USER MOD reduce.3.24.130724 H: found=0, std=0, add=1130, rem=0, adj=33 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 12 ASN : amide:sc= 1.3! C(o=-0.3!,f=-6.2!) USER MOD Set 1.2: A 63 HIS : no HE2:sc= -1.61! K(o=-0.3!,f=-7.7) USER MOD Set 2.1: A 9 CYS SG : rot 83:sc= 1.13 USER MOD Set 2.2: A 16 SER OG : rot 68:sc= 1.37 USER MOD Set 3.1: A 3 ASN : amide:sc= 0.719 K(o=1.6,f=0.29) USER MOD Set 3.2: A 4 ASN : amide:sc= 0.929 K(o=1.6,f=-0.48) USER MOD Single : A 14 CYS SG : rot -121:sc= -0.451 USER MOD Single : A 18 THR OG1 : rot 93:sc= 1.24 USER MOD Single : A 24 GLN : amide:sc= 0.522 K(o=0.52,f=-5.3!) USER MOD Single : A 26 TYR OH : rot 30:sc= 0.321 USER MOD Single : A 27 HIS : no HE2:sc= 0.913 K(o=0.91,f=-4.2!) USER MOD Single : A 31 LYS NZ :NH3+ 145:sc= 1.31 (180deg=0.722) USER MOD Single : A 34 SER OG : rot 97:sc= 1.28 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 90:sc= 1.22 USER MOD Single : A 51 SER OG : rot 86:sc= 1.28 USER MOD Single : A 56 HIS : no HD1:sc= 0 X(o=0,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 USER MOD Single : A 67 GLN : amide:sc= 0.833 K(o=0.83,f=0) USER MOD Single : A 69 SER OG : rot 67:sc= 0.48 USER MOD Single : A 73 CYS SG : rot 67:sc= 0.614 USER MOD Single : A 75 ASN : amide:sc= 0.892 K(o=0.89,f=-0.039) USER MOD Single : A 76 TYR OH : rot 110:sc= 0.652 USER MOD Single : A 81 THR OG1 : rot -43:sc= 0.0807 USER MOD Single : A 82 MET CE :methyl -149:sc= 0 (180deg=-1.44) USER MOD Single : A 84 LYS NZ :NH3+ -153:sc= 1.05 (180deg=0.605) USER MOD Single : A 86 HIS : no HE2:sc= -0.273 K(o=-0.27,f=-1.4) USER MOD Single : A 91 CYS SG : rot 74:sc= 0.598 USER MOD Single : A 93 MET CE :methyl -169:sc=-0.00766 (180deg=-0.173) USER MOD Single : A 97 MET CE :methyl 176:sc= -0.463 (180deg=-0.478) USER MOD Single : A 100 LYS NZ :NH3+ -168:sc= 1.26 (180deg=1.18) USER MOD Single : A 102 MET CE :methyl 171:sc= 0 (180deg=-0.123) USER MOD Single : A 106 HIS : no HE2:sc= 1.05 K(o=1,f=-3.1!) USER MOD Single : A 109 ASN : amide:sc= -0.252 X(o=-0.25,f=-0.25) USER MOD Single : A 111 CYS SG : rot -151:sc= -0.192 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0.00271 USER MOD Single : A 123 THR OG1 : rot -150:sc= 0 USER MOD Single : A 128 TYR OH : rot 28:sc= 1.78 USER MOD Single : A 129 THR OG1 : rot 75:sc= 1.2 USER MOD Single : A 134 SER OG : rot 77:sc= 1.18 USER MOD Single : A 137 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 140 GLN : amide:sc= -0.84 X(o=-0.84,f=-0.92) USER MOD ----------------------------------------------------------------- ATOM 18 N PHE A 2 -4.525 8.391 -12.676 1.00 0.00 N ATOM 19 CA PHE A 2 -4.354 7.150 -11.911 1.00 0.00 C ATOM 20 C PHE A 2 -5.389 7.037 -10.769 1.00 0.00 C ATOM 21 O PHE A 2 -5.023 6.880 -9.606 1.00 0.00 O ATOM 22 CB PHE A 2 -2.911 7.083 -11.375 1.00 0.00 C ATOM 23 CG PHE A 2 -1.809 7.300 -12.400 1.00 0.00 C ATOM 24 CD1 PHE A 2 -1.425 6.252 -13.257 1.00 0.00 C ATOM 25 CD2 PHE A 2 -1.151 8.544 -12.485 1.00 0.00 C ATOM 26 CE1 PHE A 2 -0.400 6.446 -14.199 1.00 0.00 C ATOM 27 CE2 PHE A 2 -0.129 8.740 -13.432 1.00 0.00 C ATOM 28 CZ PHE A 2 0.247 7.691 -14.290 1.00 0.00 C ATOM 0 HA PHE A 2 -4.529 6.300 -12.571 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -2.801 7.830 -10.589 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -2.762 6.108 -10.911 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -1.920 5.294 -13.191 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -1.432 9.349 -11.822 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -0.109 5.638 -14.854 1.00 0.00 H new ATOM 0 HE2 PHE A 2 0.367 9.697 -13.500 1.00 0.00 H new ATOM 0 HZ PHE A 2 1.031 7.841 -15.017 1.00 0.00 H new ATOM 38 N ASN A 3 -6.683 7.188 -11.069 1.00 0.00 N ATOM 39 CA ASN A 3 -7.743 7.316 -10.066 1.00 0.00 C ATOM 40 C ASN A 3 -7.877 6.072 -9.193 1.00 0.00 C ATOM 41 O ASN A 3 -8.199 6.186 -8.010 1.00 0.00 O ATOM 42 CB ASN A 3 -9.088 7.581 -10.758 1.00 0.00 C ATOM 43 CG ASN A 3 -10.211 7.734 -9.734 1.00 0.00 C ATOM 44 OD1 ASN A 3 -10.384 8.801 -9.153 1.00 0.00 O ATOM 45 ND2 ASN A 3 -10.997 6.697 -9.490 1.00 0.00 N ATOM 0 H ASN A 3 -7.027 7.225 -12.028 1.00 0.00 H new ATOM 0 HA ASN A 3 -7.468 8.151 -9.422 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -9.018 8.485 -11.363 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -9.320 6.760 -11.437 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -11.756 6.780 -8.813 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -10.844 5.815 -9.979 1.00 0.00 H new ATOM 52 N ASN A 4 -7.647 4.897 -9.784 1.00 0.00 N ATOM 53 CA ASN A 4 -7.830 3.622 -9.108 1.00 0.00 C ATOM 54 C ASN A 4 -6.430 3.142 -8.754 1.00 0.00 C ATOM 55 O ASN A 4 -5.582 3.062 -9.645 1.00 0.00 O ATOM 56 CB ASN A 4 -8.504 2.601 -10.045 1.00 0.00 C ATOM 57 CG ASN A 4 -9.984 2.829 -10.325 1.00 0.00 C ATOM 58 OD1 ASN A 4 -10.528 3.912 -10.121 1.00 0.00 O ATOM 59 ND2 ASN A 4 -10.665 1.802 -10.811 1.00 0.00 N ATOM 0 H ASN A 4 -7.328 4.809 -10.749 1.00 0.00 H new ATOM 0 HA ASN A 4 -8.466 3.728 -8.229 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -7.970 2.602 -10.995 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -8.385 1.607 -9.613 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -11.658 1.903 -11.022 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -10.197 0.911 -10.974 1.00 0.00 H new ATOM 66 N ILE A 5 -6.181 2.803 -7.492 1.00 0.00 N ATOM 67 CA ILE A 5 -4.841 2.521 -6.988 1.00 0.00 C ATOM 68 C ILE A 5 -4.948 1.270 -6.112 1.00 0.00 C ATOM 69 O ILE A 5 -5.919 1.115 -5.367 1.00 0.00 O ATOM 70 CB ILE A 5 -4.323 3.755 -6.202 1.00 0.00 C ATOM 71 CG1 ILE A 5 -4.258 5.007 -7.111 1.00 0.00 C ATOM 72 CG2 ILE A 5 -2.951 3.492 -5.556 1.00 0.00 C ATOM 73 CD1 ILE A 5 -3.745 6.290 -6.447 1.00 0.00 C ATOM 0 H ILE A 5 -6.911 2.716 -6.784 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.126 2.334 -7.789 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.037 3.942 -5.400 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -3.617 4.781 -7.963 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -5.256 5.199 -7.505 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -2.626 4.382 -5.016 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -3.030 2.655 -4.862 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -2.224 3.253 -6.332 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -3.742 7.101 -7.176 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -4.396 6.554 -5.613 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -2.732 6.129 -6.079 1.00 0.00 H new ATOM 85 N LEU A 6 -3.937 0.403 -6.166 1.00 0.00 N ATOM 86 CA LEU A 6 -3.869 -0.801 -5.346 1.00 0.00 C ATOM 87 C LEU A 6 -2.538 -0.814 -4.614 1.00 0.00 C ATOM 88 O LEU A 6 -1.517 -0.449 -5.198 1.00 0.00 O ATOM 89 CB LEU A 6 -3.991 -2.038 -6.249 1.00 0.00 C ATOM 90 CG LEU A 6 -4.057 -3.381 -5.498 1.00 0.00 C ATOM 91 CD1 LEU A 6 -5.275 -3.473 -4.575 1.00 0.00 C ATOM 92 CD2 LEU A 6 -4.113 -4.537 -6.500 1.00 0.00 C ATOM 0 H LEU A 6 -3.136 0.520 -6.787 1.00 0.00 H new ATOM 0 HA LEU A 6 -4.683 -0.814 -4.621 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -4.886 -1.936 -6.862 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -3.140 -2.059 -6.929 1.00 0.00 H new ATOM 0 HG LEU A 6 -3.159 -3.446 -4.884 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -5.276 -4.438 -4.069 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.231 -2.675 -3.834 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -6.186 -3.372 -5.164 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -4.159 -5.483 -5.961 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -4.998 -4.432 -7.127 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -3.221 -4.519 -7.126 1.00 0.00 H new ATOM 104 N VAL A 7 -2.533 -1.290 -3.372 1.00 0.00 N ATOM 105 CA VAL A 7 -1.312 -1.486 -2.605 1.00 0.00 C ATOM 106 C VAL A 7 -1.232 -2.970 -2.247 1.00 0.00 C ATOM 107 O VAL A 7 -2.250 -3.561 -1.878 1.00 0.00 O ATOM 108 CB VAL A 7 -1.308 -0.573 -1.361 1.00 0.00 C ATOM 109 CG1 VAL A 7 0.086 -0.607 -0.728 1.00 0.00 C ATOM 110 CG2 VAL A 7 -1.669 0.892 -1.677 1.00 0.00 C ATOM 0 H VAL A 7 -3.381 -1.551 -2.869 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.430 -1.211 -3.183 1.00 0.00 H new ATOM 0 HB VAL A 7 -2.072 -0.954 -0.683 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.101 0.035 0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 7 0.328 -1.629 -0.436 1.00 0.00 H new ATOM 0 HG13 VAL A 7 0.822 -0.251 -1.449 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.647 1.478 -0.758 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.948 1.300 -2.385 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.668 0.935 -2.111 1.00 0.00 H new ATOM 120 N VAL A 8 -0.047 -3.578 -2.375 1.00 0.00 N ATOM 121 CA VAL A 8 0.112 -5.022 -2.234 1.00 0.00 C ATOM 122 C VAL A 8 1.335 -5.319 -1.357 1.00 0.00 C ATOM 123 O VAL A 8 2.394 -4.715 -1.551 1.00 0.00 O ATOM 124 CB VAL A 8 0.204 -5.698 -3.625 1.00 0.00 C ATOM 125 CG1 VAL A 8 -0.073 -7.205 -3.504 1.00 0.00 C ATOM 126 CG2 VAL A 8 -0.794 -5.142 -4.658 1.00 0.00 C ATOM 0 H VAL A 8 0.821 -3.083 -2.578 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.763 -5.443 -1.739 1.00 0.00 H new ATOM 0 HB VAL A 8 1.215 -5.489 -3.974 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.005 -7.668 -4.489 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.662 -7.658 -2.839 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -1.073 -7.360 -3.099 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.667 -5.666 -5.605 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -1.812 -5.288 -4.296 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.611 -4.078 -4.805 1.00 0.00 H new ATOM 136 N CYS A 9 1.208 -6.266 -0.416 1.00 0.00 N ATOM 137 CA CYS A 9 2.346 -6.742 0.389 1.00 0.00 C ATOM 138 C CYS A 9 2.195 -8.227 0.746 1.00 0.00 C ATOM 139 O CYS A 9 1.206 -8.848 0.367 1.00 0.00 O ATOM 140 CB CYS A 9 2.522 -5.861 1.639 1.00 0.00 C ATOM 141 SG CYS A 9 1.135 -6.039 2.799 1.00 0.00 S ATOM 0 H CYS A 9 0.323 -6.721 -0.192 1.00 0.00 H new ATOM 0 HA CYS A 9 3.254 -6.656 -0.208 1.00 0.00 H new ATOM 0 HB2 CYS A 9 3.452 -6.127 2.142 1.00 0.00 H new ATOM 0 HB3 CYS A 9 2.610 -4.817 1.337 1.00 0.00 H new ATOM 0 HG CYS A 9 1.321 -7.091 3.539 1.00 0.00 H new ATOM 147 N VAL A 10 3.168 -8.831 1.434 1.00 0.00 N ATOM 148 CA VAL A 10 2.937 -10.171 1.989 1.00 0.00 C ATOM 149 C VAL A 10 2.158 -9.990 3.303 1.00 0.00 C ATOM 150 O VAL A 10 2.286 -8.955 3.961 1.00 0.00 O ATOM 151 CB VAL A 10 4.255 -10.954 2.173 1.00 0.00 C ATOM 152 CG1 VAL A 10 4.790 -11.400 0.804 1.00 0.00 C ATOM 153 CG2 VAL A 10 5.346 -10.178 2.925 1.00 0.00 C ATOM 0 H VAL A 10 4.090 -8.434 1.617 1.00 0.00 H new ATOM 0 HA VAL A 10 2.352 -10.778 1.298 1.00 0.00 H new ATOM 0 HB VAL A 10 4.010 -11.816 2.794 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.720 -11.952 0.939 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.055 -12.041 0.317 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.975 -10.524 0.183 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.239 -10.797 3.012 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.588 -9.267 2.377 1.00 0.00 H new ATOM 0 HG23 VAL A 10 4.987 -9.917 3.921 1.00 0.00 H new ATOM 163 N GLY A 11 1.317 -10.959 3.674 1.00 0.00 N ATOM 164 CA GLY A 11 0.475 -10.869 4.865 1.00 0.00 C ATOM 165 C GLY A 11 -0.806 -10.074 4.610 1.00 0.00 C ATOM 166 O GLY A 11 -1.864 -10.504 5.065 1.00 0.00 O ATOM 0 H GLY A 11 1.202 -11.829 3.154 1.00 0.00 H new ATOM 0 HA2 GLY A 11 0.216 -11.873 5.201 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.038 -10.398 5.671 1.00 0.00 H new ATOM 170 N ASN A 12 -0.725 -8.968 3.851 1.00 0.00 N ATOM 171 CA ASN A 12 -1.843 -8.061 3.511 1.00 0.00 C ATOM 172 C ASN A 12 -2.378 -7.277 4.708 1.00 0.00 C ATOM 173 O ASN A 12 -2.542 -6.066 4.597 1.00 0.00 O ATOM 174 CB ASN A 12 -3.000 -8.801 2.798 1.00 0.00 C ATOM 175 CG ASN A 12 -4.157 -7.966 2.232 1.00 0.00 C ATOM 176 OD1 ASN A 12 -4.969 -8.512 1.498 1.00 0.00 O ATOM 177 ND2 ASN A 12 -4.324 -6.692 2.538 1.00 0.00 N ATOM 0 H ASN A 12 0.157 -8.666 3.438 1.00 0.00 H new ATOM 0 HA ASN A 12 -1.414 -7.337 2.819 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -2.571 -9.375 1.977 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -3.421 -9.518 3.503 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -5.121 -6.178 2.163 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -3.656 -6.222 3.149 1.00 0.00 H new ATOM 184 N ILE A 13 -2.654 -7.930 5.832 1.00 0.00 N ATOM 185 CA ILE A 13 -3.377 -7.401 6.989 1.00 0.00 C ATOM 186 C ILE A 13 -2.690 -6.256 7.765 1.00 0.00 C ATOM 187 O ILE A 13 -3.116 -5.969 8.886 1.00 0.00 O ATOM 188 CB ILE A 13 -3.785 -8.589 7.901 1.00 0.00 C ATOM 189 CG1 ILE A 13 -2.576 -9.305 8.547 1.00 0.00 C ATOM 190 CG2 ILE A 13 -4.662 -9.592 7.120 1.00 0.00 C ATOM 191 CD1 ILE A 13 -2.976 -10.236 9.698 1.00 0.00 C ATOM 0 H ILE A 13 -2.364 -8.898 5.970 1.00 0.00 H new ATOM 0 HA ILE A 13 -4.261 -6.897 6.598 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.365 -8.167 8.722 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -2.053 -9.883 7.785 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.874 -8.558 8.918 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.939 -10.419 7.774 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -5.563 -9.090 6.768 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.103 -9.976 6.266 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.085 -10.709 10.110 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.473 -9.658 10.477 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -3.655 -11.003 9.326 1.00 0.00 H new ATOM 203 N CYS A 14 -1.646 -5.605 7.238 1.00 0.00 N ATOM 204 CA CYS A 14 -0.927 -4.555 7.959 1.00 0.00 C ATOM 205 C CYS A 14 -0.587 -3.359 7.062 1.00 0.00 C ATOM 206 O CYS A 14 -1.289 -2.347 7.076 1.00 0.00 O ATOM 207 CB CYS A 14 0.345 -5.124 8.630 1.00 0.00 C ATOM 208 SG CYS A 14 -0.005 -6.566 9.677 1.00 0.00 S ATOM 0 H CYS A 14 -1.280 -5.792 6.305 1.00 0.00 H new ATOM 0 HA CYS A 14 -1.595 -4.186 8.737 1.00 0.00 H new ATOM 0 HB2 CYS A 14 1.063 -5.404 7.860 1.00 0.00 H new ATOM 0 HB3 CYS A 14 0.812 -4.346 9.234 1.00 0.00 H new ATOM 0 HG CYS A 14 0.372 -6.319 10.896 1.00 0.00 H new ATOM 214 N ARG A 15 0.484 -3.454 6.268 1.00 0.00 N ATOM 215 CA ARG A 15 1.020 -2.287 5.567 1.00 0.00 C ATOM 216 C ARG A 15 0.194 -1.851 4.358 1.00 0.00 C ATOM 217 O ARG A 15 0.064 -0.642 4.181 1.00 0.00 O ATOM 218 CB ARG A 15 2.538 -2.423 5.325 1.00 0.00 C ATOM 219 CG ARG A 15 3.012 -3.734 4.682 1.00 0.00 C ATOM 220 CD ARG A 15 4.532 -3.904 4.816 1.00 0.00 C ATOM 221 NE ARG A 15 4.938 -5.268 4.438 1.00 0.00 N ATOM 222 CZ ARG A 15 6.084 -5.622 3.845 1.00 0.00 C ATOM 223 NH1 ARG A 15 7.074 -4.764 3.657 1.00 0.00 N ATOM 224 NH2 ARG A 15 6.265 -6.867 3.437 1.00 0.00 N ATOM 0 H ARG A 15 0.993 -4.321 6.096 1.00 0.00 H new ATOM 0 HA ARG A 15 0.911 -1.432 6.235 1.00 0.00 H new ATOM 0 HB2 ARG A 15 2.858 -1.596 4.691 1.00 0.00 H new ATOM 0 HB3 ARG A 15 3.048 -2.308 6.281 1.00 0.00 H new ATOM 0 HG2 ARG A 15 2.507 -4.577 5.154 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.734 -3.746 3.628 1.00 0.00 H new ATOM 0 HD2 ARG A 15 5.041 -3.179 4.182 1.00 0.00 H new ATOM 0 HD3 ARG A 15 4.837 -3.700 5.842 1.00 0.00 H new ATOM 0 HE ARG A 15 4.280 -6.018 4.649 1.00 0.00 H new ATOM 0 HH11 ARG A 15 6.977 -3.797 3.968 1.00 0.00 H new ATOM 0 HH12 ARG A 15 7.934 -5.069 3.201 1.00 0.00 H new ATOM 0 HH21 ARG A 15 5.530 -7.561 3.574 1.00 0.00 H new ATOM 0 HH22 ARG A 15 7.140 -7.134 2.985 1.00 0.00 H new ATOM 238 N SER A 16 -0.430 -2.753 3.587 1.00 0.00 N ATOM 239 CA SER A 16 -1.340 -2.334 2.519 1.00 0.00 C ATOM 240 C SER A 16 -2.490 -1.456 3.053 1.00 0.00 C ATOM 241 O SER A 16 -2.572 -0.308 2.618 1.00 0.00 O ATOM 242 CB SER A 16 -1.875 -3.512 1.696 1.00 0.00 C ATOM 243 OG SER A 16 -0.842 -4.281 1.121 1.00 0.00 O ATOM 0 H SER A 16 -0.322 -3.763 3.683 1.00 0.00 H new ATOM 0 HA SER A 16 -0.744 -1.723 1.841 1.00 0.00 H new ATOM 0 HB2 SER A 16 -2.486 -4.150 2.335 1.00 0.00 H new ATOM 0 HB3 SER A 16 -2.525 -3.134 0.907 1.00 0.00 H new ATOM 0 HG SER A 16 -0.349 -4.747 1.828 1.00 0.00 H new ATOM 249 N PRO A 17 -3.334 -1.894 4.016 1.00 0.00 N ATOM 250 CA PRO A 17 -4.450 -1.074 4.469 1.00 0.00 C ATOM 251 C PRO A 17 -3.978 0.195 5.179 1.00 0.00 C ATOM 252 O PRO A 17 -4.649 1.221 5.077 1.00 0.00 O ATOM 253 CB PRO A 17 -5.318 -1.967 5.361 1.00 0.00 C ATOM 254 CG PRO A 17 -4.360 -3.056 5.832 1.00 0.00 C ATOM 255 CD PRO A 17 -3.408 -3.202 4.645 1.00 0.00 C ATOM 0 HA PRO A 17 -5.034 -0.711 3.623 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -5.734 -1.410 6.201 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -6.159 -2.386 4.809 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -3.833 -2.766 6.741 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -4.882 -3.988 6.050 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -2.423 -3.530 4.975 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -3.775 -3.951 3.943 1.00 0.00 H new ATOM 263 N THR A 18 -2.830 0.171 5.863 1.00 0.00 N ATOM 264 CA THR A 18 -2.291 1.375 6.485 1.00 0.00 C ATOM 265 C THR A 18 -1.941 2.398 5.391 1.00 0.00 C ATOM 266 O THR A 18 -2.384 3.546 5.468 1.00 0.00 O ATOM 267 CB THR A 18 -1.113 1.005 7.403 1.00 0.00 C ATOM 268 OG1 THR A 18 -1.521 0.024 8.339 1.00 0.00 O ATOM 269 CG2 THR A 18 -0.599 2.204 8.205 1.00 0.00 C ATOM 0 H THR A 18 -2.262 -0.666 5.997 1.00 0.00 H new ATOM 0 HA THR A 18 -3.032 1.851 7.128 1.00 0.00 H new ATOM 0 HB THR A 18 -0.319 0.639 6.752 1.00 0.00 H new ATOM 0 HG1 THR A 18 -1.324 -0.868 7.985 1.00 0.00 H new ATOM 0 HG21 THR A 18 0.232 1.890 8.837 1.00 0.00 H new ATOM 0 HG22 THR A 18 -0.260 2.982 7.520 1.00 0.00 H new ATOM 0 HG23 THR A 18 -1.402 2.595 8.830 1.00 0.00 H new ATOM 277 N ALA A 19 -1.223 1.981 4.338 1.00 0.00 N ATOM 278 CA ALA A 19 -0.890 2.852 3.214 1.00 0.00 C ATOM 279 C ALA A 19 -2.149 3.377 2.535 1.00 0.00 C ATOM 280 O ALA A 19 -2.240 4.568 2.248 1.00 0.00 O ATOM 281 CB ALA A 19 -0.075 2.078 2.182 1.00 0.00 C ATOM 0 H ALA A 19 -0.860 1.032 4.247 1.00 0.00 H new ATOM 0 HA ALA A 19 -0.315 3.692 3.604 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.170 2.733 1.346 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.845 1.717 2.642 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -0.657 1.231 1.820 1.00 0.00 H new ATOM 287 N GLU A 20 -3.110 2.490 2.287 1.00 0.00 N ATOM 288 CA GLU A 20 -4.369 2.830 1.651 1.00 0.00 C ATOM 289 C GLU A 20 -5.078 3.921 2.440 1.00 0.00 C ATOM 290 O GLU A 20 -5.416 4.959 1.875 1.00 0.00 O ATOM 291 CB GLU A 20 -5.214 1.557 1.572 1.00 0.00 C ATOM 292 CG GLU A 20 -6.659 1.741 1.092 1.00 0.00 C ATOM 293 CD GLU A 20 -7.561 0.677 1.731 1.00 0.00 C ATOM 294 OE1 GLU A 20 -7.456 -0.507 1.334 1.00 0.00 O ATOM 295 OE2 GLU A 20 -8.337 1.027 2.653 1.00 0.00 O ATOM 0 H GLU A 20 -3.029 1.502 2.528 1.00 0.00 H new ATOM 0 HA GLU A 20 -4.202 3.218 0.646 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -4.716 0.855 0.904 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -5.236 1.096 2.560 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -7.015 2.737 1.355 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -6.703 1.663 0.006 1.00 0.00 H new ATOM 302 N ARG A 21 -5.292 3.725 3.743 1.00 0.00 N ATOM 303 CA ARG A 21 -6.007 4.708 4.542 1.00 0.00 C ATOM 304 C ARG A 21 -5.242 6.024 4.616 1.00 0.00 C ATOM 305 O ARG A 21 -5.873 7.078 4.605 1.00 0.00 O ATOM 306 CB ARG A 21 -6.267 4.149 5.941 1.00 0.00 C ATOM 307 CG ARG A 21 -7.308 3.025 6.002 1.00 0.00 C ATOM 308 CD ARG A 21 -8.691 3.396 5.448 1.00 0.00 C ATOM 309 NE ARG A 21 -9.726 2.664 6.190 1.00 0.00 N ATOM 310 CZ ARG A 21 -10.035 1.368 6.081 1.00 0.00 C ATOM 311 NH1 ARG A 21 -9.614 0.612 5.069 1.00 0.00 N ATOM 312 NH2 ARG A 21 -10.773 0.824 7.039 1.00 0.00 N ATOM 0 H ARG A 21 -4.982 2.901 4.258 1.00 0.00 H new ATOM 0 HA ARG A 21 -6.963 4.915 4.061 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -5.327 3.777 6.349 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -6.594 4.963 6.587 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -6.928 2.167 5.447 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -7.421 2.709 7.039 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -8.855 4.470 5.537 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -8.747 3.152 4.387 1.00 0.00 H new ATOM 0 HE ARG A 21 -10.269 3.205 6.863 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -9.031 1.018 4.337 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -9.874 -0.373 5.026 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -11.086 1.392 7.826 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -11.028 -0.162 6.988 1.00 0.00 H new ATOM 326 N LEU A 22 -3.909 5.996 4.659 1.00 0.00 N ATOM 327 CA LEU A 22 -3.106 7.213 4.640 1.00 0.00 C ATOM 328 C LEU A 22 -3.291 7.948 3.313 1.00 0.00 C ATOM 329 O LEU A 22 -3.502 9.159 3.309 1.00 0.00 O ATOM 330 CB LEU A 22 -1.628 6.871 4.886 1.00 0.00 C ATOM 331 CG LEU A 22 -1.330 6.503 6.352 1.00 0.00 C ATOM 332 CD1 LEU A 22 -0.016 5.725 6.445 1.00 0.00 C ATOM 333 CD2 LEU A 22 -1.239 7.768 7.207 1.00 0.00 C ATOM 0 H LEU A 22 -3.363 5.136 4.708 1.00 0.00 H new ATOM 0 HA LEU A 22 -3.439 7.875 5.439 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.342 6.039 4.243 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.011 7.723 4.599 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.142 5.878 6.724 1.00 0.00 H new ATOM 0 HD11 LEU A 22 0.183 5.471 7.486 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -0.092 4.811 5.856 1.00 0.00 H new ATOM 0 HD13 LEU A 22 0.798 6.338 6.059 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.028 7.494 8.241 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.439 8.405 6.830 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -2.185 8.307 7.160 1.00 0.00 H new ATOM 345 N LEU A 23 -3.264 7.233 2.187 1.00 0.00 N ATOM 346 CA LEU A 23 -3.499 7.818 0.869 1.00 0.00 C ATOM 347 C LEU A 23 -4.916 8.385 0.786 1.00 0.00 C ATOM 348 O LEU A 23 -5.091 9.486 0.270 1.00 0.00 O ATOM 349 CB LEU A 23 -3.287 6.767 -0.233 1.00 0.00 C ATOM 350 CG LEU A 23 -1.814 6.400 -0.489 1.00 0.00 C ATOM 351 CD1 LEU A 23 -1.720 5.032 -1.175 1.00 0.00 C ATOM 352 CD2 LEU A 23 -1.137 7.466 -1.360 1.00 0.00 C ATOM 0 H LEU A 23 -3.078 6.230 2.165 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.785 8.628 0.720 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.833 5.862 0.035 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.722 7.138 -1.161 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.300 6.354 0.471 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -0.673 4.784 -1.351 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -2.170 4.273 -0.536 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.250 5.065 -2.127 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.096 7.190 -1.530 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.655 7.537 -2.316 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.178 8.430 -0.853 1.00 0.00 H new ATOM 364 N GLN A 24 -5.918 7.679 1.321 1.00 0.00 N ATOM 365 CA GLN A 24 -7.284 8.183 1.389 1.00 0.00 C ATOM 366 C GLN A 24 -7.350 9.449 2.251 1.00 0.00 C ATOM 367 O GLN A 24 -8.060 10.379 1.886 1.00 0.00 O ATOM 368 CB GLN A 24 -8.242 7.111 1.943 1.00 0.00 C ATOM 369 CG GLN A 24 -8.536 5.943 0.982 1.00 0.00 C ATOM 370 CD GLN A 24 -9.266 6.359 -0.298 1.00 0.00 C ATOM 371 OE1 GLN A 24 -8.863 6.008 -1.400 1.00 0.00 O ATOM 372 NE2 GLN A 24 -10.354 7.104 -0.195 1.00 0.00 N ATOM 0 H GLN A 24 -5.800 6.746 1.716 1.00 0.00 H new ATOM 0 HA GLN A 24 -7.599 8.433 0.376 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -7.819 6.707 2.863 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -9.185 7.590 2.209 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -7.596 5.463 0.712 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -9.136 5.198 1.505 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -10.688 7.395 0.724 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -10.859 7.387 -1.034 1.00 0.00 H new ATOM 381 N ARG A 25 -6.614 9.531 3.366 1.00 0.00 N ATOM 382 CA ARG A 25 -6.597 10.730 4.204 1.00 0.00 C ATOM 383 C ARG A 25 -6.076 11.922 3.403 1.00 0.00 C ATOM 384 O ARG A 25 -6.696 12.986 3.421 1.00 0.00 O ATOM 385 CB ARG A 25 -5.765 10.475 5.475 1.00 0.00 C ATOM 386 CG ARG A 25 -5.882 11.626 6.488 1.00 0.00 C ATOM 387 CD ARG A 25 -5.099 11.336 7.775 1.00 0.00 C ATOM 388 NE ARG A 25 -3.638 11.411 7.582 1.00 0.00 N ATOM 389 CZ ARG A 25 -2.716 10.873 8.393 1.00 0.00 C ATOM 390 NH1 ARG A 25 -3.070 10.144 9.451 1.00 0.00 N ATOM 391 NH2 ARG A 25 -1.429 11.064 8.143 1.00 0.00 N ATOM 0 H ARG A 25 -6.020 8.775 3.708 1.00 0.00 H new ATOM 0 HA ARG A 25 -7.612 10.969 4.521 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -6.095 9.547 5.943 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -4.719 10.340 5.201 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -5.511 12.546 6.037 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -6.932 11.791 6.731 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.397 12.048 8.545 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -5.363 10.343 8.140 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.301 11.915 6.762 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -4.057 9.987 9.655 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -2.354 9.743 10.057 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -1.143 11.619 7.336 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -0.724 10.657 8.757 1.00 0.00 H new ATOM 405 N TYR A 26 -4.950 11.748 2.707 1.00 0.00 N ATOM 406 CA TYR A 26 -4.329 12.844 1.969 1.00 0.00 C ATOM 407 C TYR A 26 -5.064 13.180 0.662 1.00 0.00 C ATOM 408 O TYR A 26 -5.003 14.334 0.232 1.00 0.00 O ATOM 409 CB TYR A 26 -2.845 12.546 1.716 1.00 0.00 C ATOM 410 CG TYR A 26 -1.979 12.605 2.964 1.00 0.00 C ATOM 411 CD1 TYR A 26 -1.834 13.826 3.652 1.00 0.00 C ATOM 412 CD2 TYR A 26 -1.318 11.455 3.438 1.00 0.00 C ATOM 413 CE1 TYR A 26 -1.064 13.895 4.824 1.00 0.00 C ATOM 414 CE2 TYR A 26 -0.548 11.514 4.613 1.00 0.00 C ATOM 415 CZ TYR A 26 -0.424 12.736 5.313 1.00 0.00 C ATOM 416 OH TYR A 26 0.286 12.776 6.475 1.00 0.00 O ATOM 0 H TYR A 26 -4.453 10.860 2.641 1.00 0.00 H new ATOM 0 HA TYR A 26 -4.407 13.734 2.594 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -2.755 11.555 1.271 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -2.461 13.259 0.986 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -2.318 14.715 3.275 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -1.403 10.524 2.897 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -0.962 14.833 5.350 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -0.052 10.627 4.980 1.00 0.00 H new ATOM 0 HH TYR A 26 -0.099 13.452 7.071 1.00 0.00 H new ATOM 426 N HIS A 27 -5.750 12.224 0.026 1.00 0.00 N ATOM 427 CA HIS A 27 -6.357 12.394 -1.295 1.00 0.00 C ATOM 428 C HIS A 27 -7.675 11.589 -1.383 1.00 0.00 C ATOM 429 O HIS A 27 -7.754 10.593 -2.110 1.00 0.00 O ATOM 430 CB HIS A 27 -5.309 12.023 -2.368 1.00 0.00 C ATOM 431 CG HIS A 27 -5.413 12.783 -3.671 1.00 0.00 C ATOM 432 ND1 HIS A 27 -6.480 13.512 -4.150 1.00 0.00 N ATOM 433 CD2 HIS A 27 -4.407 12.909 -4.591 1.00 0.00 C ATOM 434 CE1 HIS A 27 -6.124 14.047 -5.329 1.00 0.00 C ATOM 435 NE2 HIS A 27 -4.864 13.703 -5.648 1.00 0.00 N ATOM 0 H HIS A 27 -5.900 11.296 0.423 1.00 0.00 H new ATOM 0 HA HIS A 27 -6.642 13.431 -1.474 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -4.315 12.186 -1.951 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -5.395 10.958 -2.581 1.00 0.00 H new ATOM 0 HD1 HIS A 27 -7.383 13.625 -3.689 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -3.424 12.469 -4.514 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -6.763 14.669 -5.938 1.00 0.00 H new ATOM 443 N PRO A 28 -8.720 11.963 -0.615 1.00 0.00 N ATOM 444 CA PRO A 28 -9.944 11.172 -0.470 1.00 0.00 C ATOM 445 C PRO A 28 -10.765 11.056 -1.761 1.00 0.00 C ATOM 446 O PRO A 28 -11.671 10.224 -1.835 1.00 0.00 O ATOM 447 CB PRO A 28 -10.750 11.855 0.644 1.00 0.00 C ATOM 448 CG PRO A 28 -10.258 13.300 0.610 1.00 0.00 C ATOM 449 CD PRO A 28 -8.791 13.156 0.218 1.00 0.00 C ATOM 0 HA PRO A 28 -9.690 10.141 -0.226 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -11.822 11.792 0.459 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -10.566 11.392 1.613 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -10.812 13.898 -0.114 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.371 13.787 1.579 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -8.443 14.034 -0.326 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -8.158 13.056 1.100 1.00 0.00 H new ATOM 457 N GLU A 29 -10.465 11.876 -2.770 1.00 0.00 N ATOM 458 CA GLU A 29 -11.129 11.835 -4.064 1.00 0.00 C ATOM 459 C GLU A 29 -10.823 10.525 -4.813 1.00 0.00 C ATOM 460 O GLU A 29 -11.582 10.140 -5.705 1.00 0.00 O ATOM 461 CB GLU A 29 -10.670 13.027 -4.929 1.00 0.00 C ATOM 462 CG GLU A 29 -10.919 14.420 -4.318 1.00 0.00 C ATOM 463 CD GLU A 29 -9.906 14.869 -3.241 1.00 0.00 C ATOM 464 OE1 GLU A 29 -8.898 14.166 -2.996 1.00 0.00 O ATOM 465 OE2 GLU A 29 -10.119 15.951 -2.645 1.00 0.00 O ATOM 0 H GLU A 29 -9.744 12.595 -2.705 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.203 11.891 -3.886 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -9.603 12.921 -5.127 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -11.180 12.974 -5.891 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -10.916 15.155 -5.123 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -11.917 14.431 -3.879 1.00 0.00 H new ATOM 472 N LEU A 30 -9.706 9.862 -4.487 1.00 0.00 N ATOM 473 CA LEU A 30 -9.197 8.719 -5.243 1.00 0.00 C ATOM 474 C LEU A 30 -9.811 7.410 -4.732 1.00 0.00 C ATOM 475 O LEU A 30 -10.509 7.382 -3.714 1.00 0.00 O ATOM 476 CB LEU A 30 -7.655 8.687 -5.193 1.00 0.00 C ATOM 477 CG LEU A 30 -6.949 9.987 -5.627 1.00 0.00 C ATOM 478 CD1 LEU A 30 -5.441 9.727 -5.716 1.00 0.00 C ATOM 479 CD2 LEU A 30 -7.444 10.531 -6.974 1.00 0.00 C ATOM 0 H LEU A 30 -9.128 10.109 -3.684 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.493 8.828 -6.286 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.347 8.450 -4.175 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -7.305 7.874 -5.830 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.182 10.742 -4.876 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.932 10.641 -6.022 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -5.068 9.413 -4.741 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -5.250 8.942 -6.448 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.905 11.446 -7.217 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -7.269 9.789 -7.753 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.511 10.745 -6.910 1.00 0.00 H new ATOM 491 N LYS A 31 -9.533 6.317 -5.450 1.00 0.00 N ATOM 492 CA LYS A 31 -10.052 4.985 -5.154 1.00 0.00 C ATOM 493 C LYS A 31 -8.846 4.100 -4.868 1.00 0.00 C ATOM 494 O LYS A 31 -8.351 3.407 -5.757 1.00 0.00 O ATOM 495 CB LYS A 31 -10.935 4.533 -6.337 1.00 0.00 C ATOM 496 CG LYS A 31 -11.365 3.054 -6.396 1.00 0.00 C ATOM 497 CD LYS A 31 -11.853 2.420 -5.085 1.00 0.00 C ATOM 498 CE LYS A 31 -13.046 3.149 -4.451 1.00 0.00 C ATOM 499 NZ LYS A 31 -13.616 2.369 -3.327 1.00 0.00 N ATOM 0 H LYS A 31 -8.927 6.338 -6.270 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.698 4.942 -4.277 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -11.838 5.143 -6.332 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -10.401 4.762 -7.259 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -12.161 2.961 -7.135 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -10.521 2.470 -6.762 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -12.132 1.384 -5.275 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -11.029 2.403 -4.372 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.728 4.128 -4.093 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -13.814 3.319 -5.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -13.951 3.019 -2.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -14.413 1.796 -3.