USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 878 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 32 ASN : amide:sc= -0.0197 K(o=-0.49,f=-2.1!) USER MOD Set 1.2: A 46 SER OG : rot -170:sc= -0.468 USER MOD Single : A 1 GLY N :NH3+ -108:sc= 0.0429 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 39:sc= 0.318 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.103 K(o=-0.1,f=-0.91) USER MOD Single : A 13 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.228 X(o=-0.23,f=-0.19) USER MOD Single : A 21 MET CE :methyl -159:sc= -0.0955 (180deg=-0.918) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.112 K(o=-0.11,f=-2.1!) USER MOD Single : A 40 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.301) USER MOD Single : A 41 MET CE :methyl 145:sc= 0 (180deg=-0.879) USER MOD Single : A 52 THR OG1 : rot -100:sc= 1.13 USER MOD Single : A 57 CYS SG : rot -79:sc= 0.756 USER MOD Single : A 62 ASN :FLIP amide:sc= 0.497 F(o=-0.62,f=0.5) USER MOD Single : A 66 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 71 ASN : amide:sc= -10.4! C(o=-10!,f=-10!) USER MOD Single : A 78 HIS : no HE2:sc= -3.99! C(o=-4!,f=-3.8!) USER MOD Single : A 79 THR OG1 : rot -110:sc= -0.85 USER MOD Single : A 80 HIS : no HD1:sc= -1.11 X(o=-1.1,f=-1.5) USER MOD Single : A 82 GLN :FLIP amide:sc= -0.721 F(o=-1.7!,f=-0.72) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 88:sc= 0.841 USER MOD Single : A 91 CYS SG : rot -22:sc= -0.726 USER MOD Single : A 94 HIS :FLIP no HD1:sc= -0.191 F(o=-0.86,f=-0.19) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 159:sc= -0.479 (180deg=-1.04) USER MOD Single : A 105 ASN : amide:sc= -0.116 K(o=-0.12,f=-2!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.315 23.892 -11.593 1.00 0.00 N ATOM 2 CA GLY A 1 3.478 23.504 -12.370 1.00 0.00 C ATOM 3 C GLY A 1 3.592 22.001 -12.531 1.00 0.00 C ATOM 4 O GLY A 1 3.088 21.241 -11.704 1.00 0.00 O ATOM 0 H1 GLY A 1 1.606 24.322 -12.221 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.908 23.052 -11.134 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.597 24.581 -10.867 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.425 23.969 -13.354 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.378 23.884 -11.886 1.00 0.00 H new ATOM 8 N SER A 2 4.256 21.570 -13.599 1.00 0.00 N ATOM 9 CA SER A 2 4.431 20.148 -13.868 1.00 0.00 C ATOM 10 C SER A 2 5.488 19.924 -14.945 1.00 0.00 C ATOM 11 O SER A 2 5.511 20.619 -15.961 1.00 0.00 O ATOM 12 CB SER A 2 3.104 19.523 -14.303 1.00 0.00 C ATOM 13 OG SER A 2 2.518 20.256 -15.365 1.00 0.00 O ATOM 0 H SER A 2 4.682 22.186 -14.292 1.00 0.00 H new ATOM 0 HA SER A 2 4.767 19.669 -12.949 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.270 18.492 -14.617 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.418 19.492 -13.456 1.00 0.00 H new ATOM 0 HG SER A 2 1.672 19.835 -15.625 1.00 0.00 H new ATOM 19 N SER A 3 6.362 18.950 -14.715 1.00 0.00 N ATOM 20 CA SER A 3 7.425 18.636 -15.662 1.00 0.00 C ATOM 21 C SER A 3 7.575 17.127 -15.831 1.00 0.00 C ATOM 22 O SER A 3 7.844 16.407 -14.870 1.00 0.00 O ATOM 23 CB SER A 3 8.749 19.242 -15.195 1.00 0.00 C ATOM 24 OG SER A 3 9.104 18.762 -13.909 1.00 0.00 O ATOM 0 H SER A 3 6.355 18.364 -13.880 1.00 0.00 H new ATOM 0 HA SER A 3 7.157 19.067 -16.626 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.536 18.997 -15.908 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.667 20.329 -15.171 1.00 0.00 H new ATOM 0 HG SER A 3 8.874 17.812 -13.840 1.00 0.00 H new ATOM 30 N GLY A 4 7.397 16.655 -17.061 1.00 0.00 N ATOM 31 CA GLY A 4 7.516 15.235 -17.335 1.00 0.00 C ATOM 32 C GLY A 4 8.789 14.893 -18.084 1.00 0.00 C ATOM 33 O GLY A 4 9.800 14.543 -17.476 1.00 0.00 O ATOM 0 H GLY A 4 