USER MOD reduce.3.24.130724 H: found=0, std=0, add=1130, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1126 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 81 THR OG1 : rot 41:sc= 1.16 USER MOD Set 1.2: A 86 HIS : no HE2:sc= 0.0168 K(o=1.2,f=-0.78!) USER MOD Set 2.1: A 12 ASN : amide:sc= -0.613! C(o=-0.027!,f=-6.4!) USER MOD Set 2.2: A 34 SER OG : rot -83:sc= 1.17 USER MOD Set 2.3: A 63 HIS : no HE2:sc= -0.585 K(o=-0.027,f=-1.1) USER MOD Set 3.1: A 9 CYS SG : rot -72:sc= 0.387 USER MOD Set 3.2: A 16 SER OG : rot -178:sc= 1.95 USER MOD Single : A 3 ASN : amide:sc= 0 X(o=0,f=-0.0028) USER MOD Single : A 4 ASN : amide:sc= -0.575 K(o=-0.58,f=-3.7!) USER MOD Single : A 14 CYS SG : rot 180:sc= -0.0449 USER MOD Single : A 18 THR OG1 : rot 92:sc= 1.21 USER MOD Single : A 24 GLN : amide:sc= 0.283 K(o=0.28,f=-2.3) USER MOD Single : A 26 TYR OH : rot 165:sc= 0 USER MOD Single : A 27 HIS : no HE2:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 31 LYS NZ :NH3+ -140:sc= 1.24 (180deg=0.157) USER MOD Single : A 43 LYS NZ :NH3+ -134:sc= 0.996 (180deg=-0.363) USER MOD Single : A 48 THR OG1 : rot 82:sc= 1.61 USER MOD Single : A 51 SER OG : rot -7:sc=-0.00165 USER MOD Single : A 56 HIS : no HD1:sc= -0.207 X(o=-0.21,f=0) USER MOD Single : A 57 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 CYS SG : rot 180:sc= -0.119 USER MOD Single : A 67 GLN : amide:sc= 1.36 K(o=1.4,f=-3.3!) USER MOD Single : A 69 SER OG : rot 180:sc= 0.286 USER MOD Single : A 73 CYS SG : rot 72:sc= 0.542 USER MOD Single : A 75 ASN : amide:sc= 1.23 K(o=1.2,f=-0.014) USER MOD Single : A 76 TYR OH : rot -170:sc= 1.25 USER MOD Single : A 82 MET CE :methyl -155:sc= -0.0543 (180deg=-0.839) USER MOD Single : A 84 LYS NZ :NH3+ -175:sc= 2.15 (180deg=2.05) USER MOD Single : A 91 CYS SG : rot 73:sc= 0.31 USER MOD Single : A 93 MET CE :methyl -172:sc= 0 (180deg=-0.0661) USER MOD Single : A 97 MET CE :methyl 172:sc= -0.016 (180deg=-0.0495) USER MOD Single : A 100 LYS NZ :NH3+ -175:sc= 1.25 (180deg=1.19) USER MOD Single : A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 HIS : no HE2:sc= 1.04 K(o=1,f=-3.1!) USER MOD Single : A 109 ASN : amide:sc= -0.172 X(o=-0.17,f=-0.16) USER MOD Single : A 111 CYS SG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 178:sc= 1.14 (180deg=1.14) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 81:sc= 0.909 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot 80:sc= 1.22 USER MOD Single : A 134 SER OG : rot 74:sc= 1.27 USER MOD Single : A 137 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 140 GLN : amide:sc= -0.385 K(o=-0.38,f=-4.1!) USER MOD ----------------------------------------------------------------- ATOM 18 N PHE A 2 -4.946 8.770 -11.200 1.00 0.00 N ATOM 19 CA PHE A 2 -5.059 7.347 -11.555 1.00 0.00 C ATOM 20 C PHE A 2 -6.479 6.807 -11.312 1.00 0.00 C ATOM 21 O PHE A 2 -6.869 5.813 -11.922 1.00 0.00 O ATOM 22 CB PHE A 2 -4.051 6.512 -10.746 1.00 0.00 C ATOM 23 CG PHE A 2 -2.598 6.936 -10.873 1.00 0.00 C ATOM 24 CD1 PHE A 2 -1.940 6.843 -12.115 1.00 0.00 C ATOM 25 CD2 PHE A 2 -1.890 7.397 -9.743 1.00 0.00 C ATOM 26 CE1 PHE A 2 -0.588 7.214 -12.229 1.00 0.00 C ATOM 27 CE2 PHE A 2 -0.535 7.759 -9.858 1.00 0.00 C ATOM 28 CZ PHE A 2 0.115 7.672 -11.101 1.00 0.00 C ATOM 0 HA PHE A 2 -4.839 7.262 -12.619 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -4.333 6.554 -9.694 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.136 5.471 -11.057 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -2.475 6.486 -12.982 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -2.389 7.472 -8.788 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -0.089 7.147 -13.185 1.00 0.00 H new ATOM 0 HE2 PHE A 2 0.006 8.104 -8.990 1.00 0.00 H new ATOM 0 HZ PHE A 2 1.153 7.957 -11.190 1.00 0.00 H new ATOM 38 N ASN A 3 -7.242 7.468 -10.427 1.00 0.00 N ATOM 39 CA ASN A 3 -8.633 7.222 -10.028 1.00 0.00 C ATOM 40 C ASN A 3 -8.832 5.934 -9.229 1.00 0.00 C ATOM 41 O ASN A 3 -9.482 5.988 -8.187 1.00 0.00 O ATOM 42 CB ASN A 3 -9.602 7.295 -11.219 1.00 0.00 C ATOM 43 CG ASN A 3 -11.040 7.056 -10.762 1.00 0.00 C ATOM 44 OD1 ASN A 3 -11.564 5.952 -10.875 1.00 0.00 O ATOM 45 ND2 ASN A 3 -11.704 8.072 -10.235 1.00 0.00 N ATOM 0 H ASN A 3 -6.859 8.268 -9.924 1.00 0.00 H new ATOM 0 HA ASN A 3 -8.876 8.038 -9.347 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -9.525 8.271 -11.697 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -9.324 6.551 -11.966 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -12.664 7.943 -9.916 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -11.255 8.984 -10.147 1.00 0.00 H new ATOM 52 N ASN A 4 -8.258 4.816 -9.677 1.00 0.00 N ATOM 53 CA ASN A 4 -8.520 3.497 -9.112 1.00 0.00 C ATOM 54 C ASN A 4 -7.179 2.793 -8.917 1.00 0.00 C ATOM 55 O ASN A 4 -6.505 2.486 -9.902 1.00 0.00 O ATOM 56 CB ASN A 4 -9.446 2.720 -10.063 1.00 0.00 C ATOM 57 CG ASN A 4 -9.874 1.393 -9.457 1.00 0.00 C ATOM 58 OD1 ASN A 4 -10.110 1.307 -8.261 1.00 0.00 O ATOM 59 ND2 ASN A 4 -9.987 0.338 -10.244 1.00 0.00 N ATOM 0 H ASN A 4 -7.592 4.804 -10.450 1.00 0.00 H new ATOM 0 HA ASN A 4 -9.021 3.565 -8.146 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -10.327 3.321 -10.287 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -8.933 2.542 -11.008 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -10.274 -0.560 -9.855 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -9.787 0.422 -11.241 1.00 0.00 H new ATOM 66 N ILE A 5 -6.789 2.562 -7.661 1.00 0.00 N ATOM 67 CA ILE A 5 -5.439 2.116 -7.299 1.00 0.00 C ATOM 68 C ILE A 5 -5.540 0.894 -6.379 1.00 0.00 C ATOM 69 O ILE A 5 -6.519 0.741 -5.646 1.00 0.00 O ATOM 70 CB ILE A 5 -4.713 3.298 -6.591 1.00 0.00 C ATOM 71 CG1 ILE A 5 -4.679 4.566 -7.483 1.00 0.00 C ATOM 72 CG2 ILE A 5 -3.294 2.958 -6.079 1.00 0.00 C ATOM 73 CD1 ILE A 5 -4.107 5.802 -6.786 1.00 0.00 C ATOM 0 H ILE A 5 -7.407 2.680 -6.858 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.871 1.825 -8.182 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.314 3.502 -5.705 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -4.085 4.356 -8.373 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -5.692 4.788 -7.820 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -2.860 3.836 -5.600 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -3.353 2.143 -5.358 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -2.667 2.656 -6.918 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -4.117 6.646 -7.476 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -4.713 6.040 -5.912 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -3.082 5.602 -6.473 1.00 0.00 H new ATOM 85 N LEU A 6 -4.494 0.065 -6.360 1.00 0.00 N ATOM 86 CA LEU A 6 -4.360 -1.020 -5.392 1.00 0.00 C ATOM 87 C LEU A 6 -2.984 -0.921 -4.746 1.00 0.00 C ATOM 88 O LEU A 6 -2.009 -0.587 -5.422 1.00 0.00 O ATOM 89 CB LEU A 6 -4.527 -2.370 -6.108 1.00 0.00 C ATOM 90 CG LEU A 6 -4.679 -3.596 -5.186 1.00 0.00 C ATOM 91 CD1 LEU A 6 -6.041 -3.637 -4.488 1.00 0.00 C ATOM 92 CD2 LEU A 6 -4.533 -4.873 -6.019 1.00 0.00 C ATOM 0 H LEU A 6 -3.716 0.129 -7.017 1.00 0.00 H new ATOM 0 HA LEU A 6 -5.128 -0.943 -4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -5.403 -2.313 -6.755 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -3.664 -2.528 -6.754 1.00 0.00 H new ATOM 0 HG LEU A 6 -3.905 -3.523 -4.422 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -6.097 -4.520 -3.851 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -6.165 -2.741 -3.879 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -6.832 -3.679 -5.236 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -4.640 -5.744 -5.372 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -5.305 -4.896 -6.788 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -3.550 -4.890 -6.490 1.00 0.00 H new ATOM 104 N VAL A 7 -2.890 -1.260 -3.463 1.00 0.00 N ATOM 105 CA VAL A 7 -1.611 -1.405 -2.779 1.00 0.00 C ATOM 106 C VAL A 7 -1.503 -2.852 -2.291 1.00 0.00 C ATOM 107 O VAL A 7 -2.492 -3.426 -1.826 1.00 0.00 O ATOM 108 CB VAL A 7 -1.433 -0.293 -1.729 1.00 0.00 C ATOM 109 CG1 VAL A 7 -2.572 -0.205 -0.706 1.00 0.00 C ATOM 110 CG2 VAL A 7 -0.085 -0.433 -1.017 1.00 0.00 C ATOM 0 H VAL A 7 -3.699 -1.442 -2.869 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.755 -1.252 -3.437 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.460 0.643 -2.286 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.368 0.603 -0.003 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -3.511 -0.008 -1.223 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -2.647 -1.147 -0.163 1.00 0.00 H new ATOM 0 HG21 VAL A 7 0.021 0.362 -0.279 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.036 -1.400 -0.517 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.721 -0.361 -1.747 1.00 0.00 H new ATOM 120 N VAL A 8 -0.314 -3.447 -2.424 1.00 0.00 N ATOM 121 CA VAL A 8 -0.123 -4.881 -2.228 1.00 0.00 C ATOM 122 C VAL A 8 1.142 -5.125 -1.398 1.00 0.00 C ATOM 123 O VAL A 8 2.152 -4.462 -1.633 1.00 0.00 O ATOM 124 CB VAL A 8 -0.019 -5.556 -3.622 1.00 0.00 C ATOM 125 CG1 VAL A 8 -0.142 -7.084 -3.522 1.00 0.00 C ATOM 126 CG2 VAL A 8 -1.083 -5.079 -4.630 1.00 0.00 C ATOM 0 H VAL A 8 0.540 -2.946 -2.670 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.965 -5.310 -1.685 1.00 0.00 H new ATOM 0 HB VAL A 8 0.966 -5.262 -3.985 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.064 -7.521 -4.517 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.658 -7.473 -2.892 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -1.107 -7.344 -3.086 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.943 -5.597 -5.579 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.077 -5.298 -4.240 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.982 -4.005 -4.785 1.00 0.00 H new ATOM 136 N CYS A 9 1.144 -6.095 -0.476 1.00 0.00 N ATOM 137 CA CYS A 9 2.380 -6.525 0.195 1.00 0.00 C ATOM 138 C CYS A 9 2.326 -7.993 0.628 1.00 0.00 C ATOM 139 O CYS A 9 1.304 -8.653 0.446 1.00 0.00 O ATOM 140 CB CYS A 9 2.673 -5.595 1.383 1.00 0.00 C ATOM 141 SG CYS A 9 1.465 -5.807 2.722 1.00 0.00 S ATOM 0 H CYS A 9 0.308 -6.596 -0.177 1.00 0.00 H new ATOM 0 HA CYS A 9 3.198 -6.452 -0.521 1.00 0.00 H new ATOM 0 HB2 CYS A 9 3.675 -5.796 1.763 1.00 0.00 H new ATOM 0 HB3 CYS A 9 2.662 -4.559 1.045 1.00 0.00 H new ATOM 0 HG CYS A 9 0.324 -5.298 2.362 1.00 0.00 H new ATOM 147 N VAL A 10 3.410 -8.526 1.197 1.00 0.00 N ATOM 148 CA VAL A 10 3.330 -9.836 1.843 1.00 0.00 C ATOM 149 C VAL A 10 2.696 -9.590 3.220 1.00 0.00 C ATOM 150 O VAL A 10 2.989 -8.572 3.859 1.00 0.00 O ATOM 151 CB VAL A 10 4.701 -10.549 1.866 1.00 0.00 C ATOM 152 CG1 VAL A 10 5.772 -9.859 2.721 1.00 0.00 C ATOM 153 CG2 VAL A 10 4.556 -12.010 2.316 1.00 0.00 C ATOM 0 H VAL A 10 4.329 -8.085 1.224 1.00 0.00 H new ATOM 0 HA VAL A 10 2.706 -10.537 1.289 1.00 0.00 H new ATOM 0 HB VAL A 10 5.051 -10.499 0.835 1.00 0.00 H new ATOM 0 HG11 VAL A 10 6.698 -10.432 2.676 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.948 -8.853 2.341 1.00 0.00 H new ATOM 0 HG13 VAL A 10 5.431 -9.802 3.755 1.00 0.00 H new ATOM 0 HG21 VAL A 10 5.536 -12.488 2.323 1.00 0.00 H new ATOM 0 HG22 VAL A 10 4.130 -12.041 3.319 1.00 0.00 H new ATOM 0 HG23 VAL A 10 3.899 -12.540 1.626 1.00 0.00 H new ATOM 163 N GLY A 11 1.799 -10.485 3.645 1.00 0.00 N ATOM 164 CA GLY A 11 1.064 -10.360 4.901 1.00 0.00 C ATOM 165 C GLY A 11 -0.276 -9.653 4.707 1.00 0.00 C ATOM 166 O GLY A 11 -1.277 -10.122 5.242 1.00 0.00 O ATOM 0 H GLY A 11 1.562 -11.326 3.118 1.00 0.00 H new ATOM 0 HA2 GLY A 11 0.894 -11.351 5.323 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.666 -9.806 5.621 1.00 0.00 H new ATOM 170 N ASN A 12 -0.302 -8.585 3.895 1.00 0.00 N ATOM 171 CA ASN A 12 -1.494 -7.781 3.559 1.00 0.00 C ATOM 172 C ASN A 12 -2.082 -6.997 4.732 1.00 0.00 C ATOM 173 O ASN A 12 -2.246 -5.788 4.604 1.00 0.00 O ATOM 174 CB ASN A 12 -2.606 -8.642 2.918 1.00 0.00 C ATOM 175 CG ASN A 12 -3.817 -7.900 2.344 1.00 0.00 C ATOM 176 OD1 ASN A 12 -4.619 -8.515 1.655 1.00 0.00 O ATOM 177 ND2 ASN A 12 -4.037 -6.619 2.575 1.00 0.00 N ATOM 0 H ASN A 12 0.540 -8.241 3.434 1.00 0.00 H new ATOM 0 HA ASN A 12 -1.126 -7.050 2.839 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -2.159 -9.231 2.117 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -2.965 -9.346 3.669 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -4.861 -6.164 2.182 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -3.383 -6.084 3.147 1.00 0.00 H new ATOM 184 N ILE A 13 -2.414 -7.659 5.837 1.00 0.00 N ATOM 185 CA ILE A 13 -3.190 -7.175 6.983 1.00 0.00 C ATOM 186 C ILE A 13 -2.652 -5.941 7.729 1.00 0.00 C ATOM 187 O ILE A 13 -3.201 -5.595 8.772 1.00 0.00 O ATOM 188 CB ILE A 13 -3.432 -8.368 7.947 1.00 0.00 C ATOM 189 CG1 ILE A 13 -2.109 -8.894 8.555 1.00 0.00 C ATOM 190 CG2 ILE A 13 -4.219 -9.485 7.234 1.00 0.00 C ATOM 191 CD1 ILE A 13 -2.304 -9.983 9.618 1.00 0.00 C ATOM 0 H ILE A 13 -2.125 -8.628 5.968 1.00 0.00 H new ATOM 0 HA ILE A 13 -4.122 -6.793 6.566 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.036 -8.010 8.781 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -1.484 -9.289 7.754 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.567 -8.059 8.999 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.380 -10.314 7.924 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -5.182 -9.097 6.902 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -3.652 -9.836 6.371 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.332 -10.300 9.996 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -2.901 -9.587 10.439 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.817 -10.836 9.175 1.00 0.00 H new ATOM 203 N CYS A 14 -1.598 -5.270 7.263 1.00 0.00 N ATOM 204 CA CYS A 14 -0.999 -4.150 7.982 1.00 0.00 C ATOM 205 C CYS A 14 -0.616 -3.024 7.026 1.00 0.00 C ATOM 206 O CYS A 14 -1.196 -1.939 7.086 1.00 0.00 O ATOM 207 CB CYS A 14 0.190 -4.654 8.823 1.00 0.00 C ATOM 208 SG CYS A 14 1.298 -5.774 7.904 1.00 0.00 S ATOM 0 H CYS A 14 -1.138 -5.488 6.379 1.00 0.00 H new ATOM 0 HA CYS A 14 -1.731 -3.724 8.668 1.00 0.00 H new ATOM 0 HB2 CYS A 14 0.763 -3.798 9.179 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -0.190 -5.172 9.704 1.00 0.00 H new ATOM 0 HG CYS A 14 2.272 -6.152 8.678 1.00 0.00 H new ATOM 214 N ARG A 15 0.334 -3.260 6.120 1.00 0.00 N ATOM 215 CA ARG A 15 0.903 -2.175 5.320 1.00 0.00 C ATOM 216 C ARG A 15 -0.079 -1.726 4.251 1.00 0.00 C ATOM 217 O ARG A 15 -0.302 -0.525 4.122 1.00 0.00 O ATOM 218 CB ARG A 15 2.246 -2.599 4.713 1.00 0.00 C ATOM 219 CG ARG A 15 3.267 -2.899 5.817 1.00 0.00 C ATOM 220 CD ARG A 15 4.595 -3.402 5.260 1.00 0.00 C ATOM 221 NE ARG A 15 4.503 -4.770 4.714 1.00 0.00 N ATOM 222 CZ ARG A 15 5.492 -5.394 4.065 1.00 0.00 C ATOM 223 NH1 ARG A 15 6.660 -4.803 3.861 1.00 0.00 N ATOM 224 NH2 ARG A 15 5.339 -6.630 3.609 1.00 0.00 N ATOM 0 H ARG A 15 0.722 -4.182 5.923 1.00 0.00 H new ATOM 0 HA ARG A 15 1.091 -1.322 5.972 1.00 0.00 H new ATOM 0 HB2 ARG A 15 2.107 -3.482 4.089 1.00 0.00 H new ATOM 0 HB3 ARG A 15 2.624 -1.808 4.065 1.00 0.00 H new ATOM 0 HG2 ARG A 15 3.440 -1.996 6.403 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.855 -3.645 6.496 1.00 0.00 H new ATOM 0 HD2 ARG A 15 4.935 -2.725 4.477 1.00 0.00 H new ATOM 0 HD3 ARG A 15 5.347 -3.380 6.049 1.00 0.00 H new ATOM 0 HE ARG A 15 3.625 -5.274 4.840 1.00 0.00 H new ATOM 0 HH11 ARG A 15 6.818 -3.855 4.201 1.00 0.00 H new ATOM 0 HH12 ARG A 15 7.401 -5.296 3.364 1.00 0.00 H new ATOM 0 HH21 ARG A 15 4.456 -7.120 3.751 1.00 0.00 H new ATOM 0 HH22 ARG A 15 6.104 -7.090 3.116 1.00 0.00 H new ATOM 238 N SER A 16 -0.699 -2.666 3.533 1.00 0.00 N ATOM 239 CA SER A 16 -1.675 -2.336 2.505 1.00 0.00 C ATOM 240 C SER A 16 -2.823 -1.468 3.055 1.00 0.00 C ATOM 241 O SER A 16 -3.038 -0.397 2.490 1.00 0.00 O ATOM 242 CB SER A 16 -2.170 -3.608 1.807 1.00 0.00 C ATOM 243 OG SER A 16 -1.103 -4.462 1.445 1.00 0.00 O ATOM 0 H SER A 16 -0.537 -3.666 3.650 1.00 0.00 H new ATOM 0 HA SER A 16 -1.182 -1.724 1.750 1.00 0.00 H new ATOM 0 HB2 SER A 16 -2.854 -4.142 2.467 1.00 0.00 H new ATOM 0 HB3 SER A 16 -2.735 -3.336 0.916 1.00 0.00 H new ATOM 0 HG SER A 16 -1.456 -5.243 0.970 1.00 0.00 H new ATOM 249 N PRO A 17 -3.543 -1.823 4.142 1.00 0.00 N ATOM 250 CA PRO A 17 -4.618 -0.971 4.640 1.00 0.00 C ATOM 251 C PRO A 17 -4.105 0.360 5.188 1.00 0.00 C ATOM 252 O PRO A 17 -4.795 1.365 5.029 1.00 0.00 O ATOM 253 CB PRO A 17 -5.353 -1.774 5.715 1.00 0.00 C ATOM 254 CG PRO A 17 -4.341 -2.824 6.158 1.00 0.00 C ATOM 255 CD PRO A 17 -3.524 -3.070 4.892 1.00 0.00 C ATOM 0 HA PRO A 17 -5.289 -0.702 3.824 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -5.658 -1.139 6.547 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -6.257 -2.235 5.318 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -3.718 -2.464 6.977 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -4.830 -3.734 6.506 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -2.502 -3.359 5.139 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -3.952 -3.883 4.305 1.00 0.00 H new ATOM 263 N THR A 18 -2.914 0.398 5.796 1.00 0.00 N ATOM 264 CA THR A 18 -2.337 1.649 6.278 1.00 0.00 C ATOM 265 C THR A 18 -2.121 2.596 5.091 1.00 0.00 C ATOM 266 O THR A 18 -2.617 3.724 5.111 1.00 0.00 O ATOM 267 CB THR A 18 -1.045 1.353 7.060 1.00 0.00 C ATOM 268 OG1 THR A 18 -1.320 0.513 8.161 1.00 0.00 O ATOM 269 CG2 THR A 18 -0.380 2.622 7.600 1.00 0.00 C ATOM 0 H THR A 18 -2.335 -0.425 5.964 1.00 0.00 H new ATOM 0 HA THR A 18 -3.015 2.150 6.969 1.00 0.00 H new ATOM 0 HB THR A 18 -0.367 0.872 6.355 1.00 0.00 H new ATOM 0 HG1 THR A 18 -1.207 -0.423 7.895 1.00 0.00 H new ATOM 0 HG21 THR A 18 0.527 2.355 8.143 1.00 0.00 H new ATOM 0 HG22 THR A 18 -0.125 3.281 6.770 1.00 0.00 H new ATOM 0 HG23 THR A 18 -1.068 3.135 8.272 1.00 0.00 H new ATOM 277 N ALA A 19 -1.446 2.127 4.035 1.00 0.00 N ATOM 278 CA ALA A 19 -1.205 2.917 2.834 1.00 0.00 C ATOM 279 C ALA A 19 -2.512 3.358 2.187 1.00 0.00 C ATOM 280 O ALA A 19 -2.654 4.524 1.822 1.00 0.00 O ATOM 281 CB ALA A 19 -0.423 2.079 1.825 1.00 0.00 C ATOM 0 H ALA A 19 -1.053 1.187 3.995 1.00 0.00 H new ATOM 0 HA ALA A 19 -0.640 3.803 3.123 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -0.242 2.668 0.926 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.530 1.780 2.261 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -0.999 1.190 1.567 1.00 0.00 H new ATOM 287 N GLU A 20 -3.451 2.424 2.036 1.00 0.00 N ATOM 288 CA GLU A 20 -4.730 2.686 1.403 1.00 0.00 C ATOM 289 C GLU A 20 -5.447 3.816 2.138 1.00 0.00 C ATOM 290 O GLU A 20 -5.790 4.832 1.537 1.00 0.00 O ATOM 291 CB GLU A 20 -5.554 1.393 1.435 1.00 0.00 C ATOM 292 CG GLU A 20 -6.923 1.537 0.766 1.00 0.00 C ATOM 293 CD GLU A 20 -7.997 0.766 1.538 1.00 0.00 C ATOM 294 OE1 GLU A 20 -8.075 -0.472 1.365 1.00 0.00 O ATOM 295 OE2 GLU A 20 -8.734 1.401 2.327 1.00 0.00 O ATOM 0 H GLU A 20 -3.339 1.461 2.353 1.00 0.00 H new ATOM 0 HA GLU A 20 -4.592 2.999 0.368 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -4.995 0.600 0.938 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -5.693 1.083 2.471 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -7.196 2.591 0.712 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -6.871 1.168 -0.258 1.00 0.00 H new ATOM 302 N ARG A 21 -5.649 3.663 3.448 1.00 0.00 N ATOM 303 CA ARG A 21 -6.406 4.623 4.231 1.00 0.00 C ATOM 304 C ARG A 21 -5.684 5.968 4.306 1.00 0.00 C ATOM 305 O ARG A 21 -6.352 7.000 4.266 1.00 0.00 O ATOM 306 CB ARG A 21 -6.658 4.023 5.618 1.00 0.00 C ATOM 307 CG ARG A 21 -7.714 2.907 5.632 1.00 0.00 C ATOM 308 CD ARG A 21 -9.129 3.479 5.500 1.00 0.00 C ATOM 309 NE ARG A 21 -10.121 2.577 6.106 1.00 0.00 N ATOM 310 CZ ARG A 21 -10.870 1.640 5.513 1.00 0.00 C ATOM 311 NH1 ARG A 21 -10.699 1.293 4.241 1.00 0.00 N ATOM 312 NH2 ARG A 21 -11.815 1.038 6.231 1.00 0.00 N ATOM 0 H ARG A 21 -5.292 2.874 3.987 1.00 0.00 H new ATOM 0 HA ARG A 21 -7.364 4.823 3.751 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -5.720 3.627 6.007 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -6.974 4.817 6.294 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -7.523 2.212 4.815 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -7.634 2.339 6.559 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -9.177 4.455 5.983 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -9.367 3.632 4.447 1.00 0.00 H new ATOM 0 HE ARG A 21 -10.256 2.680 7.112 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -9.976 1.746 3.682 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -11.290 0.574 3.825 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -11.954 1.294 7.208 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -12.400 0.320 5.804 1.00 0.00 H new ATOM 326 N LEU A 22 -4.347 5.987 4.356 1.00 0.00 N ATOM 327 CA LEU A 22 -3.576 7.227 4.274 1.00 0.00 C ATOM 328 C LEU A 22 -3.874 7.939 2.953 1.00 0.00 C ATOM 329 O LEU A 22 -4.192 9.126 2.955 1.00 0.00 O ATOM 330 CB LEU A 22 -2.069 6.937 4.376 1.00 0.00 C ATOM 331 CG LEU A 22 -1.554 6.717 5.809 1.00 0.00 C ATOM 332 CD1 LEU A 22 -0.185 6.031 5.741 1.00 0.00 C ATOM 333 CD2 LEU A 22 -1.428 8.046 6.565 1.00 0.00 C ATOM 0 H LEU A 22 -3.775 5.148 4.454 1.00 0.00 H new ATOM 0 HA LEU A 22 -3.866 7.868 5.106 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.842 6.051 3.783 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.522 7.768 3.931 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.267 6.092 6.347 1.00 0.00 H new ATOM 0 HD11 LEU A 22 0.191 5.869 6.751 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -0.283 5.072 5.232 1.00 0.00 H new ATOM 0 HD13 LEU A 22 0.512 6.663 5.191 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.062 7.857 7.574 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.729 8.698 6.041 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -2.404 8.529 6.617 1.00 0.00 H new ATOM 345 N LEU A 23 -3.805 7.225 1.826 1.00 0.00 N ATOM 346 CA LEU A 23 -4.061 7.806 0.511 1.00 0.00 C ATOM 347 C LEU A 23 -5.512 8.286 0.402 1.00 0.00 C ATOM 348 O LEU A 23 -5.744 9.354 -0.161 1.00 0.00 O ATOM 349 CB LEU A 23 -3.718 6.795 -0.596 1.00 0.00 C ATOM 350 CG LEU A 23 -2.201 6.614 -0.817 1.00 0.00 C ATOM 351 CD1 LEU A 23 -1.926 5.319 -1.593 1.00 0.00 C ATOM 352 CD2 LEU A 23 -1.588 7.804 -1.574 1.00 0.00 C ATOM 0 H LEU A 23 -3.571 6.233 1.802 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.417 8.676 0.382 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.158 5.830 -0.345 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.177 7.121 -1.530 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.735 6.560 0.167 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -0.852 5.205 -1.741 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -2.307 4.468 -1.028 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.423 5.363 -2.562 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.519 7.638 -1.709 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -2.066 7.901 -2.549 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.743 8.718 -1.001 1.00 0.00 H new ATOM 364 N GLN A 24 -6.477 7.558 0.978 1.00 0.00 N ATOM 365 CA GLN A 24 -7.863 8.014 1.040 1.00 0.00 C ATOM 366 C GLN A 24 -7.975 9.310 1.851 1.00 0.00 C ATOM 367 O GLN A 24 -8.690 10.218 1.434 1.00 0.00 O ATOM 368 CB GLN A 24 -8.783 6.934 1.641 1.00 0.00 C ATOM 369 CG GLN A 24 -8.996 5.702 0.746 1.00 0.00 C ATOM 370 CD GLN A 24 -9.625 6.057 -0.600 1.00 0.00 C ATOM 371 OE1 GLN A 24 -8.975 5.994 -1.635 1.00 0.00 O ATOM 372 NE2 GLN A 24 -10.885 6.448 -0.633 1.00 0.00 N ATOM 0 H GLN A 24 -6.318 6.647 1.408 1.00 0.00 H new ATOM 0 HA GLN A 24 -8.188 8.210 0.018 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -8.364 6.607 2.592 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -9.753 7.381 1.857 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -8.038 5.210 0.577 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -9.635 4.987 1.264 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -11.426 6.500 0.230 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -11.318 6.698 -1.522 1.00 0.00 H new ATOM 381 N ARG A 25 -7.273 9.440 2.985 1.00 0.00 N ATOM 382 CA ARG A 25 -7.281 10.676 3.766 1.00 0.00 C ATOM 383 C ARG A 25 -6.717 11.832 2.938 1.00 0.00 C ATOM 384 O ARG A 25 -7.317 12.908 2.923 1.00 0.00 O ATOM 385 CB ARG A 25 -6.540 10.470 5.101 1.00 0.00 C ATOM 386 CG ARG A 25 -6.391 11.773 5.909 1.00 0.00 C ATOM 387 CD ARG A 25 -6.019 11.514 7.376 1.00 0.00 C ATOM 388 NE ARG A 25 -7.181 11.027 8.141 1.00 0.00 N ATOM 389 CZ ARG A 25 -7.176 10.565 9.398 1.00 0.00 C ATOM 390 NH1 ARG A 25 -6.049 10.506 10.104 1.00 0.00 N ATOM 391 NH2 ARG A 25 -8.320 10.149 9.927 1.00 0.00 N ATOM 0 H ARG A 25 -6.692 8.700 3.379 1.00 0.00 H new ATOM 0 HA ARG A 25 -8.307 10.944 4.017 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -7.078 9.736 5.700 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -5.551 10.056 4.902 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.626 12.397 5.448 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -7.326 12.332 5.867 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.214 10.781 7.426 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -5.642 12.432 7.826 1.00 0.00 H new ATOM 0 HE ARG A 25 -8.082 11.044 7.664 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -5.170 10.816 9.689 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -6.064 10.151 11.060 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -9.179 10.185 9.378 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -8.340 9.793 10.883 1.00 0.00 H new ATOM 405 N TYR A 26 -5.592 11.627 2.248 1.00 0.00 N ATOM 406 CA TYR A 26 -4.967 12.691 1.466 1.00 0.00 C ATOM 407 C TYR A 26 -5.782 13.069 0.221 1.00 0.00 C ATOM 408 O TYR A 26 -5.735 14.230 -0.187 1.00 0.00 O ATOM 409 CB TYR A 26 -3.523 12.326 1.095 1.00 0.00 C ATOM 410 CG TYR A 26 -2.577 12.199 2.279 1.00 0.00 C ATOM 411 CD1 TYR A 26 -2.464 13.253 3.210 1.00 0.00 C ATOM 412 CD2 TYR A 26 -1.808 11.032 2.456 1.00 0.00 C ATOM 413 CE1 TYR A 26 -1.636 13.124 4.337 1.00 0.00 C ATOM 414 CE2 TYR A 26 -0.974 10.898 3.581 1.00 0.00 C ATOM 415 CZ TYR A 26 -0.898 11.935 4.535 1.00 0.00 C ATOM 416 OH TYR A 26 -0.122 11.773 5.640 1.00 0.00 O ATOM 0 H TYR A 26 -5.098 10.735 2.216 1.00 0.00 H new ATOM 0 HA TYR A 26 -4.945 13.576 2.102 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -3.530 11.382 0.549 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -3.134 13.084 0.416 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -3.019 14.167 3.055 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -1.859 10.238 1.726 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -1.563 13.931 5.051 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -0.390 9.999 3.715 1.00 0.00 H new ATOM 0 HH TYR A 26 0.117 10.827 5.736 1.00 0.00 H new ATOM 426 N HIS A 27 -6.551 12.140 -0.360 1.00 0.00 N ATOM 427 CA HIS A 27 -7.400 12.382 -1.523 1.00 0.00 C ATOM 428 C HIS A 27 -8.751 11.673 -1.323 1.00 0.00 C ATOM 429 O HIS A 27 -8.930 10.556 -1.813 1.00 0.00 O ATOM 430 CB HIS A 27 -6.689 11.927 -2.812 1.00 0.00 C ATOM 431 CG HIS A 27 -5.593 12.848 -3.292 1.00 0.00 C ATOM 432 ND1 HIS A 27 -5.782 14.058 -3.929 1.00 0.00 N ATOM 433 CD2 HIS A 27 -4.241 12.618 -3.264 1.00 0.00 C ATOM 434 CE1 HIS A 27 -4.576 14.543 -4.270 1.00 0.00 C ATOM 435 NE2 HIS A 27 -3.604 13.698 -3.886 1.00 0.00 N ATOM 0 H HIS A 27 -6.598 11.178 -0.023 1.00 0.00 H new ATOM 0 HA HIS A 27 -7.591 13.450 -1.627 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -6.265 10.937 -2.646 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -7.432 11.827 -3.603 1.00 0.00 H new ATOM 0 HD1 HIS A 27 -6.680 14.506 -4.109 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -3.753 11.754 -2.837 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -4.411 15.480 -4.781 1.00 0.00 H new ATOM 443 N PRO A 28 -9.721 12.290 -0.620 1.00 0.00 N ATOM 444 CA PRO A 28 -11.039 11.701 -0.366 1.00 0.00 C ATOM 445 C PRO A 28 -11.818 11.285 -1.623 1.00 0.00 C ATOM 446 O PRO A 28 -12.692 10.420 -1.543 1.00 0.00 O ATOM 447 CB PRO A 28 -11.816 12.759 0.424 1.00 0.00 C ATOM 448 CG PRO A 28 -10.721 13.559 1.123 1.00 0.00 C ATOM 449 CD PRO A 28 -9.590 13.550 0.099 1.00 0.00 C ATOM 0 HA PRO A 28 -10.908 10.765 0.176 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -12.416 13.389 -0.232 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.499 12.303 1.141 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -11.047 14.573 1.357 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.419 13.097 2.063 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -9.670 14.399 -0.580 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -8.618 13.623 0.588 1.00 0.00 H new ATOM 457 N GLU A 29 -11.525 11.899 -2.776 1.00 0.00 N ATOM 458 CA GLU A 29 -12.211 11.600 -4.037 1.00 0.00 C ATOM 459 C GLU A 29 -11.718 10.284 -4.662 1.00 0.00 C ATOM 460 O GLU A 29 -12.348 9.753 -5.580 1.00 0.00 O ATOM 461 CB GLU A 29 -11.967 12.740 -5.045 1.00 0.00 C ATOM 462 CG GLU A 29 -12.313 14.128 -4.492 1.00 0.00 C ATOM 463 CD GLU A 29 -12.267 15.205 -5.591 1.00 0.00 C ATOM 464 OE1 GLU A 29 -11.192 15.805 -5.820 1.00 0.00 O ATOM 465 OE2 GLU A 29 -13.311 15.482 -6.224 1.00 0.00 O ATOM 0 H GLU A 29 -10.805 12.617 -2.860 1.00 0.00 H new ATOM 0 HA GLU A 29 -13.273 11.501 -3.812 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -10.920 12.729 -5.348 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -12.560 12.556 -5.941 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -13.307 14.105 -4.046 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -11.614 14.388 -3.698 1.00 0.00 H new ATOM 472 N LEU A 30 -10.565 9.786 -4.209 1.00 0.00 N ATOM 473 CA LEU A 30 -9.838 8.682 -4.817 1.00 0.00 C ATOM 474 C LEU A 30 -10.438 7.331 -4.421 1.00 0.00 C ATOM 475 O LEU A 30 -11.191 7.233 -3.444 1.00 0.00 O ATOM 476 CB LEU A 30 -8.373 8.804 -4.354 1.00 0.00 C ATOM 477 CG LEU A 30 -7.297 8.073 -5.171 1.00 0.00 C ATOM 478 CD1 LEU A 30 -7.352 8.466 -6.653 1.00 0.00 C ATOM 479 CD2 LEU A 30 -5.930 8.462 -4.596 1.00 0.00 C ATOM 0 H LEU A 30 -10.101 10.157 -3.380 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.903 8.732 -5.904 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -8.116 9.863 -4.334 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.316 8.443 -3.327 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.466 6.998 -5.107 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.577 7.930 -7.201 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.329 8.208 -7.062 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.189 9.539 -6.751 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.143 7.958 -5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.796 9.541 -4.673 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -5.878 8.164 -3.549 1.00 0.00 H new ATOM 491 N LYS A 31 -10.064 6.284 -5.162 1.00 0.00 N ATOM 492 CA LYS A 31 -10.355 4.906 -4.802 1.00 0.00 C ATOM 493 C LYS A 31 -9.013 4.197 -4.705 1.00 0.00 C ATOM 494 O LYS A 31 -8.277 4.108 -5.691 1.00 0.00 O ATOM 495 CB LYS A 31 -11.291 4.270 -5.843 1.00 0.00 C ATOM 496 CG LYS A 31 -11.521 2.771 -5.599 1.00 0.00 C ATOM 497 CD LYS A 31 -12.608 2.221 -6.538 1.00 0.00 C ATOM 498 CE LYS A 31 -12.623 0.686 -6.537 1.00 0.00 C ATOM 499 NZ LYS A 31 -13.135 0.107 -5.272 1.00 0.00 N ATOM 0 H LYS A 31 -9.546 6.377 -6.036 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.879 4.831 -3.849 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -12.250 4.788 -5.827 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -10.869 4.411 -6.838 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.590 2.226 -5.756 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.815 2.608 -4.562 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -13.583 2.596 -6.228 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -12.434 2.584 -7.551 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -13.239 0.335 -7.365 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.612 0.319 -6.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.566 -0.725 -5.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -13.071 0.817 -4.