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -12.885 1.743 -2.933 1.00 0.00 H new ATOM 513 N VAL A 32 -8.341 4.170 -3.640 1.00 0.00 N ATOM 514 CA VAL A 32 -7.222 3.348 -3.205 1.00 0.00 C ATOM 515 C VAL A 32 -7.799 2.128 -2.483 1.00 0.00 C ATOM 516 O VAL A 32 -8.713 2.268 -1.665 1.00 0.00 O ATOM 517 CB VAL A 32 -6.278 4.164 -2.299 1.00 0.00 C ATOM 518 CG1 VAL A 32 -4.960 3.406 -2.088 1.00 0.00 C ATOM 519 CG2 VAL A 32 -5.939 5.550 -2.878 1.00 0.00 C ATOM 0 H VAL A 32 -8.698 4.799 -2.920 1.00 0.00 H new ATOM 0 HA VAL A 32 -6.625 3.016 -4.055 1.00 0.00 H new ATOM 0 HB VAL A 32 -6.810 4.304 -1.358 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.302 3.992 -1.447 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -5.165 2.445 -1.616 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -4.476 3.242 -3.051 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -5.272 6.076 -2.195 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.449 5.431 -3.844 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -6.856 6.126 -3.005 1.00 0.00 H new ATOM 529 N GLU A 33 -7.258 0.943 -2.764 1.00 0.00 N ATOM 530 CA GLU A 33 -7.620 -0.298 -2.082 1.00 0.00 C ATOM 531 C GLU A 33 -6.344 -1.119 -1.810 1.00 0.00 C ATOM 532 O GLU A 33 -5.242 -0.713 -2.199 1.00 0.00 O ATOM 533 CB GLU A 33 -8.627 -1.093 -2.937 1.00 0.00 C ATOM 534 CG GLU A 33 -9.964 -0.382 -3.224 1.00 0.00 C ATOM 535 CD GLU A 33 -10.824 -0.070 -1.980 1.00 0.00 C ATOM 536 OE1 GLU A 33 -10.734 -0.787 -0.957 1.00 0.00 O ATOM 537 OE2 GLU A 33 -11.676 0.846 -2.062 1.00 0.00 O ATOM 0 H GLU A 33 -6.545 0.817 -3.483 1.00 0.00 H new ATOM 0 HA GLU A 33 -8.097 -0.073 -1.128 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -8.155 -1.338 -3.888 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -8.838 -2.036 -2.434 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -9.756 0.552 -3.745 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -10.548 -1.002 -3.903 1.00 0.00 H new ATOM 544 N SER A 34 -6.494 -2.290 -1.180 1.00 0.00 N ATOM 545 CA SER A 34 -5.367 -3.093 -0.699 1.00 0.00 C ATOM 546 C SER A 34 -5.515 -4.564 -1.097 1.00 0.00 C ATOM 547 O SER A 34 -6.632 -5.015 -1.374 1.00 0.00 O ATOM 548 CB SER A 34 -5.321 -2.986 0.827 1.00 0.00 C ATOM 549 OG SER A 34 -5.108 -1.663 1.230 1.00 0.00 O ATOM 0 H SER A 34 -7.405 -2.708 -0.989 1.00 0.00 H new ATOM 0 HA SER A 34 -4.448 -2.716 -1.148 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.257 -3.353 1.249 1.00 0.00 H new ATOM 0 HB3 SER A 34 -4.525 -3.621 1.216 1.00 0.00 H new ATOM 0 HG SER A 34 -5.967 -1.245 1.449 1.00 0.00 H new ATOM 555 N ALA A 35 -4.398 -5.296 -1.123 1.00 0.00 N ATOM 556 CA ALA A 35 -4.356 -6.744 -1.311 1.00 0.00 C ATOM 557 C ALA A 35 -2.997 -7.271 -0.807 1.00 0.00 C ATOM 558 O ALA A 35 -2.157 -6.516 -0.291 1.00 0.00 O ATOM 559 CB ALA A 35 -4.543 -7.072 -2.804 1.00 0.00 C ATOM 0 H ALA A 35 -3.472 -4.883 -1.010 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.157 -7.222 -0.748 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.512 -8.152 -2.946 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.506 -6.689 -3.143 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -3.744 -6.607 -3.382 1.00 0.00 H new ATOM 565 N GLY A 36 -2.735 -8.566 -1.005 1.00 0.00 N ATOM 566 CA GLY A 36 -1.411 -9.114 -0.767 1.00 0.00 C ATOM 567 C GLY A 36 -1.060 -10.334 -1.599 1.00 0.00 C ATOM 568 O GLY A 36 -1.935 -11.019 -2.124 1.00 0.00 O ATOM 0 H GLY A 36 -3.423 -9.246 -1.328 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -0.673 -8.336 -0.961 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.328 -9.376 0.288 1.00 0.00 H new ATOM 572 N LEU A 37 0.243 -10.600 -1.701 1.00 0.00 N ATOM 573 CA LEU A 37 0.774 -11.785 -2.377 1.00 0.00 C ATOM 574 C LEU A 37 0.417 -13.022 -1.555 1.00 0.00 C ATOM 575 O LEU A 37 -0.282 -13.915 -2.036 1.00 0.00 O ATOM 576 CB LEU A 37 2.301 -11.633 -2.541 1.00 0.00 C ATOM 577 CG LEU A 37 2.681 -10.744 -3.743 1.00 0.00 C ATOM 578 CD1 LEU A 37 4.061 -10.111 -3.536 1.00 0.00 C ATOM 579 CD2 LEU A 37 2.684 -11.560 -5.041 1.00 0.00 C ATOM 0 H LEU A 37 0.966 -9.994 -1.313 1.00 0.00 H new ATOM 0 HA LEU A 37 0.337 -11.894 -3.370 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.720 -11.205 -1.630 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.750 -12.619 -2.666 1.00 0.00 H new ATOM 0 HG LEU A 37 1.935 -9.953 -3.820 1.00 0.00 H new ATOM 0 HD11 LEU A 37 4.308 -9.488 -4.396 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.048 -9.497 -2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.809 -10.896 -3.429 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.955 -10.914 -5.876 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.408 -12.370 -4.960 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.691 -11.977 -5.211 1.00 0.00 H new ATOM 591 N GLY A 38 0.819 -13.011 -0.282 1.00 0.00 N ATOM 592 CA GLY A 38 0.477 -14.043 0.689 1.00 0.00 C ATOM 593 C GLY A 38 -0.575 -13.478 1.633 1.00 0.00 C ATOM 594 O GLY A 38 -0.336 -13.383 2.837 1.00 0.00 O ATOM 0 H GLY A 38 1.402 -12.269 0.106 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.096 -14.930 0.183 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.362 -14.349 1.246 1.00 0.00 H new ATOM 598 N ALA A 39 -1.677 -12.979 1.065 1.00 0.00 N ATOM 599 CA ALA A 39 -2.769 -12.409 1.843 1.00 0.00 C ATOM 600 C ALA A 39 -3.490 -13.479 2.666 1.00 0.00 C ATOM 601 O ALA A 39 -3.317 -14.682 2.454 1.00 0.00 O ATOM 602 CB ALA A 39 -3.776 -11.738 0.910 1.00 0.00 C ATOM 0 H ALA A 39 -1.832 -12.961 0.057 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.340 -11.676 2.526 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.590 -11.314 1.498 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.281 -10.945 0.350 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.177 -12.476 0.215 1.00 0.00 H new ATOM 608 N LEU A 40 -4.374 -13.012 3.551 1.00 0.00 N ATOM 609 CA LEU A 40 -5.131 -13.853 4.465 1.00 0.00 C ATOM 610 C LEU A 40 -6.588 -13.460 4.257 1.00 0.00 C ATOM 611 O LEU A 40 -7.100 -12.576 4.941 1.00 0.00 O ATOM 612 CB LEU A 40 -4.648 -13.615 5.909 1.00 0.00 C ATOM 613 CG LEU A 40 -3.184 -14.016 6.177 1.00 0.00 C ATOM 614 CD1 LEU A 40 -2.778 -13.534 7.570 1.00 0.00 C ATOM 615 CD2 LEU A 40 -2.963 -15.531 6.076 1.00 0.00 C ATOM 0 H LEU A 40 -4.584 -12.019 3.650 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.999 -14.919 4.280 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.770 -12.559 6.148 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.293 -14.172 6.589 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.568 -13.546 5.411 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.743 -13.815 7.765 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.876 -12.450 7.623 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.425 -13.993 8.317 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.916 -15.760 6.273 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.590 -16.040 6.808 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.226 -15.871 5.074 1.00 0.00 H new ATOM 627 N VAL A 41 -7.209 -14.046 3.232 1.00 0.00 N ATOM 628 CA VAL A 41 -8.526 -13.649 2.742 1.00 0.00 C ATOM 629 C VAL A 41 -9.534 -13.487 3.894 1.00 0.00 C ATOM 630 O VAL A 41 -9.815 -14.441 4.623 1.00 0.00 O ATOM 631 CB VAL A 41 -9.015 -14.637 1.656 1.00 0.00 C ATOM 632 CG1 VAL A 41 -10.259 -14.089 0.940 1.00 0.00 C ATOM 633 CG2 VAL A 41 -7.934 -14.922 0.595 1.00 0.00 C ATOM 0 H VAL A 41 -6.802 -14.823 2.711 1.00 0.00 H new ATOM 0 HA VAL A 41 -8.442 -12.667 2.276 1.00 0.00 H new ATOM 0 HB VAL A 41 -9.253 -15.566 2.175 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.585 -14.800 0.181 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.059 -13.939 1.665 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -10.016 -13.138 0.466 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.325 -15.620 -0.145 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.653 -13.991 0.102 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -7.058 -15.356 1.076 1.00 0.00 H new ATOM 643 N GLY A 42 -10.070 -12.271 4.045 1.00 0.00 N ATOM 644 CA GLY A 42 -11.146 -11.981 4.987 1.00 0.00 C ATOM 645 C GLY A 42 -10.742 -11.966 6.467 1.00 0.00 C ATOM 646 O GLY A 42 -11.632 -11.897 7.316 1.00 0.00 O ATOM 0 H GLY A 42 -9.764 -11.457 3.511 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -11.574 -11.011 4.735 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -11.934 -12.722 4.851 1.00 0.00 H new ATOM 650 N LYS A 43 -9.448 -12.029 6.816 1.00 0.00 N ATOM 651 CA LYS A 43 -9.028 -12.087 8.229 1.00 0.00 C ATOM 652 C LYS A 43 -9.192 -10.761 8.965 1.00 0.00 C ATOM 653 O LYS A 43 -9.140 -10.760 10.197 1.00 0.00 O ATOM 654 CB LYS A 43 -7.581 -12.610 8.368 1.00 0.00 C ATOM 655 CG LYS A 43 -7.531 -14.129 8.607 1.00 0.00 C ATOM 656 CD LYS A 43 -8.236 -14.922 7.498 1.00 0.00 C ATOM 657 CE LYS A 43 -8.284 -16.436 7.758 1.00 0.00 C ATOM 658 NZ LYS A 43 -6.949 -17.090 7.758 1.00 0.00 N ATOM 0 H LYS A 43 -8.678 -12.041 6.147 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.704 -12.795 8.708 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -7.021 -12.368 7.465 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.089 -12.098 9.195 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.491 -14.449 8.673 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.997 -14.358 9.565 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -9.254 -14.549 7.387 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.725 -14.740 6.552 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -8.765 -16.614 8.720 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -8.908 -16.906 6.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -7.061 -18.108 7.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -6.494 -16.951 6.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -6.356 -16.669 8.502 1.00 0.00 H new ATOM 672 N GLY A 44 -9.403 -9.648 8.260 1.00 0.00 N ATOM 673 CA GLY A 44 -9.364 -8.334 8.876 1.00 0.00 C ATOM 674 C GLY A 44 -7.918 -7.914 9.134 1.00 0.00 C ATOM 675 O GLY A 44 -6.985 -8.711 9.022 1.00 0.00 O ATOM 0 H GLY A 44 -9.603 -9.638 7.260 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -9.851 -7.606 8.228 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.919 -8.348 9.814 1.00 0.00 H new ATOM 679 N ALA A 45 -7.743 -6.636 9.456 1.00 0.00 N ATOM 680 CA ALA A 45 -6.435 -6.075 9.774 1.00 0.00 C ATOM 681 C ALA A 45 -5.902 -6.669 11.085 1.00 0.00 C ATOM 682 O ALA A 45 -6.676 -7.049 11.969 1.00 0.00 O ATOM 683 CB ALA A 45 -6.529 -4.549 9.869 1.00 0.00 C ATOM 0 H ALA A 45 -8.505 -5.960 9.504 1.00 0.00 H new ATOM 0 HA ALA A 45 -5.737 -6.331 8.977 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -5.548 -4.138 10.107 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -6.870 -4.145 8.916 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -7.236 -4.276 10.652 1.00 0.00 H new ATOM 689 N ASP A 46 -4.576 -6.703 11.224 1.00 0.00 N ATOM 690 CA ASP A 46 -3.926 -7.066 12.481 1.00 0.00 C ATOM 691 C ASP A 46 -4.246 -5.989 13.526 1.00 0.00 C ATOM 692 O ASP A 46 -4.121 -4.802 13.209 1.00 0.00 O ATOM 693 CB ASP A 46 -2.409 -7.167 12.285 1.00 0.00 C ATOM 694 CG ASP A 46 -1.723 -7.607 13.586 1.00 0.00 C ATOM 695 OD1 ASP A 46 -1.489 -6.743 14.459 1.00 0.00 O ATOM 696 OD2 ASP A 46 -1.449 -8.818 13.743 1.00 0.00 O ATOM 0 H ASP A 46 -3.926 -6.480 10.470 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.294 -8.035 12.818 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.186 -7.880 11.491 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -2.013 -6.202 11.967 1.00 0.00 H new ATOM 701 N PRO A 47 -4.636 -6.335 14.764 1.00 0.00 N ATOM 702 CA PRO A 47 -5.065 -5.344 15.746 1.00 0.00 C ATOM 703 C PRO A 47 -3.968 -4.344 16.131 1.00 0.00 C ATOM 704 O PRO A 47 -4.292 -3.267 16.631 1.00 0.00 O ATOM 705 CB PRO A 47 -5.579 -6.139 16.951 1.00 0.00 C ATOM 706 CG PRO A 47 -4.889 -7.496 16.817 1.00 0.00 C ATOM 707 CD PRO A 47 -4.775 -7.677 15.306 1.00 0.00 C ATOM 0 HA PRO A 47 -5.846 -4.712 15.323 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -5.322 -5.651 17.891 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -6.664 -6.239 16.930 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -3.911 -7.501 17.299 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -5.474 -8.293 17.276 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -3.915 -8.295 15.048 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -5.657 -8.174 14.902 1.00 0.00 H new ATOM 715 N THR A 48 -2.691 -4.636 15.883 1.00 0.00 N ATOM 716 CA THR A 48 -1.614 -3.695 16.161 1.00 0.00 C ATOM 717 C THR A 48 -1.650 -2.576 15.116 1.00 0.00 C ATOM 718 O THR A 48 -1.475 -1.411 15.469 1.00 0.00 O ATOM 719 CB THR A 48 -0.249 -4.412 16.160 1.00 0.00 C ATOM 720 OG1 THR A 48 -0.359 -5.755 16.587 1.00 0.00 O ATOM 721 CG2 THR A 48 0.759 -3.686 17.059 1.00 0.00 C ATOM 0 H THR A 48 -2.379 -5.523 15.488 1.00 0.00 H new ATOM 0 HA THR A 48 -1.753 -3.264 17.152 1.00 0.00 H new ATOM 0 HB THR A 48 0.105 -4.399 15.129 1.00 0.00 H new ATOM 0 HG1 THR A 48 -0.520 -6.333 15.812 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.712 -4.215 17.038 1.00 0.00 H new ATOM 0 HG22 THR A 48 0.901 -2.667 16.698 1.00 0.00 H new ATOM 0 HG23 THR A 48 0.381 -3.659 18.081 1.00 0.00 H new ATOM 729 N ALA A 49 -1.956 -2.907 13.853 1.00 0.00 N ATOM 730 CA ALA A 49 -2.138 -1.909 12.810 1.00 0.00 C ATOM 731 C ALA A 49 -3.345 -1.031 13.136 1.00 0.00 C ATOM 732 O ALA A 49 -3.256 0.192 13.024 1.00 0.00 O ATOM 733 CB ALA A 49 -2.325 -2.606 11.458 1.00 0.00 C ATOM 0 H ALA A 49 -2.082 -3.868 13.536 1.00 0.00 H new ATOM 0 HA ALA A 49 -1.254 -1.273 12.756 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -2.461 -1.857 10.678 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.444 -3.207 11.234 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.203 -3.250 11.499 1.00 0.00 H new ATOM 739 N ILE A 50 -4.451 -1.641 13.584 1.00 0.00 N ATOM 740 CA ILE A 50 -5.641 -0.898 13.994 1.00 0.00 C ATOM 741 C ILE A 50 -5.262 0.054 15.135 1.00 0.00 C ATOM 742 O ILE A 50 -5.577 1.239 15.061 1.00 0.00 O ATOM 743 CB ILE A 50 -6.806 -1.833 14.403 1.00 0.00 C ATOM 744 CG1 ILE A 50 -7.112 -2.900 13.325 1.00 0.00 C ATOM 745 CG2 ILE A 50 -8.070 -0.997 14.692 1.00 0.00 C ATOM 746 CD1 ILE A 50 -8.240 -3.877 13.680 1.00 0.00 C ATOM 0 H ILE A 50 -4.542 -2.653 13.670 1.00 0.00 H new ATOM 0 HA ILE A 50 -6.003 -0.323 13.142 1.00 0.00 H new ATOM 0 HB ILE A 50 -6.498 -2.364 15.304 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -7.371 -2.392 12.396 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -6.204 -3.472 13.133 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -8.887 -1.659 14.979 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -7.867 -0.299 15.504 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -8.351 -0.441 13.797 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -8.379 -4.585 12.863 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -7.979 -4.419 14.589 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -9.165 -3.322 13.840 1.00 0.00 H new ATOM 758 N SER A 51 -4.570 -0.443 16.165 1.00 0.00 N ATOM 759 CA SER A 51 -4.223 0.346 17.339 1.00 0.00 C ATOM 760 C SER A 51 -3.333 1.527 16.947 1.00 0.00 C ATOM 761 O SER A 51 -3.668 2.669 17.255 1.00 0.00 O ATOM 762 CB SER A 51 -3.543 -0.540 18.390 1.00 0.00 C ATOM 763 OG SER A 51 -4.371 -1.631 18.758 1.00 0.00 O ATOM 0 H SER A 51 -4.237 -1.406 16.203 1.00 0.00 H new ATOM 0 HA SER A 51 -5.136 0.749 17.777 1.00 0.00 H new ATOM 0 HB2 SER A 51 -2.598 -0.914 17.997 1.00 0.00 H new ATOM 0 HB3 SER A 51 -3.308 0.055 19.273 1.00 0.00 H new ATOM 0 HG SER A 51 -4.238 -2.370 18.128 1.00 0.00 H new ATOM 769 N VAL A 52 -2.248 1.284 16.206 1.00 0.00 N ATOM 770 CA VAL A 52 -1.331 2.343 15.798 1.00 0.00 C ATOM 771 C VAL A 52 -2.051 3.362 14.902 1.00 0.00 C ATOM 772 O VAL A 52 -1.797 4.558 15.035 1.00 0.00 O ATOM 773 CB VAL A 52 -0.069 1.714 15.166 1.00 0.00 C ATOM 774 CG1 VAL A 52 0.854 2.738 14.489 1.00 0.00 C ATOM 775 CG2 VAL A 52 0.747 0.995 16.258 1.00 0.00 C ATOM 0 H VAL A 52 -1.985 0.355 15.876 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.991 2.913 16.663 1.00 0.00 H new ATOM 0 HB VAL A 52 -0.425 1.026 14.399 1.00 0.00 H new ATOM 0 HG11 VAL A 52 1.719 2.226 14.068 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.311 3.247 13.693 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.188 3.469 15.225 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.638 0.551 15.814 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.043 1.713 17.023 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.138 0.212 16.711 1.00 0.00 H new ATOM 785 N ALA A 53 -2.985 2.947 14.037 1.00 0.00 N ATOM 786 CA ALA A 53 -3.733 3.892 13.220 1.00 0.00 C ATOM 787 C ALA A 53 -4.721 4.702 14.067 1.00 0.00 C ATOM 788 O ALA A 53 -4.842 5.911 13.870 1.00 0.00 O ATOM 789 CB ALA A 53 -4.463 3.140 12.115 1.00 0.00 C ATOM 0 H ALA A 53 -3.235 1.969 13.890 1.00 0.00 H new ATOM 0 HA ALA A 53 -3.032 4.598 12.774 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -5.023 3.847 11.503 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.739 2.615 11.492 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -5.150 2.419 12.558 1.00 0.00 H new ATOM 795 N ALA A 54 -5.397 4.072 15.032 1.00 0.00 N ATOM 796 CA ALA A 54 -6.296 4.766 15.949 1.00 0.00 C ATOM 797 C ALA A 54 -5.526 5.751 16.835 1.00 0.00 C ATOM 798 O ALA A 54 -6.024 6.839 17.115 1.00 0.00 O ATOM 799 CB ALA A 54 -7.055 3.746 16.805 1.00 0.00 C ATOM 0 H ALA A 54 -5.334 3.067 15.197 1.00 0.00 H new ATOM 0 HA ALA A 54 -7.014 5.340 15.363 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.724 4.270 17.487 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -7.637 3.090 16.158 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -6.344 3.152 17.379 1.00 0.00 H new ATOM 805 N GLU A 55 -4.288 5.428 17.213 1.00 0.00 N ATOM 806 CA GLU A 55 -3.393 6.341 17.930 1.00 0.00 C ATOM 807 C GLU A 55 -3.008 7.574 17.082 1.00 0.00 C ATOM 808 O GLU A 55 -2.435 8.527 17.612 1.00 0.00 O ATOM 809 CB GLU A 55 -2.157 5.552 18.412 1.00 0.00 C ATOM 810 CG GLU A 55 -2.494 4.654 19.616 1.00 0.00 C ATOM 811 CD GLU A 55 -1.540 3.456 19.774 1.00 0.00 C ATOM 812 OE1 GLU A 55 -0.299 3.626 19.821 1.00 0.00 O ATOM 813 OE2 GLU A 55 -2.027 2.314 19.916 1.00 0.00 O ATOM 0 H GLU A 55 -3.873 4.515 17.028 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.918 6.742 18.797 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.774 4.939 17.596 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.364 6.248 18.687 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -2.465 5.254 20.526 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -3.514 