N SER B 15 10.002 -8.641 -18.811 1.00 0.00 N ATOM 1515 CA SER B 15 10.963 -9.688 -18.340 1.00 0.00 C ATOM 1516 C SER B 15 12.079 -9.036 -17.517 1.00 0.00 C ATOM 1517 O SER B 15 13.219 -8.979 -17.932 1.00 0.00 O ATOM 1518 CB SER B 15 11.566 -10.410 -19.547 1.00 0.00 C ATOM 1519 OG SER B 15 11.896 -9.456 -20.548 1.00 0.00 O ATOM 0 H SER B 15 9.018 -8.905 -18.752 1.00 0.00 H new ATOM 0 HA SER B 15 10.433 -10.408 -17.716 1.00 0.00 H new ATOM 0 HB2 SER B 15 12.456 -10.963 -19.247 1.00 0.00 H new ATOM 0 HB3 SER B 15 10.857 -11.138 -19.942 1.00 0.00 H new ATOM 0 HG SER B 15 12.399 -8.719 -20.144 1.00 0.00 H new ATOM 1525 N LEU B 16 11.752 -8.534 -16.360 1.00 0.00 N ATOM 1526 CA LEU B 16 12.787 -7.872 -15.518 1.00 0.00 C ATOM 1527 C LEU B 16 13.620 -8.940 -14.802 1.00 0.00 C ATOM 1528 O LEU B 16 13.182 -10.056 -14.603 1.00 0.00 O ATOM 1529 CB LEU B 16 12.098 -6.975 -14.488 1.00 0.00 C ATOM 1530 CG LEU B 16 11.119 -6.030 -15.199 1.00 0.00 C ATOM 1531 CD1 LEU B 16 10.360 -5.210 -14.152 1.00 0.00 C ATOM 1532 CD2 LEU B 16 11.886 -5.081 -16.133 1.00 0.00 C ATOM 0 H LEU B 16 10.814 -8.553 -15.961 1.00 0.00 H new ATOM 0 HA LEU B 16 13.442 -7.267 -16.145 1.00 0.00 H new ATOM 0 HB2 LEU B 16 11.565 -7.585 -13.759 1.00 0.00 H new ATOM 0 HB3 LEU B 16 12.842 -6.398 -13.938 1.00 0.00 H new ATOM 0 HG LEU B 16 10.417 -6.619 -15.789 1.00 0.00 H new ATOM 0 HD11 LEU B 16 9.663 -4.537 -14.652 1.00 0.00 H new ATOM 0 HD12 LEU B 16 9.808 -5.881 -13.495 1.00 0.00 H new ATOM 0 HD13 LEU B 16 11.068 -4.627 -13.563 1.00 0.00 H new ATOM 0 HD21 LEU B 16 11.183 -4.415 -16.633 1.00 0.00 H new ATOM 0 HD22 LEU B 16 12.594 -4.491 -15.551 1.00 0.00 H new ATOM 0 HD23 LEU B 16 12.427 -5.663 -16.879 1.00 0.00 H new ATOM 1544 N THR B 17 14.829 -8.608 -14.424 1.00 0.00 N ATOM 1545 CA THR B 17 15.709 -9.601 -13.731 1.00 0.00 C ATOM 1546 C THR B 17 15.637 -9.393 -12.217 1.00 0.00 C ATOM 1547 O THR B 17 15.600 -8.279 -11.733 1.00 0.00 O ATOM 1548 CB THR B 17 17.156 -9.407 -14.196 1.00 0.00 C ATOM 1549 OG1 THR B 17 17.510 -8.035 -14.078 1.00 0.00 O ATOM 1550 CG2 THR B 17 17.289 -9.848 -15.654 1.00 0.00 C ATOM 0 H THR B 17 15.247 -7.688 -14.566 1.00 0.00 H new ATOM 0 HA THR B 17 15.372 -10.609 -13.974 1.00 0.00 H new ATOM 0 HB THR B 17 17.821 -10.008 -13.576 1.00 0.00 H new ATOM 0 HG1 THR B 17 18.436 -7.909 -14.373 1.00 0.00 H new ATOM 0 HG21 THR B 17 18.319 -9.709 -15.984 1.00 0.00 H new ATOM 0 HG22 THR B 17 17.018 -10.900 -15.742 1.00 0.00 H new ATOM 0 HG23 THR B 17 16.625 -9.249 -16.277 1.00 0.00 H new ATOM 1558 N ALA B 18 15.618 -10.460 -11.463 1.00 0.00 N ATOM 1559 CA ALA B 18 15.552 -10.326 -9.980 1.00 0.00 C ATOM 1560 C ALA B 18 16.812 -9.627 -9.475 1.00 0.00 C ATOM 1561 O ALA B 18 16.773 -8.856 -8.540 1.00 0.00 O ATOM 1562 CB ALA B 18 15.457 -11.711 -9.336 1.00 0.00 C ATOM 0 H ALA B 18 15.645 -11.418 -11.811 1.00 0.00 H new ATOM 0 HA ALA B 18 14.672 -9.740 -9.715 1.00 0.00 H new ATOM 0 HB1 ALA B 18 15.409 -11.606 -8.252 1.00 0.00 H new ATOM 0 HB2 ALA B 18 14.559 -12.217 -9.691 1.00 0.00 H new ATOM 0 HB3 ALA B 18 16.335 -12.298 -9.605 1.00 0.00 H new ATOM 1568 N LYS B 19 17.933 -9.899 -10.082 1.00 0.00 N ATOM 1569 CA LYS B 19 19.197 -9.257 -9.634 1.00 0.00 C ATOM 1570 C LYS B 19 19.089 -7.737 -9.782 1.00 0.00 C ATOM 1571 O LYS B 19 19.466 -6.992 -8.898 1.00 0.00 O ATOM 1572 CB LYS B 19 20.351 -9.771 -10.495 1.00 0.00 C ATOM 1573 CG LYS B 19 21.678 -9.219 -9.969 1.00 0.00 C ATOM 1574 CD LYS B 19 22.829 -9.819 -10.778 1.00 0.00 C ATOM 1575 CE LYS B 19 24.162 -9.296 -10.239 1.00 0.00 C ATOM 1576 NZ LYS B 19 24.203 -7.813 -10.369 1.00 0.00 N ATOM 0 H LYS B 19 18.027 -10.539 -10.870 1.00 0.00 H new ATOM 0 HA LYS B 19 19.378 -9.502 -8.587 1.00 0.00 H new ATOM 0 HB2 LYS B 19 20.369 -10.861 -10.481 1.00 0.00 H new ATOM 0 HB3 LYS B 19 20.206 -9.468 -11.532 1.00 0.00 H new ATOM 0 HG2 LYS B 19 21.690 -8.132 -10.048 1.00 0.00 H new ATOM 0 HG3 LYS B 19 21.794 -9.463 -8.913 1.00 0.00 H new ATOM 0 HD2 LYS B 19 22.802 -10.907 -10.716 1.00 0.00 H new ATOM 0 HD3 LYS B 19 22.723 -9.557 -11.831 1.00 0.00 H new ATOM 0 HE2 LYS B 19 24.282 -9.584 -9.194 1.00 0.00 H new ATOM 0 HE3 LYS B 19 24.990 -9.743 -10.790 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 25.190 -7.488 -10.332 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 23.780 -7.532 -11.277 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 23.667 -7.381 -9.589 1.00 0.00 H new ATOM 1590 N SER B 20 18.594 -7.268 -10.894 1.00 0.00 N ATOM 1591 CA SER B 20 18.478 -5.795 -11.090 1.00 0.00 C ATOM 1592 C SER B 20 17.533 -5.190 -10.046 1.00 0.00 C ATOM 1593 O SER B 20 17.867 -4.235 -9.374 1.00 0.00 O ATOM 1594 CB SER B 20 17.922 -5.514 -12.486 1.00 0.00 C ATOM 1595 OG SER B 20 17.480 -4.165 -12.554 1.00 0.00 O ATOM 0 H SER B 20 18.266 -7.839 -11.673 1.00 0.00 H new ATOM 0 HA SER B 20 19.465 -5.347 -10.980 1.00 0.00 H new ATOM 0 HB2 SER B 20 18.689 -5.695 -13.239 1.00 0.00 H new ATOM 0 HB3 SER B 20 17.096 -6.191 -12.704 1.00 0.00 H new ATOM 0 HG SER B 20 17.124 -3.982 -13.449 1.00 0.00 H new ATOM 1601 N VAL B 21 16.353 -5.732 -9.908 1.00 0.00 N ATOM 1602 CA VAL B 21 15.393 -5.170 -8.915 1.00 0.00 C ATOM 1603 C VAL B 21 15.920 -5.399 -7.496 1.00 0.00 C ATOM 1604 O VAL B 21 15.894 -4.514 -6.662 1.00 0.00 O ATOM 1605 CB VAL B 21 14.037 -5.863 -9.072 1.00 0.00 C ATOM 1606 CG1 VAL B 21 13.049 -5.299 -8.043 1.00 0.00 C ATOM 1607 CG2 VAL B 21 13.494 -5.642 -10.493 1.00 0.00 C ATOM 0 H VAL B 21 16.014 -6.535 -10.437 1.00 0.00 H new ATOM 0 HA VAL B 21 15.281 -4.100 -9.088 1.00 0.00 H new ATOM 0 HB VAL B 21 14.161 -6.933 -8.904 1.00 0.00 H new ATOM 0 HG11 VAL B 21 12.084 -5.793 -8.156 1.00 0.00 H new ATOM 0 HG12 VAL B 21 13.431 -5.475 -7.037 1.00 0.00 H new ATOM 0 HG13 VAL B 21 12.929 -4.228 -8.203 1.00 0.00 H new ATOM 0 HG21 VAL B 21 12.529 -6.139 -10.595 1.00 0.00 H new ATOM 0 HG22 VAL B 21 13.373 -4.574 -10.674 1.00 0.00 H new ATOM 0 HG23 VAL B 21 14.194 -6.056 -11.219 1.00 0.00 H new ATOM 1617 N ALA B 22 16.392 -6.582 -7.214 1.00 0.00 N ATOM 1618 CA ALA B 22 16.916 -6.878 -5.851 1.00 0.00 C ATOM 1619 C ALA B 22 18.153 -6.017 -5.563 1.00 0.00 C ATOM 1620 O ALA B 22 18.378 -5.595 -4.446 1.00 0.00 O ATOM 1621 CB ALA B 22 17.292 -8.360 -5.765 1.00 0.00 C ATOM 0 H ALA B 22 16.437 -7.360 -7.872 1.00 0.00 H new ATOM 0 HA ALA B 22 16.147 -6.649 -5.114 1.00 0.00 H new ATOM 0 HB1 ALA B 22 17.676 -8.581 -4.769 1.00 0.00 H new ATOM 0 HB2 ALA B 22 16.410 -8.971 -5.958 1.00 0.00 H new ATOM 0 HB3 ALA B 22 18.058 -8.585 -6.507 1.00 0.00 H new ATOM 1627 N GLU B 23 18.968 -5.766 -6.556 1.00 0.00 N ATOM 1628 CA GLU B 23 20.197 -4.946 -6.324 1.00 0.00 C ATOM 1629 C GLU B 23 19.824 -3.543 -5.835 1.00 0.00 C ATOM 1630 O GLU B 23 20.324 -3.077 -4.831 1.00 0.00 O ATOM 1631 CB GLU B 23 20.992 -4.843 -7.636 1.00 0.00 C ATOM 1632 CG GLU B 23 22.137 -3.828 -7.493 1.00 0.00 C ATOM 1633 CD GLU B 23 22.958 -4.145 -6.241 1.00 0.00 C ATOM 1634 OE1 GLU B 23 23.669 -5.135 -6.257 1.00 0.00 O ATOM 1635 OE2 GLU B 23 22.861 -3.390 -5.288 1.00 0.00 O ATOM 0 H GLU B 23 18.837 -6.092 -7.514 1.00 0.00 H new ATOM 0 HA GLU B 23 20.805 -5.428 -5.559 1.00 0.00 H new ATOM 0 HB2 GLU B 23 21.395 -5.820 -7.901 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.329 -4.541 -8.447 1.00 0.00 H new ATOM 0 HG2 GLU B 23 22.776 -3.860 -8.376 1.00 0.00 H new ATOM 0 HG3 GLU B 23 21.733 -2.818 -7.428 1.00 0.00 H new ATOM 1642 N GLU B 24 18.966 -2.854 -6.537 1.00 0.00 N ATOM 1643 CA GLU B 24 18.596 -1.479 -6.094 1.00 0.00 C ATOM 1644 C GLU B 24 17.775 -1.555 -4.805 1.00 0.00 C ATOM 1645 O GLU B 24 17.942 -0.761 -3.901 1.00 0.00 O ATOM 1646 CB GLU B 24 17.765 -0.791 -7.181 1.00 0.00 C ATOM 1647 CG GLU B 24 18.413 -1.012 -8.550 1.00 0.00 C ATOM 1648 CD GLU B 24 19.818 -0.405 -8.568 1.00 0.00 C ATOM 1649 OE1 GLU B 24 20.091 0.436 -7.729 1.00 0.00 O ATOM 1650 OE2 GLU B 24 20.594 -0.788 -9.427 1.00 0.00 O ATOM 0 H GLU B 24 18.509 -3.179 -7.389 1.00 0.00 H new ATOM 0 HA GLU B 24 19.506 -0.907 -5.914 1.00 0.00 H new ATOM 0 HB2 GLU B 24 16.750 -1.188 -7.181 1.00 0.00 H new ATOM 0 HB3 GLU B 24 17.690 0.276 -6.973 1.00 0.00 H new ATOM 0 HG2 GLU B 24 18.466 -2.079 -8.769 1.00 0.00 H new ATOM 0 HG3 GLU B 24 17.801 -0.557 -9.329 1.00 0.00 H new ATOM 1657 N MET B 25 16.884 -2.503 -4.721 1.00 0.00 N ATOM 1658 CA MET B 25 16.039 -2.633 -3.501 1.00 0.00 C ATOM 1659 C MET B 25 16.923 -2.977 -2.298 1.00 0.00 C ATOM 1660 O MET B 25 16.716 -2.485 -1.207 1.00 0.00 O ATOM 1661 CB MET B 25 15.014 -3.746 -3.721 1.00 0.00 C ATOM 1662 CG MET B 25 13.916 -3.257 -4.674 1.00 0.00 C ATOM 1663 SD MET B 25 12.923 -1.974 -3.870 1.00 0.00 S ATOM 1664 CE MET B 25 11.793 -3.070 -2.971 1.00 0.00 C ATOM 0 H MET B 25 16.704 -3.196 -5.447 1.00 0.00 H new ATOM 0 HA MET B 25 15.524 -1.692 -3.308 1.00 0.00 H new ATOM 0 HB2 MET B 25 15.503 -4.627 -4.136 1.00 0.00 H new ATOM 0 HB3 MET B 25 14.576 -4.044 -2.768 1.00 0.00 H new ATOM 0 HG2 MET B 25 14.364 -2.863 -5.586 1.00 0.00 H new ATOM 0 HG3 MET B 25 13.279 -4.092 -4.966 1.00 0.00 H new ATOM 0 HE1 MET B 25 10.837 -3.115 -3.493 1.00 0.00 H new ATOM 0 HE2 MET B 25 12.223 -4.070 -2.915 1.00 0.00 H new ATOM 0 HE3 MET B 25 11.638 -2.685 -1.963 1.00 0.00 H new ATOM 1674 N GLY B 26 17.906 -3.816 -2.488 1.00 0.00 N ATOM 1675 CA GLY B 26 18.803 -4.187 -1.354 1.00 0.00 C ATOM 1676 C GLY B 26 18.182 -5.339 -0.560 1.00 0.00 C ATOM 1677 O GLY B 26 18.380 -5.456 0.632 1.00 0.00 O ATOM 0 H GLY B 26 18.127 -4.261 -3.379 1.00 0.00 H new ATOM 0 HA2 GLY B 26 19.782 -4.480 -1.733 1.00 0.00 H new ATOM 0 HA3 GLY B 26 18.958 -3.326 -0.704 1.00 0.00 H new ATOM 1681 N ILE B 27 17.434 -6.193 -1.219 1.00 0.00 N ATOM 1682 CA ILE B 27 16.788 -7.354 -0.523 1.00 0.00 C ATOM 1683 C ILE B 27 17.217 -8.658 -1.197 1.00 0.00 C ATOM 1684 O ILE B 27 17.728 -8.665 -2.300 1.00 0.00 O ATOM 1685 CB ILE B 27 15.263 -7.215 -0.591 1.00 0.00 C ATOM 1686 CG1 ILE B 27 14.809 -7.124 -2.053 1.00 0.00 C ATOM 1687 CG2 ILE B 27 14.831 -5.955 0.160 1.00 0.00 C ATOM 1688 CD1 ILE B 27 13.280 -7.069 -2.114 1.00 0.00 C ATOM 0 H ILE B 27 17.241 -6.135 -2.219 1.00 0.00 H new ATOM 0 HA ILE B 27 17.100 -7.367 0.521 1.00 0.00 H new ATOM 0 HB ILE B 27 14.804 -8.089 -0.130 1.00 0.00 H new ATOM 0 HG12 ILE B 27 15.234 -6.236 -2.522 1.00 0.00 H new ATOM 0 HG13 ILE B 27 15.175 -7.985 -2.612 1.00 0.00 H new ATOM 0 HG21 ILE B 27 13.747 -5.856 0.111 1.00 0.00 H new ATOM 0 HG22 ILE B 27 15.143 -6.028 1.202 1.00 0.00 H new ATOM 0 HG23 ILE B 27 15.296 -5.082 -0.297 1.00 0.00 H new ATOM 0 HD11 ILE B 27 12.959 -7.004 -3.154 1.00 0.00 H new ATOM 0 HD12 ILE B 27 12.865 -7.970 -1.662 1.00 0.00 H new ATOM 0 HD13 ILE B 27 12.925 -6.194 -1.570 1.00 0.00 H new ATOM 1700 N SER B 28 17.021 -9.764 -0.533 1.00 0.00 N ATOM 1701 CA SER B 28 17.424 -11.072 -1.118 1.00 0.00 C ATOM 1702 C SER B 28 16.463 -11.460 -2.241 1.00 0.00 C ATOM 1703 O SER B 28 15.383 -10.920 -2.366 1.00 0.00 O ATOM 1704 CB SER B 28 17.382 -12.145 -0.028 1.00 0.00 C ATOM 1705 OG SER B 28 16.034 -12.351 0.374 1.00 0.00 O ATOM 0 H SER B 28 16.597 -9.817 0.393 1.00 0.00 H new ATOM 0 HA SER B 28 18.433 -10.989 -1.521 1.00 0.00 H new ATOM 0 HB2 SER B 28 17.809 -13.076 -0.401 1.00 0.00 H new ATOM 0 HB3 SER B 28 17.986 -11.837 0.826 1.00 0.00 H new ATOM 0 HG SER B 28 16.002 -13.039 1.071 1.00 0.00 H new ATOM 1711 N ARG B 29 16.856 -12.395 -3.059 1.00 0.00 N ATOM 1712 CA ARG B 29 15.975 -12.830 -4.177 1.00 0.00 C ATOM 1713 C ARG B 29 14.708 -13.462 -3.593 1.00 0.00 C ATOM 1714 O ARG B 29 13.625 -13.302 -4.120 1.00 0.00 O ATOM 1715 CB ARG B 29 16.710 -13.867 -5.035 1.00 0.00 C ATOM 1716 CG ARG B 29 18.045 -13.303 -5.549 1.00 0.00 C ATOM 1717 CD ARG B 29 17.823 -12.360 -6.733 1.00 0.00 C ATOM 1718 NE ARG B 29 19.127 -11.754 -7.118 1.00 0.00 N ATOM 1719 CZ ARG B 29 19.645 -10.817 -6.375 1.00 0.00 C ATOM 1720 NH1 ARG B 29 19.048 -10.456 -5.272 1.00 0.00 N ATOM 1721 NH2 ARG B 29 20.764 -10.248 -6.727 1.00 0.00 N ATOM 0 H ARG B 29 17.752 -12.878 -3.001 1.00 0.00 H new ATOM 0 HA ARG B 29 15.712 -11.971 -4.795 1.00 0.00 H new ATOM 0 HB2 ARG B 29 16.892 -14.768 -4.449 1.00 0.00 H new ATOM 0 HB3 ARG B 29 16.084 -14.157 -5.879 1.00 0.00 H new ATOM 0 HG2 ARG B 29 18.552 -12.770 -4.745 1.00 0.00 H new ATOM 0 HG3 ARG B 29 18.698 -14.122 -5.850 1.00 0.00 H new ATOM 0 HD2 ARG B 29 17.398 -12.906 -7.575 1.00 0.00 H new ATOM 0 HD3 ARG B 29 17.109 -11.581 -6.466 1.00 0.00 H new ATOM 0 HE ARG B 29 19.612 -12.070 -7.958 1.00 0.00 H new ATOM 0 HH11 ARG B 29 18.177 -10.907 -4.992 1.00 0.00 H new ATOM 0 HH12 ARG B 29 19.452 -9.723 -4.690 1.00 0.00 H new ATOM 0 HH21 ARG B 29 21.235 -10.536 -7.585 1.00 0.00 H new ATOM 0 HH22 ARG B 29 21.169 -9.515 -6.145 1.00 0.00 H new ATOM 1735 N GLN B 30 14.834 -14.179 -2.506 1.00 0.00 N ATOM 1736 CA GLN B 30 13.633 -14.816 -1.892 1.00 0.00 C ATOM 1737 C GLN B 30 12.634 -13.725 -1.502 1.00 0.00 C ATOM 1738 O GLN B 30 11.445 -13.853 -1.718 1.00 0.00 O ATOM 1739 CB GLN B 30 14.056 -15.596 -0.641 1.00 0.00 C ATOM 1740 CG GLN B 30 12.857 -16.356 -0.062 1.00 0.00 C ATOM 1741 CD GLN B 30 12.417 -17.445 -1.040 1.00 0.00 C ATOM 1742 OE1 GLN B 30 11.672 -17.185 -1.964 1.00 0.00 O ATOM 1743 NE2 GLN B 30 12.855 -18.665 -0.880 1.00 0.00 N ATOM 0 H GLN B 30 15.714 -14.350 -2.019 1.00 0.00 H new ATOM 0 HA GLN B 30 13.170 -15.499 -2.605 1.00 0.00 H new ATOM 0 HB2 GLN B 30 14.853 -16.296 -0.892 1.00 0.00 H new ATOM 0 HB3 GLN B 30 14.457 -14.911 0.106 1.00 0.00 H new ATOM 0 HG2 GLN B 30 13.124 -16.801 0.896 1.00 0.00 H new ATOM 0 HG3 GLN B 30 12.033 -15.667 0.125 1.00 0.00 H new ATOM 0 HE21 GLN B 30 13.480 -18.885 -0.105 1.00 0.00 H new ATOM 0 HE22 GLN B 30 12.572 -19.398 -1.530 1.00 0.00 H new ATOM 1752 N GLN B 31 13.108 -12.645 -0.942 1.00 0.00 N ATOM 1753 CA GLN B 31 12.184 -11.543 -0.554 1.00 0.00 C ATOM 1754 C GLN B 31 11.523 -10.977 -1.812 1.00 0.00 C ATOM 1755 O GLN B 31 10.332 -10.741 -1.850 1.00 0.00 O ATOM 1756 CB GLN B 31 12.987 -10.436 0.147 1.00 0.00 C ATOM 1757 CG GLN B 31 13.198 -10.788 1.623 1.00 0.00 C ATOM 1758 CD GLN B 31 11.916 -10.490 2.405 1.00 0.00 C ATOM 1759 OE1 GLN B 31 11.014 -9.858 1.896 1.00 0.00 O ATOM 1760 NE2 GLN B 31 11.804 -10.905 3.634 1.00 0.00 N ATOM 0 H GLN B 31 14.093 -12.479 -0.737 1.00 0.00 H new ATOM 0 HA GLN B 31 11.417 -11.921 0.122 1.00 0.00 H new ATOM 0 HB2 GLN B 31 13.951 -10.309 -0.345 1.00 0.00 H new ATOM 0 HB3 GLN B 31 12.459 -9.486 0.064 1.00 0.00 H new ATOM 0 HG2 GLN B 31 13.462 -11.841 1.723 1.00 0.00 H new ATOM 0 HG3 GLN B 31 14.028 -10.211 2.031 1.00 0.00 H new ATOM 0 HE21 GLN B 31 12.561 -11.436 4.064 1.00 0.00 H new ATOM 0 HE22 GLN B 31 10.959 -10.699 4.167 1.00 0.00 H new ATOM 1769 N LEU B 32 12.291 -10.757 -2.841 1.00 0.00 N ATOM 1770 CA LEU B 32 11.713 -10.208 -4.095 1.00 0.00 C ATOM 1771 C LEU B 32 10.711 -11.208 -4.675 1.00 0.00 C ATOM 1772 O LEU B 32 9.647 -10.842 -5.134 1.00 0.00 O ATOM 1773 CB LEU B 32 12.841 -9.964 -5.104 1.00 0.00 C ATOM 1774 CG LEU B 32 12.278 -9.357 -6.397 1.00 0.00 C ATOM 1775 CD1 LEU B 32 11.602 -8.007 -6.101 1.00 0.00 C ATOM 1776 CD2 LEU B 32 13.425 -9.153 -7.392 1.00 0.00 C ATOM 0 H LEU B 32 13.295 -10.934 -2.867 1.00 0.00 H new ATOM 0 HA LEU B 32 11.202 -9.268 -3.885 1.00 0.00 H new ATOM 0 HB2 LEU B 32 13.585 -9.293 -4.673 1.00 0.00 H new ATOM 0 HB3 LEU B 32 13.349 -10.903 -5.326 1.00 0.00 H new ATOM 0 HG LEU B 32 11.535 -10.033 -6.820 1.00 0.00 H new ATOM 0 HD11 LEU B 32 11.207 -7.587 -7.026 1.00 0.00 H new ATOM 0 HD12 LEU B 32 10.787 -8.156 -5.393 1.00 0.00 H new ATOM 0 HD13 LEU B 32 12.333 -7.320 -5.674 1.00 0.00 H new ATOM 0 HD21 LEU B 32 13.035 -8.722 -8.314 1.00 0.00 H new ATOM 0 HD22 LEU B 32 14.165 -8.479 -6.961 1.00 0.00 H new ATOM 0 HD23 LEU B 32 13.893 -10.113 -7.610 1.00 0.00 H new ATOM 1788 N CYS B 33 11.045 -12.470 -4.661 1.00 0.00 N ATOM 1789 CA CYS B 33 10.118 -13.494 -5.218 1.00 0.00 C ATOM 1790 C CYS B 33 8.781 -13.441 -4.463 1.00 0.00 C ATOM 1791 O CYS B 33 7.727 -13.619 -5.040 1.00 0.00 O ATOM 1792 CB CYS B 33 10.764 -14.887 -5.079 1.00 0.00 C ATOM 1793 SG CYS B 33 10.372 -15.898 -6.533 1.00 0.00 S ATOM 0 H CYS B 33 11.921 -12.836 -4.287 1.00 0.00 H new ATOM 0 HA CYS B 33 9.929 -13.294 -6.273 1.00 0.00 H new ATOM 0 HB2 CYS B 33 11.844 -14.788 -4.975 1.00 0.00 H new ATOM 0 HB3 CYS B 33 10.401 -15.377 -4.176 1.00 0.00 H new ATOM 0 HG CYS B 33 9.250 -16.525 -6.336 1.00 0.00 H new ATOM 1799 N ASN B 34 8.815 -13.194 -3.180 1.00 0.00 N ATOM 1800 CA ASN B 34 7.541 -13.128 -2.405 1.00 0.00 C ATOM 1801 C ASN B 34 6.674 -11.981 -2.935 1.00 0.00 C ATOM 1802 O ASN B 34 5.474 -12.113 -3.071 1.00 0.00 O ATOM 1803 CB ASN B 34 7.855 -12.898 -0.915 1.00 0.00 C ATOM 1804 CG ASN B 34 8.140 -14.236 -0.224 1.00 0.00 C ATOM 1805 OD1 ASN B 34 7.260 -15.066 -0.101 1.00 0.00 O ATOM 1806 ND2 ASN B 34 9.334 -14.484 0.241 1.00 0.00 N ATOM 0 H ASN B 34 9.664 -13.036 -2.638 1.00 0.00 H new ATOM 0 HA ASN B 34 7.000 -14.067 -2.518 1.00 0.00 H new ATOM 0 HB2 ASN B 34 8.716 -12.237 -0.815 1.00 0.00 H new ATOM 0 HB3 ASN B 34 7.014 -12.402 -0.431 1.00 0.00 H new ATOM 0 HD21 ASN B 34 9.526 -15.371 0.706 1.00 0.00 H new ATOM 0 HD22 ASN B 34 10.075 -13.790 0.140 1.00 0.00 H new ATOM 1813 N ILE B 35 7.267 -10.859 -3.234 1.00 0.00 N ATOM 1814 CA ILE B 35 6.467 -9.714 -3.751 1.00 0.00 C ATOM 1815 C ILE B 35 5.827 -10.094 -5.086 1.00 0.00 C ATOM 1816 O ILE B 35 4.648 -9.890 -5.302 1.00 0.00 O ATOM 1817 CB ILE B 35 7.381 -8.506 -3.951 1.00 0.00 C ATOM 1818 CG1 ILE B 35 8.086 -8.185 -2.632 1.00 0.00 C ATOM 1819 CG2 ILE B 35 6.549 -7.300 -4.393 1.00 0.00 C ATOM 1820 CD1 ILE B 35 9.145 -7.106 -2.864 1.00 0.00 C ATOM 0 H ILE B 35 8.268 -10.686 -3.143 1.00 0.00 H new ATOM 0 HA ILE B 35 5.685 -9.466 -3.034 1.00 0.00 H new ATOM 0 HB ILE B 35 8.122 -8.732 -4.718 1.00 0.00 H new ATOM 0 HG12 ILE B 35 7.360 -7.843 -1.894 1.00 0.00 H new ATOM 0 HG13 ILE B 35 8.551 -9.084 -2.229 1.00 0.00 H new ATOM 0 HG21 ILE B 35 7.203 -6.439 -4.535 1.00 0.00 H new ATOM 0 HG22 ILE B 35 6.044 -7.531 -5.331 1.00 0.00 H new ATOM 0 HG23 ILE B 35 5.807 -7.070 -3.628 1.00 0.00 H new ATOM 0 HD11 ILE B 35 9.646 -6.879 -1.923 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.877 -7.465 -3.587 1.00 0.00 H new ATOM 0 HD13 ILE B 35 8.668 -6.204 -3.247 1.00 0.00 H new ATOM 1832 N GLU B 36 6.592 -10.648 -5.984 1.00 0.00 N ATOM 1833 CA GLU B 36 6.026 -11.040 -7.303 1.00 0.00 C ATOM 1834 C GLU B 36 5.054 -12.213 -7.107 1.00 0.00 C ATOM 1835 O GLU B 36 4.084 -12.351 -7.826 1.00 0.00 O ATOM 1836 CB GLU B 36 7.182 -11.436 -8.261 1.00 0.00 C ATOM 1837 CG GLU B 36 7.331 -10.400 -9.385 1.00 0.00 C ATOM 1838 CD GLU B 36 6.077 -10.420 -10.261 1.00 0.00 C ATOM 1839 OE1 GLU B 36 5.677 -11.502 -10.661 1.00 0.00 O ATOM 1840 OE2 GLU B 36 5.534 -9.357 -10.511 1.00 0.00 O ATOM 0 H GLU B 36 7.585 -10.846 -5.861 1.00 0.00 H new ATOM 0 HA GLU B 36 5.481 -10.204 -7.742 1.00 0.00 H new ATOM 0 HB2 GLU B 36 8.115 -11.511 -7.702 1.00 0.00 H new ATOM 0 HB3 GLU B 36 6.986 -12.419 -8.689 1.00 0.00 H new ATOM 0 HG2 GLU B 36 7.477 -9.406 -8.962 1.00 0.00 H new ATOM 0 HG3 GLU B 36 8.212 -10.623 -9.986 1.00 0.00 H new ATOM 1847 N GLN B 37 5.311 -13.066 -6.149 1.00 0.00 N ATOM 1848 CA GLN B 37 4.403 -14.231 -5.927 1.00 0.00 C ATOM 1849 C GLN B 37 3.255 -13.830 -4.999 1.00 0.00 C ATOM 1850 O GLN B 37 2.360 -14.610 -4.737 1.00 0.00 O ATOM 1851 CB GLN B 37 5.193 -15.374 -5.289 1.00 0.00 C ATOM 1852 CG GLN B 37 6.173 -15.942 -6.316 1.00 0.00 C ATOM 1853 CD GLN B 37 6.982 -17.078 -5.687 1.00 0.00 C ATOM 1854 OE1 GLN B 37 8.156 -16.821 -5.182 1.00 0.00 O flip ATOM 1855 NE2 GLN B 37 6.540 -18.210 -5.657 1.00 0.00 N flip ATOM 0 H GLN B 37 6.107 -13.007 -5.513 1.00 0.00 H new ATOM 0 HA GLN B 37 3.994 -14.553 -6.885 1.00 0.00 H new ATOM 0 HB2 GLN B 37 5.733 -15.014 -4.413 1.00 0.00 H new ATOM 0 HB3 GLN B 37 4.514 -16.155 -4.946 1.00 0.00 H new ATOM 0 HG2 GLN B 37 5.630 -16.309 -7.187 1.00 0.00 H new ATOM 0 HG3 GLN B 37 6.843 -15.157 -6.666 1.00 0.00 H new ATOM 0 HE21 GLN B 37 5.621 -18.409 -6.053 1.00 0.00 H new ATOM 0 HE22 GLN B 37 7.088 -18.960 -5.236 1.00 0.00 H new ATOM 1864 N SER B 38 3.261 -12.624 -4.506 1.00 0.00 N ATOM 1865 CA SER B 38 2.155 -12.190 -3.606 1.00 0.00 C ATOM 1866 C SER B 38 2.262 -10.691 -3.338 1.00 0.00 C ATOM 1867 O SER B 38 3.056 -10.246 -2.532 1.00 0.00 O ATOM 1868 CB SER B 38 2.239 -12.947 -2.281 1.00 0.00 C ATOM 1869 OG SER B 38 3.500 -12.695 -1.675 1.00 0.00 O ATOM 0 H SER B 38 3.979 -11.922 -4.685 1.00 0.00 H new ATOM 0 HA SER B 38 1.202 -12.405 -4.088 1.00 0.00 H new ATOM 0 HB2 SER B 38 1.434 -12.632 -1.617 1.00 0.00 H new ATOM 0 HB3 SER B 38 2.111 -14.016 -2.451 1.00 0.00 H new ATOM 0 HG SER B 38 3.991 -12.032 -2.204 1.00 0.00 H new ATOM 1875 N GLU B 39 1.460 -9.906 -4.004 1.00 0.00 N ATOM 1876 CA GLU B 39 1.495 -8.431 -3.791 1.00 0.00 C ATOM 1877 C GLU B 39 0.494 -8.073 -2.694 1.00 0.00 C ATOM 1878 O GLU B 39 -0.696 -7.992 -2.923 1.00 0.00 O ATOM 1879 CB GLU B 39 1.108 -7.726 -5.095 1.00 0.00 C ATOM 1880 CG GLU B 39 2.134 -8.058 -6.193 1.00 0.00 C ATOM 1881 CD GLU B 39 3.342 -7.120 -6.084 1.00 0.00 C ATOM 1882 OE1 GLU B 39 3.695 -6.765 -4.972 1.00 0.00 O ATOM 1883 OE2 GLU B 39 3.891 -6.774 -7.117 1.00 0.00 O ATOM 0 H GLU B 39 0.777 -10.225 -4.691 1.00 0.00 H new ATOM 0 HA GLU B 39 2.495 -8.114 -3.495 1.00 0.00 H new ATOM 0 HB2 GLU B 39 0.113 -8.041 -5.408 1.00 0.00 H new ATOM 0 HB3 GLU B 39 1.066 -6.648 -4.938 1.00 0.00 H new ATOM 0 HG2 GLU B 39 2.458 -9.094 -6.098 1.00 0.00 H new ATOM 0 HG3 GLU B 39 1.673 -7.957 -7.175 1.00 0.00 H new ATOM 1890 N THR B 40 0.967 -7.870 -1.498 1.00 0.00 N ATOM 1891 CA THR B 40 0.044 -7.533 -0.378 1.00 0.00 C ATOM 1892 C THR B 40 -0.548 -6.139 -0.597 1.00 0.00 C ATOM 1893 O THR B 40 0.143 -5.212 -0.971 1.00 0.00 O ATOM 1894 CB THR B 40 0.820 -7.559 0.942 1.00 0.00 C ATOM 1895 OG1 THR B 40 1.707 -6.450 0.993 1.00 0.00 O ATOM 1896 CG2 THR B 40 1.624 -8.857 1.039 1.00 0.00 C ATOM 0 H THR B 40 1.954 -7.923 -1.246 1.00 0.00 H new ATOM 0 HA THR B 40 -0.764 -8.263 -0.342 1.00 0.00 H new ATOM 0 HB THR B 40 0.118 -7.503 1.774 1.00 0.00 H new ATOM 0 HG1 THR B 40 2.202 -6.466 1.839 1.00 0.00 H new ATOM 0 HG21 THR B 40 2.176 -8.874 1.979 1.00 0.00 H new ATOM 0 HG22 THR B 40 0.945 -9.709 1.001 1.00 0.00 H new ATOM 0 HG23 THR B 40 2.325 -8.914 0.206 1.00 0.00 H new ATOM 1904 N ALA B 41 -1.829 -5.990 -0.362 1.00 0.00 N ATOM 1905 CA ALA B 41 -2.499 -4.663 -0.544 1.00 0.00 C ATOM 1906 C ALA B 41 -3.130 -4.227 0.781 1.00 0.00 C ATOM 1907 O ALA B 41 -4.308 -4.427 1.001 1.00 0.00 O ATOM 1908 CB ALA B 41 -3.606 -4.800 -1.583 1.00 0.00 C ATOM 0 H ALA B 41 -2.446 -6.739 -0.048 1.00 0.00 H new ATOM 0 HA ALA B 41 -1.763 -3.927 -0.869 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -4.098 -3.837 -1.720 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -3.177 -5.127 -2.530 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -4.336 -5.535 -1.243 1.00 0.00 H new ATOM 1914 N PRO B 42 -2.362 -3.647 1.665 1.00 0.00 N ATOM 1915 CA PRO B 42 -2.875 -3.193 2.987 1.00 0.00 C ATOM 1916 C PRO B 42 -3.720 -1.913 2.887 1.00 0.00 C ATOM 1917 O PRO B 42 -3.626 -1.161 1.938 1.00 0.00 O ATOM 1918 CB PRO B 42 -1.600 -2.976 3.812 1.00 0.00 C ATOM 1919 CG PRO B 42 -0.544 -2.636 2.807 1.00 0.00 C ATOM 1920 CD PRO B 42 -0.921 -3.358 1.508 1.00 0.00 C ATOM 0 HA PRO B 42 -3.553 -3.918 3.437 1.00 0.00 H new ATOM 0 HB2 