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -14.128 -0.177 -5.397 1.00 0.00 H new ATOM 513 N VAL A 32 -8.727 3.668 -3.523 1.00 0.00 N ATOM 514 CA VAL A 32 -7.591 2.798 -3.288 1.00 0.00 C ATOM 515 C VAL A 32 -8.157 1.592 -2.535 1.00 0.00 C ATOM 516 O VAL A 32 -9.041 1.757 -1.689 1.00 0.00 O ATOM 517 CB VAL A 32 -6.472 3.528 -2.506 1.00 0.00 C ATOM 518 CG1 VAL A 32 -5.185 2.685 -2.492 1.00 0.00 C ATOM 519 CG2 VAL A 32 -6.115 4.909 -3.086 1.00 0.00 C ATOM 0 H VAL A 32 -9.290 3.836 -2.689 1.00 0.00 H new ATOM 0 HA VAL A 32 -7.113 2.483 -4.216 1.00 0.00 H new ATOM 0 HB VAL A 32 -6.870 3.669 -1.501 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.410 3.214 -1.938 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -5.383 1.726 -2.013 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -4.849 2.517 -3.515 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -5.324 5.362 -2.488 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.772 4.794 -4.114 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -6.996 5.550 -3.067 1.00 0.00 H new ATOM 529 N GLU A 33 -7.650 0.396 -2.829 1.00 0.00 N ATOM 530 CA GLU A 33 -7.938 -0.807 -2.052 1.00 0.00 C ATOM 531 C GLU A 33 -6.621 -1.501 -1.692 1.00 0.00 C ATOM 532 O GLU A 33 -5.551 -1.103 -2.166 1.00 0.00 O ATOM 533 CB GLU A 33 -8.924 -1.720 -2.803 1.00 0.00 C ATOM 534 CG GLU A 33 -10.344 -1.141 -2.750 1.00 0.00 C ATOM 535 CD GLU A 33 -11.377 -2.103 -3.341 1.00 0.00 C ATOM 536 OE1 GLU A 33 -11.596 -2.066 -4.572 1.00 0.00 O ATOM 537 OE2 GLU A 33 -11.981 -2.888 -2.575 1.00 0.00 O ATOM 0 H GLU A 33 -7.024 0.234 -3.618 1.00 0.00 H new ATOM 0 HA GLU A 33 -8.434 -0.542 -1.118 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -8.609 -1.829 -3.841 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -8.915 -2.716 -2.360 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -10.606 -0.918 -1.716 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -10.372 -0.198 -3.297 1.00 0.00 H new ATOM 544 N SER A 34 -6.698 -2.546 -0.868 1.00 0.00 N ATOM 545 CA SER A 34 -5.527 -3.160 -0.261 1.00 0.00 C ATOM 546 C SER A 34 -5.569 -4.688 -0.411 1.00 0.00 C ATOM 547 O SER A 34 -6.616 -5.305 -0.199 1.00 0.00 O ATOM 548 CB SER A 34 -5.482 -2.691 1.203 1.00 0.00 C ATOM 549 OG SER A 34 -6.754 -2.654 1.826 1.00 0.00 O ATOM 0 H SER A 34 -7.579 -2.988 -0.605 1.00 0.00 H new ATOM 0 HA SER A 34 -4.608 -2.854 -0.761 1.00 0.00 H new ATOM 0 HB2 SER A 34 -4.829 -3.355 1.769 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.038 -1.697 1.244 1.00 0.00 H new ATOM 0 HG SER A 34 -7.204 -1.813 1.600 1.00 0.00 H new ATOM 555 N ALA A 35 -4.434 -5.302 -0.772 1.00 0.00 N ATOM 556 CA ALA A 35 -4.331 -6.736 -1.051 1.00 0.00 C ATOM 557 C ALA A 35 -2.936 -7.251 -0.665 1.00 0.00 C ATOM 558 O ALA A 35 -2.113 -6.499 -0.125 1.00 0.00 O ATOM 559 CB ALA A 35 -4.602 -6.966 -2.549 1.00 0.00 C ATOM 0 H ALA A 35 -3.549 -4.806 -0.879 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.065 -7.285 -0.461 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.529 -8.030 -2.773 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.602 -6.611 -2.796 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -3.867 -6.420 -3.140 1.00 0.00 H new ATOM 565 N GLY A 36 -2.633 -8.521 -0.955 1.00 0.00 N ATOM 566 CA GLY A 36 -1.287 -9.035 -0.752 1.00 0.00 C ATOM 567 C GLY A 36 -0.903 -10.265 -1.557 1.00 0.00 C ATOM 568 O GLY A 36 -1.758 -11.015 -2.028 1.00 0.00 O ATOM 0 H GLY A 36 -3.297 -9.200 -1.326 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -0.579 -8.240 -0.986 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.167 -9.268 0.306 1.00 0.00 H new ATOM 572 N LEU A 37 0.416 -10.458 -1.677 1.00 0.00 N ATOM 573 CA LEU A 37 1.025 -11.623 -2.332 1.00 0.00 C ATOM 574 C LEU A 37 0.949 -12.876 -1.458 1.00 0.00 C ATOM 575 O LEU A 37 1.067 -13.985 -1.980 1.00 0.00 O ATOM 576 CB LEU A 37 2.504 -11.323 -2.650 1.00 0.00 C ATOM 577 CG LEU A 37 2.706 -10.551 -3.968 1.00 0.00 C ATOM 578 CD1 LEU A 37 4.090 -9.899 -3.976 1.00 0.00 C ATOM 579 CD2 LEU A 37 2.594 -11.472 -5.192 1.00 0.00 C ATOM 0 H LEU A 37 1.103 -9.797 -1.315 1.00 0.00 H new ATOM 0 HA LEU A 37 0.466 -11.813 -3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.933 -10.746 -1.831 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.054 -12.263 -2.701 1.00 0.00 H new ATOM 0 HG LEU A 37 1.922 -9.796 -4.028 1.00 0.00 H new ATOM 0 HD11 LEU A 37 4.230 -9.354 -4.909 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.172 -9.208 -3.137 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.856 -10.670 -3.888 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.743 -10.889 -6.101 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.354 -12.251 -5.132 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.606 -11.931 -5.213 1.00 0.00 H new ATOM 591 N GLY A 38 0.742 -12.709 -0.151 1.00 0.00 N ATOM 592 CA GLY A 38 0.596 -13.805 0.798 1.00 0.00 C ATOM 593 C GLY A 38 -0.414 -13.350 1.841 1.00 0.00 C ATOM 594 O GLY A 38 -0.089 -13.237 3.022 1.00 0.00 O ATOM 0 H GLY A 38 0.670 -11.788 0.282 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.252 -14.709 0.295 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.552 -14.043 1.264 1.00 0.00 H new ATOM 598 N ALA A 39 -1.583 -12.928 1.354 1.00 0.00 N ATOM 599 CA ALA A 39 -2.623 -12.337 2.176 1.00 0.00 C ATOM 600 C ALA A 39 -3.351 -13.393 3.010 1.00 0.00 C ATOM 601 O ALA A 39 -3.183 -14.601 2.819 1.00 0.00 O ATOM 602 CB ALA A 39 -3.628 -11.643 1.255 1.00 0.00 C ATOM 0 H ALA A 39 -1.830 -12.991 0.366 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.164 -11.627 2.864 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.419 -11.192 1.854 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.120 -10.868 0.681 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.062 -12.374 0.573 1.00 0.00 H new ATOM 608 N LEU A 40 -4.227 -12.907 3.890 1.00 0.00 N ATOM 609 CA LEU A 40 -5.070 -13.729 4.742 1.00 0.00 C ATOM 610 C LEU A 40 -6.493 -13.258 4.453 1.00 0.00 C ATOM 611 O LEU A 40 -6.972 -12.320 5.090 1.00 0.00 O ATOM 612 CB LEU A 40 -4.702 -13.549 6.229 1.00 0.00 C ATOM 613 CG LEU A 40 -3.346 -14.131 6.685 1.00 0.00 C ATOM 614 CD1 LEU A 40 -2.153 -13.205 6.401 1.00 0.00 C ATOM 615 CD2 LEU A 40 -3.383 -14.385 8.198 1.00 0.00 C ATOM 0 H LEU A 40 -4.369 -11.907 4.029 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.948 -14.793 4.540 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.707 -12.482 6.454 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.488 -14.005 6.831 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.204 -15.049 6.115 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.234 -13.678 6.748 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.084 -13.019 5.329 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.294 -12.259 6.925 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -2.427 -14.796 8.521 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.570 -13.447 8.720 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.179 -15.093 8.429 1.00 0.00 H new ATOM 627 N VAL A 41 -7.114 -13.821 3.414 1.00 0.00 N ATOM 628 CA VAL A 41 -8.406 -13.363 2.901 1.00 0.00 C ATOM 629 C VAL A 41 -9.420 -13.162 4.041 1.00 0.00 C ATOM 630 O VAL A 41 -9.688 -14.085 4.816 1.00 0.00 O ATOM 631 CB VAL A 41 -8.930 -14.342 1.821 1.00 0.00 C ATOM 632 CG1 VAL A 41 -10.146 -13.755 1.090 1.00 0.00 C ATOM 633 CG2 VAL A 41 -7.853 -14.682 0.773 1.00 0.00 C ATOM 0 H VAL A 41 -6.730 -14.615 2.901 1.00 0.00 H new ATOM 0 HA VAL A 41 -8.269 -12.390 2.430 1.00 0.00 H new ATOM 0 HB VAL A 41 -9.212 -15.253 2.348 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.494 -14.462 0.337 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -10.945 -13.565 1.807 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -9.863 -12.820 0.606 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.267 -15.371 0.037 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.530 -13.769 0.274 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -7.000 -15.147 1.266 1.00 0.00 H new ATOM 643 N GLY A 42 -9.981 -11.949 4.133 1.00 0.00 N ATOM 644 CA GLY A 42 -11.042 -11.626 5.083 1.00 0.00 C ATOM 645 C GLY A 42 -10.617 -11.600 6.558 1.00 0.00 C ATOM 646 O GLY A 42 -11.488 -11.523 7.426 1.00 0.00 O ATOM 0 H GLY A 42 -9.706 -11.163 3.544 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -11.455 -10.651 4.824 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -11.845 -12.353 4.966 1.00 0.00 H new ATOM 650 N LYS A 43 -9.315 -11.668 6.874 1.00 0.00 N ATOM 651 CA LYS A 43 -8.848 -11.774 8.262 1.00 0.00 C ATOM 652 C LYS A 43 -9.024 -10.479 9.070 1.00 0.00 C ATOM 653 O LYS A 43 -8.919 -10.523 10.298 1.00 0.00 O ATOM 654 CB LYS A 43 -7.394 -12.293 8.246 1.00 0.00 C ATOM 655 CG LYS A 43 -6.826 -12.691 9.621 1.00 0.00 C ATOM 656 CD LYS A 43 -5.995 -11.573 10.280 1.00 0.00 C ATOM 657 CE LYS A 43 -5.949 -11.660 11.814 1.00 0.00 C ATOM 658 NZ LYS A 43 -7.295 -11.520 12.430 1.00 0.00 N ATOM 0 H LYS A 43 -8.565 -11.651 6.183 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.477 -12.489 8.793 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -7.341 -13.158 7.584 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.755 -11.522 7.816 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -7.649 -12.962 10.283 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -6.204 -13.579 9.507 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -4.977 -11.612 9.892 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.409 -10.607 9.992 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -5.515 -12.616 12.108 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -5.293 -10.880 12.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -7.244 -10.857 13.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -7.965 -11.157 11.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -7.619 -12.448 12.770 1.00 0.00 H new ATOM 672 N GLY A 44 -9.301 -9.335 8.435 1.00 0.00 N ATOM 673 CA GLY A 44 -9.269 -8.041 9.109 1.00 0.00 C ATOM 674 C GLY A 44 -7.837 -7.505 9.162 1.00 0.00 C ATOM 675 O GLY A 44 -6.885 -8.233 8.869 1.00 0.00 O ATOM 0 H GLY A 44 -9.551 -9.284 7.447 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -9.910 -7.334 8.583 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.665 -8.140 10.120 1.00 0.00 H new ATOM 679 N ALA A 45 -7.672 -6.227 9.512 1.00 0.00 N ATOM 680 CA ALA A 45 -6.346 -5.679 9.779 1.00 0.00 C ATOM 681 C ALA A 45 -5.784 -6.289 11.069 1.00 0.00 C ATOM 682 O ALA A 45 -6.529 -6.732 11.949 1.00 0.00 O ATOM 683 CB ALA A 45 -6.394 -4.149 9.858 1.00 0.00 C ATOM 0 H ALA A 45 -8.436 -5.559 9.616 1.00 0.00 H new ATOM 0 HA ALA A 45 -5.681 -5.940 8.956 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -5.394 -3.763 10.058 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -6.756 -3.747 8.912 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -7.066 -3.847 10.661 1.00 0.00 H new ATOM 689 N ASP A 46 -4.458 -6.294 11.180 1.00 0.00 N ATOM 690 CA ASP A 46 -3.759 -6.768 12.367 1.00 0.00 C ATOM 691 C ASP A 46 -4.054 -5.836 13.554 1.00 0.00 C ATOM 692 O ASP A 46 -3.999 -4.617 13.371 1.00 0.00 O ATOM 693 CB ASP A 46 -2.253 -6.804 12.092 1.00 0.00 C ATOM 694 CG ASP A 46 -1.518 -7.306 13.331 1.00 0.00 C ATOM 695 OD1 ASP A 46 -1.408 -8.535 13.520 1.00 0.00 O ATOM 696 OD2 ASP A 46 -1.098 -6.470 14.156 1.00 0.00 O ATOM 0 H ASP A 46 -3.835 -5.966 10.442 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.104 -7.772 12.613 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.044 -7.456 11.244 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -1.898 -5.809 11.825 1.00 0.00 H new ATOM 701 N PRO A 47 -4.342 -6.345 14.767 1.00 0.00 N ATOM 702 CA PRO A 47 -4.622 -5.513 15.935 1.00 0.00 C ATOM 703 C PRO A 47 -3.578 -4.426 16.220 1.00 0.00 C ATOM 704 O PRO A 47 -3.939 -3.355 16.708 1.00 0.00 O ATOM 705 CB PRO A 47 -4.730 -6.484 17.115 1.00 0.00 C ATOM 706 CG PRO A 47 -5.214 -7.775 16.461 1.00 0.00 C ATOM 707 CD PRO A 47 -4.519 -7.751 15.102 1.00 0.00 C ATOM 0 HA PRO A 47 -5.537 -4.948 15.756 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -3.770 -6.620 17.613 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -5.432 -6.126 17.868 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -4.933 -8.653 17.043 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -6.299 -7.794 16.359 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -3.559 -8.266 15.145 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -5.119 -8.259 14.348 1.00 0.00 H new ATOM 715 N THR A 48 -2.304 -4.672 15.913 1.00 0.00 N ATOM 716 CA THR A 48 -1.224 -3.729 16.189 1.00 0.00 C ATOM 717 C THR A 48 -1.220 -2.628 15.123 1.00 0.00 C ATOM 718 O THR A 48 -0.934 -1.469 15.429 1.00 0.00 O ATOM 719 CB THR A 48 0.142 -4.450 16.216 1.00 0.00 C ATOM 720 OG1 THR A 48 0.016 -5.852 16.377 1.00 0.00 O ATOM 721 CG2 THR A 48 1.045 -3.904 17.324 1.00 0.00 C ATOM 0 H THR A 48 -1.993 -5.534 15.465 1.00 0.00 H new ATOM 0 HA THR A 48 -1.390 -3.283 17.170 1.00 0.00 H new ATOM 0 HB THR A 48 0.596 -4.253 15.245 1.00 0.00 H new ATOM 0 HG1 THR A 48 -0.180 -6.265 15.510 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.997 -4.435 17.312 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.221 -2.841 17.160 1.00 0.00 H new ATOM 0 HG23 THR A 48 0.562 -4.047 18.291 1.00 0.00 H new ATOM 729 N ALA A 49 -1.577 -2.967 13.877 1.00 0.00 N ATOM 730 CA ALA A 49 -1.769 -1.969 12.840 1.00 0.00 C ATOM 731 C ALA A 49 -2.947 -1.073 13.224 1.00 0.00 C ATOM 732 O ALA A 49 -2.834 0.148 13.143 1.00 0.00 O ATOM 733 CB ALA A 49 -2.007 -2.660 11.493 1.00 0.00 C ATOM 0 H ALA A 49 -1.736 -3.927 13.572 1.00 0.00 H new ATOM 0 HA ALA A 49 -0.878 -1.349 12.743 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -2.151 -1.907 10.718 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.144 -3.278 11.243 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -2.896 -3.288 11.558 1.00 0.00 H new ATOM 739 N ILE A 50 -4.053 -1.670 13.684 1.00 0.00 N ATOM 740 CA ILE A 50 -5.233 -0.932 14.121 1.00 0.00 C ATOM 741 C ILE A 50 -4.849 0.008 15.269 1.00 0.00 C ATOM 742 O ILE A 50 -5.171 1.190 15.182 1.00 0.00 O ATOM 743 CB ILE A 50 -6.381 -1.896 14.505 1.00 0.00 C ATOM 744 CG1 ILE A 50 -6.866 -2.708 13.280 1.00 0.00 C ATOM 745 CG2 ILE A 50 -7.580 -1.139 15.117 1.00 0.00 C ATOM 746 CD1 ILE A 50 -7.801 -3.875 13.625 1.00 0.00 C ATOM 0 H ILE A 50 -4.150 -2.682 13.762 1.00 0.00 H new ATOM 0 HA ILE A 50 -5.608 -0.324 13.298 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.977 -2.579 15.252 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -7.381 -2.036 12.594 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.997 -3.099 12.751 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -8.366 -1.849 15.374 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -7.258 -0.613 16.016 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -7.964 -0.419 14.394 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -8.093 -4.390 12.710 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -7.285 -4.572 14.285 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -8.690 -3.493 14.126 1.00 0.00 H new ATOM 758 N SER A 51 -4.172 -0.461 16.325 1.00 0.00 N ATOM 759 CA SER A 51 -3.902 0.385 17.482 1.00 0.00 C ATOM 760 C SER A 51 -2.973 1.543 17.110 1.00 0.00 C ATOM 761 O SER A 51 -3.269 2.691 17.445 1.00 0.00 O ATOM 762 CB SER A 51 -3.359 -0.445 18.650 1.00 0.00 C ATOM 763 OG SER A 51 -2.213 -1.191 18.286 1.00 0.00 O ATOM 0 H SER A 51 -3.807 -1.411 16.397 1.00 0.00 H new ATOM 0 HA SER A 51 -4.842 0.827 17.814 1.00 0.00 H new ATOM 0 HB2 SER A 51 -3.112 0.217 19.480 1.00 0.00 H new ATOM 0 HB3 SER A 51 -4.135 -1.123 19.004 1.00 0.00 H new ATOM 0 HG SER A 51 -2.060 -1.106 17.322 1.00 0.00 H new ATOM 769 N VAL A 52 -1.899 1.277 16.362 1.00 0.00 N ATOM 770 CA VAL A 52 -0.994 2.327 15.910 1.00 0.00 C ATOM 771 C VAL A 52 -1.742 3.317 15.009 1.00 0.00 C ATOM 772 O VAL A 52 -1.530 4.521 15.139 1.00 0.00 O ATOM 773 CB VAL A 52 0.253 1.696 15.256 1.00 0.00 C ATOM 774 CG1 VAL A 52 1.139 2.711 14.522 1.00 0.00 C ATOM 775 CG2 VAL A 52 1.108 1.017 16.342 1.00 0.00 C ATOM 0 H VAL A 52 -1.638 0.339 16.058 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.632 2.910 16.756 1.00 0.00 H new ATOM 0 HB VAL A 52 -0.115 0.983 14.519 1.00 0.00 H new ATOM 0 HG11 VAL A 52 1.997 2.198 14.087 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.563 3.191 13.731 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.487 3.466 15.226 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.990 0.570 15.884 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.418 1.759 17.078 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.522 0.241 16.834 1.00 0.00 H new ATOM 785 N ALA A 53 -2.652 2.868 14.138 1.00 0.00 N ATOM 786 CA ALA A 53 -3.408 3.782 13.292 1.00 0.00 C ATOM 787 C ALA A 53 -4.471 4.550 14.092 1.00 0.00 C ATOM 788 O ALA A 53 -4.799 5.686 13.746 1.00 0.00 O ATOM 789 CB ALA A 53 -4.026 2.999 12.138 1.00 0.00 C ATOM 0 H ALA A 53 -2.878 1.882 14.005 1.00 0.00 H new ATOM 0 HA ALA A 53 -2.730 4.533 12.888 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -4.593 3.677 11.501 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.236 2.528 11.554 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.691 2.232 12.534 1.00 0.00 H new ATOM 795 N ALA A 54 -4.985 3.976 15.185 1.00 0.00 N ATOM 796 CA ALA A 54 -5.904 4.661 16.084 1.00 0.00 C ATOM 797 C ALA A 54 -5.213 5.833 16.786 1.00 0.00 C ATOM 798 O ALA A 54 -5.860 6.853 17.016 1.00 0.00 O ATOM 799 CB ALA A 54 -6.502 3.684 17.101 1.00 0.00 C ATOM 0 H ALA A 54 -4.771 3.019 15.467 1.00 0.00 H new ATOM 0 HA ALA A 54 -6.721 5.066 15.487 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.185 4.219 17.761 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -7.046 2.899 16.575 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -5.702 3.238 17.691 1.00 0.00 H new ATOM 805 N GLU A 55 -3.901 5.760 17.040 1.00 0.00 N ATOM 806 CA GLU A 55 -3.128 6.909 17.536 1.00 0.00 C ATOM 807 C GLU A 55 -3.136 8.092 16.542 1.00 0.00 C ATOM 808 O GLU A 55 -2.763 9.206 16.911 1.00 0.00 O ATOM 809 CB GLU A 55 -1.684 6.504 17.894 1.00 0.00 C ATOM 810 CG GLU A 55 -1.603 5.472 19.029 1.00 0.00 C ATOM 811 CD GLU A 55 -0.149 5.089 19.360 1.00 0.00 C ATOM 812 OE1 GLU A 55 0.585 5.922 19.940 1.00 0.00 O ATOM 813 OE2 GLU A 55 0.267 3.940 19.080 1.00 0.00 O ATOM 0 H GLU A 55 -3.348 4.913 16.910 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.622 7.248 18.447 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.198 6.097 17.007 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.126 7.395 18.182 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -2.083 5.876 19.920 