4.285 19.510 1.00 0.00 H new ATOM 820 N HIS A 56 -3.376 7.592 15.796 1.00 0.00 N ATOM 821 CA HIS A 56 -3.269 8.718 14.869 1.00 0.00 C ATOM 822 C HIS A 56 -4.648 9.066 14.265 1.00 0.00 C ATOM 823 O HIS A 56 -4.726 9.758 13.248 1.00 0.00 O ATOM 824 CB HIS A 56 -2.224 8.377 13.800 1.00 0.00 C ATOM 825 CG HIS A 56 -0.799 8.470 14.292 1.00 0.00 C ATOM 826 ND1 HIS A 56 0.059 9.533 14.099 1.00 0.00 N ATOM 827 CD2 HIS A 56 -0.114 7.534 15.022 1.00 0.00 C ATOM 828 CE1 HIS A 56 1.227 9.241 14.695 1.00 0.00 C ATOM 829 NE2 HIS A 56 1.172 8.029 15.279 1.00 0.00 N ATOM 0 H HIS A 56 -3.781 6.769 15.350 1.00 0.00 H new ATOM 0 HA HIS A 56 -2.938 9.612 15.398 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -2.408 7.367 13.434 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -2.351 9.051 12.953 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -0.499 6.578 15.344 1.00 0.00 H new ATOM 0 HE1 HIS A 56 2.091 9.889 14.704 1.00 0.00 H new ATOM 0 HE2 HIS A 56 1.915 7.565 15.802 1.00 0.00 H new ATOM 837 N GLN A 57 -5.731 8.615 14.916 1.00 0.00 N ATOM 838 CA GLN A 57 -7.117 8.913 14.545 1.00 0.00 C ATOM 839 C GLN A 57 -7.420 8.627 13.067 1.00 0.00 C ATOM 840 O GLN A 57 -8.112 9.406 12.406 1.00 0.00 O ATOM 841 CB GLN A 57 -7.491 10.342 15.001 1.00 0.00 C ATOM 842 CG GLN A 57 -7.309 10.608 16.506 1.00 0.00 C ATOM 843 CD GLN A 57 -8.341 9.872 17.361 1.00 0.00 C ATOM 844 OE1 GLN A 57 -9.411 10.397 17.662 1.00 0.00 O ATOM 845 NE2 GLN A 57 -8.061 8.646 17.773 1.00 0.00 N ATOM 0 H GLN A 57 -5.661 8.016 15.738 1.00 0.00 H new ATOM 0 HA GLN A 57 -7.770 8.223 15.079 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.884 11.056 14.444 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -8.531 10.532 14.736 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -6.307 10.301 16.807 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -7.384 11.679 16.694 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -7.172 8.214 17.521 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -8.734 8.133 18.342 1.00 0.00 H new ATOM 854 N LEU A 58 -6.925 7.494 12.555 1.00 0.00 N ATOM 855 CA LEU A 58 -7.269 7.011 11.221 1.00 0.00 C ATOM 856 C LEU A 58 -8.058 5.712 11.375 1.00 0.00 C ATOM 857 O LEU A 58 -7.647 4.820 12.121 1.00 0.00 O ATOM 858 CB LEU A 58 -6.000 6.814 10.371 1.00 0.00 C ATOM 859 CG LEU A 58 -6.131 7.405 8.955 1.00 0.00 C ATOM 860 CD1 LEU A 58 -4.881 7.051 8.143 1.00 0.00 C ATOM 861 CD2 LEU A 58 -7.393 6.951 8.209 1.00 0.00 C ATOM 0 H LEU A 58 -6.275 6.889 13.057 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.884 7.743 10.698 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -5.154 7.279 10.877 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -5.780 5.749 10.296 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.224 8.485 9.070 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.969 7.467 7.139 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -4.000 7.466 8.632 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -4.784 5.967 8.079 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -7.415 7.408 7.220 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.385 5.866 8.107 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -8.277 7.256 8.770 1.00 0.00 H new ATOM 873 N SER A 59 -9.199 5.618 10.694 1.00 0.00 N ATOM 874 CA SER A 59 -10.165 4.542 10.860 1.00 0.00 C ATOM 875 C SER A 59 -9.726 3.287 10.090 1.00 0.00 C ATOM 876 O SER A 59 -10.233 2.984 9.006 1.00 0.00 O ATOM 877 CB SER A 59 -11.551 5.040 10.418 1.00 0.00 C ATOM 878 OG SER A 59 -11.857 6.284 11.037 1.00 0.00 O ATOM 0 H SER A 59 -9.481 6.306 9.996 1.00 0.00 H new ATOM 0 HA SER A 59 -10.221 4.255 11.910 1.00 0.00 H new ATOM 0 HB2 SER A 59 -11.575 5.152 9.334 1.00 0.00 H new ATOM 0 HB3 SER A 59 -12.309 4.302 10.679 1.00 0.00 H new ATOM 0 HG SER A 59 -12.742 6.587 10.743 1.00 0.00 H new ATOM 884 N LEU A 60 -8.781 2.539 10.662 1.00 0.00 N ATOM 885 CA LEU A 60 -8.244 1.294 10.090 1.00 0.00 C ATOM 886 C LEU A 60 -9.056 0.096 10.628 1.00 0.00 C ATOM 887 O LEU A 60 -8.570 -1.026 10.656 1.00 0.00 O ATOM 888 CB LEU A 60 -6.758 1.245 10.517 1.00 0.00 C ATOM 889 CG LEU A 60 -5.693 0.439 9.739 1.00 0.00 C ATOM 890 CD1 LEU A 60 -5.758 -1.088 9.810 1.00 0.00 C ATOM 891 CD2 LEU A 60 -5.633 0.858 8.273 1.00 0.00 C ATOM 0 H LEU A 60 -8.355 2.784 11.556 1.00 0.00 H new ATOM 0 HA LEU A 60 -8.319 1.253 9.003 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -6.408 2.277 10.545 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.741 0.875 11.542 1.00 0.00 H new ATOM 0 HG LEU A 60 -4.784 0.704 10.279 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.949 -1.515 9.216 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -5.655 -1.409 10.847 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.716 -1.430 9.417 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.873 0.270 7.757 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.603 0.687 7.806 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.380 1.916 8.207 1.00 0.00 H new ATOM 903 N GLU A 61 -10.281 0.331 11.117 1.00 0.00 N ATOM 904 CA GLU A 61 -11.062 -0.663 11.865 1.00 0.00 C ATOM 905 C GLU A 61 -11.298 -2.007 11.158 1.00 0.00 C ATOM 906 O GLU A 61 -11.566 -3.000 11.839 1.00 0.00 O ATOM 907 CB GLU A 61 -12.406 -0.042 12.283 1.00 0.00 C ATOM 908 CG GLU A 61 -12.234 1.176 13.206 1.00 0.00 C ATOM 909 CD GLU A 61 -13.594 1.704 13.696 1.00 0.00 C ATOM 910 OE1 GLU A 61 -14.217 2.540 13.003 1.00 0.00 O ATOM 911 OE2 GLU A 61 -14.050 1.303 14.792 1.00 0.00 O ATOM 0 H GLU A 61 -10.762 1.224 11.004 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.448 -0.918 12.729 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -12.956 0.258 11.391 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -13.008 -0.796 12.791 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -11.618 0.902 14.063 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -11.705 1.967 12.673 1.00 0.00 H new ATOM 918 N GLY A 62 -11.193 -2.081 9.828 1.00 0.00 N ATOM 919 CA GLY A 62 -11.284 -3.327 9.102 1.00 0.00 C ATOM 920 C GLY A 62 -10.895 -3.100 7.649 1.00 0.00 C ATOM 921 O GLY A 62 -10.978 -1.986 7.122 1.00 0.00 O ATOM 0 H GLY A 62 -11.042 -1.267 9.232 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -10.627 -4.071 9.553 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -12.299 -3.720 9.160 1.00 0.00 H new ATOM 925 N HIS A 63 -10.461 -4.185 7.022 1.00 0.00 N ATOM 926 CA HIS A 63 -10.162 -4.312 5.606 1.00 0.00 C ATOM 927 C HIS A 63 -10.420 -5.771 5.221 1.00 0.00 C ATOM 928 O HIS A 63 -9.917 -6.681 5.885 1.00 0.00 O ATOM 929 CB HIS A 63 -8.694 -3.930 5.347 1.00 0.00 C ATOM 930 CG HIS A 63 -8.180 -4.402 4.008 1.00 0.00 C ATOM 931 ND1 HIS A 63 -8.718 -4.122 2.770 1.00 0.00 N ATOM 932 CD2 HIS A 63 -7.168 -5.303 3.813 1.00 0.00 C ATOM 933 CE1 HIS A 63 -8.058 -4.853 1.859 1.00 0.00 C ATOM 934 NE2 HIS A 63 -7.071 -5.559 2.440 1.00 0.00 N ATOM 0 H HIS A 63 -10.298 -5.057 7.525 1.00 0.00 H new ATOM 0 HA HIS A 63 -10.786 -3.647 5.009 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -8.592 -2.846 5.406 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -8.072 -4.352 6.136 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -9.482 -3.474 2.580 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -6.551 -5.740 4.584 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -8.288 -4.872 0.804 1.00 0.00 H new ATOM 942 N CYS A 64 -11.188 -5.996 4.153 1.00 0.00 N ATOM 943 CA CYS A 64 -11.365 -7.324 3.582 1.00 0.00 C ATOM 944 C CYS A 64 -10.091 -7.701 2.813 1.00 0.00 C ATOM 945 O CYS A 64 -9.975 -7.406 1.620 1.00 0.00 O ATOM 946 CB CYS A 64 -12.606 -7.353 2.676 1.00 0.00 C ATOM 947 SG CYS A 64 -14.097 -6.923 3.624 1.00 0.00 S ATOM 0 H CYS A 64 -11.701 -5.263 3.664 1.00 0.00 H new ATOM 0 HA CYS A 64 -11.528 -8.057 4.372 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -12.478 -6.652 1.851 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -12.720 -8.344 2.237 1.00 0.00 H new ATOM 0 HG CYS A 64 -15.133 -6.951 2.839 1.00 0.00 H new ATOM 953 N ALA A 65 -9.139 -8.343 3.501 1.00 0.00 N ATOM 954 CA ALA A 65 -7.919 -8.849 2.881 1.00 0.00 C ATOM 955 C ALA A 65 -8.256 -9.877 1.798 1.00 0.00 C ATOM 956 O ALA A 65 -9.300 -10.533 1.864 1.00 0.00 O ATOM 957 CB ALA A 65 -7.015 -9.435 3.969 1.00 0.00 C ATOM 0 H ALA A 65 -9.197 -8.524 4.503 1.00 0.00 H new ATOM 0 HA ALA A 65 -7.384 -8.036 2.389 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -6.100 -9.816 3.516 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -6.765 -8.658 4.692 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.535 -10.248 4.475 1.00 0.00 H new ATOM 963 N ARG A 66 -7.368 -10.023 0.813 1.00 0.00 N ATOM 964 CA ARG A 66 -7.629 -10.790 -0.408 1.00 0.00 C ATOM 965 C ARG A 66 -6.310 -10.996 -1.149 1.00 0.00 C ATOM 966 O ARG A 66 -5.459 -10.103 -1.149 1.00 0.00 O ATOM 967 CB ARG A 66 -8.642 -10.027 -1.296 1.00 0.00 C ATOM 968 CG ARG A 66 -8.192 -8.597 -1.648 1.00 0.00 C ATOM 969 CD ARG A 66 -9.290 -7.776 -2.324 1.00 0.00 C ATOM 970 NE ARG A 66 -8.769 -6.427 -2.580 1.00 0.00 N ATOM 971 CZ ARG A 66 -9.115 -5.581 -3.550 1.00 0.00 C ATOM 972 NH1 ARG A 66 -10.128 -5.826 -4.376 1.00 0.00 N ATOM 973 NH2 ARG A 66 -8.405 -4.471 -3.687 1.00 0.00 N ATOM 0 H ARG A 66 -6.437 -9.608 0.840 1.00 0.00 H new ATOM 0 HA ARG A 66 -8.056 -11.761 -0.159 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -8.800 -10.587 -2.218 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -9.602 -9.982 -0.782 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -7.873 -8.088 -0.739 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -7.325 -8.646 -2.307 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -9.596 -8.248 -3.258 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -10.173 -7.727 -1.687 1.00 0.00 H new ATOM 0 HE ARG A 66 -8.052 -6.096 -1.934 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -10.669 -6.685 -4.279 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -10.364 -5.155 -5.107 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -7.621 -4.286 -3.061 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -8.642 -3.801 -4.419 1.00 0.00 H new ATOM 987 N GLN A 67 -6.129 -12.158 -1.776 1.00 0.00 N ATOM 988 CA GLN A 67 -4.934 -12.399 -2.574 1.00 0.00 C ATOM 989 C GLN A 67 -4.990 -11.586 -3.862 1.00 0.00 C ATOM 990 O GLN A 67 -6.038 -11.465 -4.504 1.00 0.00 O ATOM 991 CB GLN A 67 -4.713 -13.888 -2.877 1.00 0.00 C ATOM 992 CG GLN A 67 -4.118 -14.633 -1.672 1.00 0.00 C ATOM 993 CD GLN A 67 -3.521 -15.975 -2.095 1.00 0.00 C ATOM 994 OE1 GLN A 67 -4.206 -16.995 -2.145 1.00 0.00 O ATOM 995 NE2 GLN A 67 -2.238 -16.006 -2.422 1.00 0.00 N ATOM 0 H GLN A 67 -6.787 -12.937 -1.746 1.00 0.00 H new ATOM 0 HA GLN A 67 -4.079 -12.074 -1.981 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -5.662 -14.347 -3.156 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -4.046 -13.990 -3.733 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -3.347 -14.019 -1.206 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -4.893 -14.796 -0.923 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -1.679 -15.154 -2.377 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -1.808 -16.882 -2.719 1.00 0.00 H new ATOM 1004 N ILE A 68 -3.822 -11.069 -4.237 1.00 0.00 N ATOM 1005 CA ILE A 68 -3.607 -10.451 -5.529 1.00 0.00 C ATOM 1006 C ILE A 68 -3.995 -11.467 -6.611 1.00 0.00 C ATOM 1007 O ILE A 68 -3.658 -12.652 -6.520 1.00 0.00 O ATOM 1008 CB ILE A 68 -2.150 -9.941 -5.611 1.00 0.00 C ATOM 1009 CG1 ILE A 68 -1.881 -9.054 -6.841 1.00 0.00 C ATOM 1010 CG2 ILE A 68 -1.101 -11.064 -5.588 1.00 0.00 C ATOM 1011 CD1 ILE A 68 -2.728 -7.778 -6.865 1.00 0.00 C ATOM 0 H ILE A 68 -2.994 -11.071 -3.641 1.00 0.00 H new ATOM 0 HA ILE A 68 -4.233 -9.572 -5.684 1.00 0.00 H new ATOM 0 HB ILE A 68 -2.044 -9.341 -4.707 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.826 -8.782 -6.860 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.078 -9.630 -7.745 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -0.103 -10.631 -5.649 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -1.195 -11.631 -4.662 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.261 -11.728 -6.437 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -2.489 -7.199 -7.757 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -3.785 -8.043 -6.877 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -2.513 -7.182 -5.978 1.00 0.00 H new ATOM 1023 N SER A 69 -4.745 -10.998 -7.603 1.00 0.00 N ATOM 1024 CA SER A 69 -5.328 -11.835 -8.644 1.00 0.00 C ATOM 1025 C SER A 69 -5.277 -11.037 -9.950 1.00 0.00 C ATOM 1026 O SER A 69 -5.157 -9.807 -9.916 1.00 0.00 O ATOM 1027 CB SER A 69 -6.769 -12.197 -8.238 1.00 0.00 C ATOM 1028 OG SER A 69 -6.820 -12.888 -6.998 1.00 0.00 O ATOM 0 H SER A 69 -4.968 -10.008 -7.707 1.00 0.00 H new ATOM 0 HA SER A 69 -4.783 -12.769 -8.780 1.00 0.00 H new ATOM 0 HB2 SER A 69 -7.365 -11.287 -8.169 1.00 0.00 H new ATOM 0 HB3 SER A 69 -7.219 -12.815 -9.015 1.00 0.00 H new ATOM 0 HG SER A 69 -6.548 -12.284 -6.276 1.00 0.00 H new ATOM 1034 N ARG A 70 -5.371 -11.690 -11.112 1.00 0.00 N ATOM 1035 CA ARG A 70 -5.204 -10.996 -12.395 1.00 0.00 C ATOM 1036 C ARG A 70 -6.276 -9.925 -12.596 1.00 0.00 C ATOM 1037 O ARG A 70 -5.965 -8.829 -13.065 1.00 0.00 O ATOM 1038 CB ARG A 70 -5.196 -12.022 -13.546 1.00 0.00 C ATOM 1039 CG ARG A 70 -4.570 -11.500 -14.851 1.00 0.00 C ATOM 1040 CD ARG A 70 -3.078 -11.183 -14.667 1.00 0.00 C ATOM 1041 NE ARG A 70 -2.368 -11.049 -15.947 1.00 0.00 N ATOM 1042 CZ ARG A 70 -1.770 -12.027 -16.634 1.00 0.00 C ATOM 1043 NH1 ARG A 70 -1.890 -13.303 -16.272 1.00 0.00 N ATOM 1044 NH2 ARG A 70 -1.053 -11.704 -17.702 1.00 0.00 N ATOM 0 H ARG A 70 -5.560 -12.689 -11.192 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.245 -10.478 -12.390 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -4.650 -12.909 -13.224 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -6.221 -12.334 -13.747 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -4.691 -12.244 -15.638 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -5.097 -10.603 -15.176 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -2.974 -10.258 -14.099 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -2.612 -11.973 -14.078 1.00 0.00 H new ATOM 0 HE ARG A 70 -2.328 -10.114 -16.352 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -2.448 -13.551 -15.455 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -1.424 -14.032 -16.812 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -0.968 -10.727 -17.983 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -0.587 -12.433 -18.243 1.00 0.00 H new ATOM 1058 N ARG A 71 -7.520 -10.209 -12.192 1.00 0.00 N ATOM 1059 CA ARG A 71 -8.609 -9.230 -12.257 1.00 0.00 C ATOM 1060 C ARG A 71 -8.275 -8.008 -11.410 1.00 0.00 C ATOM 1061 O ARG A 71 -8.426 -6.889 -11.894 1.00 0.00 O ATOM 1062 CB ARG A 71 -9.947 -9.856 -11.815 1.00 0.00 C ATOM 1063 CG ARG A 71 -10.428 -11.035 -12.680 1.00 0.00 C ATOM 1064 CD ARG A 71 -10.693 -10.640 -14.139 1.00 0.00 C ATOM 1065 NE ARG A 71 -11.218 -11.776 -14.919 1.00 0.00 N ATOM 1066 CZ ARG A 71 -11.653 -11.720 -16.185 1.00 0.00 C ATOM 1067 NH1 ARG A 71 -11.647 -10.571 -16.856 1.00 0.00 N ATOM 1068 NH2 ARG A 71 -12.092 -12.826 -16.778 1.00 0.00 N ATOM 0 H ARG A 71 -7.797 -11.115 -11.815 1.00 0.00 H new ATOM 0 HA ARG A 71 -8.719 -8.912 -13.294 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -9.849 -10.197 -10.784 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -10.714 -9.082 -11.823 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -9.679 -11.827 -12.654 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -11.341 -11.446 -12.249 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -11.405 -9.816 -14.170 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -9.770 -10.281 -14.593 1.00 0.00 H new ATOM 0 HE ARG A 71 -11.253 -12.683 -14.454 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -11.309 -9.720 -16.407 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -11.981 -10.541 -17.819 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -12.096 -13.710 -16.269 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -12.425 -12.790 -17.742 1.00 0.00 H new ATOM 1082 N LEU A 72 -7.765 -8.204 -10.187 1.00 0.00 N ATOM 1083 CA LEU A 72 -7.318 -7.109 -9.332 1.00 0.00 C ATOM 1084 C LEU A 72 -6.258 -6.294 -10.055 1.00 0.00 C ATOM 1085 O LEU A 72 -6.394 -5.078 -10.139 1.00 0.00 O ATOM 1086 CB LEU A 72 -6.749 -7.627 -7.998 1.00 0.00 C ATOM 1087 CG LEU A 72 -7.756 -7.591 -6.846 1.00 0.00 C ATOM 1088 CD1 LEU A 72 -8.962 -8.510 -7.071 1.00 0.00 C ATOM 1089 CD2 LEU A 72 -7.039 -7.991 -5.555 1.00 0.00 C ATOM 0 H LEU A 72 -7.653 -9.127 -9.768 1.00 0.00 H new ATOM 0 HA LEU A 72 -8.182 -6.483 -9.110 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.402 -8.651 -8.134 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -5.879 -7.029 -7.727 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.146 -6.575 -6.782 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -9.638 -8.439 -6.219 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -9.487 -8.206 -7.977 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -8.620 -9.539 -7.178 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.745 -7.970 -4.725 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.634 -8.997 -5.661 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.227 -7.291 -5.358 1.00 0.00 H new ATOM 1101 N CYS A 73 -5.238 -6.946 -10.617 1.00 0.00 N ATOM 1102 CA CYS A 73 -4.136 -6.236 -11.257 1.00 0.00 C ATOM 1103 C CYS A 73 -4.622 -5.324 -12.394 1.00 0.00 C ATOM 1104 O CYS A 73 -4.015 -4.284 -12.641 1.00 0.00 O ATOM 1105 CB CYS A 73 -3.096 -7.225 -11.803 1.00 0.00 C ATOM 1106 SG CYS A 73 -2.408 -8.282 -10.494 1.00 0.00 S ATOM 0 H CYS A 73 -5.155 -7.962 -10.640 1.00 0.00 H new ATOM 0 HA CYS A 73 -3.677 -5.610 -10.492 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -3.557 -7.849 -12.569 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -2.289 -6.673 -12.285 1.00 0.00 H new ATOM 0 HG CYS A 73 -3.335 -9.075 -10.045 1.00 0.00 H new ATOM 1112 N ARG A 74 -5.706 -5.703 -13.084 1.00 0.00 N ATOM 1113 CA ARG A 74 -6.262 -4.920 -14.189 1.00 0.00 C ATOM 1114 C ARG A 74 -7.295 -3.889 -13.711 1.00 0.00 C ATOM 1115 O ARG A 74 -7.544 -2.917 -14.424 1.00 0.00 O ATOM 1116 CB ARG A 74 -6.884 -5.884 -15.215 1.00 0.00 C ATOM 1117 CG ARG A 74 -5.822 -6.771 -15.891 1.00 0.00 C ATOM 1118 CD ARG A 74 -6.466 -7.819 -16.803 1.00 0.00 C ATOM 1119 NE ARG A 74 -5.442 -8.670 -17.428 1.00 0.00 N ATOM 1120 CZ ARG A 74 -5.652 -9.750 -18.186 1.00 0.00 C ATOM 1121 NH1 ARG A 74 -6.881 -10.177 -18.465 1.00 0.00 N ATOM 1122 NH2 ARG A 74 -4.589 -10.389 -18.653 1.00 0.00 N ATOM 0 H ARG A 74 -6.220 -6.562 -12.890 1.00 0.00 H new ATOM 0 HA ARG A 74 -5.455 -4.353 -14.652 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -7.621 -6.515 -14.719 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.415 -5.311 -15.975 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.143 -6.148 -16.473 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -5.223 -7.269 -15.129 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.154 -8.436 -16.225 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.054 -7.323 -17.576 1.00 0.00 H new ATOM 0 HE ARG A 74 -4.470 -8.408 -17.266 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -7.690 -9.677 -18.098 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -7.014 -11.005 -19.046 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -3.653 -10.052 -18.430 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -4.707 -11.218 -19.235 1.00 0.00 H new ATOM 1136 N ASN A 75 -7.908 -4.083 -12.537 1.00 0.00 N ATOM 1137 CA ASN A 75 -8.970 -3.219 -12.012 1.00 0.00 C ATOM 1138 C ASN A 75 -8.460 -1.840 -11.577 1.00 0.00 C ATOM 1139 O ASN A 75 -9.234 -0.877 -11.542 1.00 0.00 O ATOM 1140 CB ASN A 75 -9.659 -3.904 -10.823 1.00 0.00 C ATOM 1141 CG ASN A 75 -10.842 -3.079 -10.321 1.00 0.00 C ATOM 1142 OD1 ASN A 75 -11.898 -3.051 -10.945 1.00 0.00 O ATOM 1143 ND2 ASN A 75 -10.704 -2.402 -9.193 1.00 0.00 N ATOM 0 H ASN A 75 -7.675 -4.858 -11.916 1.00 0.00 H new ATOM 0 HA ASN A 75 -9.677 -3.061 -12.826 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -10.003 -4.895 -11.120 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -8.941 -4.045 -10.015 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.481 -1.848 -8.832 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -9.821 -2.434 -8.684 1.00 0.00 H new ATOM 1150 N TYR A 76 -7.170 -1.734 -11.245 1.00 0.00 N ATOM 1151 CA TYR A 76 -6.560 -0.489 -10.788 1.00 0.00 C ATOM 1152 C TYR A 76 -5.494 -0.059 -11.798 1.00 0.00 C ATOM 1153 O TYR A 76 -5.072 -0.859 -12.634 1.00 0.00 O ATOM 1154 CB TYR A 76 -6.024 -0.641 -9.353 1.00 0.00 C ATOM 1155 CG TYR A 76 -7.022 -1.232 -8.363 1.00 0.00 C ATOM 1156 CD1 TYR A 76 -7.911 -0.426 -7.624 1.00 0.00 C ATOM 1157 CD2 TYR A 76 -7.055 -2.624 -8.180 1.00 0.00 C ATOM 1158 CE1 TYR A 76 -8.845 -1.012 -6.749 1.00 0.00 C ATOM 1159 CE2 TYR A 76 -7.970 -3.220 -7.300 1.00 0.00 C ATOM 1160 CZ TYR A 76 -8.877 -2.414 -6.581 1.00 0.00 C ATOM 1161 OH TYR A 76 -9.786 -3.008 -5.759 1.00 0.00 O ATOM 0 H TYR A 76 -6.518 -2.517 -11.287 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.304 0.306 -10.739 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -5.136 -1.273 -9.376 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -5.709 0.338 -8.991 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -7.875 0.648 -7.730 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.363 -3.247 -8.727 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -9.539 -0.388 -6.205 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -7.980 -4.292 -7.173 1.00 0.00 H new ATOM 0 HH TYR A 76 -10.441 -3.500 -6.297 1.00 0.00 H new ATOM 1171 N ASP A 77 -5.067 1.204 -11.731 1.00 0.00 N ATOM 1172 CA ASP A 77 -4.220 1.819 -12.761 1.00 0.00 C ATOM 1173 C ASP A 77 -2.852 2.242 -12.214 1.00 0.00 C ATOM 1174 O ASP A 77 -2.006 2.743 -12.950 1.00 0.00 O ATOM 1175 CB ASP A 77 -4.969 3.003 -13.386 1.00 0.00 C ATOM 1176 CG ASP A 77 -4.283 3.517 -14.663 1.00 0.00 C ATOM 1177 OD1 ASP A 77 -3.976 2.696 -15.558 1.00 0.00 O ATOM 1178 OD2 ASP A 77 -4.128 4.749 -14.810 1.00 0.00 O ATOM 0 H ASP A 77 -5.298 1.832 -10.961 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.016 1.075 -13.531 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.990 2.702 -13.620 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.035 3.813 -12.660 1.00 0.00 H new ATOM 1183 N LEU A 78 -2.604 2.001 -10.925 1.00 0.00 N ATOM 1184 CA LEU A 78 -1.318 2.179 -10.265 1.00 0.00 C ATOM 1185 C LEU A 78 -1.236 1.059 -9.238 1.00 0.00 C ATOM 1186 O LEU A 78 -2.203 0.865 -8.497 1.00 0.00 O ATOM 1187 CB LEU A 78 -1.261 3.557 -9.569 1.00 0.00 C ATOM 1188 CG LEU A 78 -0.030 4.402 -9.935 1.00 0.00 C ATOM 1189 CD1 LEU A 78 -0.082 5.729 -9.169 1.00 0.00 C ATOM 1190 CD2 LEU A 78 1.298 3.705 -9.608 1.00 0.00 C ATOM 0 H LEU A 78 -3.327 1.663 -10.290 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.487 2.144 -10.970 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.160 4.117 -9.825 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.275 3.406 -8.490 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.065 4.559 -11.013 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.789 6.332 -9.426 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.989 6.270 -9.439 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.083 5.531 -8.097 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.128 4.353 -9.890 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.346 3.497 -8.539 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.364 2.769 -10.163 1.00 0.00 H new ATOM 1202 N ILE A 79 -0.121 0.329 -9.182 1.00 0.00 N ATOM 1203 CA ILE A 79 0.040 -0.792 -8.266 1.00 0.00 C ATOM 1204 C ILE A 79 1.301 -0.478 -7.463 1.00 0.00 C ATOM 1205 O ILE A 79 2.379 -0.294 -8.034 1.00 0.00 O ATOM 1206 CB ILE A 79 0.147 -2.137 -9.027 1.00 0.00 C ATOM 1207 CG1 ILE A 79 -0.899 -2.362 -10.146 1.00 0.00 C ATOM 1208 CG2 ILE A 79 0.119 -3.306 -8.025 1.00 0.00 C ATOM 1209 CD1 ILE A 79 -2.360 -2.471 -9.695 1.00 0.00 C ATOM 0 H ILE A 79 0.693 0.501 -9.772 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.823 -0.910 -7.611 1.00 0.00 H new ATOM 0 HB ILE A 79 1.101 -2.092 -9.551 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.821 -1.541 -10.858 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -0.637 -3.274 -10.682 1.00 0.00 H new ATOM 0 HG21 ILE A 79 0.194 -4.250 -8.565 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.958 -3.214 -7.335 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -0.816 -3.282 -7.464 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.998 -2.627 -10.564 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.468 -3.312 -9.010 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.654 -1.551 -9.189 1.00 0.00 H new ATOM 1221 N LEU A 80 1.165 -0.380 -6.145 1.00 0.00 N ATOM 1222 CA LEU A 80 2.249 -0.006 -5.251 1.00 0.00 C ATOM 1223 C LEU A 80 2.623 -1.228 -4.434 1.00 0.00 C ATOM 1224 O LEU A 80 1.762 -2.026 -4.054 1.00 0.00 O ATOM 1225 CB LEU A 80 1.854 1.165 -4.332 1.00 0.00 C ATOM 1226 CG LEU A 80 1.681 2.546 -4.997 1.00 0.00 C ATOM 1227 CD1 LEU A 80 2.877 2.946 -5.869 1.00 0.00 C ATOM 1228 CD2 LEU A 80 0.394 2.659 -5.816 1.00 0.00 C ATOM 0 H LEU A 80 0.285 -0.561 -5.663 1.00 0.00 H new ATOM 0 HA LEU A 80 3.101 0.335 -5.838 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.918 0.907 -3.837 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.611 1.256 -3.553 1.00 0.00 H new ATOM 0 HG LEU A 80 1.618 3.242 -4.161 1.00 0.00 H new ATOM 0 HD11 LEU A 80 2.695 3.927 -6.309 1.00 0.00 H new ATOM 0 HD12 LEU A 80 3.777 2.985 -5.256 1.00 0.00 H new ATOM 0 HD13 LEU A 80 3.010 2.211 -6.663 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.330 3.653 -6.258 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.399 1.910 -6.607 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.466 2.495 -5.167 1.00 0.00 H new ATOM 1240 N THR A 81 3.912 -1.355 -4.143 1.00 0.00 N ATOM 1241 CA THR A 81 4.472 -2.511 -3.463 1.00 0.00 C ATOM 1242 C THR A 81 5.502 -1.987 -2.455 1.00 0.00 C ATOM 1243 O THR A 81 5.979 -0.859 -2.601 1.00 0.00 O ATOM 1244 CB THR A 81 5.075 -3.456 -4.520 1.00 0.00 C ATOM 1245 OG1 THR A 81 5.921 -2.770 -5.417 1.00 0.00 O ATOM 1246 CG2 THR A 81 4.020 -4.184 -5.357 1.00 0.00 C ATOM 0 H THR A 81 4.606 -0.645 -4.377 1.00 0.00 H new ATOM 0 HA THR A 81 3.726 -3.088 -2.916 1.00 0.00 H new ATOM 0 HB THR A 81 5.638 -4.186 -3.939 1.00 0.00 H new ATOM 0 HG1 THR A 81 5.503 -1.923 -5.678 1.00 0.00 H new ATOM 0 HG21 THR A 81 4.514 -4.832 -6.081 1.00 0.00 H new ATOM 0 HG22 THR A 81 3.388 -4.785 -4.703 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.406 -3.454 -5.884 1.00 0.00 H new ATOM 1254 N MET A 82 5.850 -2.747 -1.412 1.00 0.00 N ATOM 1255 CA MET A 82 6.653 -2.219 -0.303 1.00 0.00 C ATOM 1256 C MET A 82 8.138 -2.559 -0.434 1.00 0.00 C ATOM 1257 O MET A 82 8.974 -1.908 0.193 1.00 0.00 O ATOM 1258 CB MET A 82 6.102 -2.785 1.017 1.00 0.00 C ATOM 1259 CG MET A 82 4.654 -2.349 1.267 1.00 0.00 C ATOM 1260 SD MET A 82 4.421 -0.555 1.341 1.00 0.00 S ATOM 1261 CE MET A 82 2.629 -0.507 1.560 1.00 0.00 C ATOM 0 H MET A 82 5.589 -3.728 -1.312 1.00 0.00 H new ATOM 0 HA MET A 82 6.578 -1.132 -0.322 1.00 0.00 H new ATOM 0 HB2 MET A 82 6.154 -3.874 0.995 1.00 0.00 H new ATOM 0 HB3 MET A 82 6.729 -2.452 1.844 1.00 0.00 H new ATOM 0 HG2 MET A 82 4.023 -2.754 0.476 1.00 0.00 H new ATOM 0 HG3 MET A 82 4.311 -2.788 2.204 1.00 0.00 H new ATOM 0 HE1 MET A 82 2.230 0.396 1.098 1.00 0.00 H new ATOM 0 HE2 MET A 82 2.181 -1.383 1.090 1.00 0.00 H new ATOM 0 HE3 MET A 82 2.392 -0.505 2.624 1.00 0.00 H new ATOM 1271 N GLU A 83 8.472 -3.577 -1.229 1.00 0.00 N ATOM 1272 CA GLU A 83 9.825 -4.103 -1.338 1.00 0.00 C ATOM 1273 C GLU A 83 10.068 -4.436 -2.810 1.00 0.00 C ATOM 1274 O GLU A 83 9.127 -4.771 -3.533 1.00 0.00 O ATOM 1275 CB GLU A 83 9.951 -5.359 -0.459 1.00 0.00 C ATOM 1276 CG GLU A 83 9.820 -5.061 1.044 1.00 0.00 C ATOM 1277 CD GLU A 83 9.890 -6.343 1.876 1.00 0.00 C ATOM 1278 OE1 GLU A 83 10.908 -7.064 1.819 1.00 0.00 O ATOM 1279 OE2 GLU A 83 8.907 -6.671 2.579 1.00 0.00 O ATOM 0 H GLU A 83 7.798 -4.063 -1.821 1.00 0.00 H new ATOM 0 HA GLU A 83 10.565 -3.379 -0.998 1.00 0.00 H new ATOM 0 HB2 GLU A 83 9.183 -6.076 -0.749 1.00 0.00 H new ATOM 0 HB3 GLU A 83 10.915 -5.831 -0.647 1.00 0.00 H new ATOM 0 HG2 GLU A 83 10.615 -4.382 1.352 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.875 -4.553 1.235 1.00 0.00 H new ATOM 1286 N LYS A 84 11.314 -4.376 -3.277 1.00 0.00 N ATOM 1287 CA LYS A 84 11.620 -4.587 -4.694 1.00 0.00 C ATOM 1288 C LYS A 84 11.303 -6.023 -5.118 1.00 0.00 C ATOM 1289 O LYS A 84 10.813 -6.236 -6.226 1.00 0.00 O ATOM 1290 CB LYS A 84 13.067 -4.168 -5.007 1.00 0.00 C ATOM 1291 CG LYS A 84 13.271 -2.659 -4.772 1.00 0.00 C ATOM 1292 CD LYS A 84 14.671 -2.179 -5.186 1.00 0.00 C ATOM 1293 CE LYS A 84 14.843 -0.659 -4.994 1.00 0.00 C ATOM 1294 NZ LYS A 84 14.965 -0.259 -3.567 1.00 0.00 N ATOM 0 H LYS A 84 12.130 -4.183 -2.696 1.00 0.00 H new ATOM 0 HA LYS A 84 10.975 -3.945 -5.293 1.00 0.00 H new ATOM 0 HB2 LYS A 84 13.756 -4.733 -4.380 1.00 0.00 H new ATOM 0 HB3 LYS A 84 13.304 -4.413 -6.042 1.00 0.00 H new ATOM 0 HG2 LYS A 84 12.520 -2.103 -5.333 1.00 0.00 H new ATOM 0 HG3 LYS A 84 13.111 -2.435 -3.717 1.00 0.00 H new ATOM 0 HD2 LYS A 84 15.423 -2.706 -4.598 1.00 0.00 H new ATOM 0 HD3 LYS A 84 14.847 -2.434 -6.231 1.00 0.00 H new ATOM 0 HE2 LYS A 84 15.730 -0.329 -5.534 1.00 0.00 H new ATOM 0 HE3 LYS A 84 13.990 -0.145 -5.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 14.627 0.717 -3.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 14.393 -0.897 -2.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 15.961 -0.318 -3.274 1.00 0.00 H new ATOM 1308 N ARG A 85 11.456 -6.999 -4.213 1.00 0.00 N ATOM 1309 CA ARG A 85 10.977 -8.365 -4.449 1.00 0.00 C ATOM 1310 C ARG A 85 9.480 -8.404 -4.774 1.00 0.00 C ATOM 1311 O ARG A 85 9.058 -9.215 -5.594 1.00 0.00 O ATOM 1312 CB ARG A 85 11.337 -9.305 -3.275 1.00 0.00 C ATOM 1313 CG ARG A 85 10.850 -8.838 -1.889 1.00 0.00 C ATOM 1314 CD ARG A 85 11.017 -9.930 -0.824 1.00 0.00 C ATOM 1315 NE ARG A 85 10.526 -9.460 0.484 1.00 0.00 N ATOM 1316 CZ ARG A 85 9.852 -10.153 1.407 1.00 0.00 C ATOM 1317 NH1 ARG A 85 9.612 -11.454 1.254 1.00 0.00 N ATOM 1318 NH2 ARG A 85 9.408 -9.512 2.481 1.00 0.00 N ATOM 0 H ARG A 85 11.909 -6.866 -3.309 1.00 0.00 H new ATOM 0 HA ARG A 85 11.498 -8.737 -5.332 1.00 0.00 H new ATOM 0 HB2 ARG A 85 10.917 -10.290 -3.477 1.00 0.00 H new ATOM 0 HB3 ARG A 85 12.420 -9.421 -3.242 1.00 0.00 H new ATOM 0 HG2 ARG A 85 11.407 -7.950 -1.589 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.801 -8.550 -1.951 1.00 0.00 H new ATOM 0 HD2 ARG A 85 10.470 -10.824 -1.124 1.00 0.00 H new ATOM 0 HD3 ARG A 85 12.067 -10.210 -0.745 1.00 0.00 H new ATOM 0 HE ARG A 85 10.725 -8.486 0.713 1.00 0.00 H new ATOM 0 HH11 ARG A 85 9.944 -11.939 0.421 1.00 0.00 H new ATOM 0 HH12 ARG A 85 9.096 -11.965 1.970 1.00 0.00 H new ATOM 0 HH21 ARG A 85 9.584 -8.513 2.588 1.00 0.00 H new ATOM 0 HH22 ARG A 85 8.891 -10.018 3.200 1.00 0.00 H new ATOM 1332 N HIS A 86 8.665 -7.536 -4.165 1.00 0.00 N ATOM 1333 CA HIS A 86 7.231 -7.517 -4.420 1.00 0.00 C ATOM 1334 C HIS A 86 6.948 -6.896 -5.788 1.00 0.00 C ATOM 1335 O HIS A 86 6.021 -7.359 -6.449 1.00 0.00 O ATOM 1336 CB HIS A 86 6.472 -6.767 -3.314 1.00 0.00 C ATOM 1337 CG HIS A 86 6.545 -7.350 -1.922 1.00 0.00 C ATOM 1338 ND1 HIS A 86 7.055 -8.572 -1.541 1.00 0.00 N ATOM 1339 CD2 HIS A 86 6.079 -6.743 -0.786 1.00 0.00 C ATOM 1340 CE1 HIS A 86 6.915 -8.681 -0.209 1.00 0.00 C ATOM 1341 NE2 HIS A 86 6.310 -7.594 0.299 1.00 0.00 N ATOM 0 H HIS A 86 8.980 -6.838 -3.491 1.00 0.00 H new ATOM 0 HA HIS A 86 6.874 -8.547 -4.420 1.00 0.00 H new ATOM 0 HB2 HIS A 86 6.851 -5.746 -3.275 1.00 0.00 H new ATOM 0 HB3 HIS A 86 5.423 -6.707 -3.603 1.00 0.00 H new ATOM 0 HD1 HIS A 86 7.466 -9.270 -2.160 1.00 0.00 H new ATOM 0 HD2 HIS A 86 5.612 -5.771 -0.737 1.00 0.00 H new ATOM 0 HE1 HIS A 86 7.244 -9.528 0.375 1.00 0.00 H new ATOM 1349 N ILE A 87 7.746 -5.918 -6.253 1.00 0.00 N ATOM 1350 CA ILE A 87 7.632 -5.401 -7.622 1.00 0.00 C ATOM 1351 C ILE A 87 7.784 -6.586 -8.575 1.00 0.00 C ATOM 1352 O ILE A 87 6.943 -6.779 -9.451 1.00 0.00 O ATOM 1353 CB ILE A 87 8.694 -4.316 -7.956 1.00 0.00 C ATOM 1354 CG1 ILE A 87 8.715 -3.140 -6.960 1.00 0.00 C ATOM 1355 CG2 ILE A 87 8.495 -3.765 -9.385 1.00 0.00 C ATOM 1356 CD1 ILE A 87 9.927 -2.220 -7.154 1.00 0.00 C ATOM 0 H ILE A 87 8.476 -5.472 -5.698 1.00 0.00 H new ATOM 0 HA ILE A 87 6.662 -4.916 -7.728 1.00 0.00 H new ATOM 0 HB ILE A 87 9.655 -4.824 -7.879 1.00 0.00 H new ATOM 0 HG12 ILE A 87 7.801 -2.558 -7.073 1.00 0.00 H new ATOM 0 HG13 ILE A 87 8.720 -3.531 -5.943 1.00 0.00 H new ATOM 0 HG21 ILE A 87 9.251 -3.008 -9.592 1.00 0.00 H new ATOM 0 HG22 ILE A 87 8.589 -4.578 -10.105 1.00 0.00 H new ATOM 0 HG23 ILE A 87 7.504 -3.320 -9.468 1.00 0.00 H new ATOM 0 HD11 ILE A 87 9.889 -1.410 -6.426 1.00 0.00 H new ATOM 0 HD12 ILE A 87 10.844 -2.792 -7.013 1.00 0.00 H new ATOM 0 HD13 ILE A 87 9.910 -1.803 -8.161 1.00 0.00 H new ATOM 1368 N GLU A 88 8.835 -7.393 -8.388 1.00 0.00 N ATOM 1369 CA GLU A 88 9.139 -8.487 -9.306 1.00 0.00 C ATOM 1370 C GLU A 88 8.000 -9.510 -9.315 1.00 0.00 C ATOM 1371 O GLU A 88 7.555 -9.931 -10.383 1.00 0.00 O ATOM 1372 CB GLU A 88 10.473 -9.153 -8.933 1.00 0.00 C ATOM 1373 CG GLU A 88 11.672 -8.225 -9.175 1.00 0.00 C ATOM 1374 CD GLU A 88 13.004 -8.934 -8.868 1.00 0.00 C ATOM 1375 OE1 GLU A 88 13.438 -8.953 -7.695 1.00 0.00 O ATOM 1376 OE2 GLU A 88 13.642 -9.467 -9.804 1.00 0.00 O ATOM 0 H GLU A 88 9.487 -7.306 -7.608 1.00 0.00 H new ATOM 0 HA GLU A 88 9.237 -8.078 -10.312 1.00 0.00 H new ATOM 0 HB2 