PRO B 42 -1.730 -2.172 4.536 1.00 0.00 H new ATOM 0 HB3 PRO B 42 -1.336 -3.872 4.375 1.00 0.00 H new ATOM 0 HG2 PRO B 42 -0.492 -1.559 2.650 1.00 0.00 H new ATOM 0 HG3 PRO B 42 0.438 -2.955 3.155 1.00 0.00 H new ATOM 0 HD2 PRO B 42 -0.732 -2.733 0.635 1.00 0.00 H new ATOM 0 HD3 PRO B 42 -0.342 -4.272 1.377 1.00 0.00 H new ATOM 1928 N VAL B 43 -4.550 -1.676 3.866 1.00 0.00 N ATOM 1929 CA VAL B 43 -5.421 -0.465 3.853 1.00 0.00 C ATOM 1930 C VAL B 43 -4.584 0.788 3.569 1.00 0.00 C ATOM 1931 O VAL B 43 -5.112 1.831 3.241 1.00 0.00 O ATOM 1932 CB VAL B 43 -6.120 -0.323 5.213 1.00 0.00 C ATOM 1933 CG1 VAL B 43 -7.221 -1.377 5.336 1.00 0.00 C ATOM 1934 CG2 VAL B 43 -5.108 -0.522 6.346 1.00 0.00 C ATOM 0 H VAL B 43 -4.663 -2.276 4.683 1.00 0.00 H new ATOM 0 HA VAL B 43 -6.169 -0.573 3.067 1.00 0.00 H new ATOM 0 HB VAL B 43 -6.553 0.675 5.285 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -7.716 -1.275 6.302 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -7.950 -1.237 4.538 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -6.783 -2.372 5.256 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -5.613 -0.420 7.307 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -4.669 -1.517 6.271 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -4.322 0.229 6.267 1.00 0.00 H new ATOM 1944 N VAL B 44 -3.288 0.698 3.690 1.00 0.00 N ATOM 1945 CA VAL B 44 -2.434 1.894 3.422 1.00 0.00 C ATOM 1946 C VAL B 44 -2.636 2.337 1.972 1.00 0.00 C ATOM 1947 O VAL B 44 -2.808 3.506 1.685 1.00 0.00 O ATOM 1948 CB VAL B 44 -0.965 1.525 3.643 1.00 0.00 C ATOM 1949 CG1 VAL B 44 -0.064 2.713 3.290 1.00 0.00 C ATOM 1950 CG2 VAL B 44 -0.757 1.140 5.110 1.00 0.00 C ATOM 0 H VAL B 44 -2.784 -0.146 3.961 1.00 0.00 H new ATOM 0 HA VAL B 44 -2.710 2.705 4.095 1.00 0.00 H new ATOM 0 HB VAL B 44 -0.706 0.683 3.001 1.00 0.00 H new ATOM 0 HG11 VAL B 44 0.979 2.439 3.451 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -0.211 2.983 2.244 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -0.318 3.563 3.923 1.00 0.00 H new ATOM 0 HG21 VAL B 44 0.288 0.876 5.272 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -1.022 1.983 5.748 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -1.389 0.286 5.355 1.00 0.00 H new ATOM 1960 N VAL B 45 -2.621 1.410 1.055 1.00 0.00 N ATOM 1961 CA VAL B 45 -2.817 1.774 -0.375 1.00 0.00 C ATOM 1962 C VAL B 45 -4.202 2.399 -0.540 1.00 0.00 C ATOM 1963 O VAL B 45 -4.374 3.387 -1.225 1.00 0.00 O ATOM 1964 CB VAL B 45 -2.709 0.517 -1.239 1.00 0.00 C ATOM 1965 CG1 VAL B 45 -3.026 0.869 -2.693 1.00 0.00 C ATOM 1966 CG2 VAL B 45 -1.288 -0.042 -1.146 1.00 0.00 C ATOM 0 H VAL B 45 -2.481 0.416 1.235 1.00 0.00 H new ATOM 0 HA VAL B 45 -2.054 2.487 -0.687 1.00 0.00 H new ATOM 0 HB VAL B 45 -3.418 -0.231 -0.885 1.00 0.00 H new ATOM 0 HG11 VAL B 45 -2.949 -0.027 -3.309 1.00 0.00 H new ATOM 0 HG12 VAL B 45 -4.038 1.269 -2.758 1.00 0.00 H new ATOM 0 HG13 VAL B 45 -2.317 1.616 -3.049 1.00 0.00 H new ATOM 0 HG21 VAL B 45 -1.209 -0.938 -1.761 1.00 0.00 H new ATOM 0 HG22 VAL B 45 -0.579 0.706 -1.501 1.00 0.00 H new ATOM 0 HG23 VAL B 45 -1.063 -0.292 -0.109 1.00 0.00 H new ATOM 1976 N LYS B 46 -5.191 1.825 0.087 1.00 0.00 N ATOM 1977 CA LYS B 46 -6.572 2.373 -0.023 1.00 0.00 C ATOM 1978 C LYS B 46 -6.589 3.813 0.503 1.00 0.00 C ATOM 1979 O LYS B 46 -7.270 4.668 -0.029 1.00 0.00 O ATOM 1980 CB LYS B 46 -7.524 1.519 0.822 1.00 0.00 C ATOM 1981 CG LYS B 46 -7.522 0.060 0.342 1.00 0.00 C ATOM 1982 CD LYS B 46 -8.056 -0.032 -1.092 1.00 0.00 C ATOM 1983 CE LYS B 46 -8.463 -1.476 -1.396 1.00 0.00 C ATOM 1984 NZ LYS B 46 -8.979 -1.562 -2.791 1.00 0.00 N ATOM 0 H LYS B 46 -5.101 0.996 0.674 1.00 0.00 H new ATOM 0 HA LYS B 46 -6.889 2.358 -1.066 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -7.225 1.562 1.869 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.534 1.925 0.762 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -6.510 -0.343 0.386 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -8.137 -0.549 1.005 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -8.912 0.632 -1.215 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -7.293 0.298 -1.797 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -7.608 -2.140 -1.271 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -9.228 -1.806 -0.693 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -9.256 -2.543 -2.999 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -9.806 -0.939 -2.894 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -8.236 -1.264 -3.455 1.00 0.00 H new ATOM 1998 N TYR B 47 -5.849 4.089 1.544 1.00 0.00 N ATOM 1999 CA TYR B 47 -5.830 5.474 2.104 1.00 0.00 C ATOM 2000 C TYR B 47 -5.361 6.445 1.011 1.00 0.00 C ATOM 2001 O TYR B 47 -5.969 7.470 0.766 1.00 0.00 O ATOM 2002 CB TYR B 47 -4.844 5.510 3.293 1.00 0.00 C ATOM 2003 CG TYR B 47 -5.273 6.526 4.344 1.00 0.00 C ATOM 2004 CD1 TYR B 47 -5.668 7.822 3.977 1.00 0.00 C ATOM 2005 CD2 TYR B 47 -5.263 6.166 5.698 1.00 0.00 C ATOM 2006 CE1 TYR B 47 -6.049 8.747 4.956 1.00 0.00 C ATOM 2007 CE2 TYR B 47 -5.645 7.093 6.676 1.00 0.00 C ATOM 2008 CZ TYR B 47 -6.039 8.381 6.306 1.00 0.00 C ATOM 2009 OH TYR B 47 -6.415 9.293 7.271 1.00 0.00 O ATOM 0 H TYR B 47 -5.257 3.416 2.031 1.00 0.00 H new ATOM 0 HA TYR B 47 -6.825 5.764 2.443 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -4.782 4.520 3.746 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -3.846 5.758 2.932 1.00 0.00 H new ATOM 0 HD1 TYR B 47 -5.678 8.107 2.935 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -4.960 5.171 5.988 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -6.351 9.743 4.669 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -5.635 6.811 7.719 1.00 0.00 H new ATOM 0 HH TYR B 47 -6.352 8.877 8.156 1.00 0.00 H new ATOM 2019 N ILE B 48 -4.288 6.129 0.345 1.00 0.00 N ATOM 2020 CA ILE B 48 -3.781 7.033 -0.720 1.00 0.00 C ATOM 2021 C ILE B 48 -4.829 7.161 -1.822 1.00 0.00 C ATOM 2022 O ILE B 48 -5.087 8.238 -2.322 1.00 0.00 O ATOM 2023 CB ILE B 48 -2.484 6.466 -1.301 1.00 0.00 C ATOM 2024 CG1 ILE B 48 -1.479 6.242 -0.167 1.00 0.00 C ATOM 2025 CG2 ILE B 48 -1.901 7.455 -2.313 1.00 0.00 C ATOM 2026 CD1 ILE B 48 -0.272 5.462 -0.693 1.00 0.00 C ATOM 0 H ILE B 48 -3.739 5.282 0.493 1.00 0.00 H new ATOM 0 HA ILE B 48 -3.583 8.018 -0.296 1.00 0.00 H new ATOM 0 HB ILE B 48 -2.690 5.519 -1.800 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -1.156 7.200 0.240 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -1.952 5.693 0.648 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -0.977 7.050 -2.726 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -2.618 7.617 -3.118 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -1.692 8.403 -1.817 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.441 5.305 0.117 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.602 4.497 -1.078 1.00 0.00 H new ATOM 0 HD13 ILE B 48 0.206 6.028 -1.493 1.00 0.00 H new ATOM 2038 N ALA B 49 -5.439 6.075 -2.206 1.00 0.00 N ATOM 2039 CA ALA B 49 -6.467 6.150 -3.277 1.00 0.00 C ATOM 2040 C ALA B 49 -7.486 7.240 -2.928 1.00 0.00 C ATOM 2041 O ALA B 49 -7.861 8.046 -3.762 1.00 0.00 O ATOM 2042 CB ALA B 49 -7.180 4.801 -3.396 1.00 0.00 C ATOM 0 H ALA B 49 -5.270 5.144 -1.826 1.00 0.00 H new ATOM 0 HA ALA B 49 -5.988 6.391 -4.226 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -7.934 4.856 -4.181 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -6.454 4.026 -3.643 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -7.661 4.559 -2.448 1.00 0.00 H new ATOM 2048 N PHE B 50 -7.937 7.275 -1.705 1.00 0.00 N ATOM 2049 CA PHE B 50 -8.929 8.312 -1.309 1.00 0.00 C ATOM 2050 C PHE B 50 -8.314 9.697 -1.523 1.00 0.00 C ATOM 2051 O PHE B 50 -8.942 10.594 -2.051 1.00 0.00 O ATOM 2052 CB PHE B 50 -9.296 8.138 0.165 1.00 0.00 C ATOM 2053 CG PHE B 50 -10.515 8.973 0.479 1.00 0.00 C ATOM 2054 CD1 PHE B 50 -11.792 8.437 0.277 1.00 0.00 C ATOM 2055 CD2 PHE B 50 -10.373 10.279 0.965 1.00 0.00 C ATOM 2056 CE1 PHE B 50 -12.927 9.204 0.562 1.00 0.00 C ATOM 2057 CE2 PHE B 50 -11.510 11.046 1.249 1.00 0.00 C ATOM 2058 CZ PHE B 50 -12.787 10.508 1.048 1.00 0.00 C ATOM 0 H PHE B 50 -7.662 6.631 -0.964 1.00 0.00 H new ATOM 0 HA PHE B 50 -9.829 8.209 -1.916 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -9.495 7.088 0.380 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -8.461 8.440 0.797 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -11.901 7.431 -0.099 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -9.388 10.694 1.121 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -13.912 8.789 0.407 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -11.402 12.053 1.623 1.00 0.00 H new ATOM 0 HZ PHE B 50 -13.663 11.100 1.268 1.00 0.00 H new ATOM 2068 N LEU B 51 -7.083 9.875 -1.121 1.00 0.00 N ATOM 2069 CA LEU B 51 -6.419 11.198 -1.299 1.00 0.00 C ATOM 2070 C LEU B 51 -6.327 11.516 -2.796 1.00 0.00 C ATOM 2071 O LEU B 51 -6.484 12.650 -3.210 1.00 0.00 O ATOM 2072 CB LEU B 51 -5.008 11.155 -0.698 1.00 0.00 C ATOM 2073 CG LEU B 51 -5.077 10.910 0.819 1.00 0.00 C ATOM 2074 CD1 LEU B 51 -3.654 10.851 1.390 1.00 0.00 C ATOM 2075 CD2 LEU B 51 -5.867 12.035 1.512 1.00 0.00 C ATOM 0 H LEU B 51 -6.508 9.159 -0.676 1.00 0.00 H new ATOM 0 HA LEU B 51 -7.000 11.968 -0.793 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -4.427 10.365 -1.174 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -4.492 12.094 -0.898 1.00 0.00 H new ATOM 0 HG LEU B 51 -5.587 9.964 1.001 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -3.700 10.677 2.465 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -3.105 10.038 0.915 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -3.145 11.795 1.196 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -5.906 11.845 2.585 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -5.375 12.990 1.330 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -6.881 12.067 1.113 1.00 0.00 H new ATOM 2087 N ARG B 52 -6.069 10.531 -3.613 1.00 0.00 N ATOM 2088 CA ARG B 52 -5.973 10.792 -5.076 1.00 0.00 C ATOM 2089 C ARG B 52 -7.300 11.356 -5.578 1.00 0.00 C ATOM 2090 O ARG B 52 -7.342 12.105 -6.533 1.00 0.00 O ATOM 2091 CB ARG B 52 -5.671 9.498 -5.829 1.00 0.00 C ATOM 2092 CG ARG B 52 -4.265 9.016 -5.483 1.00 0.00 C ATOM 2093 CD ARG B 52 -3.877 7.876 -6.425 1.00 0.00 C ATOM 2094 NE ARG B 52 -4.893 6.794 -6.332 1.00 0.00 N ATOM 2095 CZ ARG B 52 -4.704 5.668 -6.959 1.00 0.00 C ATOM 2096 NH1 ARG B 52 -3.610 5.481 -7.645 1.00 0.00 N ATOM 2097 NH2 ARG B 52 -5.609 4.729 -6.901 1.00 0.00 N ATOM 0 H ARG B 52 -5.921 9.562 -3.332 1.00 0.00 H new ATOM 0 HA ARG B 52 -5.168 11.506 -5.252 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -6.403 8.734 -5.566 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -5.755 9.663 -6.903 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -3.554 9.837 -5.574 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -4.229 8.676 -4.448 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -3.812 8.242 -7.450 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -2.893 7.490 -6.161 1.00 0.00 H new ATOM 0 HE ARG B 52 -5.738 6.934 -5.777 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -2.904 6.216 -7.690 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -3.461 4.600 -8.136 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -6.464 4.877 -6.365 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -5.461 3.847 -7.392 1.00 0.00 H new ATOM 2111 N SER B 53 -8.391 10.997 -4.956 1.00 0.00 N ATOM 2112 CA SER B 53 -9.703 11.521 -5.426 1.00 0.00 C ATOM 2113 C SER B 53 -9.629 