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -2.158 4.578 18.746 1.00 0.00 H new ATOM 820 N HIS A 56 -3.607 7.875 15.307 1.00 0.00 N ATOM 821 CA HIS A 56 -3.781 8.874 14.253 1.00 0.00 C ATOM 822 C HIS A 56 -5.248 8.947 13.788 1.00 0.00 C ATOM 823 O HIS A 56 -5.539 9.542 12.745 1.00 0.00 O ATOM 824 CB HIS A 56 -2.831 8.531 13.100 1.00 0.00 C ATOM 825 CG HIS A 56 -1.374 8.554 13.499 1.00 0.00 C ATOM 826 ND1 HIS A 56 -0.608 9.676 13.728 1.00 0.00 N ATOM 827 CD2 HIS A 56 -0.576 7.467 13.742 1.00 0.00 C ATOM 828 CE1 HIS A 56 0.620 9.274 14.099 1.00 0.00 C ATOM 829 NE2 HIS A 56 0.691 7.930 14.126 1.00 0.00 N ATOM 0 H HIS A 56 -3.892 6.944 15.003 1.00 0.00 H new ATOM 0 HA HIS A 56 -3.535 9.864 14.637 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -3.080 7.542 12.716 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -2.989 9.238 12.286 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -0.872 6.432 13.653 1.00 0.00 H new ATOM 0 HE1 HIS A 56 1.437 9.938 14.342 1.00 0.00 H new ATOM 0 HE2 HIS A 56 1.502 7.363 14.375 1.00 0.00 H new ATOM 837 N GLN A 57 -6.170 8.362 14.569 1.00 0.00 N ATOM 838 CA GLN A 57 -7.607 8.347 14.288 1.00 0.00 C ATOM 839 C GLN A 57 -7.905 7.901 12.848 1.00 0.00 C ATOM 840 O GLN A 57 -8.699 8.536 12.150 1.00 0.00 O ATOM 841 CB GLN A 57 -8.234 9.709 14.665 1.00 0.00 C ATOM 842 CG GLN A 57 -8.037 10.119 16.135 1.00 0.00 C ATOM 843 CD GLN A 57 -8.844 9.248 17.099 1.00 0.00 C ATOM 844 OE1 GLN A 57 -10.000 9.538 17.404 1.00 0.00 O ATOM 845 NE2 GLN A 57 -8.275 8.163 17.598 1.00 0.00 N ATOM 0 H GLN A 57 -5.927 7.876 15.432 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.085 7.595 14.916 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -7.806 10.481 14.026 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -9.302 9.674 14.451 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -6.979 10.052 16.389 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -8.330 11.161 16.260 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -7.316 7.926 17.342 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -8.795 7.563 18.238 1.00 0.00 H new ATOM 854 N LEU A 58 -7.229 6.847 12.380 1.00 0.00 N ATOM 855 CA LEU A 58 -7.272 6.411 10.985 1.00 0.00 C ATOM 856 C LEU A 58 -7.692 4.943 11.012 1.00 0.00 C ATOM 857 O LEU A 58 -6.889 4.044 11.249 1.00 0.00 O ATOM 858 CB LEU A 58 -5.895 6.712 10.367 1.00 0.00 C ATOM 859 CG LEU A 58 -5.680 6.517 8.858 1.00 0.00 C ATOM 860 CD1 LEU A 58 -5.293 5.079 8.524 1.00 0.00 C ATOM 861 CD2 LEU A 58 -6.871 6.983 8.015 1.00 0.00 C ATOM 0 H LEU A 58 -6.630 6.267 12.968 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.992 6.930 10.352 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -5.653 7.749 10.599 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -5.163 6.091 10.883 1.00 0.00 H new ATOM 0 HG LEU A 58 -4.843 7.161 8.590 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -5.150 4.981 7.448 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -4.367 4.823 9.038 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -6.086 4.404 8.847 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.656 6.818 6.959 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.760 6.418 8.297 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -7.046 8.045 8.188 1.00 0.00 H new ATOM 873 N SER A 59 -8.994 4.716 10.864 1.00 0.00 N ATOM 874 CA SER A 59 -9.641 3.430 11.086 1.00 0.00 C ATOM 875 C SER A 59 -9.281 2.372 10.032 1.00 0.00 C ATOM 876 O SER A 59 -9.787 2.416 8.909 1.00 0.00 O ATOM 877 CB SER A 59 -11.160 3.661 11.143 1.00 0.00 C ATOM 878 OG SER A 59 -11.471 4.740 12.016 1.00 0.00 O ATOM 0 H SER A 59 -9.647 5.446 10.577 1.00 0.00 H new ATOM 0 HA SER A 59 -9.277 3.024 12.030 1.00 0.00 H new ATOM 0 HB2 SER A 59 -11.538 3.875 10.143 1.00 0.00 H new ATOM 0 HB3 SER A 59 -11.658 2.754 11.485 1.00 0.00 H new ATOM 0 HG SER A 59 -12.442 4.873 12.038 1.00 0.00 H new ATOM 884 N LEU A 60 -8.453 1.389 10.412 1.00 0.00 N ATOM 885 CA LEU A 60 -8.197 0.188 9.595 1.00 0.00 C ATOM 886 C LEU A 60 -9.147 -0.956 10.004 1.00 0.00 C ATOM 887 O LEU A 60 -9.045 -2.065 9.482 1.00 0.00 O ATOM 888 CB LEU A 60 -6.755 -0.331 9.790 1.00 0.00 C ATOM 889 CG LEU A 60 -5.606 0.688 9.724 1.00 0.00 C ATOM 890 CD1 LEU A 60 -4.271 -0.055 9.803 1.00 0.00 C ATOM 891 CD2 LEU A 60 -5.646 1.552 8.469 1.00 0.00 C ATOM 0 H LEU A 60 -7.940 1.401 11.294 1.00 0.00 H new ATOM 0 HA LEU A 60 -8.355 0.478 8.556 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -6.707 -0.826 10.760 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.569 -1.093 9.033 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.721 1.364 10.571 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.452 0.663 9.757 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.217 -0.607 10.741 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.192 -0.751 8.968 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.809 2.251 8.481 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.574 0.916 7.587 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -6.583 2.108 8.440 1.00 0.00 H new ATOM 903 N GLU A 61 -10.042 -0.694 10.965 1.00 0.00 N ATOM 904 CA GLU A 61 -10.848 -1.712 11.637 1.00 0.00 C ATOM 905 C GLU A 61 -11.631 -2.623 10.682 1.00 0.00 C ATOM 906 O GLU A 61 -11.720 -3.825 10.938 1.00 0.00 O ATOM 907 CB GLU A 61 -11.771 -1.009 12.646 1.00 0.00 C ATOM 908 CG GLU A 61 -12.500 -1.984 13.580 1.00 0.00 C ATOM 909 CD GLU A 61 -13.339 -1.240 14.634 1.00 0.00 C ATOM 910 OE1 GLU A 61 -14.512 -0.900 14.357 1.00 0.00 O ATOM 911 OE2 GLU A 61 -12.844 -1.001 15.759 1.00 0.00 O ATOM 0 H GLU A 61 -10.227 0.251 11.301 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.170 -2.391 12.153 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -11.182 -0.314 13.245 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.508 -0.417 12.103 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -13.147 -2.636 12.993 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -11.772 -2.623 14.079 1.00 0.00 H new ATOM 918 N GLY A 62 -12.166 -2.092 9.574 1.00 0.00 N ATOM 919 CA GLY A 62 -13.018 -2.854 8.665 1.00 0.00 C ATOM 920 C GLY A 62 -12.301 -3.260 7.376 1.00 0.00 C ATOM 921 O GLY A 62 -12.969 -3.514 6.373 1.00 0.00 O ATOM 0 H GLY A 62 -12.018 -1.124 9.288 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -13.374 -3.750 9.174 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -13.896 -2.259 8.414 1.00 0.00 H new ATOM 925 N HIS A 63 -10.962 -3.282 7.372 1.00 0.00 N ATOM 926 CA HIS A 63 -10.174 -3.766 6.241 1.00 0.00 C ATOM 927 C HIS A 63 -10.599 -5.191 5.859 1.00 0.00 C ATOM 928 O HIS A 63 -10.870 -6.020 6.731 1.00 0.00 O ATOM 929 CB HIS A 63 -8.683 -3.725 6.607 1.00 0.00 C ATOM 930 CG HIS A 63 -7.787 -4.416 5.607 1.00 0.00 C ATOM 931 ND1 HIS A 63 -7.688 -4.146 4.259 1.00 0.00 N ATOM 932 CD2 HIS A 63 -6.934 -5.457 5.868 1.00 0.00 C ATOM 933 CE1 HIS A 63 -6.804 -5.002 3.731 1.00 0.00 C ATOM 934 NE2 HIS A 63 -6.298 -5.812 4.674 1.00 0.00 N ATOM 0 H HIS A 63 -10.396 -2.962 8.158 1.00 0.00 H new ATOM 0 HA HIS A 63 -10.349 -3.122 5.379 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -8.371 -2.685 6.701 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -8.546 -4.189 7.584 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -8.198 -3.422 3.753 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -6.780 -5.923 6.830 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -6.534 -5.036 2.686 1.00 0.00 H new ATOM 942 N CYS A 64 -10.584 -5.484 4.556 1.00 0.00 N ATOM 943 CA CYS A 64 -10.836 -6.813 4.019 1.00 0.00 C ATOM 944 C CYS A 64 -9.636 -7.201 3.150 1.00 0.00 C ATOM 945 O CYS A 64 -9.525 -6.783 1.990 1.00 0.00 O ATOM 946 CB CYS A 64 -12.192 -6.864 3.288 1.00 0.00 C ATOM 947 SG CYS A 64 -12.581 -5.334 2.378 1.00 0.00 S ATOM 0 H CYS A 64 -10.392 -4.787 3.836 1.00 0.00 H new ATOM 0 HA CYS A 64 -10.927 -7.553 4.814 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -12.189 -7.702 2.591 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -12.981 -7.056 4.015 1.00 0.00 H new ATOM 0 HG CYS A 64 -13.734 -5.460 1.791 1.00 0.00 H new ATOM 953 N ALA A 65 -8.720 -7.965 3.755 1.00 0.00 N ATOM 954 CA ALA A 65 -7.557 -8.523 3.077 1.00 0.00 C ATOM 955 C ALA A 65 -7.991 -9.516 1.999 1.00 0.00 C ATOM 956 O ALA A 65 -9.080 -10.094 2.080 1.00 0.00 O ATOM 957 CB ALA A 65 -6.671 -9.214 4.120 1.00 0.00 C ATOM 0 H ALA A 65 -8.771 -8.213 4.743 1.00 0.00 H new ATOM 0 HA ALA A 65 -6.997 -7.726 2.588 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.795 -9.638 3.630 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -6.353 -8.486 4.866 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.235 -10.010 4.607 1.00 0.00 H new ATOM 963 N ARG A 66 -7.133 -9.730 1.001 1.00 0.00 N ATOM 964 CA ARG A 66 -7.463 -10.505 -0.193 1.00 0.00 C ATOM 965 C ARG A 66 -6.175 -10.911 -0.900 1.00 0.00 C ATOM 966 O ARG A 66 -5.236 -10.117 -0.993 1.00 0.00 O ATOM 967 CB ARG A 66 -8.386 -9.682 -1.119 1.00 0.00 C ATOM 968 CG ARG A 66 -7.706 -8.440 -1.721 1.00 0.00 C ATOM 969 CD ARG A 66 -8.712 -7.408 -2.230 1.00 0.00 C ATOM 970 NE ARG A 66 -9.310 -6.659 -1.115 1.00 0.00 N ATOM 971 CZ ARG A 66 -10.151 -5.632 -1.231 1.00 0.00 C ATOM 972 NH1 ARG A 66 -10.588 -5.236 -2.421 1.00 0.00 N ATOM 973 NH2 ARG A 66 -10.546 -5.008 -0.132 1.00 0.00 N ATOM 0 H ARG A 66 -6.180 -9.366 1.000 1.00 0.00 H new ATOM 0 HA ARG A 66 -8.001 -11.411 0.087 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -8.738 -10.321 -1.929 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -9.265 -9.368 -0.556 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -7.068 -7.979 -0.967 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -7.059 -8.747 -2.543 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -8.216 -6.717 -2.912 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -9.496 -7.909 -2.798 1.00 0.00 H new ATOM 0 HE ARG A 66 -9.059 -6.951 -0.170 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -10.280 -5.720 -3.264 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -11.232 -4.448 -2.492 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -10.207 -5.316 0.779 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -11.189 -4.219 -0.197 1.00 0.00 H new ATOM 987 N GLN A 67 -6.134 -12.144 -1.396 1.00 0.00 N ATOM 988 CA GLN A 67 -4.990 -12.644 -2.136 1.00 0.00 C ATOM 989 C GLN A 67 -5.021 -12.012 -3.517 1.00 0.00 C ATOM 990 O GLN A 67 -6.053 -12.013 -4.193 1.00 0.00 O ATOM 991 CB GLN A 67 -5.048 -14.182 -2.145 1.00 0.00 C ATOM 992 CG GLN A 67 -3.881 -14.873 -2.863 1.00 0.00 C ATOM 993 CD GLN A 67 -2.491 -14.517 -2.324 1.00 0.00 C ATOM 994 OE1 GLN A 67 -2.315 -14.151 -1.166 1.00 0.00 O ATOM 995 NE2 GLN A 67 -1.468 -14.619 -3.156 1.00 0.00 N ATOM 0 H GLN A 67 -6.892 -12.819 -1.295 1.00 0.00 H new ATOM 0 HA GLN A 67 -4.037 -12.375 -1.680 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -5.080 -14.535 -1.114 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -5.980 -14.492 -2.618 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -4.017 -15.952 -2.792 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -3.921 -14.616 -3.922 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -1.621 -14.924 -4.117 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -0.526 -14.393 -2.836 1.00 0.00 H new ATOM 1004 N ILE A 68 -3.880 -11.447 -3.905 1.00 0.00 N ATOM 1005 CA ILE A 68 -3.711 -10.854 -5.214 1.00 0.00 C ATOM 1006 C ILE A 68 -3.924 -11.933 -6.283 1.00 0.00 C ATOM 1007 O ILE A 68 -3.587 -13.106 -6.090 1.00 0.00 O ATOM 1008 CB ILE A 68 -2.339 -10.145 -5.288 1.00 0.00 C ATOM 1009 CG1 ILE A 68 -2.223 -9.189 -6.489 1.00 0.00 C ATOM 1010 CG2 ILE A 68 -1.164 -11.132 -5.336 1.00 0.00 C ATOM 1011 CD1 ILE A 68 -3.100 -7.945 -6.356 1.00 0.00 C ATOM 0 H ILE A 68 -3.050 -11.391 -3.314 1.00 0.00 H new ATOM 0 HA ILE A 68 -4.456 -10.081 -5.403 1.00 0.00 H new ATOM 0 HB ILE A 68 -2.283 -9.565 -4.367 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.183 -8.882 -6.601 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.498 -9.724 -7.398 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -0.226 -10.579 -5.387 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -1.172 -11.751 -4.439 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.259 -11.768 -6.216 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -2.971 -7.313 -7.235 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.145 -8.244 -6.274 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -2.810 -7.389 -5.464 1.00 0.00 H new ATOM 1023 N SER A 69 -4.461 -11.513 -7.418 1.00 0.00 N ATOM 1024 CA SER A 69 -4.633 -12.350 -8.595 1.00 0.00 C ATOM 1025 C SER A 69 -4.315 -11.487 -9.821 1.00 0.00 C ATOM 1026 O SER A 69 -4.262 -10.256 -9.705 1.00 0.00 O ATOM 1027 CB SER A 69 -6.072 -12.884 -8.589 1.00 0.00 C ATOM 1028 OG SER A 69 -7.000 -11.835 -8.820 1.00 0.00 O ATOM 0 H SER A 69 -4.797 -10.559 -7.549 1.00 0.00 H new ATOM 0 HA SER A 69 -3.966 -13.212 -8.609 1.00 0.00 H new ATOM 0 HB2 SER A 69 -6.184 -13.650 -9.356 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.284 -13.359 -7.631 1.00 0.00 H new ATOM 0 HG SER A 69 -7.911 -12.197 -8.814 1.00 0.00 H new ATOM 1034 N ARG A 70 -4.140 -12.081 -11.009 1.00 0.00 N ATOM 1035 CA ARG A 70 -3.993 -11.286 -12.236 1.00 0.00 C ATOM 1036 C ARG A 70 -5.235 -10.424 -12.468 1.00 0.00 C ATOM 1037 O ARG A 70 -5.100 -9.275 -12.890 1.00 0.00 O ATOM 1038 CB ARG A 70 -3.686 -12.198 -13.439 1.00 0.00 C ATOM 1039 CG ARG A 70 -3.513 -11.400 -14.745 1.00 0.00 C ATOM 1040 CD ARG A 70 -3.057 -12.294 -15.900 1.00 0.00 C ATOM 1041 NE ARG A 70 -3.112 -11.581 -17.188 1.00 0.00 N ATOM 1042 CZ ARG A 70 -2.961 -12.140 -18.393 1.00 0.00 C ATOM 1043 NH1 ARG A 70 -2.627 -13.422 -18.527 1.00 0.00 N ATOM 1044 NH2 ARG A 70 -3.160 -11.383 -19.462 1.00 0.00 N ATOM 0 H ARG A 70 -4.097 -13.091 -11.146 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.146 -10.609 -12.120 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -2.778 -12.766 -13.239 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -4.493 -12.920 -13.561 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -4.457 -10.921 -15.006 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -2.784 -10.604 -14.591 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -2.039 -12.637 -15.716 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -3.689 -13.181 -15.947 1.00 0.00 H new ATOM 0 HE ARG A 70 -3.280 -10.575 -17.158 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -2.481 -14.000 -17.699 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -2.518 -13.826 -19.457 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -3.421 -10.403 -19.352 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -3.053 -11.780 -20.395 1.00 0.00 H new ATOM 1058 N ARG A 71 -6.429 -10.948 -12.161 1.00 0.00 N ATOM 1059 CA ARG A 71 -7.675 -10.190 -12.281 1.00 0.00 C ATOM 1060 C ARG A 71 -7.599 -8.933 -11.426 1.00 0.00 C ATOM 1061 O ARG A 71 -7.879 -7.848 -11.932 1.00 0.00 O ATOM 1062 CB ARG A 71 -8.885 -11.049 -11.875 1.00 0.00 C ATOM 1063 CG ARG A 71 -9.121 -12.239 -12.821 1.00 0.00 C ATOM 1064 CD ARG A 71 -10.340 -13.078 -12.413 1.00 0.00 C ATOM 1065 NE ARG A 71 -10.139 -13.762 -11.119 1.00 0.00 N ATOM 1066 CZ ARG A 71 -10.660 -13.416 -9.932 1.00 0.00 C ATOM 1067 NH1 ARG A 71 -11.470 -12.366 -9.817 1.00 0.00 N ATOM 1068 NH2 ARG A 71 -10.358 -14.130 -8.852 1.00 0.00 N ATOM 0 H ARG A 71 -6.555 -11.903 -11.825 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.807 -9.902 -13.324 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -8.736 -11.421 -10.862 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -9.778 -10.424 -11.856 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -9.261 -11.870 -13.837 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.234 -12.873 -12.832 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -11.217 -12.434 -12.349 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -10.544 -13.819 -13.186 1.00 0.00 H new ATOM 0 HE ARG A 71 -9.539 -14.587 -11.129 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -11.704 -11.810 -10.639 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -11.857 -12.118 -8.906 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -9.735 -14.934 -8.930 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -10.750 -13.874 -7.946 1.00 0.00 H new ATOM 1082 N LEU A 72 -7.174 -9.049 -10.163 1.00 0.00 N ATOM 1083 CA LEU A 72 -6.989 -7.877 -9.320 1.00 0.00 C ATOM 1084 C LEU A 72 -5.928 -6.965 -9.919 1.00 0.00 C ATOM 1085 O LEU A 72 -6.183 -5.773 -10.038 1.00 0.00 O ATOM 1086 CB LEU A 72 -6.608 -8.255 -7.882 1.00 0.00 C ATOM 1087 CG LEU A 72 -7.819 -8.288 -6.939 1.00 0.00 C ATOM 1088 CD1 LEU A 72 -8.836 -9.384 -7.277 1.00 0.00 C ATOM 1089 CD2 LEU A 72 -7.346 -8.477 -5.495 1.00 0.00 C ATOM 0 H LEU A 72 -6.955 -9.937 -9.711 1.00 0.00 H new ATOM 0 HA LEU A 72 -7.942 -7.350 -9.278 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.126 -9.233 -7.883 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -5.877 -7.540 -7.504 