GLU A 88 10.449 -9.447 -7.884 1.00 0.00 H new ATOM 0 HB3 GLU A 88 10.598 -10.065 -9.517 1.00 0.00 H new ATOM 0 HG2 GLU A 88 11.669 -7.887 -10.211 1.00 0.00 H new ATOM 0 HG3 GLU A 88 11.578 -7.337 -8.550 1.00 0.00 H new ATOM 1383 N ARG A 89 7.478 -9.870 -8.138 1.00 0.00 N ATOM 1384 CA ARG A 89 6.374 -10.825 -8.041 1.00 0.00 C ATOM 1385 C ARG A 89 5.103 -10.271 -8.687 1.00 0.00 C ATOM 1386 O ARG A 89 4.401 -11.019 -9.365 1.00 0.00 O ATOM 1387 CB ARG A 89 6.142 -11.228 -6.577 1.00 0.00 C ATOM 1388 CG ARG A 89 7.300 -12.085 -6.037 1.00 0.00 C ATOM 1389 CD ARG A 89 7.104 -12.420 -4.555 1.00 0.00 C ATOM 1390 NE ARG A 89 8.228 -13.218 -4.029 1.00 0.00 N ATOM 1391 CZ ARG A 89 8.274 -13.819 -2.831 1.00 0.00 C ATOM 1392 NH1 ARG A 89 7.249 -13.732 -1.986 1.00 0.00 N ATOM 1393 NH2 ARG A 89 9.357 -14.504 -2.482 1.00 0.00 N ATOM 0 H ARG A 89 7.804 -9.513 -7.240 1.00 0.00 H new ATOM 0 HA ARG A 89 6.645 -11.723 -8.595 1.00 0.00 H new ATOM 0 HB2 ARG A 89 6.035 -10.333 -5.965 1.00 0.00 H new ATOM 0 HB3 ARG A 89 5.208 -11.784 -6.495 1.00 0.00 H new ATOM 0 HG2 ARG A 89 7.372 -13.007 -6.614 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.242 -11.552 -6.170 1.00 0.00 H new ATOM 0 HD2 ARG A 89 7.011 -11.498 -3.981 1.00 0.00 H new ATOM 0 HD3 ARG A 89 6.173 -12.971 -4.425 1.00 0.00 H new ATOM 0 HE ARG A 89 9.044 -13.322 -4.631 1.00 0.00 H new ATOM 0 HH11 ARG A 89 6.416 -13.204 -2.247 1.00 0.00 H new ATOM 0 HH12 ARG A 89 7.296 -14.194 -1.078 1.00 0.00 H new ATOM 0 HH21 ARG A 89 10.147 -14.571 -3.124 1.00 0.00 H new ATOM 0 HH22 ARG A 89 9.399 -14.964 -1.572 1.00 0.00 H new ATOM 1407 N LEU A 90 4.806 -8.978 -8.540 1.00 0.00 N ATOM 1408 CA LEU A 90 3.660 -8.362 -9.210 1.00 0.00 C ATOM 1409 C LEU A 90 3.851 -8.358 -10.727 1.00 0.00 C ATOM 1410 O LEU A 90 2.894 -8.614 -11.458 1.00 0.00 O ATOM 1411 CB LEU A 90 3.431 -6.925 -8.707 1.00 0.00 C ATOM 1412 CG LEU A 90 2.283 -6.744 -7.704 1.00 0.00 C ATOM 1413 CD1 LEU A 90 0.922 -7.042 -8.345 1.00 0.00 C ATOM 1414 CD2 LEU A 90 2.481 -7.597 -6.448 1.00 0.00 C ATOM 0 H LEU A 90 5.346 -8.336 -7.960 1.00 0.00 H new ATOM 0 HA LEU A 90 2.780 -8.959 -8.969 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.352 -6.571 -8.244 1.00 0.00 H new ATOM 0 HB3 LEU A 90 3.240 -6.285 -9.568 1.00 0.00 H new ATOM 0 HG LEU A 90 2.295 -5.697 -7.402 1.00 0.00 H new ATOM 0 HD11 LEU A 90 0.133 -6.904 -7.605 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.758 -6.363 -9.182 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.906 -8.071 -8.704 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.646 -7.439 -5.765 1.00 0.00 H new ATOM 0 HD22 LEU A 90 2.527 -8.650 -6.727 1.00 0.00 H new ATOM 0 HD23 LEU A 90 3.411 -7.311 -5.957 1.00 0.00 H new ATOM 1426 N CYS A 91 5.067 -8.094 -11.211 1.00 0.00 N ATOM 1427 CA CYS A 91 5.353 -8.140 -12.639 1.00 0.00 C ATOM 1428 C CYS A 91 5.164 -9.566 -13.172 1.00 0.00 C ATOM 1429 O CYS A 91 4.653 -9.733 -14.273 1.00 0.00 O ATOM 1430 CB CYS A 91 6.771 -7.636 -12.929 1.00 0.00 C ATOM 1431 SG CYS A 91 6.923 -5.888 -12.453 1.00 0.00 S ATOM 0 H CYS A 91 5.868 -7.846 -10.630 1.00 0.00 H new ATOM 0 HA CYS A 91 4.652 -7.481 -13.152 1.00 0.00 H new ATOM 0 HB2 CYS A 91 7.497 -8.235 -12.380 1.00 0.00 H new ATOM 0 HB3 CYS A 91 6.997 -7.753 -13.989 1.00 0.00 H new ATOM 0 HG CYS A 91 6.967 -5.793 -11.157 1.00 0.00 H new ATOM 1437 N GLU A 92 5.530 -10.597 -12.404 1.00 0.00 N ATOM 1438 CA GLU A 92 5.284 -11.984 -12.781 1.00 0.00 C ATOM 1439 C GLU A 92 3.780 -12.303 -12.789 1.00 0.00 C ATOM 1440 O GLU A 92 3.323 -13.040 -13.664 1.00 0.00 O ATOM 1441 CB GLU A 92 6.043 -12.944 -11.848 1.00 0.00 C ATOM 1442 CG GLU A 92 7.559 -12.965 -12.095 1.00 0.00 C ATOM 1443 CD GLU A 92 7.928 -13.604 -13.447 1.00 0.00 C ATOM 1444 OE1 GLU A 92 7.955 -14.853 -13.548 1.00 0.00 O ATOM 1445 OE2 GLU A 92 8.216 -12.871 -14.420 1.00 0.00 O ATOM 0 H GLU A 92 6.003 -10.490 -11.507 1.00 0.00 H new ATOM 0 HA GLU A 92 5.657 -12.125 -13.795 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.855 -12.657 -10.813 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.648 -13.952 -11.976 1.00 0.00 H new ATOM 0 HG2 GLU A 92 7.943 -11.946 -12.062 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.047 -13.516 -11.291 1.00 0.00 H new ATOM 1452 N MET A 93 3.003 -11.743 -11.851 1.00 0.00 N ATOM 1453 CA MET A 93 1.551 -11.930 -11.818 1.00 0.00 C ATOM 1454 C MET A 93 0.878 -11.293 -13.038 1.00 0.00 C ATOM 1455 O MET A 93 -0.049 -11.888 -13.589 1.00 0.00 O ATOM 1456 CB MET A 93 0.949 -11.344 -10.528 1.00 0.00 C ATOM 1457 CG MET A 93 1.202 -12.221 -9.296 1.00 0.00 C ATOM 1458 SD MET A 93 0.414 -13.862 -9.305 1.00 0.00 S ATOM 1459 CE MET A 93 -1.346 -13.417 -9.335 1.00 0.00 C ATOM 0 H MET A 93 3.363 -11.153 -11.101 1.00 0.00 H new ATOM 0 HA MET A 93 1.364 -13.004 -11.840 1.00 0.00 H new ATOM 0 HB2 MET A 93 1.370 -10.354 -10.355 1.00 0.00 H new ATOM 0 HB3 MET A 93 -0.125 -11.215 -10.661 1.00 0.00 H new ATOM 0 HG2 MET A 93 2.278 -12.358 -9.187 1.00 0.00 H new ATOM 0 HG3 MET A 93 0.859 -11.681 -8.414 1.00 0.00 H new ATOM 0 HE1 MET A 93 -1.949 -14.305 -9.147 1.00 0.00 H new ATOM 0 HE2 MET A 93 -1.546 -12.672 -8.565 1.00 0.00 H new ATOM 0 HE3 MET A 93 -1.601 -13.006 -10.312 1.00 0.00 H new ATOM 1469 N ALA A 94 1.326 -10.106 -13.463 1.00 0.00 N ATOM 1470 CA ALA A 94 0.692 -9.354 -14.538 1.00 0.00 C ATOM 1471 C ALA A 94 1.763 -8.622 -15.361 1.00 0.00 C ATOM 1472 O ALA A 94 1.988 -7.427 -15.142 1.00 0.00 O ATOM 1473 CB ALA A 94 -0.353 -8.393 -13.948 1.00 0.00 C ATOM 0 H ALA A 94 2.143 -9.643 -13.065 1.00 0.00 H new ATOM 0 HA ALA A 94 0.169 -10.030 -15.215 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.826 -7.831 -14.753 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -1.110 -8.964 -13.410 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.135 -7.701 -13.261 1.00 0.00 H new ATOM 1479 N PRO A 95 2.454 -9.300 -16.295 1.00 0.00 N ATOM 1480 CA PRO A 95 3.517 -8.683 -17.082 1.00 0.00 C ATOM 1481 C PRO A 95 3.006 -7.546 -17.969 1.00 0.00 C ATOM 1482 O PRO A 95 3.771 -6.627 -18.267 1.00 0.00 O ATOM 1483 CB PRO A 95 4.156 -9.818 -17.889 1.00 0.00 C ATOM 1484 CG PRO A 95 3.062 -10.884 -17.953 1.00 0.00 C ATOM 1485 CD PRO A 95 2.331 -10.710 -16.624 1.00 0.00 C ATOM 0 HA PRO A 95 4.252 -8.204 -16.436 1.00 0.00 H new ATOM 0 HB2 PRO A 95 4.448 -9.485 -18.885 1.00 0.00 H new ATOM 0 HB3 PRO A 95 5.055 -10.197 -17.403 1.00 0.00 H new ATOM 0 HG2 PRO A 95 2.397 -10.728 -18.802 1.00 0.00 H new ATOM 0 HG3 PRO A 95 3.480 -11.885 -18.055 1.00 0.00 H new ATOM 0 HD2 PRO A 95 1.285 -11.003 -16.710 1.00 0.00 H new ATOM 0 HD3 PRO A 95 2.774 -11.334 -15.848 1.00 0.00 H new ATOM 1493 N GLU A 96 1.727 -7.543 -18.351 1.00 0.00 N ATOM 1494 CA GLU A 96 1.119 -6.437 -19.083 1.00 0.00 C ATOM 1495 C GLU A 96 1.061 -5.151 -18.242 1.00 0.00 C ATOM 1496 O GLU A 96 0.946 -4.056 -18.795 1.00 0.00 O ATOM 1497 CB GLU A 96 -0.282 -6.833 -19.600 1.00 0.00 C ATOM 1498 CG GLU A 96 -1.407 -6.973 -18.550 1.00 0.00 C ATOM 1499 CD GLU A 96 -1.501 -8.343 -17.865 1.00 0.00 C ATOM 1500 OE1 GLU A 96 -0.478 -9.018 -17.626 1.00 0.00 O ATOM 1501 OE2 GLU A 96 -2.631 -8.781 -17.556 1.00 0.00 O ATOM 0 H GLU A 96 1.084 -8.312 -18.159 1.00 0.00 H new ATOM 0 HA GLU A 96 1.754 -6.223 -19.942 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.594 -6.089 -20.333 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.192 -7.783 -20.128 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.262 -6.212 -17.784 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.361 -6.761 -19.034 1.00 0.00 H new ATOM 1508 N MET A 97 1.149 -5.275 -16.913 1.00 0.00 N ATOM 1509 CA MET A 97 0.990 -4.189 -15.958 1.00 0.00 C ATOM 1510 C MET A 97 2.347 -3.736 -15.403 1.00 0.00 C ATOM 1511 O MET A 97 2.398 -2.784 -14.629 1.00 0.00 O ATOM 1512 CB MET A 97 0.048 -4.690 -14.844 1.00 0.00 C ATOM 1513 CG MET A 97 -0.558 -3.577 -13.990 1.00 0.00 C ATOM 1514 SD MET A 97 -1.565 -2.389 -14.917 1.00 0.00 S ATOM 1515 CE MET A 97 -2.084 -1.323 -13.553 1.00 0.00 C ATOM 0 H MET A 97 1.340 -6.170 -16.463 1.00 0.00 H new ATOM 0 HA MET A 97 0.558 -3.313 -16.441 1.00 0.00 H new ATOM 0 HB2 MET A 97 -0.759 -5.265 -15.297 1.00 0.00 H new ATOM 0 HB3 MET A 97 0.600 -5.371 -14.196 1.00 0.00 H new ATOM 0 HG2 MET A 97 -1.173 -4.027 -13.211 1.00 0.00 H new ATOM 0 HG3 MET A 97 0.248 -3.040 -13.489 1.00 0.00 H new ATOM 0 HE1 MET A 97 -2.660 -0.485 -13.945 1.00 0.00 H new ATOM 0 HE2 MET A 97 -2.701 -1.894 -12.859 1.00 0.00 H new ATOM 0 HE3 MET A 97 -1.205 -0.946 -13.031 1.00 0.00 H new ATOM 1525 N ARG A 98 3.456 -4.387 -15.786 1.00 0.00 N ATOM 1526 CA ARG A 98 4.774 -4.192 -15.171 1.00 0.00 C ATOM 1527 C ARG A 98 5.211 -2.725 -15.102 1.00 0.00 C ATOM 1528 O ARG A 98 5.787 -2.317 -14.096 1.00 0.00 O ATOM 1529 CB ARG A 98 5.817 -5.087 -15.868 1.00 0.00 C ATOM 1530 CG ARG A 98 6.158 -4.674 -17.310 1.00 0.00 C ATOM 1531 CD ARG A 98 6.963 -5.773 -18.013 1.00 0.00 C ATOM 1532 NE ARG A 98 7.376 -5.368 -19.369 1.00 0.00 N ATOM 1533 CZ ARG A 98 6.633 -5.420 -20.483 1.00 0.00 C ATOM 1534 NH1 ARG A 98 5.367 -5.832 -20.448 1.00 0.00 N ATOM 1535 NH2 ARG A 98 7.167 -5.051 -21.643 1.00 0.00 N ATOM 0 H ARG A 98 3.461 -5.072 -16.542 1.00 0.00 H new ATOM 0 HA ARG A 98 4.693 -4.500 -14.128 1.00 0.00 H new ATOM 0 HB2 ARG A 98 6.733 -5.082 -15.277 1.00 0.00 H new ATOM 0 HB3 ARG A 98 5.448 -6.113 -15.876 1.00 0.00 H new ATOM 0 HG2 ARG A 98 5.240 -4.478 -17.864 1.00 0.00 H new ATOM 0 HG3 ARG A 98 6.730 -3.746 -17.302 1.00 0.00 H new ATOM 0 HD2 ARG A 98 7.846 -6.012 -17.420 1.00 0.00 H new ATOM 0 HD3 ARG A 98 6.363 -6.681 -18.072 1.00 0.00 H new ATOM 0 HE ARG A 98 8.326 -5.011 -19.470 1.00 0.00 H new ATOM 0 HH11 ARG A 98 4.947 -6.115 -19.563 1.00 0.00 H new ATOM 0 HH12 ARG A 98 4.817 -5.865 -21.307 1.00 0.00 H new ATOM 0 HH21 ARG A 98 8.135 -4.732 -21.680 1.00 0.00 H new ATOM 0 HH22 ARG A 98 6.609 -5.087 -22.496 1.00 0.00 H new ATOM 1549 N GLY A 99 4.888 -1.917 -16.119 1.00 0.00 N ATOM 1550 CA GLY A 99 5.249 -0.501 -16.166 1.00 0.00 C ATOM 1551 C GLY A 99 4.526 0.351 -15.114 1.00 0.00 C ATOM 1552 O GLY A 99 4.966 1.466 -14.827 1.00 0.00 O ATOM 0 H GLY A 99 4.365 -2.232 -16.936 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.325 -0.404 -16.023 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.022 -0.109 -17.158 1.00 0.00 H new ATOM 1556 N LYS A 100 3.439 -0.159 -14.525 1.00 0.00 N ATOM 1557 CA LYS A 100 2.602 0.535 -13.543 1.00 0.00 C ATOM 1558 C LYS A 100 2.749 -0.079 -12.147 1.00 0.00 C ATOM 1559 O LYS A 100 2.109 0.409 -11.214 1.00 0.00 O ATOM 1560 CB LYS A 100 1.140 0.509 -14.018 1.00 0.00 C ATOM 1561 CG LYS A 100 0.926 1.355 -15.283 1.00 0.00 C ATOM 1562 CD LYS A 100 -0.498 1.171 -15.819 1.00 0.00 C ATOM 1563 CE LYS A 100 -0.752 2.114 -17.002 1.00 0.00 C ATOM 1564 NZ LYS A 100 -2.141 2.008 -17.508 1.00 0.00 N ATOM 0 H LYS A 100 3.106 -1.102 -14.727 1.00 0.00 H new ATOM 0 HA LYS A 100 2.932 1.571 -13.464 1.00 0.00 H new ATOM 0 HB2 LYS A 100 0.843 -0.521 -14.217 1.00 0.00 H new ATOM 0 HB3 LYS A 100 0.494 0.879 -13.222 1.00 0.00 H new ATOM 0 HG2 LYS A 100 1.103 2.407 -15.058 1.00 0.00 H new ATOM 0 HG3 LYS A 100 1.648 1.067 -16.047 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -0.644 0.137 -16.132 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -1.220 1.369 -15.027 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -0.555 3.141 -16.695 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -0.054 1.882 -17.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -2.216 2.500 -18.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -2.389 1.006 -17.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -2.793 2.444 -16.825 1.00 0.00 H new ATOM 1578 N VAL A 101 3.566 -1.124 -11.986 1.00 0.00 N ATOM 1579 CA VAL A 101 3.940 -1.621 -10.669 1.00 0.00 C ATOM 1580 C VAL A 101 5.172 -0.809 -10.256 1.00 0.00 C ATOM 1581 O VAL A 101 6.100 -0.677 -11.059 1.00 0.00 O ATOM 1582 CB VAL A 101 4.274 -3.126 -10.735 1.00 0.00 C ATOM 1583 CG1 VAL A 101 4.578 -3.685 -9.337 1.00 0.00 C ATOM 1584 CG2 VAL A 101 3.139 -3.971 -11.342 1.00 0.00 C ATOM 0 H VAL A 101 3.981 -1.642 -12.761 1.00 0.00 H new ATOM 0 HA VAL A 101 3.129 -1.510 -9.949 1.00 0.00 H new ATOM 0 HB VAL A 101 5.149 -3.198 -11.382 1.00 0.00 H new ATOM 0 HG11 VAL A 101 4.810 -4.747 -9.412 1.00 0.00 H new ATOM 0 HG12 VAL A 101 5.431 -3.157 -8.911 1.00 0.00 H new ATOM 0 HG13 VAL A 101 3.709 -3.548 -8.694 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.436 -5.020 -11.360 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.239 -3.859 -10.737 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.938 -3.633 -12.359 1.00 0.00 H new ATOM 1594 N MET A 102 5.220 -0.285 -9.026 1.00 0.00 N ATOM 1595 CA MET A 102 6.421 0.370 -8.508 1.00 0.00 C ATOM 1596 C MET A 102 6.458 0.374 -6.979 1.00 0.00 C ATOM 1597 O MET A 102 5.494 -0.013 -6.311 1.00 0.00 O ATOM 1598 CB MET A 102 6.557 1.789 -9.090 1.00 0.00 C ATOM 1599 CG MET A 102 5.428 2.743 -8.691 1.00 0.00 C ATOM 1600 SD MET A 102 5.525 4.330 -9.560 1.00 0.00 S ATOM 1601 CE MET A 102 4.850 3.862 -11.175 1.00 0.00 C ATOM 0 H MET A 102 4.438 -0.303 -8.371 1.00 0.00 H new ATOM 0 HA MET A 102 7.284 -0.210 -8.834 1.00 0.00 H new ATOM 0 HB2 MET A 102 7.507 2.213 -8.765 1.00 0.00 H new ATOM 0 HB3 MET A 102 6.593 1.721 -10.177 1.00 0.00 H new ATOM 0 HG2 MET A 102 4.467 2.274 -8.903 1.00 0.00 H new ATOM 0 HG3 MET A 102 5.467 2.918 -7.616 1.00 0.00 H new ATOM 0 HE1 MET A 102 4.692 4.757 -11.776 1.00 0.00 H new ATOM 0 HE2 MET A 102 5.551 3.202 -11.685 1.00 0.00 H new ATOM 0 HE3 MET A 102 3.900 3.345 -11.037 1.00 0.00 H new ATOM 1611 N LEU A 103 7.602 0.797 -6.437 1.00 0.00 N ATOM 1612 CA LEU A 103 7.842 0.839 -5.001 1.00 0.00 C ATOM 1613 C LEU A 103 7.098 2.023 -4.386 1.00 0.00 C ATOM 1614 O LEU A 103 7.182 3.141 -4.898 1.00 0.00 O ATOM 1615 CB LEU A 103 9.356 1.002 -4.777 1.00 0.00 C ATOM 1616 CG LEU A 103 9.850 0.590 -3.381 1.00 0.00 C ATOM 1617 CD1 LEU A 103 9.676 -0.907 -3.106 1.00 0.00 C ATOM 1618 CD2 LEU A 103 11.341 0.918 -3.299 1.00 0.00 C ATOM 0 H LEU A 103 8.393 1.122 -6.992 1.00 0.00 H new ATOM 0 HA LEU A 103 7.485 -0.077 -4.530 1.00 0.00 H new ATOM 0 HB2 LEU A 103 9.885 0.410 -5.523 1.00 0.00 H new ATOM 0 HB3 LEU A 103 9.624 2.044 -4.949 1.00 0.00 H new ATOM 0 HG LEU A 103 9.259 1.131 -2.642 1.00 0.00 H new ATOM 0 HD11 LEU A 103 10.042 -1.138 -2.106 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.620 -1.169 -3.176 1.00 0.00 H new ATOM 0 HD13 LEU A 103 10.241 -1.480 -3.841 1.00 0.00 H new ATOM 0 HD21 LEU A 103 11.722 0.636 -2.317 1.00 0.00 H new ATOM 0 HD22 LEU A 103 11.878 0.365 -4.069 1.00 0.00 H new ATOM 0 HD23 LEU A 103 11.487 1.987 -3.452 1.00 0.00 H new ATOM 1630 N PHE A 104 6.413 1.814 -3.263 1.00 0.00 N ATOM 1631 CA PHE A 104 5.684 2.882 -2.590 1.00 0.00 C ATOM 1632 C PHE A 104 6.634 3.970 -2.079 1.00 0.00 C ATOM 1633 O PHE A 104 6.336 5.156 -2.215 1.00 0.00 O ATOM 1634 CB PHE A 104 4.829 2.293 -1.455 1.00 0.00 C ATOM 1635 CG PHE A 104 3.803 3.244 -0.860 1.00 0.00 C ATOM 1636 CD1 PHE A 104 3.011 4.051 -1.699 1.00 0.00 C ATOM 1637 CD2 PHE A 104 3.598 3.293 0.533 1.00 0.00 C ATOM 1638 CE1 PHE A 104 2.027 4.891 -1.159 1.00 0.00 C ATOM 1639 CE2 PHE A 104 2.604 4.129 1.075 1.00 0.00 C ATOM 1640 CZ PHE A 104 1.805 4.913 0.225 1.00 0.00 C ATOM 0 H PHE A 104 6.349 0.908 -2.799 1.00 0.00 H new ATOM 0 HA PHE A 104 5.019 3.360 -3.309 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.309 1.412 -1.832 1.00 0.00 H new ATOM 0 HB3 PHE A 104 5.493 1.955 -0.659 1.00 0.00 H new ATOM 0 HD1 PHE A 104 3.163 4.023 -2.768 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.206 2.686 1.188 1.00 0.00 H new ATOM 0 HE1 PHE A 104 1.440 5.522 -1.810 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.455 4.168 2.144 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.021 5.531 0.637 1.00 0.00 H new ATOM 1650 N GLY A 105 7.813 3.572 -1.587 1.00 0.00 N ATOM 1651 CA GLY A 105 8.822 4.491 -1.067 1.00 0.00 C ATOM 1652 C GLY A 105 9.675 5.152 -2.154 1.00 0.00 C ATOM 1653 O GLY A 105 10.741 5.678 -1.835 1.00 0.00 O ATOM 0 H GLY A 105 8.092 2.592 -1.540 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.327 5.268 -0.484 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.476 3.949 -0.384 1.00 0.00 H new ATOM 1657 N HIS A 106 9.255 5.107 -3.428 1.00 0.00 N ATOM 1658 CA HIS A 106 9.980 5.663 -4.573 1.00 0.00 C ATOM 1659 C HIS A 106 10.504 7.082 -4.305 1.00 0.00 C ATOM 1660 O HIS A 106 11.682 7.358 -4.539 1.00 0.00 O ATOM 1661 CB HIS A 106 9.074 5.614 -5.813 1.00 0.00 C ATOM 1662 CG HIS A 106 9.592 6.384 -7.004 1.00 0.00 C ATOM 1663 ND1 HIS A 106 10.645 6.038 -7.825 1.00 0.00 N ATOM 1664 CD2 HIS A 106 9.091 7.570 -7.471 1.00 0.00 C ATOM 1665 CE1 HIS A 106 10.775 6.995 -8.756 1.00 0.00 C ATOM 1666 NE2 HIS A 106 9.848 7.957 -8.585 1.00 0.00 N ATOM 0 H HIS A 106 8.374 4.668 -3.694 1.00 0.00 H new ATOM 0 HA HIS A 106 10.866 5.053 -4.751 1.00 0.00 H new ATOM 0 HB2 HIS A 106 8.935 4.573 -6.103 1.00 0.00 H new ATOM 0 HB3 HIS A 106 8.092 