13.048 -5.496 1.00 0.00 C ATOM 2114 O SER B 53 -10.226 13.666 -6.355 1.00 0.00 O ATOM 2115 CB SER B 53 -10.807 11.112 -4.449 1.00 0.00 C ATOM 2116 OG SER B 53 -10.618 11.794 -3.218 1.00 0.00 O ATOM 0 H SER B 53 -8.430 10.371 -4.152 1.00 0.00 H new ATOM 0 HA SER B 53 -9.928 11.111 -6.410 1.00 0.00 H new ATOM 0 HB2 SER B 53 -11.785 11.353 -4.865 1.00 0.00 H new ATOM 0 HB3 SER B 53 -10.786 10.034 -4.288 1.00 0.00 H new ATOM 0 HG SER B 53 -9.721 11.602 -2.872 1.00 0.00 H new ATOM 2122 N LYS B 54 -8.890 13.665 -4.607 1.00 0.00 N ATOM 2123 CA LYS B 54 -8.767 15.155 -4.633 1.00 0.00 C ATOM 2124 C LYS B 54 -7.505 15.549 -5.404 1.00 0.00 C ATOM 2125 O LYS B 54 -7.231 16.716 -5.609 1.00 0.00 O ATOM 2126 CB LYS B 54 -8.671 15.685 -3.203 1.00 0.00 C ATOM 2127 CG LYS B 54 -10.006 15.469 -2.493 1.00 0.00 C ATOM 2128 CD LYS B 54 -9.902 15.968 -1.053 1.00 0.00 C ATOM 2129 CE LYS B 54 -11.235 15.738 -0.340 1.00 0.00 C ATOM 2130 NZ LYS B 54 -12.318 16.447 -1.077 1.00 0.00 N ATOM 0 H LYS B 54 -8.367 13.201 -3.865 1.00 0.00 H new ATOM 0 HA LYS B 54 -9.643 15.582 -5.122 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -7.873 15.172 -2.666 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -8.418 16.745 -3.212 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -10.800 16.001 -3.017 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -10.270 14.411 -2.505 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -9.102 15.443 -0.531 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -9.648 17.028 -1.041 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -11.453 14.671 -0.288 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -11.179 16.102 0.686 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -13.134 16.585 -0.447 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -11.970 17.372 -1.400 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -12.608 15.879 -1.899 1.00 0.00 H new ATOM 2144 N GLY B 55 -6.739 14.587 -5.845 1.00 0.00 N ATOM 2145 CA GLY B 55 -5.504 14.913 -6.615 1.00 0.00 C ATOM 2146 C GLY B 55 -4.400 15.392 -5.668 1.00 0.00 C ATOM 2147 O GLY B 55 -3.684 16.326 -5.966 1.00 0.00 O ATOM 0 H GLY B 55 -6.915 13.592 -5.706 1.00 0.00 H new ATOM 0 HA2 GLY B 55 -5.166 14.034 -7.164 1.00 0.00 H new ATOM 0 HA3 GLY B 55 -5.720 15.685 -7.353 1.00 0.00 H new ATOM 2151 N VAL B 56 -4.255 14.768 -4.530 1.00 0.00 N ATOM 2152 CA VAL B 56 -3.192 15.205 -3.577 1.00 0.00 C ATOM 2153 C VAL B 56 -1.809 14.947 -4.189 1.00 0.00 C ATOM 2154 O VAL B 56 -1.551 13.900 -4.751 1.00 0.00 O ATOM 2155 CB VAL B 56 -3.339 14.435 -2.263 1.00 0.00 C ATOM 2156 CG1 VAL B 56 -2.151 14.740 -1.343 1.00 0.00 C ATOM 2157 CG2 VAL B 56 -4.635 14.872 -1.578 1.00 0.00 C ATOM 0 H VAL B 56 -4.822 13.979 -4.220 1.00 0.00 H new ATOM 0 HA VAL B 56 -3.295 16.272 -3.380 1.00 0.00 H new ATOM 0 HB VAL B 56 -3.365 13.365 -2.468 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -2.263 14.188 -0.410 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -1.225 14.440 -1.833 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -2.120 15.809 -1.131 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -4.751 14.330 -0.640 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -4.597 15.942 -1.376 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -5.482 14.656 -2.229 1.00 0.00 H new ATOM 2167 N ASP B 57 -0.926 15.907 -4.094 1.00 0.00 N ATOM 2168 CA ASP B 57 0.440 15.744 -4.677 1.00 0.00 C ATOM 2169 C ASP B 57 1.073 14.444 -4.180 1.00 0.00 C ATOM 2170 O ASP B 57 1.801 14.425 -3.208 1.00 0.00 O ATOM 2171 CB ASP B 57 1.314 16.929 -4.256 1.00 0.00 C ATOM 2172 CG ASP B 57 1.428 16.969 -2.730 1.00 0.00 C ATOM 2173 OD1 ASP B 57 0.397 16.952 -2.076 1.00 0.00 O ATOM 2174 OD2 ASP B 57 2.544 17.013 -2.240 1.00 0.00 O ATOM 0 H ASP B 57 -1.093 16.802 -3.635 1.00 0.00 H new ATOM 0 HA ASP B 57 0.363 15.708 -5.764 1.00 0.00 H new ATOM 0 HB2 ASP B 57 2.304 16.839 -4.702 1.00 0.00 H new ATOM 0 HB3 ASP B 57 0.882 17.860 -4.623 1.00 0.00 H new ATOM 2179 N LEU B 58 0.811 13.355 -4.847 1.00 0.00 N ATOM 2180 CA LEU B 58 1.406 12.054 -4.422 1.00 0.00 C ATOM 2181 C LEU B 58 2.742 11.846 -5.138 1.00 0.00 C ATOM 2182 O LEU B 58 3.622 11.170 -4.644 1.00 0.00 O ATOM 2183 CB LEU B 58 0.438 10.916 -4.788 1.00 0.00 C ATOM 2184 CG LEU B 58 0.379 10.720 -6.331 1.00 0.00 C ATOM 2185 CD1 LEU B 58 1.286 9.551 -6.761 1.00 0.00 C ATOM 2186 CD2 LEU B 58 -1.061 10.418 -6.768 1.00 0.00 C ATOM 0 H LEU B 58 0.210 13.308 -5.670 1.00 0.00 H new ATOM 0 HA LEU B 58 1.574 12.058 -3.345 1.00 0.00 H new ATOM 0 HB2 LEU B 58 0.760 9.990 -4.311 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -0.558 11.142 -4.407 1.00 0.00 H new ATOM 0 HG LEU B 58 0.724 11.639 -6.805 1.00 0.00 H new ATOM 0 HD11 LEU B 58 1.233 9.428 -7.843 1.00 0.00 H new ATOM 0 HD12 LEU B 58 2.315 9.763 -6.470 1.00 0.00 H new ATOM 0 HD13 LEU B 58 0.953 8.634 -6.275 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -1.092 10.282 -7.849 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -1.407 9.508 -6.278 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -1.708 11.249 -6.488 1.00 0.00 H new ATOM 2198 N ASN B 59 2.896 12.413 -6.305 1.00 0.00 N ATOM 2199 CA ASN B 59 4.169 12.237 -7.059 1.00 0.00 C ATOM 2200 C ASN B 59 5.327 12.860 -6.279 1.00 0.00 C ATOM 2201 O ASN B 59 6.385 12.276 -6.147 1.00 0.00 O ATOM 2202 CB ASN B 59 4.040 12.934 -8.413 1.00 0.00 C ATOM 2203 CG ASN B 59 2.990 12.213 -9.262 1.00 0.00 C ATOM 2204 OD1 ASN B 59 3.160 11.063 -9.613 1.00 0.00 O ATOM 2205 ND2 ASN B 59 1.903 12.848 -9.609 1.00 0.00 N ATOM 0 H ASN B 59 2.194 12.991 -6.768 1.00 0.00 H new ATOM 0 HA ASN B 59 4.365 11.174 -7.200 1.00 0.00 H new ATOM 0 HB2 ASN B 59 3.755 13.976 -8.271 1.00 0.00 H new ATOM 0 HB3 ASN B 59 5.001 12.933 -8.927 1.00 0.00 H new ATOM 0 HD21 ASN B 59 1.196 12.378 -10.175 