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.327 -7.332 -7.066 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -9.663 -9.345 -6.568 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -9.216 -9.229 -8.287 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -8.353 -10.359 -7.217 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.209 -8.500 -4.829 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.798 -9.416 -5.411 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.693 -7.650 -5.215 1.00 0.00 H new ATOM 1101 N CYS A 73 -4.772 -7.493 -10.329 1.00 0.00 N ATOM 1102 CA CYS A 73 -3.682 -6.651 -10.809 1.00 0.00 C ATOM 1103 C CYS A 73 -4.124 -5.768 -11.980 1.00 0.00 C ATOM 1104 O CYS A 73 -3.765 -4.595 -12.016 1.00 0.00 O ATOM 1105 CB CYS A 73 -2.479 -7.490 -11.256 1.00 0.00 C ATOM 1106 SG CYS A 73 -1.717 -8.391 -9.880 1.00 0.00 S ATOM 0 H CYS A 73 -4.571 -8.493 -10.337 1.00 0.00 H new ATOM 0 HA CYS A 73 -3.392 -6.018 -9.970 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -2.798 -8.200 -12.019 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -1.736 -6.839 -11.716 1.00 0.00 H new ATOM 0 HG CYS A 73 -2.493 -9.370 -9.520 1.00 0.00 H new ATOM 1112 N ARG A 74 -4.897 -6.303 -12.931 1.00 0.00 N ATOM 1113 CA ARG A 74 -5.332 -5.529 -14.097 1.00 0.00 C ATOM 1114 C ARG A 74 -6.579 -4.681 -13.812 1.00 0.00 C ATOM 1115 O ARG A 74 -6.890 -3.793 -14.606 1.00 0.00 O ATOM 1116 CB ARG A 74 -5.487 -6.461 -15.315 1.00 0.00 C ATOM 1117 CG ARG A 74 -6.716 -7.386 -15.266 1.00 0.00 C ATOM 1118 CD ARG A 74 -6.596 -8.580 -16.226 1.00 0.00 C ATOM 1119 NE ARG A 74 -6.287 -8.181 -17.609 1.00 0.00 N ATOM 1120 CZ ARG A 74 -7.136 -7.688 -18.517 1.00 0.00 C ATOM 1121 NH1 ARG A 74 -8.438 -7.575 -18.252 1.00 0.00 N ATOM 1122 NH2 ARG A 74 -6.665 -7.305 -19.694 1.00 0.00 N ATOM 0 H ARG A 74 -5.233 -7.266 -12.916 1.00 0.00 H new ATOM 0 HA ARG A 74 -4.558 -4.800 -14.337 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -5.544 -5.851 -16.217 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -4.591 -7.075 -15.402 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -6.848 -7.754 -14.249 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -7.608 -6.812 -15.516 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -5.817 -9.251 -15.865 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.530 -9.141 -16.216 1.00 0.00 H new ATOM 0 HE ARG A 74 -5.318 -8.293 -17.908 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.801 -7.867 -17.345 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.071 -7.197 -18.957 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -5.669 -7.388 -19.896 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -7.299 -6.927 -20.398 1.00 0.00 H new ATOM 1136 N ASN A 75 -7.303 -4.931 -12.712 1.00 0.00 N ATOM 1137 CA ASN A 75 -8.523 -4.198 -12.367 1.00 0.00 C ATOM 1138 C ASN A 75 -8.251 -2.741 -11.980 1.00 0.00 C ATOM 1139 O ASN A 75 -9.104 -1.886 -12.222 1.00 0.00 O ATOM 1140 CB ASN A 75 -9.265 -4.890 -11.213 1.00 0.00 C ATOM 1141 CG ASN A 75 -10.536 -4.133 -10.832 1.00 0.00 C ATOM 1142 OD1 ASN A 75 -11.533 -4.180 -11.547 1.00 0.00 O ATOM 1143 ND2 ASN A 75 -10.541 -3.434 -9.706 1.00 0.00 N ATOM 0 H ASN A 75 -7.055 -5.652 -12.035 1.00 0.00 H new ATOM 0 HA ASN A 75 -9.140 -4.198 -13.265 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -9.520 -5.909 -11.502 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -8.608 -4.960 -10.346 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.380 -2.927 -9.424 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -9.706 -3.403 -9.121 1.00 0.00 H new ATOM 1150 N TYR A 76 -7.090 -2.448 -11.385 1.00 0.00 N ATOM 1151 CA TYR A 76 -6.754 -1.100 -10.920 1.00 0.00 C ATOM 1152 C TYR A 76 -5.680 -0.543 -11.861 1.00 0.00 C ATOM 1153 O TYR A 76 -4.881 -1.304 -12.408 1.00 0.00 O ATOM 1154 CB TYR A 76 -6.332 -1.122 -9.439 1.00 0.00 C ATOM 1155 CG TYR A 76 -7.319 -1.797 -8.494 1.00 0.00 C ATOM 1156 CD1 TYR A 76 -7.346 -3.197 -8.386 1.00 0.00 C ATOM 1157 CD2 TYR A 76 -8.172 -1.038 -7.676 1.00 0.00 C ATOM 1158 CE1 TYR A 76 -8.247 -3.842 -7.521 1.00 0.00 C ATOM 1159 CE2 TYR A 76 -9.082 -1.664 -6.806 1.00 0.00 C ATOM 1160 CZ TYR A 76 -9.131 -3.075 -6.727 1.00 0.00 C ATOM 1161 OH TYR A 76 -10.021 -3.698 -5.909 1.00 0.00 O ATOM 0 H TYR A 76 -6.359 -3.138 -11.213 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.619 -0.437 -10.955 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -5.371 -1.630 -9.359 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -6.178 -0.096 -9.106 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -6.663 -3.788 -8.978 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -8.128 0.040 -7.716 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -8.264 -4.920 -7.463 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -9.744 -1.066 -6.197 1.00 0.00 H new ATOM 0 HH TYR A 76 -10.659 -3.042 -5.560 1.00 0.00 H new ATOM 1171 N ASP A 77 -5.672 0.773 -12.094 1.00 0.00 N ATOM 1172 CA ASP A 77 -4.841 1.372 -13.145 1.00 0.00 C ATOM 1173 C ASP A 77 -3.400 1.623 -12.700 1.00 0.00 C ATOM 1174 O ASP A 77 -2.512 1.790 -13.534 1.00 0.00 O ATOM 1175 CB ASP A 77 -5.462 2.684 -13.641 1.00 0.00 C ATOM 1176 CG ASP A 77 -4.688 3.242 -14.851 1.00 0.00 C ATOM 1177 OD1 ASP A 77 -4.482 2.496 -15.837 1.00 0.00 O ATOM 1178 OD2 ASP A 77 -4.323 4.439 -14.839 1.00 0.00 O ATOM 0 H ASP A 77 -6.232 1.445 -11.569 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.807 0.646 -13.957 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.503 2.516 -13.918 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.461 3.418 -12.835 1.00 0.00 H new ATOM 1183 N LEU A 78 -3.140 1.633 -11.395 1.00 0.00 N ATOM 1184 CA LEU A 78 -1.826 1.881 -10.821 1.00 0.00 C ATOM 1185 C LEU A 78 -1.735 0.990 -9.594 1.00 0.00 C ATOM 1186 O LEU A 78 -2.698 0.903 -8.825 1.00 0.00 O ATOM 1187 CB LEU A 78 -1.710 3.386 -10.510 1.00 0.00 C ATOM 1188 CG LEU A 78 -0.396 3.916 -9.902 1.00 0.00 C ATOM 1189 CD1 LEU A 78 -0.326 3.757 -8.381 1.00 0.00 C ATOM 1190 CD2 LEU A 78 0.866 3.344 -10.550 1.00 0.00 C ATOM 0 H LEU A 78 -3.859 1.464 -10.691 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.996 1.644 -11.486 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.888 3.930 -11.437 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -2.519 3.646 -9.827 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.420 4.982 -10.130 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.624 4.150 -8.017 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.146 4.307 -7.920 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.405 2.701 -8.121 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.747 3.766 -10.066 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.874 2.260 -10.436 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.878 3.598 -11.610 1.00 0.00 H new ATOM 1202 N ILE A 79 -0.603 0.311 -9.429 1.00 0.00 N ATOM 1203 CA ILE A 79 -0.399 -0.637 -8.348 1.00 0.00 C ATOM 1204 C ILE A 79 0.851 -0.155 -7.620 1.00 0.00 C ATOM 1205 O ILE A 79 1.848 0.183 -8.264 1.00 0.00 O ATOM 1206 CB ILE A 79 -0.228 -2.072 -8.906 1.00 0.00 C ATOM 1207 CG1 ILE A 79 -1.298 -2.502 -9.937 1.00 0.00 C ATOM 1208 CG2 ILE A 79 -0.151 -3.101 -7.763 1.00 0.00 C ATOM 1209 CD1 ILE A 79 -2.723 -2.616 -9.389 1.00 0.00 C ATOM 0 H ILE A 79 0.202 0.407 -10.048 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.252 -0.683 -7.671 1.00 0.00 H new ATOM 0 HB ILE A 79 0.715 -2.047 -9.452 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.298 -1.785 -10.758 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.009 -3.466 -10.356 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -0.031 -4.101 -8.181 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.701 -2.871 -7.123 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -1.068 -3.061 -7.175 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.397 -2.923 -10.189 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.747 -3.357 -8.590 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.041 -1.650 -8.998 1.00 0.00 H new ATOM 1221 N LEU A 80 0.827 -0.156 -6.290 1.00 0.00 N ATOM 1222 CA LEU A 80 2.014 0.110 -5.488 1.00 0.00 C ATOM 1223 C LEU A 80 2.272 -1.087 -4.589 1.00 0.00 C ATOM 1224 O LEU A 80 1.348 -1.817 -4.231 1.00 0.00 O ATOM 1225 CB LEU A 80 1.883 1.394 -4.655 1.00 0.00 C ATOM 1226 CG LEU A 80 1.794 2.711 -5.446 1.00 0.00 C ATOM 1227 CD1 LEU A 80 1.601 3.887 -4.485 1.00 0.00 C ATOM 1228 CD2 LEU A 80 3.028 2.957 -6.319 1.00 0.00 C ATOM 0 H LEU A 80 -0.013 -0.341 -5.741 1.00 0.00 H new ATOM 0 HA LEU A 80 2.857 0.265 -6.162 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.993 1.308 -4.031 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.739 1.455 -3.983 1.00 0.00 H new ATOM 0 HG LEU A 80 0.935 2.626 -6.112 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.539 4.815 -5.053 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.681 3.746 -3.918 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.446 3.938 -3.798 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.913 3.899 -6.855 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.916 3.004 -5.689 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.135 2.143 -7.036 1.00 0.00 H new ATOM 1240 N THR A 81 3.526 -1.276 -4.199 1.00 0.00 N ATOM 1241 CA THR A 81 3.906 -2.369 -3.324 1.00 0.00 C ATOM 1242 C THR A 81 5.100 -1.956 -2.466 1.00 0.00 C ATOM 1243 O THR A 81 5.760 -0.960 -2.762 1.00 0.00 O ATOM 1244 CB THR A 81 4.092 -3.636 -4.170 1.00 0.00 C ATOM 1245 OG1 THR A 81 4.232 -4.742 -3.314 1.00 0.00 O ATOM 1246 CG2 THR A 81 5.278 -3.551 -5.134 1.00 0.00 C ATOM 0 H THR A 81 4.302 -0.677 -4.481 1.00 0.00 H new ATOM 0 HA THR A 81 3.125 -2.610 -2.603 1.00 0.00 H new ATOM 0 HB THR A 81 3.205 -3.747 -4.794 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.603 -4.659 -2.567 1.00 0.00 H new ATOM 0 HG21 THR A 81 5.353 -4.479 -5.701 1.00 0.00 H new ATOM 0 HG22 THR A 81 5.130 -2.717 -5.820 1.00 0.00 H new ATOM 0 HG23 THR A 81 6.197 -3.397 -4.568 1.00 0.00 H new ATOM 1254 N MET A 82 5.385 -2.689 -1.389 1.00 0.00 N ATOM 1255 CA MET A 82 6.337 -2.252 -0.372 1.00 0.00 C ATOM 1256 C MET A 82 7.775 -2.693 -0.620 1.00 0.00 C ATOM 1257 O MET A 82 8.686 -2.074 -0.069 1.00 0.00 O ATOM 1258 CB MET A 82 5.866 -2.801 0.989 1.00 0.00 C ATOM 1259 CG MET A 82 4.453 -2.326 1.346 1.00 0.00 C ATOM 1260 SD MET A 82 4.259 -0.530 1.330 1.00 0.00 S ATOM 1261 CE MET A 82 2.457 -0.406 1.257 1.00 0.00 C ATOM 0 H MET A 82 4.963 -3.598 -1.199 1.00 0.00 H new ATOM 0 HA MET A 82 6.354 -1.162 -0.399 1.00 0.00 H new ATOM 0 HB2 MET A 82 5.887 -3.891 0.966 1.00 0.00 H new ATOM 0 HB3 MET A 82 6.561 -2.485 1.767 1.00 0.00 H new ATOM 0 HG2 MET A 82 3.744 -2.764 0.643 1.00 0.00 H new ATOM 0 HG3 MET A 82 4.193 -2.701 2.336 1.00 0.00 H new ATOM 0 HE1 MET A 82 2.176 0.546 0.807 1.00 0.00 H new ATOM 0 HE2 MET A 82 2.060 -1.224 0.655 1.00 0.00 H new ATOM 0 HE3 MET A 82 2.047 -0.466 2.265 1.00 0.00 H new ATOM 1271 N GLU A 83 7.995 -3.745 -1.415 1.00 0.00 N ATOM 1272 CA GLU A 83 9.307 -4.376 -1.526 1.00 0.00 C ATOM 1273 C GLU A 83 9.612 -4.674 -2.993 1.00 0.00 C ATOM 1274 O GLU A 83 8.718 -5.000 -3.773 1.00 0.00 O ATOM 1275 CB GLU A 83 9.342 -5.660 -0.668 1.00 0.00 C ATOM 1276 CG GLU A 83 9.063 -5.423 0.832 1.00 0.00 C ATOM 1277 CD GLU A 83 8.925 -6.719 1.647 1.00 0.00 C ATOM 1278 OE1 GLU A 83 9.701 -7.675 1.418 1.00 0.00 O ATOM 1279 OE2 GLU A 83 8.062 -6.767 2.557 1.00 0.00 O ATOM 0 H GLU A 83 7.274 -4.177 -1.993 1.00 0.00 H new ATOM 0 HA GLU A 83 10.076 -3.700 -1.152 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.606 -6.364 -1.057 1.00 0.00 H new ATOM 0 HB3 GLU A 83 10.320 -6.129 -0.775 1.00 0.00 H new ATOM 0 HG2 GLU A 83 9.871 -4.824 1.253 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.147 -4.840 0.935 1.00 0.00 H new ATOM 1286 N LYS A 84 10.886 -4.590 -3.384 1.00 0.00 N ATOM 1287 CA LYS A 84 11.291 -4.737 -4.788 1.00 0.00 C ATOM 1288 C LYS A 84 11.018 -6.151 -5.307 1.00 0.00 C ATOM 1289 O LYS A 84 10.569 -6.316 -6.441 1.00 0.00 O ATOM 1290 CB LYS A 84 12.772 -4.336 -4.922 1.00 0.00 C ATOM 1291 CG LYS A 84 12.953 -2.822 -4.688 1.00 0.00 C ATOM 1292 CD LYS A 84 14.303 -2.465 -4.052 1.00 0.00 C ATOM 1293 CE LYS A 84 14.329 -0.952 -3.795 1.00 0.00 C ATOM 1294 NZ LYS A 84 15.449 -0.526 -2.928 1.00 0.00 N ATOM 0 H LYS A 84 11.662 -4.420 -2.744 1.00 0.00 H new ATOM 0 HA LYS A 84 10.693 -4.073 -5.412 1.00 0.00 H new ATOM 0 HB2 LYS A 84 13.371 -4.894 -4.202 1.00 0.00 H new ATOM 0 HB3 LYS A 84 13.137 -4.601 -5.914 1.00 0.00 H new ATOM 0 HG2 LYS A 84 12.858 -2.300 -5.640 1.00 0.00 H new ATOM 0 HG3 LYS A 84 12.150 -2.462 -4.046 1.00 0.00 H new ATOM 0 HD2 LYS A 84 14.439 -3.011 -3.119 1.00 0.00 H new ATOM 0 HD3 LYS A 84 15.122 -2.752 -4.712 1.00 0.00 H new ATOM 0 HE2 LYS A 84 14.398 -0.429 -4.749 1.00 0.00 H new ATOM 0 HE3 LYS A 84 13.388 -0.652 -3.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 15.363 0.490 -2.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 15.422 -1.062 -2.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 16.351 -0.706 -3.413 1.00 0.00 H new ATOM 1308 N ARG A 85 11.186 -7.171 -4.457 1.00 0.00 N ATOM 1309 CA ARG A 85 10.760 -8.537 -4.777 1.00 0.00 C ATOM 1310 C ARG A 85 9.265 -8.609 -5.088 1.00 0.00 C ATOM 1311 O ARG A 85 8.873 -9.401 -5.941 1.00 0.00 O ATOM 1312 CB ARG A 85 11.172 -9.531 -3.670 1.00 0.00 C ATOM 1313 CG ARG A 85 10.606 -9.216 -2.275 1.00 0.00 C ATOM 1314 CD ARG A 85 10.944 -10.322 -1.271 1.00 0.00 C ATOM 1315 NE ARG A 85 10.410 -9.994 0.059 1.00 0.00 N ATOM 1316 CZ ARG A 85 10.137 -10.836 1.058 1.00 0.00 C ATOM 1317 NH1 ARG A 85 10.340 -12.147 0.939 1.00 0.00 N ATOM 1318 NH2 ARG A 85 9.652 -10.320 2.178 1.00 0.00 N ATOM 0 H ARG A 85 11.617 -7.074 -3.537 1.00 0.00 H new ATOM 0 HA ARG A 85 11.282 -8.836 -5.686 1.00 0.00 H new ATOM 0 HB2 ARG A 85 10.848 -10.531 -3.960 1.00 0.00 H new ATOM 0 HB3 ARG A 85 12.260 -9.553 -3.608 1.00 0.00 H new ATOM 0 HG2 ARG A 85 11.010 -8.267 -1.923 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.524 -9.098 -2.338 1.00 0.00 H new ATOM 0 HD2 ARG A 85 10.528 -11.270 -1.612 1.00 0.00 H new ATOM 0 HD3 ARG A 85 12.025 -10.450 -1.213 1.00 0.00 H new ATOM 0 HE ARG A 85 10.227 -9.007 0.239 1.00 0.00 H new ATOM 0 HH11 ARG A 85 10.712 -12.529 0.069 1.00 0.00 H new ATOM 0 HH12 ARG A 85 10.123 -12.769 1.717 1.00 0.00 H new ATOM 0 HH21 ARG A 85 9.501 -9.314 2.252 1.00 0.00 H new ATOM 0 HH22 ARG A 85 9.430 -10.929 2.966 1.00 0.00 H new ATOM 1332 N HIS A 86 8.424 -7.790 -4.450 1.00 0.00 N ATOM 1333 CA HIS A 86 6.995 -7.806 -4.729 1.00 0.00 C ATOM 1334 C HIS A 86 6.730 -7.217 -6.110 1.00 0.00 C ATOM 1335 O HIS A 86 5.872 -7.742 -6.812 1.00 0.00 O ATOM 1336 CB HIS A 86 6.187 -7.020 -3.692 1.00 0.00 C ATOM 1337 CG HIS A 86 6.293 -7.451 -2.251 1.00 0.00 C ATOM 1338 ND1 HIS A 86 6.819 -8.621 -1.750 1.00 0.00 N ATOM 1339 CD2 HIS A 86 5.832 -6.731 -1.182 1.00 0.00 C ATOM 1340 CE1 HIS A 86 6.701 -8.584 -0.413 1.00 0.00 C ATOM 1341 NE2 HIS A 86 6.083 -7.455 -0.016 1.00 0.00 N ATOM 0 H HIS A 86 8.710 -7.114 -3.742 1.00 0.00 H new ATOM 0 HA HIS A 86 6.675 -8.847 -4.686 1.00 0.00 H new ATOM 0 HB2 HIS A 86 6.489 -5.974 -3.753 1.00 0.00 H new ATOM 0 HB3 HIS A 86 5.137 -7.066 -3.980 1.00 0.00 H new ATOM 0 HD1 HIS A 86 7.226 -9.380 -2.297 1.00 0.00 H new ATOM 0 HD2 HIS A 86 5.354 -5.764 -1.233 1.00 0.00 H new ATOM 0 HE1 HIS A 86 7.054 -9.356 0.255 1.00 0.00 H new ATOM 1349 N ILE A 87 7.467 -6.176 -6.528 1.00 0.00 N ATOM 1350 CA ILE A 87 7.341 -5.629 -7.880 1.00 0.00 C ATOM 1351 C ILE A 87 7.614 -6.763 -8.869 1.00 0.00 C ATOM 1352 O ILE A 87 6.811 -6.986 -9.774 1.00 0.00 O ATOM 1353 CB ILE A 87 8.285 -4.418 -8.117 1.00 0.00 C ATOM 1354 CG1 ILE A 87 8.090 -3.316 -7.053 1.00 0.00 C ATOM 1355 CG2 ILE A 87 8.065 -3.829 -9.525 1.00 0.00 C ATOM 1356 CD1 ILE A 87 9.098 -2.166 -7.144 1.00 0.00 C ATOM 0 H ILE A 87 8.155 -5.699 -5.946 1.00 0.00 H new ATOM 0 HA ILE A 87 6.333 -5.241 -8.024 1.00 0.00 H new ATOM 0 HB ILE A 87 9.307 -4.787 -8.034 1.00 0.00 H new ATOM 0 HG12 ILE A 87 7.083 -2.909 -7.148 1.00 0.00 H new ATOM 0 HG13 ILE A 87 8.159 -3.767 -6.063 1.00 0.00 H new ATOM 0 HG21 ILE A 87 8.734 -2.982 -9.674 1.00 0.00 H new ATOM 0 HG22 ILE A 87 8.273 -4.592 -10.275 1.00 0.00 H new ATOM 0 HG23 ILE A 87 7.032 -3.496 -9.623 1.00 0.00 H new ATOM 0 HD11 ILE A 87 8.890 -1.437 -6.361 1.00 0.00 H new ATOM 0 HD12 ILE A 87 10.108 -2.556 -7.017 1.00 0.00 H new ATOM 0 HD13 ILE A 87 9.015 -1.686 -8.119 1.00 0.00 H new ATOM 1368 N GLU A 88 8.703 -7.512 -8.668 1.00 0.00 N ATOM 1369 CA GLU A 88 9.076 -8.594 -9.575 1.00 0.00 C ATOM 1370 C GLU A 88 7.981 -9.666 -9.616 1.00 0.00 C ATOM 1371 O GLU A 88 7.531 -10.050 -10.697 1.00 0.00 O ATOM 1372 CB GLU A 88 10.440 -9.164 -9.154 1.00 0.00 C ATOM 1373 CG GLU A 88 10.951 -10.222 -10.143 1.00 0.00 C ATOM 1374 CD GLU A 88 12.370 -10.691 -9.778 1.00 0.00 C ATOM 1375 OE1 GLU A 88 12.519 -11.631 -8.964 1.00 0.00 O ATOM 1376 OE2 GLU A 88 13.356 -10.138 -10.317 1.00 0.00 O ATOM 0 H GLU A 88 9.341 -7.386 -7.882 1.00 0.00 H new ATOM 0 HA GLU A 88 9.172 -8.209 -10.590 1.00 0.00 H new ATOM 0 HB2 GLU A 88 11.165 -8.354 -9.083 1.00 0.00 H new ATOM 0 HB3 GLU A 88 10.358 -9.606 -8.161 1.00 0.00 H new ATOM 0 HG2 GLU A 88 10.274 -11.076 -10.147 1.00 0.00 H new ATOM 0 HG3 GLU A 88 10.950 -9.810 -11.152 1.00 0.00 H new ATOM 1383 N ARG A 89 7.495 -10.107 -8.449 1.00 0.00 N ATOM 1384 CA ARG A 89 6.441 -11.118 -8.375 1.00 0.00 C ATOM 1385 C ARG A 89 5.163 -10.632 -9.051 1.00 0.00 C ATOM 1386 O ARG A 89 4.516 -11.405 -9.750 1.00 0.00 O ATOM 1387 CB ARG A 89 6.166 -11.505 -6.914 1.00 0.00 C ATOM 1388 CG ARG A 89 7.299 -12.327 -6.272 1.00 0.00 C ATOM 1389 CD ARG A 89 7.500 -13.721 -6.879 1.00 0.00 C ATOM 1390 NE ARG A 89 6.288 -14.554 -6.757 1.00 0.00 N ATOM 1391 CZ ARG A 89 5.546 -15.063 -7.752 1.00 0.00 C ATOM 1392 NH1 ARG A 89 5.904 -14.944 -9.028 1.00 0.00 N ATOM 1393 NH2 ARG A 89 4.418 -15.703 -7.455 1.00 0.00 N ATOM 0 H ARG A 89 7.819 -9.775 -7.540 1.00 0.00 H new ATOM 0 HA ARG A 89 6.787 -12.003 -8.909 1.00 0.00 H new ATOM 0 HB2 ARG A 89 6.010 -10.598 -6.330 1.00 0.00 H new ATOM 0 HB3 ARG A 89 5.240 -12.078 -6.867 1.00 0.00 H new ATOM 0 HG2 ARG A 89 8.231 -11.769 -6.361 1.00 0.00 H new ATOM 0 HG3 ARG A 89 7.093 -12.435 -5.207 1.00 0.00 H new ATOM 0 HD2 ARG A 89 7.769 -13.624 -7.931 1.00 0.00 H new ATOM 0 HD3 ARG A 89 8.333 -14.217 -6.381 1.00 0.00 H new ATOM 0 HE ARG A 89 5.979 -14.767 -5.808 1.00 0.00 H new ATOM 0 HH11 ARG A 89 6.765 -14.454 -9.273 1.00 0.00 H new ATOM 0 HH12 ARG A 89 5.318 -15.342 -9.761 1.00 0.00 H new ATOM 0 HH21 ARG A 89 4.128 -15.801 -6.482 1.00 0.00 H new ATOM 0 HH22 ARG A 89 3.843 -16.096 -8.200 1.00 0.00 H new ATOM 1407 N LEU A 90 4.789 -9.364 -8.878 1.00 0.00 N ATOM 1408 CA LEU A 90 3.582 -8.817 -9.486 1.00 0.00 C ATOM 1409 C LEU A 90 3.745 -8.690 -11.000 1.00 0.00 C ATOM 1410 O LEU A 90 2.777 -8.927 -11.720 1.00 0.00 O ATOM 1411 CB LEU A 90 3.216 -7.469 -8.848 1.00 0.00 C ATOM 1412 CG LEU A 90 2.687 -7.604 -7.407 1.00 0.00 C ATOM 1413 CD1 LEU A 90 2.635 -6.237 -6.718 1.00 0.00 C ATOM 1414 CD2 LEU A 90 1.294 -8.236 -7.355 1.00 0.00 C ATOM 0 H LEU A 90 5.312 -8.693 -8.316 1.00 0.00 H new ATOM 0 HA LEU A 90 2.760 -9.508 -9.299 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.095 -6.824 -8.847 1.00 0.00 H new ATOM 0 HB3 LEU A 90 2.461 -6.977 -9.461 1.00 0.00 H new ATOM 0 HG LEU A 90 3.383 -8.261 -6.884 1.00 0.00 H new ATOM 0 HD11 LEU A 90 2.259 -6.356 -5.702 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.636 -5.807 -6.686 1.00 0.00 H new ATOM 0 HD13 LEU A 90 1.973 -5.574 -7.275 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.966 -8.309 -6.318 1.00 0.00 H new ATOM 0 HD22 LEU A 90 0.593 -7.617 -7.915 1.00 0.00 H new ATOM 0 HD23 LEU A 90 1.330 -9.232 -7.795 1.00 0.00 H new ATOM 1426 N CYS A 91 4.945 -8.383 -11.503 1.00 0.00 N ATOM 1427 CA CYS A 91 5.205 -8.400 -12.938 1.00 0.00 C ATOM 1428 C CYS A 91 5.040 -9.821 -13.493 1.00 0.00 C ATOM 1429 O CYS A 91 4.486 -9.982 -14.577 1.00 0.00 O ATOM 1430 CB CYS A 91 6.609 -7.868 -13.252 1.00 0.00 C ATOM 1431 SG CYS A 91 6.755 -6.124 -12.766 1.00 0.00 S ATOM 0 H CYS A 91 5.749 -8.120 -10.934 1.00 0.00 H new ATOM 0 HA CYS A 91 4.479 -7.745 -13.420 1.00 0.00 H new ATOM 0 HB2 CYS A 91 7.355 -8.462 -12.724 1.00 0.00 H new ATOM 0 HB3 CYS A 91 6.814 -7.973 -14.318 1.00 0.00 H new ATOM 0 HG CYS A 91 6.810 -6.038 -11.470 1.00 0.00 H new ATOM 1437 N GLU A 92 5.482 -10.851 -12.763 1.00 0.00 N ATOM 1438 CA GLU A 92 5.292 -12.240 -13.173 1.00 0.00 C ATOM 1439 C GLU A 92 3.802 -12.620 -13.149 1.00 0.00 C ATOM 1440 O GLU A 92 3.332 -13.307 -14.059 1.00 0.00 O ATOM 1441 CB GLU A 92 6.100 -13.190 -12.274 1.00 0.00 C ATOM 1442 CG GLU A 92 7.617 -13.065 -12.475 1.00 0.00 C ATOM 1443 CD GLU A 92 8.398 -14.024 -11.557 1.00 0.00 C ATOM 1444 OE1 GLU A 92 8.158 -14.032 -10.329 1.00 0.00 O ATOM 1445 OE2 GLU A 92 9.261 -14.778 -12.065 1.00 0.00 O ATOM 0 H GLU A 92 5.978 -10.743 -11.878 1.00 0.00 H new ATOM 0 HA GLU A 92 5.656 -12.340 -14.196 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.860 -12.985 -11.231 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.796 -14.217 -12.475 1.00 0.00 H new ATOM 0 HG2 GLU A 92 7.864 -13.276 -13.515 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.926 -12.039 -12.276 1.00 0.00 H new ATOM 1452 N MET A 93 3.054 -12.165 -12.136 1.00 0.00 N ATOM 1453 CA MET A 93 1.616 -12.427 -12.029 1.00 0.00 C ATOM 1454 C MET A 93 0.838 -11.745 -13.159 1.00 0.00 C ATOM 1455 O MET A 93 -0.116 -12.327 -13.676 1.00 0.00 O ATOM 1456 CB MET A 93 1.079 -11.939 -10.672 1.00 0.00 C ATOM 1457 CG MET A 93 1.504 -12.827 -9.494 1.00 0.00 C ATOM 1458 SD MET A 93 0.764 -14.485 -9.444 1.00 0.00 S ATOM 1459 CE MET A 93 -0.954 -14.077 -9.023 1.00 0.00 C ATOM 0 H MET A 93 3.429 -11.606 -11.370 1.00 0.00 H new ATOM 0 HA MET A 93 1.474 -13.505 -12.111 1.00 0.00 H new ATOM 0 HB2 MET A 93 1.429 -10.922 -10.496 1.00 0.00 H new ATOM 0 HB3 MET A 93 -0.009 -11.899 -10.713 1.00 0.00 H new ATOM 0 HG2 MET A 93 2.588 -12.935 -9.518 1.00 0.00 H new ATOM 0 HG3 MET A 93 1.255 -12.311 -8.567 1.00 0.00 H new ATOM 0 HE1 MET A 93 -1.505 -14.994 -8.816 1.00 0.00 H new ATOM 0 HE2 MET A 93 -0.970 -13.437 -8.141 1.00 0.00 H new ATOM 0 HE3 MET A 93 -1.419 -13.555 -9.859 1.00 0.00 H new ATOM 1469 N ALA A 94 1.227 -10.523 -13.535 1.00 0.00 N ATOM 1470 CA ALA A 94 0.481 -9.703 -14.478 1.00 0.00 C ATOM 1471 C ALA A 94 1.463 -8.870 -15.313 1.00 0.00 C ATOM 1472 O ALA A 94 1.704 -7.703 -14.988 1.00 0.00 O ATOM 1473 CB ALA A 94 -0.513 -8.821 -13.708 1.00 0.00 C ATOM 0 H ALA A 94 2.076 -10.077 -13.187 1.00 0.00 H new ATOM 0 HA ALA A 94 -0.091 -10.329 -15.163 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -1.074 -8.205 -14.411 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -1.203 -9.453 -13.149 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.031 -8.178 -13.016 1.00 0.00 H new ATOM 1479 N PRO A 95 2.030 -9.421 -16.403 1.00 0.00 N ATOM 1480 CA PRO A 95 2.978 -8.691 -17.237 1.00 0.00 C ATOM 1481 C PRO A 95 2.325 -7.505 -17.959 1.00 0.00 C ATOM 1482 O PRO A 95 3.034 -6.602 -18.401 1.00 0.00 O ATOM 1483 CB PRO A 95 3.574 -9.724 -18.197 1.00 0.00 C ATOM 1484 CG PRO A 95 2.492 -10.799 -18.286 1.00 0.00 C ATOM 1485 CD PRO A 95 1.859 -10.781 -16.895 1.00 0.00 C ATOM 0 HA PRO A 95 3.762 -8.231 -16.636 1.00 0.00 H new ATOM 0 HB2 PRO A 95 3.787 -9.288 -19.173 1.00 0.00 H new ATOM 0 HB3 PRO A 95 4.512 -10.130 -17.817 1.00 0.00 H new ATOM 0 HG2 PRO A 95 1.762 -10.571 -19.063 1.00 0.00 H new ATOM 0 HG3 PRO A 95 2.914 -11.776 -18.523 1.00 0.00 H new ATOM 0 HD2 PRO A 95 0.804 -11.051 -16.941 1.00 0.00 H new ATOM 0 HD3 PRO A 95 2.344 -11.500 -16.235 1.00 0.00 H new ATOM 1493 N GLU A 96 0.992 -7.442 -18.035 1.00 0.00 N ATOM 1494 CA GLU A 96 0.270 -6.258 -18.511 1.00 0.00 C ATOM 1495 C GLU A 96 0.605 -5.015 -17.673 1.00 0.00 C ATOM 1496 O GLU A 96 0.511 -3.890 -18.164 1.00 0.00 O ATOM 1497 CB GLU A 96 -1.244 -6.518 -18.439 1.00 0.00 C ATOM 1498 CG GLU A 96 -1.668 -7.772 -19.212 1.00 0.00 C ATOM 1499 CD GLU A 96 -3.187 -7.975 -19.176 1.00 0.00 C ATOM 1500 OE1 GLU A 96 -3.922 -7.284 -19.915 1.00 0.00 O ATOM 1501 OE2 GLU A 96 -3.661 -8.869 -18.437 1.00 0.00 O ATOM 0 H GLU A 96 0.381 -8.214 -17.767 1.00 0.00 H new ATOM 0 HA GLU A 96 0.577 -6.070 -19.540 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -1.541 -6.622 -17.395 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -1.776 -5.654 -18.837 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.336 -7.691 -20.247 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -1.174 -8.646 -18.787 1.00 0.00 H new ATOM 1508 N MET A 97 1.017 -5.223 -16.417 1.00 0.00 N ATOM 1509 CA MET A 97 1.298 -4.176 -15.441 1.00 0.00 C ATOM 1510 C MET A 97 2.809 -4.028 -15.206 1.00 0.00 C ATOM 1511 O MET A 97 3.211 -3.385 -14.236 1.00 0.00 O ATOM 1512 CB MET A 97 0.537 -4.470 -14.130 1.00 0.00 C ATOM 1513 CG MET A 97 -0.979 -4.647 -14.312 1.00 0.00 C ATOM 1514 SD MET A 97 -1.869 -3.234 -15.031 1.00 0.00 S ATOM 1515 CE MET A 97 -1.919 -2.109 -13.609 1.00 0.00 C ATOM 0 H MET A 97 1.168 -6.160 -16.044 1.00 0.00 H new ATOM 0 HA MET A 97 0.947 -3.221 -15.833 1.00 0.00 H new ATOM 0 HB2 MET A 97 0.946 -5.374 -13.680 1.00 0.00 H new ATOM 0 HB3 MET A 97 0.715 -3.655 -13.428 1.00 0.00 H new ATOM 0 HG2 MET A 97 -1.149 -5.518 -14.945 1.00 0.00 H new ATOM 0 HG3 MET A 97 -1.418 -4.870 -13.339 1.00 0.00 H new ATOM 0 HE1 MET A 97 -2.306 -1.140 -13.925 1.00 0.00 H new ATOM 0 HE2 MET A 97 -2.568 -2.525 -12.838 1.00 0.00 H new ATOM 0 HE3 MET A 97 -0.913 -1.984 -13.208 1.00 0.00 H new ATOM 1525 N ARG A 98 3.671 -4.593 -16.069 1.00 0.00 N ATOM 1526 CA ARG A 98 5.125 -4.619 -15.844 1.00 0.00 C ATOM 1527 C ARG A 98 5.758 -3.233 -15.660 1.00 0.00 C ATOM 1528 O ARG A 98 6.803 -3.129 -15.020 1.00 0.00 O ATOM 1529 CB ARG A 98 5.834 -5.435 -16.944 1.00 0.00 C ATOM 1530 CG ARG A 98 5.969 -4.694 -18.288 1.00 0.00 C ATOM 1531 CD ARG A 98 6.457 -5.612 -19.416 1.00 0.00 C ATOM 1532 NE ARG A 98 5.356 -6.415 -19.970 1.00 0.00 N ATOM 1533 CZ ARG A 98 5.397 -7.157 -21.082 1.00 0.00 C ATOM 1534 NH1 ARG A 98 6.534 -7.312 -21.756 1.00 0.00 N ATOM 1535 NH2 ARG A 98 4.283 -7.739 -21.516 1.00 0.00 N ATOM 0 H ARG A 98 3.381 -5.042 -16.938 1.00 0.00 H new ATOM 0 HA ARG A 98 5.274 -5.121 -14.888 1.00 0.00 H new ATOM 0 HB2 ARG A 98 6.828 -5.712 -16.592 1.00 0.00 H new ATOM 0 HB3 ARG A 98 5.284 -6.362 -17.106 1.00 0.00 H new ATOM 0 HG2 ARG A 98 5.005 -4.267 -18.563 1.00 0.00 H new ATOM 0 HG3 ARG A 98 6.665 -3.863 -18.173 1.00 0.00 H new ATOM 0 HD2 ARG A 98 6.905 -5.011 -20.208 1.00 0.00 H new ATOM 0 HD3 ARG A 98 7.237 -6.273 -19.037 1.00 0.00 H new ATOM 0 HE ARG A 98 4.475 -6.405 -19.456 1.00 0.00 H new ATOM 0 HH11 ARG A 98 7.388 -6.862 -21.426 1.00 0.00 H new ATOM 0 HH12 ARG A 98 6.552 -7.881 -22.603 1.00 0.00 H new ATOM 0 HH21 ARG A 98 3.410 -7.617 -21.002 1.00 0.00 H new ATOM 0 HH22 ARG A 98 4.301 -8.307 -22.363 1.00 0.00 H new ATOM 1549 N GLY A 99 5.130 -2.176 -16.188 1.00 0.00 N ATOM 1550 CA GLY A 99 5.564 -0.787 -16.037 1.00 0.00 C ATOM 1551 C GLY A 99 4.565 0.050 -15.232 1.00 0.00 C ATOM 1552 O GLY A 99 4.592 1.278 -15.320 1.00 0.00 O ATOM 0 H GLY A 99 4.282 -2.269 -16.747 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.535 -0.764 -15.543 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.697 -0.341 -17.023 1.00 0.00 H new ATOM 1556 N LYS A 100 3.666 -0.596 -14.475 1.00 0.00 N ATOM 1557 CA LYS A 100 2.556 0.041 -13.753 1.00 0.00 C ATOM 1558 C LYS A 100 2.525 -0.374 -12.278 1.00 0.00 C ATOM 1559 O LYS A 100 1.737 0.180 -11.513 1.00 0.00 O ATOM 1560 CB LYS A 100 1.221 -0.260 -14.459 1.00 0.00 C ATOM 1561 CG LYS A 100 1.215 0.182 -15.934 1.00 0.00 C ATOM 1562 CD LYS A 100 -0.128 -0.063 -16.633 1.00 0.00 C ATOM 1563 CE LYS A 100 -1.215 0.883 -16.102 1.00 0.00 C ATOM 1564 NZ LYS A 100 -2.502 0.767 -16.832 1.00 0.00 N ATOM 0 H LYS A 100 3.693 -1.607 -14.345 1.00 0.00 H new ATOM 0 HA LYS A 100 2.714 1.119 -13.768 1.00 0.00 H new ATOM 0 HB2 LYS A 100 1.019 -1.330 -14.404 1.00 0.00 H new ATOM 0 HB3 LYS A 100 0.413 0.245 -13.930 1.00 0.00 H new ATOM 0 HG2 LYS A 100 1.458 1.243 -15.989 1.00 0.00 H new ATOM 0 HG3 LYS A 100 1.999 -0.353 -16.470 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -0.012 0.079 -17.707 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -0.437 -1.097 -16.480 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -1.384 0.674 -15.046 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -0.858 1.911 -16.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -3.165 1.488 -16.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -2.338 0.910 -17.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -2.906 -0.179 -16.676 1.00 0.00 H new ATOM 1578 N VAL A 101 3.354 -1.342 -11.879 1.00 0.00 N ATOM 1579 CA VAL A 101 3.593 -1.656 -10.472 1.00 0.00 C ATOM 1580 C VAL A 101 4.828 -0.833 -10.078 1.00 0.00 C ATOM 1581 O VAL A 101 5.810 -0.836 -10.825 1.00 0.00 O ATOM 1582 CB VAL A 101 3.843 -3.168 -10.280 1.00 0.00 C ATOM 1583 CG1 VAL A 101 4.035 -3.501 -8.793 1.00 0.00 C ATOM 1584 CG2 VAL A 101 2.703 -4.051 -10.813 1.00 0.00 C ATOM 0 H VAL A 101 3.879 -1.930 -12.526 1.00 0.00 H new ATOM 0 HA VAL A 101 2.733 -1.412 -9.848 1.00 0.00 H new ATOM 0 HB VAL A 101 4.743 -3.385 -10.855 1.00 0.00 H new ATOM 0 HG11 VAL A 101 4.210 -4.571 -8.679 1.00 0.00 H new ATOM 0 HG12 VAL A 101 4.892 -2.950 -8.404 1.00 0.00 H new ATOM 0 HG13 VAL A 101 3.140 -3.219 -8.238 1.00 0.00 H new ATOM 0 HG21 VAL A 101 2.946 -5.100 -10.645 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.778 -3.805 -10.292 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.575 -3.875 -11.881 1.00 0.00 H new ATOM 1594 N MET A 102 4.813 -0.141 -8.929 1.00 0.00 N ATOM 1595 CA MET A 102 5.952 0.664 -8.470 1.00 0.00 C ATOM 1596 C MET A 102 6.111 0.590 -6.950 1.00 0.00 C ATOM 1597 O MET A 102 5.202 0.164 -6.234 1.00 0.00 O ATOM 1598 CB MET A 102 5.798 2.127 -8.928 1.00 0.00 C ATOM 1599 CG MET A 102 5.999 2.261 -10.441 1.00 0.00 C ATOM 1600 SD MET A 102 6.122 3.962 -11.062 1.00 0.00 S ATOM 1601 CE MET A 102 4.386 4.471 -10.954 1.00 0.00 C ATOM 0 H MET A 102 4.014 -0.124 -8.295 1.00 0.00 H new ATOM 0 HA MET A 102 6.855 0.251 -8.919 1.00 0.00 H new ATOM 0 HB2 MET A 102 4.808 2.493 -8.657 1.00 0.00 H new ATOM 0 HB3 MET A 102 6.523 2.752 -8.406 1.00 0.00 H new ATOM 0 HG2 MET A 102 6.906 1.724 -10.719 1.00 0.00 H new ATOM 0 HG3 MET A 102 5.169 1.767 -10.946 1.00 0.00 H new ATOM 0 HE1 MET A 102 4.286 5.500 -11.301 1.00 0.00 H new ATOM 0 HE2 MET A 102 3.776 3.817 -11.577 1.00 0.00 H new ATOM 0 HE3 MET A 102 4.051 4.403 -9.919 1.00 0.00 H new ATOM 1611 N LEU A 103 7.287 0.985 -6.455 1.00 0.00 N ATOM 1612 CA LEU A 103 7.600 0.943 -5.031 1.00 0.00 C ATOM 1613 C LEU A 103 6.850 2.055 -4.295 1.00 0.00 C ATOM 1614 O LEU A 103 6.890 3.213 -4.714 1.00 0.00 O ATOM 1615 CB LEU A 103 9.120 1.118 -4.850 1.00 0.00 C ATOM 1616 CG LEU A 103 9.634 0.718 -3.456 1.00 0.00 C ATOM 1617 CD1 LEU A 103 9.524 -0.793 -3.212 1.00 0.00 C ATOM 1618 CD2 LEU A 103 11.098 1.143 -3.345 1.00 0.00 C ATOM 0 H LEU A 103 8.047 1.343 -7.034 1.00 0.00 H new ATOM 0 HA LEU A 103 7.289 -0.015 -4.615 1.00 0.00 H new ATOM 0 HB2 LEU A 103 9.636 0.521 -5.602 1.00 0.00 H new ATOM 0 HB3 LEU A 103 9.380 2.160 -5.037 1.00 0.00 H new ATOM 0 HG LEU A 103 9.020 1.215 -2.705 1.00 0.00 H new ATOM 0 HD11 LEU A 103 9.898 -1.029 -2.216 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.481 -1.099 -3.290 1.00 0.00 H new ATOM 0 HD13 LEU A 103 10.115 -1.326 -3.957 1.00 0.00 H new ATOM 0 HD21 LEU A 103 11.483 0.869 -2.363 1.00 0.00 H new ATOM 0 HD22 LEU A 103 11.682 0.642 -4.117 1.00 0.00 H new ATOM 0 HD23 LEU A 103 11.174 2.222 -3.476 1.00 0.00 H new ATOM 1630 N PHE A 104 6.219 1.729 -3.168 1.00 0.00 N ATOM 1631 CA PHE A 104 5.493 2.700 -2.362 1.00 0.00 C ATOM 1632 C PHE A 104 6.446 3.778 -1.833 1.00 0.00 C ATOM 1633 O PHE A 104 6.130 4.963 -1.917 1.00 0.00 O ATOM 1634 CB PHE A 104 4.751 1.984 -1.219 1.00 0.00 C ATOM 1635 CG PHE A 104 3.552 2.765 -0.717 1.00 0.00 C ATOM 1636 CD1 PHE A 104 3.692 3.770 0.257 1.00 0.00 C ATOM 1637 CD2 PHE A 104 2.288 2.517 -1.277 1.00 0.00 C ATOM 1638 CE1 PHE A 104 2.582 4.556 0.622 1.00 0.00 C ATOM 1639 CE2 PHE A 104 1.192 3.326 -0.948 1.00 0.00 C ATOM 1640 CZ PHE A 104 1.339 4.356 -0.006 1.00 0.00 C ATOM 0 H PHE A 104 6.199 0.782 -2.790 1.00 0.00 H new ATOM 0 HA PHE A 104 4.750 3.199 -2.984 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.422 1.004 -1.563 1.00 0.00 H new ATOM 0 HB3 PHE A 104 5.442 1.816 -0.393 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.651 3.939 0.725 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.160 1.696 -1.967 1.00 0.00 H new ATOM 0 HE1 PHE A 104 2.685 5.313 1.385 1.00 0.00 H new ATOM 0 HE2 PHE A 104 0.235 3.157 -1.419 1.00 0.00 H new ATOM 0 HZ PHE A 104 0.501 4.993 0.236 1.00 0.00 H new ATOM 1650 N GLY A 105 7.640 3.380 -1.375 1.00 0.00 N ATOM 1651 CA GLY A 105 8.632 4.294 -0.812 1.00 0.00 C ATOM 1652 C GLY A 105 9.544 4.928 -1.865 1.00 0.00 C ATOM 1653 O GLY A 105 10.640 5.369 -1.525 1.00 0.00 O ATOM 0 H GLY A 105 7.943 2.406 -1.387 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.118 5.084 -0.265 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.244 3.753 -0.090 1.00 0.00 H new ATOM 1657 N HIS A 106 9.135 4.949 -3.142 1.00 0.00 N ATOM 1658 CA HIS A 106 9.916 5.480 -4.260 1.00 0.00 C ATOM 1659 C HIS A 106 10.517 6.860 -3.958 1.00 0.00 C ATOM 1660 O HIS A 106 11.698 7.092 -4.222 1.00 0.00 O ATOM 1661 CB HIS A 106 9.028 5.509 -5.511 1.00 0.00 C ATOM 1662 CG HIS A 106 9.571 6.313 -6.668 1.00 0.00 C ATOM 1663 ND1 HIS A 106 10.538 5.924 -7.571 1.00 0.00 N ATOM 1664 CD2 HIS A 106 9.178 7.578 -7.022 1.00 0.00 C ATOM 1665 CE1 HIS A 106 10.727 6.933 -8.437 1.00 0.00 C ATOM 1666 NE2 HIS A 106 9.918 7.968 -8.146 1.00 0.00 N ATOM 0 H HIS A 106 8.226 4.586 -3.430 1.00 0.00 H new ATOM 0 HA HIS A 106 10.769 4.823 -4.432 1.00 0.00 H new ATOM 0 HB2 HIS A 106 8.866 4.484 -5.846 1.00 0.00 H new ATOM 0 HB3 HIS A 106 8.053 5.912 -5.236 1.00 0.00 H new ATOM 0 HD1 HIS A 106 11.024 5.027 -7.580 1.00 0.00 H new ATOM 0 HD2 HIS A 106 8.428 8.171 -6.521 1.00 0.00 H new ATOM 0 HE1 HIS A 106 11.432 6.916 -9.255 1.00 0.00 H new ATOM 1674 N TRP A 107 9.717 7.761 -3.380 1.00 0.00 N ATOM 1675 CA TRP A 107 10.129 9.142 -3.137 1.00 0.00 C ATOM 1676 C TRP A 107 11.301 9.240 -2.158 1.00 0.00 C ATOM 1677 O TRP A 107 12.137 10.136 -2.286 1.00 0.00 O ATOM 1678 CB TRP A 107 8.925 9.923 -2.604 1.00 0.00 C ATOM 1679 CG TRP A 107 7.685 9.754 -3.425 1.00 0.00 C ATOM 1680 CD1 TRP A 107 6.623 8.986 -3.097 1.00 0.00 C ATOM 1681 CD2 TRP A 107 7.380 10.316 -4.738 1.00 0.00 C ATOM 1682 NE1 TRP A 107 5.689 9.040 -4.102 1.00 0.00 N ATOM 1683 CE2 TRP A 107 6.101 9.837 -5.147 1.00 0.00 C ATOM 1684 CE3 TRP A 107 8.064 11.168 -5.632 1.00 0.00 C ATOM 1685 CZ2 TRP A 107 5.531 10.186 -6.380 1.00 0.00 C ATOM 1686 CZ3 TRP A 107 7.500 11.525 -6.872 1.00 0.00 C ATOM 1687 CH2 TRP A 107 6.237 11.034 -7.247 1.00 0.00 C ATOM 0 H TRP A 107 8.768 7.552 -3.069 1.00 0.00 H new ATOM 0 HA TRP A 107 10.476 9.567 -4.079 1.00 0.00 H new ATOM 0 HB2 TRP A 107 8.720 9.603 -1.582 1.00 0.00 H new ATOM 0 HB3 TRP A 107 9.180 10.982 -2.562 1.00 0.00 H new ATOM 0 HD1 TRP A 107 6.524 8.417 -2.184 1.00 0.00 H new ATOM 0 HE1 TRP A 107 4.796 8.548 -4.078 1.00 0.00 H new ATOM 0 HE3 TRP A 107 9.036 11.552 -5.