6.004 -5.544 1.00 0.00 H new ATOM 0 HD1 HIS A 106 11.223 5.202 -7.739 1.00 0.00 H new ATOM 0 HD2 HIS A 106 8.256 8.113 -7.053 1.00 0.00 H new ATOM 0 HE1 HIS A 106 11.521 6.994 -9.537 1.00 0.00 H new ATOM 1674 N TRP A 107 9.647 7.967 -3.785 1.00 0.00 N ATOM 1675 CA TRP A 107 9.988 9.376 -3.598 1.00 0.00 C ATOM 1676 C TRP A 107 11.146 9.570 -2.617 1.00 0.00 C ATOM 1677 O TRP A 107 11.961 10.476 -2.792 1.00 0.00 O ATOM 1678 CB TRP A 107 8.751 10.129 -3.096 1.00 0.00 C ATOM 1679 CG TRP A 107 7.514 9.888 -3.902 1.00 0.00 C ATOM 1680 CD1 TRP A 107 6.496 9.072 -3.549 1.00 0.00 C ATOM 1681 CD2 TRP A 107 7.165 10.414 -5.219 1.00 0.00 C ATOM 1682 NE1 TRP A 107 5.554 9.056 -4.551 1.00 0.00 N ATOM 1683 CE2 TRP A 107 5.910 9.858 -5.610 1.00 0.00 C ATOM 1684 CE3 TRP A 107 7.787 11.293 -6.133 1.00 0.00 C ATOM 1685 CZ2 TRP A 107 5.306 10.154 -6.839 1.00 0.00 C ATOM 1686 CZ3 TRP A 107 7.185 11.606 -7.367 1.00 0.00 C ATOM 1687 CH2 TRP A 107 5.947 11.039 -7.720 1.00 0.00 C ATOM 0 H TRP A 107 8.703 7.726 -3.484 1.00 0.00 H new ATOM 0 HA TRP A 107 10.313 9.772 -4.560 1.00 0.00 H new ATOM 0 HB2 TRP A 107 8.559 9.840 -2.063 1.00 0.00 H new ATOM 0 HB3 TRP A 107 8.967 11.197 -3.094 1.00 0.00 H new ATOM 0 HD1 TRP A 107 6.432 8.519 -2.624 1.00 0.00 H new ATOM 0 HE1 TRP A 107 4.692 8.513 -4.513 1.00 0.00 H new ATOM 0 HE3 TRP A 107 8.741 11.733 -5.881 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 4.360 9.707 -7.105 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 7.677 12.286 -8.047 1.00 0.00 H new ATOM 0 HH2 TRP A 107 5.490 11.284 -8.667 1.00 0.00 H new ATOM 1698 N ASP A 108 11.231 8.713 -1.597 1.00 0.00 N ATOM 1699 CA ASP A 108 12.251 8.801 -0.560 1.00 0.00 C ATOM 1700 C ASP A 108 13.432 7.909 -0.943 1.00 0.00 C ATOM 1701 O ASP A 108 13.683 6.877 -0.320 1.00 0.00 O ATOM 1702 CB ASP A 108 11.650 8.477 0.811 1.00 0.00 C ATOM 1703 CG ASP A 108 12.666 8.733 1.934 1.00 0.00 C ATOM 1704 OD1 ASP A 108 13.261 9.833 1.965 1.00 0.00 O ATOM 1705 OD2 ASP A 108 12.746 7.939 2.895 1.00 0.00 O ATOM 0 H ASP A 108 10.586 7.933 -1.470 1.00 0.00 H new ATOM 0 HA ASP A 108 12.632 9.819 -0.480 1.00 0.00 H new ATOM 0 HB2 ASP A 108 10.761 9.086 0.975 1.00 0.00 H new ATOM 0 HB3 ASP A 108 11.332 7.435 0.835 1.00 0.00 H new ATOM 1710 N ASN A 109 14.113 8.309 -2.024 1.00 0.00 N ATOM 1711 CA ASN A 109 15.282 7.615 -2.578 1.00 0.00 C ATOM 1712 C ASN A 109 15.057 6.101 -2.759 1.00 0.00 C ATOM 1713 O ASN A 109 15.932 5.285 -2.464 1.00 0.00 O ATOM 1714 CB ASN A 109 16.542 7.976 -1.766 1.00 0.00 C ATOM 1715 CG ASN A 109 17.833 7.479 -2.419 1.00 0.00 C ATOM 1716 OD1 ASN A 109 18.598 6.720 -1.826 1.00 0.00 O ATOM 1717 ND2 ASN A 109 18.131 7.913 -3.635 1.00 0.00 N ATOM 0 H ASN A 109 13.860 9.145 -2.551 1.00 0.00 H new ATOM 0 HA ASN A 109 15.444 7.971 -3.595 1.00 0.00 H new ATOM 0 HB2 ASN A 109 16.594 9.058 -1.647 1.00 0.00 H new ATOM 0 HB3 ASN A 109 16.459 7.549 -0.766 1.00 0.00 H new ATOM 0 HD21 ASN A 109 18.998 7.618 -4.084 1.00 0.00 H new ATOM 0 HD22 ASN A 109 17.493 8.542 -4.122 1.00 0.00 H new ATOM 1724 N GLU A 110 13.866 5.742 -3.254 1.00 0.00 N ATOM 1725 CA GLU A 110 13.463 4.357 -3.522 1.00 0.00 C ATOM 1726 C GLU A 110 13.739 3.390 -2.365 1.00 0.00 C ATOM 1727 O GLU A 110 14.171 2.250 -2.568 1.00 0.00 O ATOM 1728 CB GLU A 110 13.999 3.866 -4.880 1.00 0.00 C ATOM 1729 CG GLU A 110 13.717 4.878 -5.996 1.00 0.00 C ATOM 1730 CD GLU A 110 13.725 4.233 -7.389 1.00 0.00 C ATOM 1731 OE1 GLU A 110 14.814 3.950 -7.939 1.00 0.00 O ATOM 1732 OE2 GLU A 110 12.624 4.033 -7.951 1.00 0.00 O ATOM 0 H GLU A 110 13.141 6.421 -3.484 1.00 0.00 H new ATOM 0 HA GLU A 110 12.376 4.365 -3.598 1.00 0.00 H new ATOM 0 HB2 GLU A 110 15.073 3.693 -4.807 1.00 0.00 H new ATOM 0 HB3 GLU A 110 13.539 2.910 -5.130 1.00 0.00 H new ATOM 0 HG2 GLU A 110 12.748 5.346 -5.821 1.00 0.00 H new ATOM 0 HG3 GLU A 110 14.465 5.670 -5.961 1.00 0.00 H new ATOM 1739 N CYS A 111 13.508 3.869 -1.144 1.00 0.00 N ATOM 1740 CA CYS A 111 13.664 3.058 0.048 1.00 0.00 C ATOM 1741 C CYS A 111 12.608 1.943 0.084 1.00 0.00 C ATOM 1742 O CYS A 111 11.436 2.161 -0.238 1.00 0.00 O ATOM 1743 CB CYS A 111 13.623 3.947 1.294 1.00 0.00 C ATOM 1744 SG CYS A 111 12.038 4.814 1.478 1.00 0.00 S ATOM 0 H CYS A 111 13.209 4.827 -0.960 1.00 0.00 H new ATOM 0 HA CYS A 111 14.637 2.568 0.030 1.00 0.00 H new ATOM 0 HB2 CYS A 111 13.804 3.336 2.178 1.00 0.00 H new ATOM 0 HB3 CYS A 111 14.430 4.678 1.241 1.00 0.00 H new ATOM 0 HG CYS A 111 12.229 5.940 2.099 1.00 0.00 H new ATOM 1750 N GLU A 112 13.025 0.739 0.479 1.00 0.00 N ATOM 1751 CA GLU A 112 12.088 -0.341 0.773 1.00 0.00 C ATOM 1752 C GLU A 112 11.484 -0.078 2.157 1.00 0.00 C ATOM 1753 O GLU A 112 12.090 0.605 2.991 1.00 0.00 O ATOM 1754 CB GLU A 112 12.803 -1.700 0.745 1.00 0.00 C ATOM 1755 CG GLU A 112 13.354 -2.029 -0.648 1.00 0.00 C ATOM 1756 CD GLU A 112 13.940 -3.447 -0.707 1.00 0.00 C ATOM 1757 OE1 GLU A 112 15.070 -3.669 -0.215 1.00 0.00 O ATOM 1758 OE2 GLU A 112 13.271 -4.332 -1.281 1.00 0.00 O ATOM 0 H GLU A 112 14.006 0.489 0.602 1.00 0.00 H new ATOM 0 HA GLU A 112 11.301 -0.370 0.019 1.00 0.00 H new ATOM 0 HB2 GLU A 112 13.620 -1.695 1.466 1.00 0.00 H new ATOM 0 HB3 GLU A 112 12.109 -2.482 1.055 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.558 -1.933 -1.386 1.00 0.00 H new ATOM 0 HG3 GLU A 112 14.124 -1.306 -0.915 1.00 0.00 H new ATOM 1765 N ILE A 113 10.305 -0.643 2.409 1.00 0.00 N ATOM 1766 CA ILE A 113 9.548 -0.394 3.631 1.00 0.00 C ATOM 1767 C ILE A 113 9.522 -1.713 4.424 1.00 0.00 C ATOM 1768 O ILE A 113 9.278 -2.761 3.815 1.00 0.00 O ATOM 1769 CB ILE A 113 8.155 0.176 3.267 1.00 0.00 C ATOM 1770 CG1 ILE A 113 8.343 1.491 2.461 1.00 0.00 C ATOM 1771 CG2 ILE A 113 7.287 0.376 4.523 1.00 0.00 C ATOM 1772 CD1 ILE A 113 7.071 2.293 2.181 1.00 0.00 C ATOM 0 H ILE A 113 9.847 -1.290 1.767 1.00 0.00 H new ATOM 0 HA ILE A 113 10.004 0.362 4.270 1.00 0.00 H new ATOM 0 HB ILE A 113 7.619 -0.538 2.642 1.00 0.00 H new ATOM 0 HG12 ILE A 113 9.040 2.130 3.004 1.00 0.00 H new ATOM 0 HG13 ILE A 113 8.811 1.246 1.508 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.316 0.777 4.234 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.149 -0.581 5.026 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.781 1.074 5.199 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.323 3.189 1.613 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.375 1.682 1.606 1.00 0.00 H new ATOM 0 HD13 ILE A 113 6.607 2.580 3.125 1.00 0.00 H new ATOM 1784 N PRO A 114 9.803 -1.698 5.745 1.00 0.00 N ATOM 1785 CA PRO A 114 9.803 -2.896 6.584 1.00 0.00 C ATOM 1786 C PRO A 114 8.464 -3.645 6.593 1.00 0.00 C ATOM 1787 O PRO A 114 7.457 -3.191 6.041 1.00 0.00 O ATOM 1788 CB PRO A 114 10.191 -2.441 7.998 1.00 0.00 C ATOM 1789 CG PRO A 114 10.873 -1.094 7.792 1.00 0.00 C ATOM 1790 CD PRO A 114 10.209 -0.541 6.535 1.00 0.00 C ATOM 0 HA PRO A 114 10.514 -3.616 6.179 1.00 0.00 H new ATOM 0 HB2 PRO A 114 9.315 -2.348 8.639 1.00 0.00 H new ATOM 0 HB3 PRO A 114 10.861 -3.156 8.475 1.00 0.00 H new ATOM 0 HG2 PRO A 114 10.724 -0.435 8.647 1.00 0.00 H new ATOM 0 HG3 PRO A 114 11.949 -1.206 7.660 1.00 0.00 H new ATOM 0 HD2 PRO A 114 9.348 0.078 6.790 1.00 0.00 H new ATOM 0 HD3 PRO A 114 10.900 0.089 5.975 1.00 0.00 H new ATOM 1798 N ASP A 115 8.449 -4.793 7.273 1.00 0.00 N ATOM 1799 CA ASP A 115 7.323 -5.719 7.316 1.00 0.00 C ATOM 1800 C ASP A 115 6.938 -5.977 8.776 1.00 0.00 C ATOM 1801 O ASP A 115 7.604 -6.768 9.446 1.00 0.00 O ATOM 1802 CB ASP A 115 7.695 -7.025 6.607 1.00 0.00 C ATOM 1803 CG ASP A 115 6.538 -8.033 6.680 1.00 0.00 C ATOM 1804 OD1 ASP A 115 5.366 -7.605 6.581 1.00 0.00 O ATOM 1805 OD2 ASP A 115 6.809 -9.246 6.814 1.00 0.00 O ATOM 0 H ASP A 115 9.246 -5.111 7.825 1.00 0.00 H new ATOM 0 HA ASP A 115 6.467 -5.286 6.799 1.00 0.00 H new ATOM 0 HB2 ASP A 115 7.941 -6.821 5.565 1.00 0.00 H new ATOM 0 HB3 ASP A 115 8.586 -7.453 7.067 1.00 0.00 H new ATOM 1810 N PRO A 116 5.923 -5.282 9.318 1.00 0.00 N ATOM 1811 CA PRO A 116 5.618 -5.315 10.745 1.00 0.00 C ATOM 1812 C PRO A 116 4.788 -6.545 11.148 1.00 0.00 C ATOM 1813 O PRO A 116 4.535 -6.723 12.336 1.00 0.00 O ATOM 1814 CB PRO A 116 4.848 -4.017 10.997 1.00 0.00 C ATOM 1815 CG PRO A 116 4.059 -3.838 9.701 1.00 0.00 C ATOM 1816 CD PRO A 116 5.021 -4.364 8.634 1.00 0.00 C ATOM 0 HA PRO A 116 6.525 -5.392 11.344 1.00 0.00 H new ATOM 0 HB2 PRO A 116 4.191 -4.097 11.863 1.00 0.00 H new ATOM 0 HB3 PRO A 116 5.518 -3.178 11.182 1.00 0.00 H new ATOM 0 HG2 PRO A 116 3.126 -4.402 9.716 1.00 0.00 H new ATOM 0 HG3 PRO A 116 3.798 -2.794 9.529 1.00 0.00 H new ATOM 0 HD2 PRO A 116 4.478 -4.873 7.837 1.00 0.00 H new ATOM 0 HD3 PRO A 116 5.574 -3.547 8.172 1.00 0.00 H new ATOM 1824 N TYR A 117 4.380 -7.391 10.192 1.00 0.00 N ATOM 1825 CA TYR A 117 3.422 -8.487 10.323 1.00 0.00 C ATOM 1826 C TYR A 117 3.512 -9.315 11.616 1.00 0.00 C ATOM 1827 O TYR A 117 2.471 -9.694 12.160 1.00 0.00 O ATOM 1828 CB TYR A 117 3.589 -9.363 9.074 1.00 0.00 C ATOM 1829 CG TYR A 117 2.772 -10.635 9.072 1.00 0.00 C ATOM 1830 CD1 TYR A 117 1.402 -10.592 8.759 1.00 0.00 C ATOM 1831 CD2 TYR A 117 3.387 -11.858 9.397 1.00 0.00 C ATOM 1832 CE1 TYR A 117 0.642 -11.775 8.767 1.00 0.00 C ATOM 1833 CE2 TYR A 117 2.634 -13.044 9.413 1.00 0.00 C ATOM 1834 CZ TYR A 117 1.256 -13.008 9.098 1.00 0.00 C ATOM 1835 OH TYR A 117 0.514 -14.151 9.116 1.00 0.00 O ATOM 0 H TYR A 117 4.739 -7.318 9.240 1.00 0.00 H new ATOM 0 HA TYR A 117 2.426 -8.052 10.399 1.00 0.00 H new ATOM 0 HB2 TYR A 117 3.319 -8.774 8.197 1.00 0.00 H new ATOM 0 HB3 TYR A 117 4.642 -9.625 8.971 1.00 0.00 H new ATOM 0 HD1 TYR A 117 0.934 -9.651 8.513 1.00 0.00 H new ATOM 0 HD2 TYR A 117 4.440 -11.885 9.635 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -0.409 -11.744 8.521 1.00 0.00 H new ATOM 0 HE2 TYR A 117 3.107 -13.982 9.665 1.00 0.00 H new ATOM 0 HH TYR A 117 1.086 -14.908 9.361 1.00 0.00 H new ATOM 1845 N ARG A 118 4.721 -9.579 12.133 1.00 0.00 N ATOM 1846 CA ARG A 118 4.919 -10.373 13.355 1.00 0.00 C ATOM 1847 C ARG A 118 5.823 -9.657 14.367 1.00 0.00 C ATOM 1848 O ARG A 118 6.459 -10.311 15.197 1.00 0.00 O ATOM 1849 CB ARG A 118 5.402 -11.791 12.979 1.00 0.00 C ATOM 1850 CG ARG A 118 6.764 -11.828 12.257 1.00 0.00 C ATOM 1851 CD ARG A 118 7.211 -13.263 11.946 1.00 0.00 C ATOM 1852 NE ARG A 118 7.524 -14.028 13.169 1.00 0.00 N ATOM 1853 CZ ARG A 118 7.811 -15.336 13.219 1.00 0.00 C ATOM 1854 NH1 ARG A 118 7.837 -16.068 12.108 1.00 0.00 N ATOM 1855 NH2 ARG A 118 8.072 -15.908 14.389 1.00 0.00 N ATOM 0 H ARG A 118 5.590 -9.248 11.715 1.00 0.00 H new ATOM 0 HA ARG A 118 3.965 -10.483 13.871 1.00 0.00 H new ATOM 0 HB2 ARG A 118 5.469 -12.392 13.886 1.00 0.00 H new ATOM 0 HB3 ARG A 118 4.653 -12.260 12.341 1.00 0.00 H new ATOM 0 HG2 ARG A 118 6.698 -11.260 11.329 1.00 0.00 H new ATOM 0 HG3 ARG A 118 7.516 -11.340 12.877 1.00 0.00 H new ATOM 0 HD2 ARG A 118 6.424 -13.774 11.391 1.00 0.00 H new ATOM 0 HD3 ARG A 118 8.090 -13.236 11.302 1.00 0.00 H new ATOM 0 HE ARG A 118 7.522 -13.517 14.052 1.00 0.00 H new ATOM 0 HH11 ARG A 118 7.637 -15.634 11.207 1.00 0.00 H new ATOM 0 HH12 ARG A 118 8.057 -17.063 12.158 1.00 0.00 H new ATOM 0 HH21 ARG A 118 8.053 -15.352 15.244 1.00 0.00 H new ATOM 0 HH22 ARG A 118 8.291 -16.903 14.433 1.00 0.00 H new ATOM 1869 N LYS A 119 5.928 -8.328 14.278 1.00 0.00 N ATOM 1870 CA LYS A 119 6.903 -7.541 15.035 1.00 0.00 C ATOM 1871 C LYS A 119 6.196 -6.713 16.113 1.00 0.00 C ATOM 1872 O LYS A 119 4.966 -6.641 16.147 1.00 0.00 O ATOM 1873 CB LYS A 119 7.679 -6.635 14.059 1.00 0.00 C ATOM 1874 CG LYS A 119 8.380 -7.363 12.893 1.00 0.00 C ATOM 1875 CD LYS A 119 9.455 -8.380 13.309 1.00 0.00 C ATOM 1876 CE LYS A 119 10.619 -7.716 14.061 1.00 0.00 C ATOM 1877 NZ LYS A 119 11.695 -8.683 14.397 1.00 0.00 N ATOM 0 H LYS A 119 5.332 -7.764 13.672 1.00 0.00 H new ATOM 0 HA LYS A 119 7.605 -8.206 15.538 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.988 -5.902 13.644 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.430 -6.082 14.623 1.00 0.00 H new ATOM 0 HG2 LYS A 119 7.624 -7.879 12.301 1.00 0.00 H new ATOM 0 HG3 LYS A 119 8.839 -6.618 12.244 1.00 0.00 H new ATOM 0 HD2 LYS A 119 9.004 -9.145 13.942 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.838 -8.885 12.422 1.00 0.00 H new ATOM 0 HE2 LYS A 119 11.032 -6.913 13.451 1.00 0.00 H new ATOM 0 HE3 LYS A 119 10.244 -7.260 14.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 12.459 -8.191 14.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 11.309 -9.436 15.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 12.072 -9.100 13.522 1.00 0.00 H new ATOM 1891 N SER A 120 6.979 -6.111 17.009 1.00 0.00 N ATOM 1892 CA SER A 120 6.469 -5.290 18.104 1.00 0.00 C ATOM 1893 C SER A 120 5.712 -4.055 17.592 1.00 0.00 C ATOM 1894 O SER A 120 5.914 -3.611 16.458 1.00 0.00 O ATOM 1895 CB SER A 120 7.660 -4.871 18.981 1.00 0.00 C ATOM 1896 OG SER A 120 8.481 -5.991 19.286 1.00 0.00 O ATOM 0 H SER A 120 7.996 -6.182 16.993 1.00 0.00 H new ATOM 0 HA SER A 120 5.754 -5.873 18.685 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.249 -4.113 18.465 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.297 -4.419 19.904 1.00 0.00 H new ATOM 0 HG SER A 120 9.234 -5.703 19.843 1.00 0.00 H new ATOM 1902 N ARG A 121 4.879 -3.439 18.443 1.00 0.00 N ATOM 1903 CA ARG A 121 4.108 -2.249 18.058 1.00 0.00 C ATOM 1904 C ARG A 121 5.002 -1.070 17.671 1.00 0.00 C ATOM 1905 O ARG A 121 4.597 -0.249 16.853 1.00 0.00 O ATOM 1906 CB ARG A 121 3.078 -1.888 19.148 1.00 0.00 C ATOM 1907 CG ARG A 121 3.623 -1.026 20.304 1.00 0.00 C ATOM 1908 CD ARG A 121 2.702 -0.988 21.535 1.00 0.00 C ATOM 1909 NE ARG A 121 1.264 -0.917 21.208 1.00 0.00 N ATOM 1910 CZ ARG A 121 0.566 0.149 20.798 1.00 0.00 C ATOM 1911 NH1 ARG A 121 1.139 1.332 20.596 1.00 0.00 N ATOM 1912 NH2 ARG A 121 -0.737 0.021 20.588 1.00 0.00 N ATOM 0 H ARG A 121 4.722 -3.746 19.403 1.00 0.00 H new ATOM 0 HA ARG A 121 3.550 -2.495 17.154 1.00 0.00 H new ATOM 0 HB2 ARG A 121 2.248 -1.358 18.680 1.00 0.00 H new ATOM 0 HB3 ARG A 121 2.673 -2.811 19.563 1.00 0.00 H new ATOM 0 HG2 ARG A 121 4.598 -1.410 20.603 1.00 0.00 H new ATOM 0 HG3 ARG A 121 3.777 -0.008 19.945 1.00 0.00 H new ATOM 0 HD2 ARG A 121 2.883 -1.877 22.139 1.00 0.00 H new ATOM 0 HD3 ARG A 121 2.968 -0.127 22.148 1.00 0.00 H new ATOM 0 HE ARG A 121 0.739 -1.786 21.306 1.00 0.00 H new ATOM 0 HH11 ARG A 121 2.140 1.447 20.754 1.00 0.00 H new ATOM 0 HH12 ARG A 121 0.577 2.124 20.283 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -1.192 -0.879 20.739 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -1.284 0.823 20.275 1.00 0.00 H new ATOM 1926 N GLU A 122 6.228 -1.001 18.196 1.00 0.00 N ATOM 1927 CA GLU A 122 7.198 0.011 17.790 1.00 0.00 C ATOM 1928 C GLU A 122 7.537 -0.134 16.300 1.00 0.00 C ATOM 1929 O GLU A 122 7.688 0.868 15.602 1.00 0.00 O ATOM 1930 CB GLU A 122 8.448 -0.107 18.678 1.00 0.00 C ATOM 1931 CG GLU A 122 9.465 1.013 18.419 1.00 0.00 C ATOM 1932 CD GLU A 122 10.649 0.938 19.401 1.00 0.00 C ATOM 1933 OE1 GLU A 122 11.640 0.226 19.117 1.00 0.00 O ATOM 1934 OE2 GLU A 122 10.613 1.606 20.460 1.00 0.00 O ATOM 0 H GLU A 122 6.572 -1.643 18.910 1.00 0.00 H new ATOM 0 HA GLU A 122 6.773 1.006 17.922 1.00 0.00 H new ATOM 0 HB2 GLU A 122 8.148 -0.085 19.726 1.00 0.00 H new ATOM 0 HB3 GLU A 122 8.924 -1.072 18.503 1.00 0.00 H new ATOM 0 HG2 GLU A 122 9.834 0.941 17.396 1.00 0.00 H new ATOM 0 HG3 GLU A 122 8.973 1.981 18.513 1.00 0.00 H new ATOM 1941 N THR A 123 7.593 -1.363 15.779 1.00 0.00 N ATOM 1942 CA THR A 123 7.825 -1.595 14.361 1.00 0.00 C ATOM 1943 C THR A 123 6.590 -1.173 13.557 1.00 0.00 C ATOM 1944 O THR A 123 6.745 -0.568 12.497 1.00 0.00 O ATOM 1945 CB THR A 123 8.180 -3.075 14.129 1.00 0.00 C ATOM 1946 OG1 THR A 123 9.069 -3.547 15.130 1.00 0.00 O ATOM 1947 CG2 THR A 123 8.819 -3.305 12.755 1.00 0.00 C ATOM 0 H THR A 123 7.479 -2.215 16.328 1.00 0.00 H new ATOM 0 HA THR A 123 8.666 -0.992 14.019 1.00 0.00 H new ATOM 0 HB THR A 123 7.242 -3.628 14.176 1.00 0.00 H new ATOM 0 HG1 THR A 123 9.638 -4.252 14.756 1.00 0.00 H new ATOM 0 HG21 THR A 123 9.053 -4.363 12.635 1.00 0.00 H new ATOM 0 HG22 THR A 123 8.124 -2.996 11.974 1.00 0.00 H new ATOM 0 HG23 THR A 123 9.735 -2.720 12.677 1.00 0.00 H new ATOM 1955 N PHE A 124 5.369 -1.407 14.058 1.00 0.00 N ATOM 1956 CA PHE A 124 4.166 -0.883 13.412 1.00 0.00 C ATOM 1957 C PHE A 124 4.195 0.648 13.383 1.00 0.00 C ATOM 1958 O PHE A 124 3.811 1.222 12.371 1.00 0.00 O ATOM 1959 CB PHE A 124 2.883 -1.382 14.099 1.00 0.00 C ATOM 1960 CG PHE A 124 2.461 -2.791 13.732 1.00 0.00 C ATOM 1961 CD1 PHE A 124 2.987 -3.899 14.422 1.00 0.00 C ATOM 1962 CD2 PHE A 124 1.517 -2.995 12.707 1.00 0.00 C ATOM 1963 CE1 PHE A 124 2.564 -5.199 14.096 1.00 0.00 C ATOM 1964 CE2 PHE A 124 1.102 -4.298 12.379 1.00 0.00 C ATOM 1965 CZ PHE A 124 1.624 -5.401 13.072 1.00 0.00 C ATOM 0 H PHE A 124 5.193 -1.952 14.902 1.00 0.00 H new ATOM 0 HA PHE A 124 4.157 -1.256 