1.00 0.00 H new ATOM 0 HD22 ASN B 59 1.760 13.814 -9.314 1.00 0.00 H new ATOM 2212 N ALA B 60 5.135 14.041 -5.757 1.00 0.00 N ATOM 2213 CA ALA B 60 6.222 14.701 -4.983 1.00 0.00 C ATOM 2214 C ALA B 60 6.422 13.972 -3.653 1.00 0.00 C ATOM 2215 O ALA B 60 7.531 13.810 -3.183 1.00 0.00 O ATOM 2216 CB ALA B 60 5.848 16.159 -4.717 1.00 0.00 C ATOM 0 H ALA B 60 4.271 14.577 -5.834 1.00 0.00 H new ATOM 0 HA ALA B 60 7.148 14.664 -5.557 1.00 0.00 H new ATOM 0 HB1 ALA B 60 6.644 16.641 -4.150 1.00 0.00 H new ATOM 0 HB2 ALA B 60 5.712 16.679 -5.665 1.00 0.00 H new ATOM 0 HB3 ALA B 60 4.921 16.198 -4.145 1.00 0.00 H new ATOM 2222 N LEU B 61 5.355 13.535 -3.040 1.00 0.00 N ATOM 2223 CA LEU B 61 5.482 12.823 -1.737 1.00 0.00 C ATOM 2224 C LEU B 61 6.295 11.540 -1.930 1.00 0.00 C ATOM 2225 O LEU B 61 7.180 11.231 -1.157 1.00 0.00 O ATOM 2226 CB LEU B 61 4.072 12.490 -1.219 1.00 0.00 C ATOM 2227 CG LEU B 61 4.143 11.624 0.072 1.00 0.00 C ATOM 2228 CD1 LEU B 61 3.084 12.090 1.083 1.00 0.00 C ATOM 2229 CD2 LEU B 61 3.873 10.149 -0.268 1.00 0.00 C ATOM 0 H LEU B 61 4.401 13.641 -3.386 1.00 0.00 H new ATOM 0 HA LEU B 61 5.996 13.453 -1.012 1.00 0.00 H new ATOM 0 HB2 LEU B 61 3.529 13.412 -1.013 1.00 0.00 H new ATOM 0 HB3 LEU B 61 3.514 11.957 -1.989 1.00 0.00 H new ATOM 0 HG LEU B 61 5.139 11.733 0.502 1.00 0.00 H new ATOM 0 HD11 LEU B 61 3.144 11.476 1.982 1.00 0.00 H new ATOM 0 HD12 LEU B 61 3.264 13.133 1.343 1.00 0.00 H new ATOM 0 HD13 LEU B 61 2.092 11.992 0.642 1.00 0.00 H new ATOM 0 HD21 LEU B 61 3.925 9.551 0.642 1.00 0.00 H new ATOM 0 HD22 LEU B 61 2.881 10.053 -0.710 1.00 0.00 H new ATOM 0 HD23 LEU B 61 4.622 9.796 -0.977 1.00 0.00 H new ATOM 2241 N PHE B 62 6.013 10.798 -2.966 1.00 0.00 N ATOM 2242 CA PHE B 62 6.781 9.546 -3.220 1.00 0.00 C ATOM 2243 C PHE B 62 8.229 9.882 -3.620 1.00 0.00 C ATOM 2244 O PHE B 62 9.154 9.192 -3.248 1.00 0.00 O ATOM 2245 CB PHE B 62 6.090 8.743 -4.348 1.00 0.00 C ATOM 2246 CG PHE B 62 5.199 7.665 -3.766 1.00 0.00 C ATOM 2247 CD1 PHE B 62 3.920 7.981 -3.287 1.00 0.00 C ATOM 2248 CD2 PHE B 62 5.662 6.347 -3.703 1.00 0.00 C ATOM 2249 CE1 PHE B 62 3.109 6.973 -2.749 1.00 0.00 C ATOM 2250 CE2 PHE B 62 4.853 5.343 -3.167 1.00 0.00 C ATOM 2251 CZ PHE B 62 3.576 5.655 -2.688 1.00 0.00 C ATOM 0 H PHE B 62 5.283 11.005 -3.648 1.00 0.00 H new ATOM 0 HA PHE B 62 6.804 8.946 -2.310 1.00 0.00 H new ATOM 0 HB2 PHE B 62 5.498 9.415 -4.970 1.00 0.00 H new ATOM 0 HB3 PHE B 62 6.843 8.291 -4.994 1.00 0.00 H new ATOM 0 HD1 PHE B 62 3.561 8.998 -3.333 1.00 0.00 H new ATOM 0 HD2 PHE B 62 6.648 6.105 -4.070 1.00 0.00 H new ATOM 0 HE1 PHE B 62 2.122 7.213 -2.381 1.00 0.00 H new ATOM 0 HE2 PHE B 62 5.213 4.326 -3.122 1.00 0.00 H new ATOM 0 HZ PHE B 62 2.951 4.879 -2.271 1.00 0.00 H new ATOM 2261 N ASP B 63 8.431 10.914 -4.393 1.00 0.00 N ATOM 2262 CA ASP B 63 9.818 11.251 -4.839 1.00 0.00 C ATOM 2263 C ASP B 63 10.743 11.447 -3.630 1.00 0.00 C ATOM 2264 O ASP B 63 11.832 10.912 -3.582 1.00 0.00 O ATOM 2265 CB ASP B 63 9.777 12.538 -5.668 1.00 0.00 C ATOM 2266 CG ASP B 63 9.089 12.257 -7.006 1.00 0.00 C ATOM 2267 OD1 ASP B 63 8.881 11.093 -7.309 1.00 0.00 O ATOM 2268 OD2 ASP B 63 8.773 13.210 -7.699 1.00 0.00 O ATOM 0 H ASP B 63 7.700 11.538 -4.735 1.00 0.00 H new ATOM 0 HA ASP B 63 10.207 10.430 -5.441 1.00 0.00 H new ATOM 0 HB2 ASP B 63 9.239 13.316 -5.126 1.00 0.00 H new ATOM 0 HB3 ASP B 63 10.788 12.908 -5.837 1.00 0.00 H new ATOM 2273 N ARG B 64 10.325 12.205 -2.658 1.00 0.00 N ATOM 2274 CA ARG B 64 11.183 12.432 -1.457 1.00 0.00 C ATOM 2275 C ARG B 64 11.371 11.128 -0.673 1.00 0.00 C ATOM 2276 O ARG B 64 12.430 10.862 -0.141 1.00 0.00 O ATOM 2277 CB ARG B 64 10.509 13.485 -0.571 1.00 0.00 C ATOM 2278 CG ARG B 64 10.616 14.862 -1.252 1.00 0.00 C ATOM 2279 CD ARG B 64 9.491 15.785 -0.772 1.00 0.00 C ATOM 2280 NE ARG B 64 9.543 17.058 -1.547 1.00 0.00 N ATOM 2281 CZ ARG B 64 9.183 17.068 -2.804 1.00 0.00 C ATOM 2282 NH1 ARG B 64 8.833 15.958 -3.394 1.00 0.00 N ATOM 2283 NH2 ARG B 64 9.187 18.185 -3.477 1.00 0.00 N ATOM 0 H ARG B 64 9.423 12.681 -2.640 1.00 0.00 H new ATOM 0 HA ARG B 64 12.167 12.780 -1.772 1.00 0.00 H new ATOM 0 HB2 ARG B 64 9.463 13.226 -0.409 1.00 0.00 H new ATOM 0 HB3 ARG B 64 10.986 13.512 0.409 1.00 0.00 H new ATOM 0 HG2 ARG B 64 11.584 15.311 -1.028 1.00 0.00 H new ATOM 0 HG3 ARG B 64 10.562 14.745 -2.334 1.00 0.00 H new ATOM 0 HD2 ARG B 64 8.524 15.301 -0.907 1.00 0.00 H new ATOM 0 HD3 ARG B 64 9.600 15.988 0.293 1.00 0.00 H new ATOM 0 HE ARG B 64 9.858 17.918 -1.098 1.00 0.00 H new ATOM 0 HH11 ARG B 64 8.840 15.080 -2.875 1.00 0.00 H new ATOM 0 HH12 ARG B 64 8.553 15.968 -4.375 1.00 0.00 H new ATOM 0 HH21 ARG B 64 9.471 19.053 -3.023 1.00 0.00 H new ATOM 0 HH22 ARG B 64 8.906 18.191 -4.457 1.00 0.00 H new ATOM 2297 N ILE B 65 10.349 10.323 -0.579 1.00 0.00 N ATOM 2298 CA ILE B 65 10.463 9.050 0.191 1.00 0.00 C ATOM 2299 C ILE B 65 11.489 8.105 -0.450 1.00 0.00 C ATOM 2300 O ILE B 65 12.268 7.481 0.242 1.00 0.00 O ATOM 2301 CB ILE B 65 9.094 8.368 0.247 1.00 0.00 C ATOM 2302 CG1 ILE B 65 8.152 9.216 1.104 1.00 0.00 C ATOM 2303 CG2 ILE B 65 9.231 6.974 0.872 1.00 0.00 C ATOM 2304 CD1 ILE B 65 6.720 8.705 0.958 1.00 0.00 C ATOM 0 H ILE B 65 9.437 10.491 -1.003 1.00 0.00 H new ATOM 0 HA ILE B 65 10.803 9.284 1.200 1.00 0.00 H new ATOM 0 HB ILE B 65 8.695 8.269 -0.762 1.00 0.00 H new ATOM 0 HG12 ILE B 65 8.459 9.173 2.149 1.00 0.00 H new ATOM 0 HG13 ILE B 65 8.208 10.261 0.798 1.00 0.00 H new ATOM 0 HG21 ILE B 65 8.253 6.494 0.909 1.00 0.00 H new ATOM 0 HG22 ILE B 65 9.909 6.370 0.269 1.00 0.00 H new ATOM 0 HG23 ILE B 65 9.628 7.066 1.883 1.00 0.00 H new ATOM 0 HD11 ILE B 65 6.053 9.312 1.570 1.00 0.00 H new ATOM 0 HD12 ILE B 65 6.415 8.771 -0.086 1.00 0.00 H new ATOM 0 HD13 ILE B 65 6.669 7.667 1.286 1.00 0.00 H new