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 4.559 9.806 -6.659 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 8.041 12.180 -7.539 1.00 0.00 H new ATOM 0 HH2 TRP A 107 5.811 11.309 -8.201 1.00 0.00 H new ATOM 1698 N ASP A 108 11.377 8.319 -1.196 1.00 0.00 N ATOM 1699 CA ASP A 108 12.446 8.284 -0.204 1.00 0.00 C ATOM 1700 C ASP A 108 13.624 7.483 -0.764 1.00 0.00 C ATOM 1701 O ASP A 108 13.954 6.413 -0.258 1.00 0.00 O ATOM 1702 CB ASP A 108 11.926 7.733 1.134 1.00 0.00 C ATOM 1703 CG ASP A 108 13.018 7.741 2.224 1.00 0.00 C ATOM 1704 OD1 ASP A 108 13.842 8.684 2.265 1.00 0.00 O ATOM 1705 OD2 ASP A 108 13.007 6.847 3.099 1.00 0.00 O ATOM 0 H ASP A 108 10.692 7.572 -1.085 1.00 0.00 H new ATOM 0 HA ASP A 108 12.801 9.294 0.003 1.00 0.00 H new ATOM 0 HB2 ASP A 108 11.077 8.330 1.467 1.00 0.00 H new ATOM 0 HB3 ASP A 108 11.564 6.715 0.991 1.00 0.00 H new ATOM 1710 N ASN A 109 14.216 7.986 -1.856 1.00 0.00 N ATOM 1711 CA ASN A 109 15.362 7.369 -2.538 1.00 0.00 C ATOM 1712 C ASN A 109 15.170 5.862 -2.797 1.00 0.00 C ATOM 1713 O ASN A 109 16.077 5.053 -2.595 1.00 0.00 O ATOM 1714 CB ASN A 109 16.668 7.721 -1.798 1.00 0.00 C ATOM 1715 CG ASN A 109 17.916 7.323 -2.585 1.00 0.00 C ATOM 1716 OD1 ASN A 109 18.749 6.550 -2.116 1.00 0.00 O ATOM 1717 ND2 ASN A 109 18.099 7.861 -3.781 1.00 0.00 N ATOM 0 H ASN A 109 13.905 8.851 -2.299 1.00 0.00 H new ATOM 0 HA ASN A 109 15.436 7.794 -3.539 1.00 0.00 H new ATOM 0 HB2 ASN A 109 16.693 8.793 -1.603 1.00 0.00 H new ATOM 0 HB3 ASN A 109 16.679 7.220 -0.830 1.00 0.00 H new ATOM 0 HD21 ASN A 109 18.935 7.635 -4.319 1.00 0.00 H new ATOM 0 HD22 ASN A 109 17.404 8.502 -4.164 1.00 0.00 H new ATOM 1724 N GLU A 110 13.961 5.501 -3.245 1.00 0.00 N ATOM 1725 CA GLU A 110 13.544 4.119 -3.497 1.00 0.00 C ATOM 1726 C GLU A 110 13.893 3.138 -2.370 1.00 0.00 C ATOM 1727 O GLU A 110 14.289 1.995 -2.611 1.00 0.00 O ATOM 1728 CB GLU A 110 13.978 3.646 -4.897 1.00 0.00 C ATOM 1729 CG GLU A 110 13.519 4.629 -5.982 1.00 0.00 C ATOM 1730 CD GLU A 110 13.468 3.986 -7.376 1.00 0.00 C ATOM 1731 OE1 GLU A 110 14.533 3.711 -7.975 1.00 0.00 O ATOM 1732 OE2 GLU A 110 12.344 3.783 -7.888 1.00 0.00 O ATOM 0 H GLU A 110 13.228 6.181 -3.447 1.00 0.00 H new ATOM 0 HA GLU A 110 12.454 4.124 -3.494 1.00 0.00 H new ATOM 0 HB2 GLU A 110 15.063 3.545 -4.929 1.00 0.00 H new ATOM 0 HB3 GLU A 110 13.560 2.659 -5.096 1.00 0.00 H new ATOM 0 HG2 GLU A 110 12.531 5.012 -5.726 1.00 0.00 H new ATOM 0 HG3 GLU A 110 14.196 5.483 -6.004 1.00 0.00 H new ATOM 1739 N CYS A 111 13.745 3.593 -1.130 1.00 0.00 N ATOM 1740 CA CYS A 111 13.844 2.725 0.031 1.00 0.00 C ATOM 1741 C CYS A 111 12.613 1.820 0.070 1.00 0.00 C ATOM 1742 O CYS A 111 11.477 2.303 0.079 1.00 0.00 O ATOM 1743 CB CYS A 111 13.942 3.558 1.311 1.00 0.00 C ATOM 1744 SG CYS A 111 15.641 4.171 1.529 1.00 0.00 S ATOM 0 H CYS A 111 13.554 4.569 -0.905 1.00 0.00 H new ATOM 0 HA CYS A 111 14.744 2.114 -0.039 1.00 0.00 H new ATOM 0 HB2 CYS A 111 13.248 4.397 1.262 1.00 0.00 H new ATOM 0 HB3 CYS A 111 13.652 2.954 2.171 1.00 0.00 H new ATOM 0 HG CYS A 111 15.711 4.878 2.617 1.00 0.00 H new ATOM 1750 N GLU A 112 12.837 0.507 0.097 1.00 0.00 N ATOM 1751 CA GLU A 112 11.780 -0.458 0.359 1.00 0.00 C ATOM 1752 C GLU A 112 11.314 -0.305 1.812 1.00 0.00 C ATOM 1753 O GLU A 112 12.067 0.168 2.672 1.00 0.00 O ATOM 1754 CB GLU A 112 12.253 -1.892 0.041 1.00 0.00 C ATOM 1755 CG GLU A 112 13.373 -2.480 0.922 1.00 0.00 C ATOM 1756 CD GLU A 112 14.756 -1.813 0.778 1.00 0.00 C ATOM 1757 OE1 GLU A 112 15.049 -1.216 -0.284 1.00 0.00 O ATOM 1758 OE2 GLU A 112 15.565 -1.894 1.730 1.00 0.00 O ATOM 0 H GLU A 112 13.753 0.088 -0.062 1.00 0.00 H new ATOM 0 HA GLU A 112 10.930 -0.264 -0.295 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.390 -2.554 0.107 1.00 0.00 H new ATOM 0 HB3 GLU A 112 12.593 -1.913 -0.995 1.00 0.00 H new ATOM 0 HG2 GLU A 112 13.064 -2.411 1.965 1.00 0.00 H new ATOM 0 HG3 GLU A 112 13.475 -3.540 0.689 1.00 0.00 H new ATOM 1765 N ILE A 113 10.072 -0.701 2.086 1.00 0.00 N ATOM 1766 CA ILE A 113 9.435 -0.470 3.378 1.00 0.00 C ATOM 1767 C ILE A 113 9.487 -1.801 4.151 1.00 0.00 C ATOM 1768 O ILE A 113 9.134 -2.834 3.570 1.00 0.00 O ATOM 1769 CB ILE A 113 8.016 0.113 3.160 1.00 0.00 C ATOM 1770 CG1 ILE A 113 8.144 1.459 2.395 1.00 0.00 C ATOM 1771 CG2 ILE A 113 7.256 0.276 4.490 1.00 0.00 C ATOM 1772 CD1 ILE A 113 6.863 2.290 2.278 1.00 0.00 C ATOM 0 H ILE A 113 9.480 -1.192 1.416 1.00 0.00 H new ATOM 0 HA ILE A 113 9.949 0.276 3.983 1.00 0.00 H new ATOM 0 HB ILE A 113 7.427 -0.583 2.563 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.902 2.065 2.891 1.00 0.00 H new ATOM 0 HG13 ILE A 113 8.510 1.249 1.390 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.266 0.687 4.295 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.157 -0.696 4.974 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.807 0.952 5.144 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.073 3.206 1.725 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.103 1.714 1.751 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.501 2.542 3.275 1.00 0.00 H new ATOM 1784 N PRO A 114 9.947 -1.812 5.423 1.00 0.00 N ATOM 1785 CA PRO A 114 10.007 -3.012 6.259 1.00 0.00 C ATOM 1786 C PRO A 114 8.655 -3.720 6.392 1.00 0.00 C ATOM 1787 O PRO A 114 7.616 -3.172 6.022 1.00 0.00 O ATOM 1788 CB PRO A 114 10.513 -2.557 7.634 1.00 0.00 C ATOM 1789 CG PRO A 114 11.235 -1.245 7.348 1.00 0.00 C ATOM 1790 CD PRO A 114 10.456 -0.669 6.169 1.00 0.00 C ATOM 0 HA PRO A 114 10.671 -3.744 5.798 1.00 0.00 H new ATOM 0 HB2 PRO A 114 9.690 -2.415 8.335 1.00 0.00 H new ATOM 0 HB3 PRO A 114 11.184 -3.294 8.076 1.00 0.00 H new ATOM 0 HG2 PRO A 114 11.214 -0.577 8.209 1.00 0.00 H new ATOM 0 HG3 PRO A 114 12.283 -1.408 7.097 1.00 0.00 H new ATOM 0 HD2 PRO A 114 9.640 -0.034 6.514 1.00 0.00 H new ATOM 0 HD3 PRO A 114 11.098 -0.050 5.543 1.00 0.00 H new ATOM 1798 N ASP A 115 8.656 -4.918 6.981 1.00 0.00 N ATOM 1799 CA ASP A 115 7.459 -5.730 7.199 1.00 0.00 C ATOM 1800 C ASP A 115 7.251 -5.926 8.704 1.00 0.00 C ATOM 1801 O ASP A 115 8.068 -6.608 9.329 1.00 0.00 O ATOM 1802 CB ASP A 115 7.597 -7.089 6.505 1.00 0.00 C ATOM 1803 CG ASP A 115 6.429 -8.026 6.860 1.00 0.00 C ATOM 1804 OD1 ASP A 115 5.326 -7.529 7.184 1.00 0.00 O ATOM 1805 OD2 ASP A 115 6.631 -9.260 6.809 1.00 0.00 O ATOM 0 H ASP A 115 9.508 -5.359 7.327 1.00 0.00 H new ATOM 0 HA ASP A 115 6.596 -5.217 6.774 1.00 0.00 H new ATOM 0 HB2 ASP A 115 7.634 -6.945 5.425 1.00 0.00 H new ATOM 0 HB3 ASP A 115 8.539 -7.554 6.797 1.00 0.00 H new ATOM 1810 N PRO A 116 6.216 -5.323 9.314 1.00 0.00 N ATOM 1811 CA PRO A 116 5.981 -5.407 10.747 1.00 0.00 C ATOM 1812 C PRO A 116 5.177 -6.652 11.162 1.00 0.00 C ATOM 1813 O PRO A 116 5.042 -6.856 12.362 1.00 0.00 O ATOM 1814 CB PRO A 116 5.209 -4.125 11.076 1.00 0.00 C ATOM 1815 CG PRO A 116 4.340 -3.930 9.835 1.00 0.00 C ATOM 1816 CD PRO A 116 5.250 -4.417 8.707 1.00 0.00 C ATOM 0 HA PRO A 116 6.921 -5.500 11.291 1.00 0.00 H new ATOM 0 HB2 PRO A 116 4.608 -4.235 11.979 1.00 0.00 H new ATOM 0 HB3 PRO A 116 5.878 -3.280 11.239 1.00 0.00 H new ATOM 0 HG2 PRO A 116 3.419 -4.510 9.891 1.00 0.00 H new ATOM 0 HG3 PRO A 116 4.053 -2.887 9.702 1.00 0.00 H new ATOM 0 HD2 PRO A 116 4.672 -4.926 7.936 1.00 0.00 H new ATOM 0 HD3 PRO A 116 5.754 -3.579 8.226 1.00 0.00 H new ATOM 1824 N TYR A 117 4.660 -7.456 10.218 1.00 0.00 N ATOM 1825 CA TYR A 117 3.699 -8.565 10.357 1.00 0.00 C ATOM 1826 C TYR A 117 3.128 -8.867 11.759 1.00 0.00 C ATOM 1827 O TYR A 117 1.937 -8.637 11.968 1.00 0.00 O ATOM 1828 CB TYR A 117 4.256 -9.837 9.701 1.00 0.00 C ATOM 1829 CG TYR A 117 3.237 -10.958 9.572 1.00 0.00 C ATOM 1830 CD1 TYR A 117 2.088 -10.775 8.776 1.00 0.00 C ATOM 1831 CD2 TYR A 117 3.430 -12.179 10.248 1.00 0.00 C ATOM 1832 CE1 TYR A 117 1.129 -11.799 8.665 1.00 0.00 C ATOM 1833 CE2 TYR A 117 2.477 -13.208 10.140 1.00 0.00 C ATOM 1834 CZ TYR A 117 1.318 -13.020 9.349 1.00 0.00 C ATOM 1835 OH TYR A 117 0.384 -14.007 9.237 1.00 0.00 O ATOM 0 H TYR A 117 4.931 -7.334 9.242 1.00 0.00 H new ATOM 0 HA TYR A 117 2.820 -8.195 9.830 1.00 0.00 H new ATOM 0 HB2 TYR A 117 4.635 -9.587 8.710 1.00 0.00 H new ATOM 0 HB3 TYR A 117 5.104 -10.195 10.286 1.00 0.00 H new ATOM 0 HD1 TYR A 117 1.943 -9.844 8.248 1.00 0.00 H new ATOM 0 HD2 TYR A 117 4.313 -12.326 10.852 1.00 0.00 H new ATOM 0 HE1 TYR A 117 0.249 -11.651 8.057 1.00 0.00 H new ATOM 0 HE2 TYR A 117 2.630 -14.142 10.661 1.00 0.00 H new ATOM 0 HH TYR A 117 0.663 -14.783 9.767 1.00 0.00 H new ATOM 1845 N ARG A 118 3.926 -9.389 12.706 1.00 0.00 N ATOM 1846 CA ARG A 118 3.480 -9.696 14.079 1.00 0.00 C ATOM 1847 C ARG A 118 4.507 -9.224 15.127 1.00 0.00 C ATOM 1848 O ARG A 118 4.539 -9.729 16.251 1.00 0.00 O ATOM 1849 CB ARG A 118 3.181 -11.211 14.194 1.00 0.00 C ATOM 1850 CG ARG A 118 1.847 -11.671 13.573 1.00 0.00 C ATOM 1851 CD ARG A 118 0.605 -10.964 14.139 1.00 0.00 C ATOM 1852 NE ARG A 118 0.592 -10.941 15.617 1.00 0.00 N ATOM 1853 CZ ARG A 118 0.479 -9.844 16.381 1.00 0.00 C ATOM 1854 NH1 ARG A 118 0.111 -8.684 15.853 1.00 0.00 N ATOM 1855 NH2 ARG A 118 0.748 -9.912 17.681 1.00 0.00 N ATOM 0 H ARG A 118 4.907 -9.612 12.540 1.00 0.00 H new ATOM 0 HA ARG A 118 2.562 -9.147 14.287 1.00 0.00 H new ATOM 0 HB2 ARG A 118 3.993 -11.761 13.718 1.00 0.00 H new ATOM 0 HB3 ARG A 118 3.185 -11.486 15.249 1.00 0.00 H new ATOM 0 HG2 ARG A 118 1.885 -11.505 12.496 1.00 0.00 H new ATOM 0 HG3 ARG A 118 1.740 -12.745 13.726 1.00 0.00 H new ATOM 0 HD2 ARG A 118 0.569 -9.942 13.762 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -0.292 -11.468 13.779 1.00 0.00 H new ATOM 0 HE ARG A 118 0.676 -11.837 16.098 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -0.090 -8.619 14.855 1.00 0.00 H new ATOM 0 HH12 ARG A 118 0.029 -7.857 16.445 1.00 0.00 H new ATOM 0 HH21 ARG A 118 1.040 -10.797 18.096 1.00 0.00 H new ATOM 0 HH22 ARG A 118 0.663 -9.079 18.264 1.00 0.00 H new ATOM 1869 N LYS A 119 5.387 -8.297 14.744 1.00 0.00 N ATOM 1870 CA LYS A 119 6.479 -7.807 15.586 1.00 0.00 C ATOM 1871 C LYS A 119 5.943 -6.808 16.624 1.00 0.00 C ATOM 1872 O LYS A 119 4.736 -6.566 16.706 1.00 0.00 O ATOM 1873 CB LYS A 119 7.557 -7.189 14.672 1.00 0.00 C ATOM 1874 CG LYS A 119 8.166 -8.230 13.711 1.00 0.00 C ATOM 1875 CD LYS A 119 9.061 -7.573 12.657 1.00 0.00 C ATOM 1876 CE LYS A 119 9.604 -8.632 11.687 1.00 0.00 C ATOM 1877 NZ LYS A 119 10.236 -8.018 10.494 1.00 0.00 N ATOM 0 H LYS A 119 5.360 -7.858 13.824 1.00 0.00 H new ATOM 0 HA LYS A 119 6.931 -8.624 16.148 1.00 0.00 H new ATOM 0 HB2 LYS A 119 7.119 -6.375 14.094 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.347 -6.756 15.285 1.00 0.00 H new ATOM 0 HG2 LYS A 119 8.747 -8.955 14.281 1.00 0.00 H new ATOM 0 HG3 LYS A 119 7.366 -8.781 13.217 1.00 0.00 H new ATOM 0 HD2 LYS A 119 8.495 -6.821 12.107 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.889 -7.056 13.143 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.333 -9.257 12.203 1.00 0.00 H new ATOM 0 HE3 LYS A 119 8.791 -9.286 11.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 10.620 -8.765 9.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 9.526 -7.470 9.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 11.007 -7.388 10.795 1.00 0.00 H new ATOM 1891 N SER A 120 6.838 -6.236 17.431 1.00 0.00 N ATOM 1892 CA SER A 120 6.481 -5.263 18.459 1.00 0.00 C ATOM 1893 C SER A 120 5.844 -4.010 17.840 1.00 0.00 C ATOM 1894 O SER A 120 6.136 -3.668 16.688 1.00 0.00 O ATOM 1895 CB SER A 120 7.749 -4.898 19.246 1.00 0.00 C ATOM 1896 OG SER A 120 8.449 -6.071 19.646 1.00 0.00 O ATOM 0 H SER A 120 7.837 -6.438 17.388 1.00 0.00 H new ATOM 0 HA SER A 120 5.742 -5.700 19.130 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.397 -4.274 18.631 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.481 -4.311 20.125 1.00 0.00 H new ATOM 0 HG SER A 120 9.254 -5.818 20.144 1.00 0.00 H new ATOM 1902 N ARG A 121 5.024 -3.283 18.615 1.00 0.00 N ATOM 1903 CA ARG A 121 4.323 -2.091 18.116 1.00 0.00 C ATOM 1904 C ARG A 121 5.271 -0.990 17.642 1.00 0.00 C ATOM 1905 O ARG A 121 4.883 -0.202 16.787 1.00 0.00 O ATOM 1906 CB ARG A 121 3.292 -1.540 19.123 1.00 0.00 C ATOM 1907 CG ARG A 121 3.888 -0.973 20.425 1.00 0.00 C ATOM 1908 CD ARG A 121 2.870 -0.136 21.216 1.00 0.00 C ATOM 1909 NE ARG A 121 2.528 1.141 20.551 1.00 0.00 N ATOM 1910 CZ ARG A 121 3.289 2.245 20.508 1.00 0.00 C ATOM 1911 NH1 ARG A 121 4.503 2.261 21.058 1.00 0.00 N ATOM 1912 NH2 ARG A 121 2.836 3.342 19.913 1.00 0.00 N ATOM 0 H ARG A 121 4.830 -3.501 19.592 1.00 0.00 H new ATOM 0 HA ARG A 121 3.772 -2.434 17.240 1.00 0.00 H new ATOM 0 HB2 ARG A 121 2.714 -0.755 18.635 1.00 0.00 H new ATOM 0 HB3 ARG A 121 2.595 -2.338 19.378 1.00 0.00 H new ATOM 0 HG2 ARG A 121 4.242 -1.794 21.048 1.00 0.00 H new ATOM 0 HG3 ARG A 121 4.755 -0.357 20.187 1.00 0.00 H new ATOM 0 HD2 ARG A 121 1.961 -0.720 21.358 1.00 0.00 H new ATOM 0 HD3 ARG A 121 3.272 0.074 22.207 1.00 0.00 H new ATOM 0 HE ARG A 121 1.625 1.186 20.079 1.00 0.00 H new ATOM 0 HH11 ARG A 121 4.865 1.426 21.519 1.00 0.00 H new ATOM 0 HH12 ARG A 121 5.070 3.108 21.017 1.00 0.00 H new ATOM 0 HH21 ARG A 121 1.909 3.346 19.488 1.00 0.00 H new ATOM 0 HH22 ARG A 121 3.415 4.181 19.881 1.00 0.00 H new ATOM 1926 N GLU A 122 6.509 -0.941 18.142 1.00 0.00 N ATOM 1927 CA GLU A 122 7.505 0.018 17.667 1.00 0.00 C ATOM 1928 C GLU A 122 7.785 -0.189 16.171 1.00 0.00 C ATOM 1929 O GLU A 122 7.956 0.783 15.434 1.00 0.00 O ATOM 1930 CB GLU A 122 8.778 -0.121 18.518 1.00 0.00 C ATOM 1931 CG GLU A 122 9.828 0.949 18.191 1.00 0.00 C ATOM 1932 CD GLU A 122 11.043 0.853 19.132 1.00 0.00 C ATOM 1933 OE1 GLU A 122 11.998 0.102 18.829 1.00 0.00 O ATOM 1934 OE2 GLU A 122 11.066 1.542 20.178 1.00 0.00 O ATOM 0 H GLU A 122 6.845 -1.559 18.880 1.00 0.00 H new ATOM 0 HA GLU A 122 7.126 1.034 17.777 1.00 0.00 H new ATOM 0 HB2 GLU A 122 8.514 -0.054 19.573 1.00 0.00 H new ATOM 0 HB3 GLU A 122 9.210 -1.109 18.359 1.00 0.00 H new ATOM 0 HG2 GLU A 122 10.156 0.834 17.158 1.00 0.00 H new ATOM 0 HG3 GLU A 122 9.379 1.939 18.275 1.00 0.00 H new ATOM 1941 N THR A 123 7.764 -1.440 15.702 1.00 0.00 N ATOM 1942 CA THR A 123 7.935 -1.752 14.285 1.00 0.00 C ATOM 1943 C THR A 123 6.759 -1.178 13.492 1.00 0.00 C ATOM 1944 O THR A 123 6.960 -0.532 12.465 1.00 0.00 O ATOM 1945 CB THR A 123 8.041 -3.278 14.060 1.00 0.00 C ATOM 1946 OG1 THR A 123 8.491 -3.972 15.212 1.00 0.00 O ATOM 1947 CG2 THR A 123 8.995 -3.585 12.903 1.00 0.00 C ATOM 0 H THR A 123 7.628 -2.260 16.293 1.00 0.00 H new ATOM 0 HA THR A 123 8.864 -1.299 13.937 1.00 0.00 H new ATOM 0 HB THR A 123 7.033 -3.621 13.827 1.00 0.00 H new ATOM 0 HG1 THR A 123 7.740 -4.106 15.827 1.00 0.00 H new ATOM 0 HG21 THR A 123 9.057 -4.664 12.759 1.00 0.00 H new ATOM 0 HG22 THR A 123 8.623 -3.118 11.991 1.00 0.00 H new ATOM 0 HG23 THR A 123 9.985 -3.192 13.134 1.00 0.00 H new ATOM 1955 N PHE A 124 5.530 -1.366 13.990 1.00 0.00 N ATOM 1956 CA PHE A 124 4.342 -0.819 13.352 1.00 0.00 C ATOM 1957 C PHE A 124 4.391 0.708 13.344 1.00 0.00 C ATOM 1958 O PHE A 124 4.018 1.298 12.338 1.00 0.00 O ATOM 1959 CB PHE A 124 3.070 -1.325 14.043 1.00 0.00 C ATOM 1960 CG PHE A 124 2.713 -2.763 13.727 1.00 0.00 C ATOM 1961 CD1 PHE A 124 3.296 -3.822 14.452 1.00 0.00 C ATOM 1962 CD2 PHE A 124 1.781 -3.043 12.709 1.00 0.00 C ATOM 1963 CE1 PHE A 124 2.930 -5.149 14.172 1.00 0.00 C ATOM 1964 CE2 PHE A 124 1.413 -4.372 12.441 1.00 0.00 C ATOM 1965 CZ PHE A 124 1.980 -5.422 13.177 1.00 0.00 C ATOM 0 H PHE A 124 5.340 -1.898 14.839 1.00 0.00 H new ATOM 0 HA PHE A 124 4.320 -1.163 12.318 1.00 0.00 H new ATOM 0 