12.388 1.00 0.00 H new ATOM 0 HB2 PHE A 124 3.025 -1.332 15.179 1.00 0.00 H new ATOM 0 HB3 PHE A 124 2.069 -0.700 13.852 1.00 0.00 H new ATOM 0 HD1 PHE A 124 3.717 -3.750 15.204 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.111 -2.149 12.172 1.00 0.00 H new ATOM 0 HE1 PHE A 124 2.963 -6.046 14.635 1.00 0.00 H new ATOM 0 HE2 PHE A 124 0.379 -4.450 11.591 1.00 0.00 H new ATOM 0 HZ PHE A 124 1.304 -6.401 12.819 1.00 0.00 H new ATOM 1975 N ALA A 125 4.666 1.319 14.440 1.00 0.00 N ATOM 1976 CA ALA A 125 4.773 2.775 14.470 1.00 0.00 C ATOM 1977 C ALA A 125 5.820 3.281 13.470 1.00 0.00 C ATOM 1978 O ALA A 125 5.569 4.256 12.757 1.00 0.00 O ATOM 1979 CB ALA A 125 5.097 3.246 15.892 1.00 0.00 C ATOM 0 H ALA A 125 4.983 0.865 15.297 1.00 0.00 H new ATOM 0 HA ALA A 125 3.813 3.196 14.171 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.175 4.333 15.906 1.00 0.00 H new ATOM 0 HB2 ALA A 125 4.304 2.930 16.569 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.043 2.810 16.213 1.00 0.00 H new ATOM 1985 N ALA A 126 6.976 2.615 13.379 1.00 0.00 N ATOM 1986 CA ALA A 126 8.011 2.959 12.408 1.00 0.00 C ATOM 1987 C ALA A 126 7.471 2.814 10.984 1.00 0.00 C ATOM 1988 O ALA A 126 7.607 3.735 10.177 1.00 0.00 O ATOM 1989 CB ALA A 126 9.243 2.072 12.627 1.00 0.00 C ATOM 0 H ALA A 126 7.217 1.824 13.977 1.00 0.00 H new ATOM 0 HA ALA A 126 8.307 3.999 12.549 1.00 0.00 H new ATOM 0 HB1 ALA A 126 10.013 2.332 11.900 1.00 0.00 H new ATOM 0 HB2 ALA A 126 9.628 2.227 13.635 1.00 0.00 H new ATOM 0 HB3 ALA A 126 8.965 1.026 12.502 1.00 0.00 H new ATOM 1995 N VAL A 127 6.817 1.687 10.689 1.00 0.00 N ATOM 1996 CA VAL A 127 6.225 1.449 9.381 1.00 0.00 C ATOM 1997 C VAL A 127 5.121 2.475 9.126 1.00 0.00 C ATOM 1998 O VAL A 127 5.136 3.078 8.060 1.00 0.00 O ATOM 1999 CB VAL A 127 5.766 -0.020 9.265 1.00 0.00 C ATOM 2000 CG1 VAL A 127 4.947 -0.285 7.993 1.00 0.00 C ATOM 2001 CG2 VAL A 127 7.002 -0.935 9.225 1.00 0.00 C ATOM 0 H VAL A 127 6.686 0.921 11.350 1.00 0.00 H new ATOM 0 HA VAL A 127 6.962 1.590 8.591 1.00 0.00 H new ATOM 0 HB VAL A 127 5.136 -0.225 10.130 1.00 0.00 H new ATOM 0 HG11 VAL A 127 4.651 -1.333 7.963 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.057 0.344 7.996 1.00 0.00 H new ATOM 0 HG13 VAL A 127 5.552 -0.054 7.116 1.00 0.00 H new ATOM 0 HG21 VAL A 127 6.683 -1.974 9.143 1.00 0.00 H new ATOM 0 HG22 VAL A 127 7.619 -0.676 8.364 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.581 -0.804 10.139 1.00 0.00 H new ATOM 2011 N TYR A 128 4.229 2.758 10.084 1.00 0.00 N ATOM 2012 CA TYR A 128 3.205 3.789 9.931 1.00 0.00 C ATOM 2013 C TYR A 128 3.844 5.121 9.532 1.00 0.00 C ATOM 2014 O TYR A 128 3.363 5.768 8.609 1.00 0.00 O ATOM 2015 CB TYR A 128 2.376 3.927 11.226 1.00 0.00 C ATOM 2016 CG TYR A 128 1.444 5.128 11.233 1.00 0.00 C ATOM 2017 CD1 TYR A 128 1.959 6.402 11.544 1.00 0.00 C ATOM 2018 CD2 TYR A 128 0.091 4.997 10.856 1.00 0.00 C ATOM 2019 CE1 TYR A 128 1.171 7.548 11.364 1.00 0.00 C ATOM 2020 CE2 TYR A 128 -0.723 6.139 10.731 1.00 0.00 C ATOM 2021 CZ TYR A 128 -0.169 7.425 10.938 1.00 0.00 C ATOM 2022 OH TYR A 128 -0.894 8.547 10.674 1.00 0.00 O ATOM 0 H TYR A 128 4.200 2.278 10.983 1.00 0.00 H new ATOM 0 HA TYR A 128 2.525 3.492 9.133 1.00 0.00 H new ATOM 0 HB2 TYR A 128 1.787 3.021 11.367 1.00 0.00 H new ATOM 0 HB3 TYR A 128 3.055 4.001 12.075 1.00 0.00 H new ATOM 0 HD1 TYR A 128 2.966 6.497 11.923 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.322 4.018 10.663 1.00 0.00 H new ATOM 0 HE1 TYR A 128 1.590 8.526 11.552 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -1.768 6.034 10.478 1.00 0.00 H new ATOM 0 HH TYR A 128 -0.291 9.268 10.396 1.00 0.00 H new ATOM 2032 N THR A 129 4.937 5.522 10.184 1.00 0.00 N ATOM 2033 CA THR A 129 5.581 6.803 9.914 1.00 0.00 C ATOM 2034 C THR A 129 6.164 6.818 8.491 1.00 0.00 C ATOM 2035 O THR A 129 5.994 7.792 7.755 1.00 0.00 O ATOM 2036 CB THR A 129 6.646 7.064 10.998 1.00 0.00 C ATOM 2037 OG1 THR A 129 6.078 6.937 12.292 1.00 0.00 O ATOM 2038 CG2 THR A 129 7.242 8.472 10.894 1.00 0.00 C ATOM 0 H THR A 129 5.396 4.970 10.909 1.00 0.00 H new ATOM 0 HA THR A 129 4.853 7.613 9.957 1.00 0.00 H new ATOM 0 HB THR A 129 7.432 6.325 10.840 1.00 0.00 H new ATOM 0 HG1 THR A 129 5.948 5.988 12.500 1.00 0.00 H new ATOM 0 HG21 THR A 129 7.987 8.610 11.677 1.00 0.00 H new ATOM 0 HG22 THR A 129 7.713 8.597 9.919 1.00 0.00 H new ATOM 0 HG23 THR A 129 6.450 9.212 11.012 1.00 0.00 H new ATOM 2046 N LEU A 130 6.816 5.730 8.070 1.00 0.00 N ATOM 2047 CA LEU A 130 7.410 5.630 6.740 1.00 0.00 C ATOM 2048 C LEU A 130 6.327 5.574 5.655 1.00 0.00 C ATOM 2049 O LEU A 130 6.462 6.205 4.603 1.00 0.00 O ATOM 2050 CB LEU A 130 8.334 4.402 6.725 1.00 0.00 C ATOM 2051 CG LEU A 130 9.122 4.175 5.421 1.00 0.00 C ATOM 2052 CD1 LEU A 130 9.850 5.431 4.922 1.00 0.00 C ATOM 2053 CD2 LEU A 130 10.158 3.075 5.673 1.00 0.00 C ATOM 0 H LEU A 130 6.945 4.896 8.643 1.00 0.00 H new ATOM 0 HA LEU A 130 8.002 6.517 6.516 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.045 4.495 7.546 1.00 0.00 H new ATOM 0 HB3 LEU A 130 7.732 3.515 6.923 1.00 0.00 H new ATOM 0 HG LEU A 130 8.404 3.897 4.650 1.00 0.00 H new ATOM 0 HD11 LEU A 130 10.384 5.200 4.001 1.00 0.00 H new ATOM 0 HD12 LEU A 130 9.124 6.221 4.732 1.00 0.00 H new ATOM 0 HD13 LEU A 130 10.560 5.765 5.679 1.00 0.00 H new ATOM 0 HD21 LEU A 130 10.729 2.897 4.762 1.00 0.00 H new ATOM 0 HD22 LEU A 130 10.834 3.387 6.469 1.00 0.00 H new ATOM 0 HD23 LEU A 130 9.650 2.157 5.968 1.00 0.00 H new ATOM 2065 N LEU A 131 5.223 4.873 5.920 1.00 0.00 N ATOM 2066 CA LEU A 131 4.056 4.841 5.048 1.00 0.00 C ATOM 2067 C LEU A 131 3.399 6.216 4.990 1.00 0.00 C ATOM 2068 O LEU A 131 2.922 6.591 3.926 1.00 0.00 O ATOM 2069 CB LEU A 131 3.017 3.814 5.536 1.00 0.00 C ATOM 2070 CG LEU A 131 3.427 2.335 5.410 1.00 0.00 C ATOM 2071 CD1 LEU A 131 2.322 1.458 6.006 1.00 0.00 C ATOM 2072 CD2 LEU A 131 3.674 1.913 3.963 1.00 0.00 C ATOM 0 H LEU A 131 5.117 4.304 6.760 1.00 0.00 H new ATOM 0 HA LEU A 131 4.401 4.550 4.056 1.00 0.00 H new ATOM 0 HB2 LEU A 131 2.792 4.021 6.582 1.00 0.00 H new ATOM 0 HB3 LEU A 131 2.094 3.965 4.976 1.00 0.00 H new ATOM 0 HG LEU A 131 4.365 2.208 5.951 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.605 0.409 5.921 1.00 0.00 H new ATOM 0 HD12 LEU A 131 2.183 1.712 7.057 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.391 1.628 5.465 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.960 0.862 3.934 1.00 0.00 H new ATOM 0 HD22 LEU A 131 2.764 2.057 3.381 1.00 0.00 H new ATOM 0 HD23 LEU A 131 4.475 2.518 3.539 1.00 0.00 H new ATOM 2084 N GLU A 132 3.364 6.970 6.091 1.00 0.00 N ATOM 2085 CA GLU A 132 2.751 8.294 6.128 1.00 0.00 C ATOM 2086 C GLU A 132 3.521 9.243 5.213 1.00 0.00 C ATOM 2087 O GLU A 132 2.904 9.927 4.397 1.00 0.00 O ATOM 2088 CB GLU A 132 2.669 8.790 7.583 1.00 0.00 C ATOM 2089 CG GLU A 132 2.034 10.179 7.710 1.00 0.00 C ATOM 2090 CD GLU A 132 1.846 10.584 9.183 1.00 0.00 C ATOM 2091 OE1 GLU A 132 2.804 11.105 9.799 1.00 0.00 O ATOM 2092 OE2 GLU A 132 0.726 10.406 9.717 1.00 0.00 O ATOM 0 H GLU A 132 3.762 6.676 6.983 1.00 0.00 H new ATOM 0 HA GLU A 132 1.729 8.251 5.752 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.091 8.078 8.171 1.00 0.00 H new ATOM 0 HB3 GLU A 132 3.672 8.815 8.009 1.00 0.00 H new ATOM 0 HG2 GLU A 132 2.662 10.914 7.207 1.00 0.00 H new ATOM 0 HG3 GLU A 132 1.069 10.186 7.204 1.00 0.00 H new ATOM 2099 N ARG A 133 4.859 9.235 5.275 1.00 0.00 N ATOM 2100 CA ARG A 133 5.677 10.014 4.343 1.00 0.00 C ATOM 2101 C ARG A 133 5.400 9.574 2.915 1.00 0.00 C ATOM 2102 O ARG A 133 5.113 10.413 2.066 1.00 0.00 O ATOM 2103 CB ARG A 133 7.174 9.870 4.661 1.00 0.00 C ATOM 2104 CG ARG A 133 7.530 10.575 5.974 1.00 0.00 C ATOM 2105 CD ARG A 133 9.017 10.461 6.330 1.00 0.00 C ATOM 2106 NE ARG A 133 9.899 11.090 5.325 1.00 0.00 N ATOM 2107 CZ ARG A 133 10.851 10.483 4.601 1.00 0.00 C ATOM 2108 NH1 ARG A 133 11.071 9.177 4.718 1.00 0.00 N ATOM 2109 NH2 ARG A 133 11.583 11.191 3.748 1.00 0.00 N ATOM 0 H ARG A 133 5.394 8.699 5.959 1.00 0.00 H new ATOM 0 HA ARG A 133 5.409 11.065 4.454 1.00 0.00 H new ATOM 0 HB2 ARG A 133 7.434 8.814 4.730 1.00 0.00 H new ATOM 0 HB3 ARG A 133 7.764 10.291 3.847 1.00 0.00 H new ATOM 0 HG2 ARG A 133 7.259 11.628 5.900 1.00 0.00 H new ATOM 0 HG3 ARG A 133 6.935 10.149 6.782 1.00 0.00 H new ATOM 0 HD2 ARG A 133 9.190 10.927 7.300 1.00 0.00 H new ATOM 0 HD3 ARG A 133 9.282 9.408 6.430 1.00 0.00 H new ATOM 0 HE ARG A 133 9.771 12.089 5.165 1.00 0.00 H new ATOM 0 HH11 ARG A 133 10.512 8.622 5.366 1.00 0.00 H new ATOM 0 HH12 ARG A 133 11.799 8.730 4.160 1.00 0.00 H new ATOM 0 HH21 ARG A 133 11.420 12.193 3.645 1.00 0.00 H new ATOM 0 HH22 ARG A 133 12.308 10.733 3.196 1.00 0.00 H new ATOM 2123 N SER A 134 5.452 8.270 2.656 1.00 0.00 N ATOM 2124 CA SER A 134 5.276 7.727 1.313 1.00 0.00 C ATOM 2125 C SER A 134 3.908 8.126 0.743 1.00 0.00 C ATOM 2126 O SER A 134 3.824 8.584 -0.397 1.00 0.00 O ATOM 2127 CB SER A 134 5.458 6.206 1.344 1.00 0.00 C ATOM 2128 OG SER A 134 6.723 5.860 1.887 1.00 0.00 O ATOM 0 H SER A 134 5.617 7.561 3.371 1.00 0.00 H new ATOM 0 HA SER A 134 6.034 8.146 0.651 1.00 0.00 H new ATOM 0 HB2 SER A 134 4.665 5.753 1.939 1.00 0.00 H new ATOM 0 HB3 SER A 134 5.368 5.804 0.335 1.00 0.00 H new ATOM 0 HG SER A 134 6.700 5.963 2.861 1.00 0.00 H new ATOM 2134 N ALA A 135 2.852 8.024 1.554 1.00 0.00 N ATOM 2135 CA ALA A 135 1.501 8.389 1.159 1.00 0.00 C ATOM 2136 C ALA A 135 1.383 9.887 0.908 1.00 0.00 C ATOM 2137 O ALA A 135 0.769 10.289 -0.079 1.00 0.00 O ATOM 2138 CB ALA A 135 0.511 7.975 2.252 1.00 0.00 C ATOM 0 H ALA A 135 2.918 7.681 2.512 1.00 0.00 H new ATOM 0 HA ALA A 135 1.269 7.866 0.231 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -0.500 8.251 1.951 1.00 0.00 H new ATOM 0 HB2 ALA A 135 0.564 6.897 2.401 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.764 8.483 3.183 1.00 0.00 H new ATOM 2144 N ARG A 136 1.965 10.720 1.777 1.00 0.00 N ATOM 2145 CA ARG A 136 1.913 12.166 1.615 1.00 0.00 C ATOM 2146 C ARG A 136 2.626 12.568 0.330 1.00 0.00 C ATOM 2147 O ARG A 136 2.083 13.363 -0.428 1.00 0.00 O ATOM 2148 CB ARG A 136 2.511 12.847 2.857 1.00 0.00 C ATOM 2149 CG ARG A 136 2.239 14.357 2.872 1.00 0.00 C ATOM 2150 CD ARG A 136 2.734 14.973 4.185 1.00 0.00 C ATOM 2151 NE ARG A 136 2.447 16.418 4.248 1.00 0.00 N ATOM 2152 CZ ARG A 136 2.713 17.220 5.287 1.00 0.00 C ATOM 2153 NH1 ARG A 136 3.286 16.740 6.389 1.00 0.00 N ATOM 2154 NH2 ARG A 136 2.402 18.511 5.219 1.00 0.00 N ATOM 0 H ARG A 136 2.479 10.410 2.602 1.00 0.00 H new ATOM 0 HA ARG A 136 0.878 12.498 1.527 1.00 0.00 H new ATOM 0 HB2 ARG A 136 2.092 12.394 3.756 1.00 0.00 H new ATOM 0 HB3 ARG A 136 3.587 12.672 2.884 1.00 0.00 H new ATOM 0 HG2 ARG A 136 2.739 14.832 2.028 1.00 0.00 H new ATOM 0 HG3 ARG A 136 1.171 14.542 2.755 1.00 0.00 H new ATOM 0 HD2 ARG A 136 2.257 14.470 5.026 1.00 0.00 H new ATOM 0 HD3 ARG A 136 3.807 14.810 4.282 1.00 0.00 H new ATOM 0 HE ARG A 136 2.009 16.843 3.431 1.00 0.00 H new ATOM 0 HH11 ARG A 136 3.528 15.751 6.449 1.00 0.00 H new ATOM 0 HH12 ARG A 136 3.483 17.361 7.173 1.00 0.00 H new ATOM 0 HH21 ARG A 136 1.963 18.886 4.378 1.00 0.00 H new ATOM 0 HH22 ARG A 136 2.602 19.126 6.008 1.00 0.00 H new ATOM 2168 N GLN A 137 3.798 11.995 0.047 1.00 0.00 N ATOM 2169 CA GLN A 137 4.545 12.266 -1.175 1.00 0.00 C ATOM 2170 C GLN A 137 3.738 11.829 -2.402 1.00 0.00 C ATOM 2171 O GLN A 137 3.631 12.589 -3.364 1.00 0.00 O ATOM 2172 CB GLN A 137 5.905 11.553 -1.137 1.00 0.00 C ATOM 2173 CG GLN A 137 6.861 12.057 -0.042 1.00 0.00 C ATOM 2174 CD GLN A 137 7.610 13.346 -0.379 1.00 0.00 C ATOM 2175 OE1 GLN A 137 7.231 14.127 -1.247 1.00 0.00 O ATOM 2176 NE2 GLN A 137 8.704 13.601 0.321 1.00 0.00 N ATOM 0 H GLN A 137 4.255 11.326 0.666 1.00 0.00 H new ATOM 0 HA GLN A 137 4.721 13.339 -1.246 1.00 0.00 H new ATOM 0 HB2 GLN A 137 5.737 10.486 -0.992 1.00 0.00 H new ATOM 0 HB3 GLN A 137 6.389 11.670 -2.106 1.00 0.00 H new ATOM 0 HG2 GLN A 137 6.290 12.215 0.873 1.00 0.00 H new ATOM 0 HG3 GLN A 137 7.591 11.276 0.169 1.00 0.00 H new ATOM 0 HE21 GLN A 137 9.013 12.947 1.041 1.00 0.00 H new ATOM 0 HE22 GLN A 137 9.238 14.451 0.141 1.00 0.00 H new ATOM 2185 N TRP A 138 3.129 10.638 -2.367 1.00 0.00 N ATOM 2186 CA TRP A 138 2.287 10.167 -3.461 1.00 0.00 C ATOM 2187 C TRP A 138 1.100 11.096 -3.699 1.00 0.00 C ATOM 2188 O TRP A 138 0.825 11.442 -4.848 1.00 0.00 O ATOM 2189 CB TRP A 138 1.832 8.721 -3.212 1.00 0.00 C ATOM 2190 CG TRP A 138 2.699 7.719 -3.899 1.00 0.00 C ATOM 2191 CD1 TRP A 138 3.623 6.914 -3.333 1.00 0.00 C ATOM 2192 CD2 TRP A 138 2.798 7.489 -5.333 1.00 0.00 C ATOM 2193 NE1 TRP A 138 4.292 6.212 -4.315 1.00 0.00 N ATOM 2194 CE2 TRP A 138 3.839 6.546 -5.577 1.00 0.00 C ATOM 2195 CE3 TRP A 138 2.148 8.050 -6.451 1.00 0.00 C ATOM 2196 CZ2 TRP A 138 4.219 6.188 -6.878 1.00 0.00 C ATOM 2197 CZ3 TRP A 138 2.520 7.696 -7.759 1.00 0.00 C ATOM 2198 CH2 TRP A 138 3.552 6.766 -7.973 1.00 0.00 C ATOM 0 H TRP A 138 3.207 9.984 -1.588 1.00 0.00 H new ATOM 0 HA TRP A 138 2.885 10.179 -4.372 1.00 0.00 H new ATOM 0 HB2 TRP A 138 1.834 8.523 -2.140 1.00 0.00 H new ATOM 0 HB3 TRP A 138 0.804 8.603 -3.556 1.00 0.00 H new ATOM 0 HD1 TRP A 138 3.810 6.832 -2.273 1.00 0.00 H new ATOM 0 HE1 TRP A 138 5.029 5.531 -4.132 1.00 0.00 H new ATOM 0 HE3 TRP A 138 1.351 8.763 -6.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 5.015 5.476 -7.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 2.012 8.140 -8.602 1.00 0.00 H new ATOM 0 HH2 TRP A 138 3.833 6.495 -8.980 1.00 0.00 H new ATOM 2209 N ALA A 139 0.416 11.533 -2.639 1.00 0.00 N ATOM 2210 CA ALA A 139 -0.701 12.452 -2.765 1.00 0.00 C ATOM 2211 C ALA A 139 -0.234 13.800 -3.316 1.00 0.00 C ATOM 2212 O ALA A 139 -0.868 14.332 -4.222 1.00 0.00 O ATOM 2213 CB ALA A 139 -1.381 12.623 -1.406 1.00 0.00 C ATOM 0 H ALA A 139 0.624 11.258 -1.679 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.423 12.039 -3.470 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -2.219 13.313 -1.503 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -1.745 11.657 -1.057 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.664 13.021 -0.688 1.00 0.00 H new ATOM 2219 N GLN A 140 0.882 14.331 -2.807 1.00 0.00 N ATOM 2220 CA GLN A 140 1.472 15.596 -3.230 1.00 0.00 C ATOM 2221 C GLN A 140 1.750 15.556 -4.735 1.00 0.00 C ATOM 2222 O GLN A 140 1.414 16.510 -5.438 1.00 0.00 O ATOM 2223 CB GLN A 140 2.739 15.844 -2.382 1.00 0.00 C ATOM 2224 CG GLN A 140 3.451 17.197 -2.548 1.00 0.00 C ATOM 2225 CD GLN A 140 4.138 17.401 -3.903 1.00 0.00 C ATOM 2226 OE1 GLN A 140 4.812 16.518 -4.424 1.00 0.00 O ATOM 2227 NE2 GLN A 140 3.992 18.572 -4.505 1.00 0.00 N ATOM 0 H GLN A 140 1.413 13.874 -2.066 1.00 0.00 H new ATOM 0 HA GLN A 140 0.791 16.431 -3.066 1.00 0.00 H new ATOM 0 HB2 GLN A 140 2.468 15.733 -1.332 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.456 15.056 -2.611 1.00 0.00 H new ATOM 0 HG2 GLN A 140 2.723 17.995 -2.402 1.00 0.00 H new ATOM 0 HG3 GLN A 140 4.197 17.298 -1.760 1.00 0.00 H new ATOM 0 HE21 GLN A 140 3.431 19.303 -4.068 1.00 0.00 H new ATOM 0 HE22 GLN A 140 4.441 18.742 -5.405 1.00 0.00 H new ATOM 2236 N ALA A 141 2.315 14.448 -5.228 1.00 0.00 N ATOM 2237 CA ALA A 141 2.579 14.270 -6.644 1.00 0.00 C ATOM 2238 C ALA A 141 1.266 14.208 -7.425 1.00 0.00 C ATOM 2239 O ALA A 141 1.027 15.048 -8.288 1.00 0.00 O ATOM 2240 CB ALA A 141 3.409 13.001 -6.852 1.00 0.00 C ATOM 0 H ALA A 141 2.598 13.656 -4.651 1.00 0.00 H new ATOM 0 HA ALA A 141 3.147 15.121 -7.019 1.00 0.00 H new ATOM 0 HB1 ALA A 141 3.608 12.866 -7.915 1.00 0.00 H new ATOM 0 HB2 ALA A 141 4.353 13.092 -6.315 1.00 0.00 H new ATOM 0 HB3 ALA A 141 2.858 12.140 -6.474 1.00 0.00 H new ATOM 2246 N LEU A 142 0.396 13.241 -7.111 1.00 0.00 N ATOM 2247 CA LEU A 142 -0.834 12.980 -7.864 1.00 0.00 C ATOM 2248 C LEU A 142 -1.723 14.223 -7.942 1.00 0.00 C ATOM 2249 O LEU A 142 -2.309 14.492 -8.992 1.00 0.00 O ATOM 2250 CB LEU A 142 -1.607 11.810 -7.228 1.00 0.00 C ATOM 2251 CG LEU A 142 -0.971 10.427 -7.472 1.00 0.00 C ATOM 2252 CD1 LEU A 142 -1.613 9.387 -6.548 1.00 0.00 C ATOM 2253 CD2 LEU A 142 -1.123 9.960 -8.926 1.00 0.00 C ATOM 0 H LEU A 142 0.528 12.612 -6.319 1.00 0.00 H new ATOM 0 HA LEU A 142 -0.551 12.712 -8.882 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -1.681 11.979 -6.154 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -2.624 11.805 -7.621 1.00 0.00 H new ATOM 0 HG LEU A 142 0.093 10.525 -7.259 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -1.159 8.412 -6.726 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -1.455 9.677 -5.509 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -2.683 9.331 -6.751 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -0.658 8.981 -9.044 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -2.181 9.892 -9.178 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -0.637 10.675 -9.590 1.00 0.00 H new