HB2 PHE A 124 3.192 -1.223 15.121 1.00 0.00 H new ATOM 0 HB3 PHE A 124 2.236 -0.685 13.755 1.00 0.00 H new ATOM 0 HD1 PHE A 124 4.024 -3.613 15.222 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.349 -2.237 12.135 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.381 -5.960 14.724 1.00 0.00 H new ATOM 0 HE2 PHE A 124 0.692 -4.585 11.666 1.00 0.00 H new ATOM 0 HZ PHE A 124 1.685 -6.442 12.978 1.00 0.00 H new ATOM 1975 N ALA A 125 4.868 1.360 14.408 1.00 0.00 N ATOM 1976 CA ALA A 125 4.986 2.813 14.461 1.00 0.00 C ATOM 1977 C ALA A 125 5.992 3.324 13.423 1.00 0.00 C ATOM 1978 O ALA A 125 5.698 4.283 12.706 1.00 0.00 O ATOM 1979 CB ALA A 125 5.379 3.252 15.876 1.00 0.00 C ATOM 0 H ALA A 125 5.183 0.891 15.257 1.00 0.00 H new ATOM 0 HA ALA A 125 4.018 3.251 14.217 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.466 4.338 15.909 1.00 0.00 H new ATOM 0 HB2 ALA A 125 4.616 2.927 16.583 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.336 2.803 16.144 1.00 0.00 H new ATOM 1985 N ALA A 126 7.156 2.677 13.308 1.00 0.00 N ATOM 1986 CA ALA A 126 8.165 3.043 12.321 1.00 0.00 C ATOM 1987 C ALA A 126 7.607 2.882 10.907 1.00 0.00 C ATOM 1988 O ALA A 126 7.684 3.810 10.101 1.00 0.00 O ATOM 1989 CB ALA A 126 9.421 2.184 12.524 1.00 0.00 C ATOM 0 H ALA A 126 7.421 1.887 13.897 1.00 0.00 H new ATOM 0 HA ALA A 126 8.438 4.090 12.453 1.00 0.00 H new ATOM 0 HB1 ALA A 126 10.174 2.459 11.785 1.00 0.00 H new ATOM 0 HB2 ALA A 126 9.818 2.351 13.525 1.00 0.00 H new ATOM 0 HB3 ALA A 126 9.165 1.131 12.406 1.00 0.00 H new ATOM 1995 N VAL A 127 7.004 1.726 10.617 1.00 0.00 N ATOM 1996 CA VAL A 127 6.432 1.450 9.306 1.00 0.00 C ATOM 1997 C VAL A 127 5.274 2.414 9.023 1.00 0.00 C ATOM 1998 O VAL A 127 5.206 2.936 7.915 1.00 0.00 O ATOM 1999 CB VAL A 127 6.051 -0.042 9.216 1.00 0.00 C ATOM 2000 CG1 VAL A 127 5.248 -0.371 7.951 1.00 0.00 C ATOM 2001 CG2 VAL A 127 7.324 -0.906 9.200 1.00 0.00 C ATOM 0 H VAL A 127 6.901 0.961 11.284 1.00 0.00 H new ATOM 0 HA VAL A 127 7.163 1.629 8.518 1.00 0.00 H new ATOM 0 HB VAL A 127 5.433 -0.257 10.088 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.007 -1.434 7.939 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.326 0.210 7.944 1.00 0.00 H new ATOM 0 HG13 VAL A 127 5.840 -0.124 7.070 1.00 0.00 H new ATOM 0 HG21 VAL A 127 7.048 -1.959 9.136 1.00 0.00 H new ATOM 0 HG22 VAL A 127 7.935 -0.638 8.338 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.892 -0.734 10.114 1.00 0.00 H new ATOM 2011 N TYR A 128 4.413 2.723 9.998 1.00 0.00 N ATOM 2012 CA TYR A 128 3.336 3.689 9.813 1.00 0.00 C ATOM 2013 C TYR A 128 3.921 5.048 9.438 1.00 0.00 C ATOM 2014 O TYR A 128 3.444 5.668 8.496 1.00 0.00 O ATOM 2015 CB TYR A 128 2.454 3.794 11.072 1.00 0.00 C ATOM 2016 CG TYR A 128 1.232 4.682 10.890 1.00 0.00 C ATOM 2017 CD1 TYR A 128 1.366 6.085 10.868 1.00 0.00 C ATOM 2018 CD2 TYR A 128 -0.038 4.105 10.688 1.00 0.00 C ATOM 2019 CE1 TYR A 128 0.262 6.903 10.579 1.00 0.00 C ATOM 2020 CE2 TYR A 128 -1.156 4.919 10.428 1.00 0.00 C ATOM 2021 CZ TYR A 128 -1.007 6.324 10.358 1.00 0.00 C ATOM 2022 OH TYR A 128 -2.072 7.124 10.075 1.00 0.00 O ATOM 0 H TYR A 128 4.446 2.311 10.931 1.00 0.00 H new ATOM 0 HA TYR A 128 2.697 3.344 9.000 1.00 0.00 H new ATOM 0 HB2 TYR A 128 2.127 2.795 11.360 1.00 0.00 H new ATOM 0 HB3 TYR A 128 3.055 4.182 11.895 1.00 0.00 H new ATOM 0 HD1 TYR A 128 2.326 6.535 11.075 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.154 3.032 10.733 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.383 7.975 10.526 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -2.128 4.471 10.282 1.00 0.00 H new ATOM 0 HH TYR A 128 -2.872 6.572 9.949 1.00 0.00 H new ATOM 2032 N THR A 129 4.966 5.506 10.132 1.00 0.00 N ATOM 2033 CA THR A 129 5.579 6.802 9.855 1.00 0.00 C ATOM 2034 C THR A 129 6.168 6.822 8.433 1.00 0.00 C ATOM 2035 O THR A 129 5.986 7.794 7.696 1.00 0.00 O ATOM 2036 CB THR A 129 6.635 7.104 10.936 1.00 0.00 C ATOM 2037 OG1 THR A 129 6.076 6.970 12.232 1.00 0.00 O ATOM 2038 CG2 THR A 129 7.187 8.530 10.820 1.00 0.00 C ATOM 0 H THR A 129 5.406 4.992 10.895 1.00 0.00 H new ATOM 0 HA THR A 129 4.827 7.590 9.893 1.00 0.00 H new ATOM 0 HB THR A 129 7.442 6.387 10.782 1.00 0.00 H new ATOM 0 HG1 THR A 129 6.047 6.022 12.479 1.00 0.00 H new ATOM 0 HG21 THR A 129 7.928 8.698 11.602 1.00 0.00 H new ATOM 0 HG22 THR A 129 7.654 8.661 9.844 1.00 0.00 H new ATOM 0 HG23 THR A 129 6.373 9.246 10.932 1.00 0.00 H new ATOM 2046 N LEU A 130 6.836 5.740 8.023 1.00 0.00 N ATOM 2047 CA LEU A 130 7.413 5.611 6.688 1.00 0.00 C ATOM 2048 C LEU A 130 6.315 5.590 5.617 1.00 0.00 C ATOM 2049 O LEU A 130 6.443 6.254 4.585 1.00 0.00 O ATOM 2050 CB LEU A 130 8.301 4.355 6.673 1.00 0.00 C ATOM 2051 CG LEU A 130 9.007 4.039 5.340 1.00 0.00 C ATOM 2052 CD1 LEU A 130 9.727 5.241 4.714 1.00 0.00 C ATOM 2053 CD2 LEU A 130 10.042 2.939 5.599 1.00 0.00 C ATOM 0 H LEU A 130 6.991 4.924 8.615 1.00 0.00 H new ATOM 0 HA LEU A 130 8.034 6.474 6.448 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.061 4.463 7.447 1.00 0.00 H new ATOM 0 HB3 LEU A 130 7.687 3.497 6.948 1.00 0.00 H new ATOM 0 HG LEU A 130 8.234 3.734 4.635 1.00 0.00 H new ATOM 0 HD11 LEU A 130 10.198 4.937 3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 130 9.006 6.034 4.515 1.00 0.00 H new ATOM 0 HD13 LEU A 130 10.489 5.607 5.402 1.00 0.00 H new ATOM 0 HD21 LEU A 130 10.556 2.697 4.669 1.00 0.00 H new ATOM 0 HD22 LEU A 130 10.767 3.288 6.334 1.00 0.00 H new ATOM 0 HD23 LEU A 130 9.540 2.049 5.978 1.00 0.00 H new ATOM 2065 N LEU A 131 5.213 4.883 5.868 1.00 0.00 N ATOM 2066 CA LEU A 131 4.058 4.860 4.980 1.00 0.00 C ATOM 2067 C LEU A 131 3.396 6.233 4.920 1.00 0.00 C ATOM 2068 O LEU A 131 2.988 6.641 3.838 1.00 0.00 O ATOM 2069 CB LEU A 131 3.036 3.803 5.439 1.00 0.00 C ATOM 2070 CG LEU A 131 3.496 2.355 5.194 1.00 0.00 C ATOM 2071 CD1 LEU A 131 2.551 1.371 5.886 1.00 0.00 C ATOM 2072 CD2 LEU A 131 3.525 2.012 3.706 1.00 0.00 C ATOM 0 H LEU A 131 5.099 4.306 6.702 1.00 0.00 H new ATOM 0 HA LEU A 131 4.408 4.596 3.982 1.00 0.00 H new ATOM 0 HB2 LEU A 131 2.839 3.938 6.503 1.00 0.00 H new ATOM 0 HB3 LEU A 131 2.094 3.970 4.917 1.00 0.00 H new ATOM 0 HG LEU A 131 4.504 2.273 5.601 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.890 0.351 5.703 1.00 0.00 H new ATOM 0 HD12 LEU A 131 2.546 1.565 6.959 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.543 1.495 5.490 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.855 0.981 3.577 1.00 0.00 H new ATOM 0 HD22 LEU A 131 2.526 2.129 3.286 1.00 0.00 H new ATOM 0 HD23 LEU A 131 4.215 2.681 3.192 1.00 0.00 H new ATOM 2084 N GLU A 132 3.313 6.950 6.044 1.00 0.00 N ATOM 2085 CA GLU A 132 2.711 8.275 6.105 1.00 0.00 C ATOM 2086 C GLU A 132 3.458 9.215 5.165 1.00 0.00 C ATOM 2087 O GLU A 132 2.841 9.796 4.272 1.00 0.00 O ATOM 2088 CB GLU A 132 2.707 8.799 7.553 1.00 0.00 C ATOM 2089 CG GLU A 132 1.893 10.092 7.684 1.00 0.00 C ATOM 2090 CD GLU A 132 2.225 10.865 8.968 1.00 0.00 C ATOM 2091 OE1 GLU A 132 1.876 10.410 10.078 1.00 0.00 O ATOM 2092 OE2 GLU A 132 2.813 11.966 8.851 1.00 0.00 O ATOM 0 H GLU A 132 3.666 6.620 6.942 1.00 0.00 H new ATOM 0 HA GLU A 132 1.672 8.221 5.780 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.292 8.039 8.214 1.00 0.00 H new ATOM 0 HB3 GLU A 132 3.732 8.979 7.878 1.00 0.00 H new ATOM 0 HG2 GLU A 132 2.085 10.728 6.820 1.00 0.00 H new ATOM 0 HG3 GLU A 132 0.830 9.852 7.672 1.00 0.00 H new ATOM 2099 N ARG A 133 4.785 9.335 5.312 1.00 0.00 N ATOM 2100 CA ARG A 133 5.558 10.213 4.432 1.00 0.00 C ATOM 2101 C ARG A 133 5.453 9.765 2.979 1.00 0.00 C ATOM 2102 O ARG A 133 5.301 10.614 2.108 1.00 0.00 O ATOM 2103 CB ARG A 133 7.015 10.415 4.890 1.00 0.00 C ATOM 2104 CG ARG A 133 7.905 9.159 4.920 1.00 0.00 C ATOM 2105 CD ARG A 133 9.393 9.505 5.091 1.00 0.00 C ATOM 2106 NE ARG A 133 9.647 10.332 6.286 1.00 0.00 N ATOM 2107 CZ ARG A 133 9.921 9.893 7.523 1.00 0.00 C ATOM 2108 NH1 ARG A 133 10.057 8.592 7.772 1.00 0.00 N ATOM 2109 NH2 ARG A 133 10.059 10.768 8.514 1.00 0.00 N ATOM 0 H ARG A 133 5.334 8.845 6.018 1.00 0.00 H new ATOM 0 HA ARG A 133 5.106 11.202 4.503 1.00 0.00 H new ATOM 0 HB2 ARG A 133 7.481 11.148 4.232 1.00 0.00 H new ATOM 0 HB3 ARG A 133 7.002 10.848 5.890 1.00 0.00 H new ATOM 0 HG2 ARG A 133 7.588 8.511 5.737 1.00 0.00 H new ATOM 0 HG3 ARG A 133 7.768 8.597 3.996 1.00 0.00 H new ATOM 0 HD2 ARG A 133 9.971 8.584 5.161 1.00 0.00 H new ATOM 0 HD3 ARG A 133 9.744 10.035 4.205 1.00 0.00 H new ATOM 0 HE ARG A 133 9.610 11.343 6.158 1.00 0.00 H new ATOM 0 HH11 ARG A 133 9.953 7.915 7.017 1.00 0.00 H new ATOM 0 HH12 ARG A 133 10.265 8.273 8.718 1.00 0.00 H new ATOM 0 HH21 ARG A 133 9.956 11.766 8.331 1.00 0.00 H new ATOM 0 HH22 ARG A 133 10.267 10.441 9.458 1.00 0.00 H new ATOM 2123 N SER A 134 5.477 8.462 2.701 1.00 0.00 N ATOM 2124 CA SER A 134 5.415 7.966 1.335 1.00 0.00 C ATOM 2125 C SER A 134 4.059 8.305 0.703 1.00 0.00 C ATOM 2126 O SER A 134 4.014 8.818 -0.413 1.00 0.00 O ATOM 2127 CB SER A 134 5.681 6.458 1.331 1.00 0.00 C ATOM 2128 OG SER A 134 6.936 6.163 1.918 1.00 0.00 O ATOM 0 H SER A 134 5.539 7.731 3.410 1.00 0.00 H new ATOM 0 HA SER A 134 6.182 8.452 0.732 1.00 0.00 H new ATOM 0 HB2 SER A 134 4.890 5.944 1.877 1.00 0.00 H new ATOM 0 HB3 SER A 134 5.657 6.083 0.308 1.00 0.00 H new ATOM 0 HG SER A 134 6.875 6.269 2.890 1.00 0.00 H new ATOM 2134 N ALA A 135 2.956 8.081 1.425 1.00 0.00 N ATOM 2135 CA ALA A 135 1.618 8.394 0.942 1.00 0.00 C ATOM 2136 C ALA A 135 1.439 9.905 0.775 1.00 0.00 C ATOM 2137 O ALA A 135 0.859 10.341 -0.220 1.00 0.00 O ATOM 2138 CB ALA A 135 0.578 7.824 1.913 1.00 0.00 C ATOM 0 H ALA A 135 2.972 7.677 2.361 1.00 0.00 H new ATOM 0 HA ALA A 135 1.477 7.936 -0.037 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -0.424 8.058 1.552 1.00 0.00 H new ATOM 0 HB2 ALA A 135 0.696 6.742 1.979 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.721 8.266 2.899 1.00 0.00 H new ATOM 2144 N ARG A 136 1.962 10.710 1.709 1.00 0.00 N ATOM 2145 CA ARG A 136 1.940 12.165 1.590 1.00 0.00 C ATOM 2146 C ARG A 136 2.708 12.596 0.343 1.00 0.00 C ATOM 2147 O ARG A 136 2.228 13.462 -0.380 1.00 0.00 O ATOM 2148 CB ARG A 136 2.504 12.806 2.873 1.00 0.00 C ATOM 2149 CG ARG A 136 2.407 14.343 2.854 1.00 0.00 C ATOM 2150 CD ARG A 136 2.984 14.992 4.120 1.00 0.00 C ATOM 2151 NE ARG A 136 2.123 14.796 5.303 1.00 0.00 N ATOM 2152 CZ ARG A 136 2.375 14.020 6.366 1.00 0.00 C ATOM 2153 NH1 ARG A 136 3.466 13.268 6.451 1.00 0.00 N ATOM 2154 NH2 ARG A 136 1.533 13.985 7.391 1.00 0.00 N ATOM 0 H ARG A 136 2.408 10.370 2.561 1.00 0.00 H new ATOM 0 HA ARG A 136 0.913 12.512 1.477 1.00 0.00 H new ATOM 0 HB2 ARG A 136 1.962 12.421 3.737 1.00 0.00 H new ATOM 0 HB3 ARG A 136 3.547 12.512 2.995 1.00 0.00 H new ATOM 0 HG2 ARG A 136 2.937 14.725 1.982 1.00 0.00 H new ATOM 0 HG3 ARG A 136 1.363 14.635 2.745 1.00 0.00 H new ATOM 0 HD2 ARG A 136 3.971 14.574 4.320 1.00 0.00 H new ATOM 0 HD3 ARG A 136 3.119 16.060 3.947 1.00 0.00 H new ATOM 0 HE ARG A 136 1.240 15.307 5.312 1.00 0.00 H new ATOM 0 HH11 ARG A 136 4.146 13.269 5.691 1.00 0.00 H new ATOM 0 HH12 ARG A 136 3.624 12.690 7.276 1.00 0.00 H new ATOM 0 HH21 ARG A 136 0.685 14.552 7.374 1.00 0.00 H new ATOM 0 HH22 ARG A 136 1.734 13.391 8.196 1.00 0.00 H new ATOM 2168 N GLN A 137 3.868 11.996 0.061 1.00 0.00 N ATOM 2169 CA GLN A 137 4.648 12.310 -1.126 1.00 0.00 C ATOM 2170 C GLN A 137 3.885 11.916 -2.395 1.00 0.00 C ATOM 2171 O GLN A 137 3.824 12.732 -3.312 1.00 0.00 O ATOM 2172 CB GLN A 137 6.024 11.633 -1.068 1.00 0.00 C ATOM 2173 CG GLN A 137 6.975 12.215 -0.008 1.00 0.00 C ATOM 2174 CD GLN A 137 7.760 13.441 -0.480 1.00 0.00 C ATOM 2175 OE1 GLN A 137 7.276 14.275 -1.242 1.00 0.00 O ATOM 2176 NE2 GLN A 137 8.998 13.583 -0.032 1.00 0.00 N ATOM 0 H GLN A 137 4.288 11.279 0.653 1.00 0.00 H new ATOM 0 HA GLN A 137 4.810 13.387 -1.156 1.00 0.00 H new ATOM 0 HB2 GLN A 137 5.884 10.570 -0.869 1.00 0.00 H new ATOM 0 HB3 GLN A 137 6.497 11.715 -2.047 1.00 0.00 H new ATOM 0 HG2 GLN A 137 6.396 12.485 0.875 1.00 0.00 H new ATOM 0 HG3 GLN A 137 7.679 11.441 0.297 1.00 0.00 H new ATOM 0 HE21 GLN A 137 9.394 12.888 0.600 1.00 0.00 H new ATOM 0 HE22 GLN A 137 9.555 14.388 -0.319 1.00 0.00 H new ATOM 2185 N TRP A 138 3.257 10.731 -2.457 1.00 0.00 N ATOM 2186 CA TRP A 138 2.427 10.356 -3.609 1.00 0.00 C ATOM 2187 C TRP A 138 1.306 11.378 -3.826 1.00 0.00 C ATOM 2188 O TRP A 138 1.094 11.825 -4.957 1.00 0.00 O ATOM 2189 CB TRP A 138 1.845 8.937 -3.455 1.00 0.00 C ATOM 2190 CG TRP A 138 2.764 7.823 -3.857 1.00 0.00 C ATOM 2191 CD1 TRP A 138 3.428 6.998 -3.018 1.00 0.00 C ATOM 2192 CD2 TRP A 138 3.157 7.405 -5.203 1.00 0.00 C ATOM 2193 NE1 TRP A 138 4.248 6.158 -3.738 1.00 0.00 N ATOM 2194 CE2 TRP A 138 4.152 6.387 -5.092 1.00 0.00 C ATOM 2195 CE3 TRP A 138 2.808 7.815 -6.508 1.00 0.00 C ATOM 2196 CZ2 TRP A 138 4.814 5.854 -6.208 1.00 0.00 C ATOM 2197 CZ3 TRP A 138 3.450 7.271 -7.639 1.00 0.00 C ATOM 2198 CH2 TRP A 138 4.463 6.307 -7.489 1.00 0.00 C ATOM 0 H TRP A 138 3.309 10.021 -1.727 1.00 0.00 H new ATOM 0 HA TRP A 138 3.071 10.354 -4.488 1.00 0.00 H new ATOM 0 HB2 TRP A 138 1.557 8.791 -2.414 1.00 0.00 H new ATOM 0 HB3 TRP A 138 0.935 8.868 -4.051 1.00 0.00 H new ATOM 0 HD1 TRP A 138 3.330 6.997 -1.942 1.00 0.00 H new ATOM 0 HE1 TRP A 138 4.853 5.452 -3.319 1.00 0.00 H new ATOM 0 HE3 TRP A 138 2.036 8.558 -6.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 5.583 5.106 -6.083 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 3.162 7.597 -8.628 1.00 0.00 H new ATOM 0 HH2 TRP A 138 4.970 5.916 -8.359 1.00 0.00 H new ATOM 2209 N ALA A 139 0.616 11.779 -2.754 1.00 0.00 N ATOM 2210 CA ALA A 139 -0.455 12.757 -2.839 1.00 0.00 C ATOM 2211 C ALA A 139 0.074 14.109 -3.323 1.00 0.00 C ATOM 2212 O ALA A 139 -0.461 14.680 -4.270 1.00 0.00 O ATOM 2213 CB ALA A 139 -1.131 12.888 -1.471 1.00 0.00 C ATOM 0 H ALA A 139 0.789 11.432 -1.810 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.191 12.418 -3.568 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.935 13.621 -1.531 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -1.541 11.923 -1.174 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.398 13.213 -0.733 1.00 0.00 H new ATOM 2219 N GLN A 140 1.146 14.617 -2.712 1.00 0.00 N ATOM 2220 CA GLN A 140 1.721 15.908 -3.063 1.00 0.00 C ATOM 2221 C GLN A 140 2.261 15.900 -4.498 1.00 0.00 C ATOM 2222 O GLN A 140 2.196 16.923 -5.179 1.00 0.00 O ATOM 2223 CB GLN A 140 2.796 16.297 -2.031 1.00 0.00 C ATOM 2224 CG GLN A 140 3.580 17.592 -2.327 1.00 0.00 C ATOM 2225 CD GLN A 140 2.754 18.889 -2.385 1.00 0.00 C ATOM 2226 OE1 GLN A 140 1.533 18.905 -2.526 1.00 0.00 O ATOM 2227 NE2 GLN A 140 3.413 20.031 -2.278 1.00 0.00 N ATOM 0 H GLN A 140 1.638 14.139 -1.957 1.00 0.00 H new ATOM 0 HA GLN A 140 0.941 16.669 -3.033 1.00 0.00 H new ATOM 0 HB2 GLN A 140 2.316 16.401 -1.058 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.508 15.475 -1.950 1.00 0.00 H new ATOM 0 HG2 GLN A 140 4.348 17.709 -1.563 1.00 0.00 H new ATOM 0 HG3 GLN A 140 4.094 17.471 -3.280 1.00 0.00 H new ATOM 0 HE21 GLN A 140 4.426 20.026 -2.161 1.00 0.00 H new ATOM 0 HE22 GLN A 140 2.908 20.916 -2.313 1.00 0.00 H new ATOM 2236 N ALA A 141 2.762 14.757 -4.977 1.00 0.00 N ATOM 2237 CA ALA A 141 3.235 14.635 -6.345 1.00 0.00 C ATOM 2238 C ALA A 141 2.056 14.807 -7.298 1.00 0.00 C ATOM 2239 O ALA A 141 2.104 15.667 -8.171 1.00 0.00 O ATOM 2240 CB ALA A 141 3.930 13.290 -6.557 1.00 0.00 C ATOM 0 H ALA A 141 2.847 13.902 -4.427 1.00 0.00 H new ATOM 0 HA ALA A 141 3.969 15.414 -6.549 1.00 0.00 H new ATOM 0 HB1 ALA A 141 4.277 13.218 -7.588 1.00 0.00 H new ATOM 0 HB2 ALA A 141 4.781 13.210 -5.881 1.00 0.00 H new ATOM 0 HB3 ALA A 141 3.228 12.482 -6.353 1.00 0.00 H new ATOM 2246 N LEU A 142 0.971 14.053 -7.092 1.00 0.00 N ATOM 2247 CA LEU A 142 -0.244 14.175 -7.901 1.00 0.00 C ATOM 2248 C LEU A 142 -0.828 15.589 -7.820 1.00 0.00 C ATOM 2249 O LEU A 142 -1.270 16.136 -8.831 1.00 0.00 O ATOM 2250 CB LEU A 142 -1.272 13.126 -7.444 1.00 0.00 C ATOM 2251 CG LEU A 142 -0.907 11.691 -7.876 1.00 0.00 C ATOM 2252 CD1 LEU A 142 -1.732 10.666 -7.093 1.00 0.00 C ATOM 2253 CD2 LEU A 142 -1.137 11.489 -9.381 1.00 0.00 C ATOM 0 H LEU A 142 0.911 13.343 -6.362 1.00 0.00 H new ATOM 0 HA LEU A 142 0.011 13.993 -8.945 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -1.359 13.161 -6.358 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -2.250 13.384 -7.851 1.00 0.00 H new ATOM 0 HG LEU A 142 0.151 11.543 -7.660 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -1.460 9.660 -7.412 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -1.532 10.775 -6.027 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -2.793 10.832 -7.282 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -0.871 10.468 -9.656 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -2.187 11.666 -9.616 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -0.517 12.189 -9.941 1.00 0.00 H new