7.173 17.231 -17.873 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.492 14.684 -16.395 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.656 14.908 -17.919 1.00 0.00 H new ATOM 37 N SER A 5 8.739 14.994 -19.409 1.00 0.00 N ATOM 38 CA SER A 5 9.895 14.687 -20.243 1.00 0.00 C ATOM 39 C SER A 5 10.587 13.414 -19.766 1.00 0.00 C ATOM 40 O SER A 5 11.815 13.346 -19.705 1.00 0.00 O ATOM 41 CB SER A 5 10.885 15.854 -20.228 1.00 0.00 C ATOM 42 OG SER A 5 10.312 17.016 -20.804 1.00 0.00 O ATOM 0 H SER A 5 7.911 15.286 -19.927 1.00 0.00 H new ATOM 0 HA SER A 5 9.544 14.529 -21.263 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.189 16.064 -19.202 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.785 15.578 -20.777 1.00 0.00 H new ATOM 0 HG SER A 5 10.963 17.748 -20.781 1.00 0.00 H new ATOM 48 N SER A 6 9.789 12.406 -19.428 1.00 0.00 N ATOM 49 CA SER A 6 10.323 11.135 -18.952 1.00 0.00 C ATOM 50 C SER A 6 9.626 9.963 -19.637 1.00 0.00 C ATOM 51 O SER A 6 8.546 10.114 -20.205 1.00 0.00 O ATOM 52 CB SER A 6 10.159 11.025 -17.435 1.00 0.00 C ATOM 53 OG SER A 6 11.149 10.179 -16.875 1.00 0.00 O ATOM 0 H SER A 6 8.771 12.445 -19.475 1.00 0.00 H new ATOM 0 HA SER A 6 11.384 11.099 -19.199 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.227 12.016 -16.986 1.00 0.00 H new ATOM 0 HB3 SER A 6 9.168 10.636 -17.200 1.00 0.00 H new ATOM 0 HG SER A 6 11.024 10.127 -15.904 1.00 0.00 H new ATOM 59 N GLY A 7 10.255 8.793 -19.578 1.00 0.00 N ATOM 60 CA GLY A 7 9.682 7.611 -20.195 1.00 0.00 C ATOM 61 C GLY A 7 10.545 7.066 -21.316 1.00 0.00 C ATOM 62 O GLY A 7 11.546 7.676 -21.690 1.00 0.00 O ATOM 0 H GLY A 7 11.151 8.643 -19.114 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.546 6.839 -19.437 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.693 7.852 -20.586 1.00 0.00 H new ATOM 66 N ASN A 8 10.158 5.913 -21.851 1.00 0.00 N ATOM 67 CA ASN A 8 10.906 5.284 -22.934 1.00 0.00 C ATOM 68 C ASN A 8 9.966 4.573 -23.903 1.00 0.00 C ATOM 69 O ASN A 8 9.169 3.726 -23.502 1.00 0.00 O ATOM 70 CB ASN A 8 11.923 4.289 -22.369 1.00 0.00 C ATOM 71 CG ASN A 8 13.257 4.940 -22.059 1.00 0.00 C ATOM 72 OD1 ASN A 8 13.737 5.787 -22.812 1.00 0.00 O ATOM 73 ND2 ASN A 8 13.863 4.545 -20.945 1.00 0.00 N ATOM 0 H ASN A 8 9.331 5.395 -21.553 1.00 0.00 H new ATOM 0 HA ASN A 8 11.436 6.066 -23.478 1.00 0.00 H new ATOM 0 HB2 ASN A 8 11.521 3.839 -21.461 1.00 0.00 H new ATOM 0 HB3 ASN A 8 12.074 3.481 -23.085 1.00 0.00 H new ATOM 0 HD21 ASN A 8 14.763 4.947 -20.684 1.00 0.00 H new ATOM 0 HD22 ASN A 8 13.428 3.840 -20.350 1.00 0.00 H new ATOM 80 N GLY A 9 10.067 4.923 -25.181 1.00 0.00 N ATOM 81 CA GLY A 9 9.221 4.309 -26.188 1.00 0.00 C ATOM 82 C GLY A 9 9.604 2.870 -26.468 1.00 0.00 C ATOM 83 O GLY A 9 10.568 2.605 -27.186 1.00 0.00 O ATOM 0 H GLY A 9 10.720 5.621 -25.538 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.183 4.348 -25.859 1.00 0.00 H new ATOM 0 HA3 GLY A 9 9.284 4.885 -27.111 1.00 0.00 H new ATOM 87 N GLY A 10 8.849 1.936 -25.897 1.00 0.00 N ATOM 88 CA GLY A 10 9.132 0.527 -26.100 1.00 0.00 C ATOM 89 C GLY A 10 8.501 -0.350 -25.037 1.00 0.00 C ATOM 90 O GLY A 10 9.104 -0.604 -23.994 1.00 0.00 O ATOM 0 H GLY A 10 8.047 2.130 -25.298 1.00 0.00 H new ATOM 0 HA2 GLY A 10 8.766 0.224 -27.081 1.00 0.00 H new ATOM 0 HA3 GLY A 10 10.211 0.373 -26.100 1.00 0.00 H new ATOM 94 N ILE A 11 7.284 -0.813 -25.300 1.00 0.00 N ATOM 95 CA ILE A 11 6.571 -1.665 -24.357 1.00 0.00 C ATOM 96 C ILE A 11 7.468 -2.785 -23.841 1.00 0.00 C ATOM 97 O ILE A 11 8.120 -3.495 -24.607 1.00 0.00 O ATOM 98 CB ILE A 11 5.314 -2.284 -24.997 1.00 0.00 C ATOM 99 CG1 ILE A 11 4.363 -1.184 -25.473 1.00 0.00 C ATOM 100 CG2 ILE A 11 4.614 -3.204 -24.007 1.00 0.00 C ATOM 101 CD1 ILE A 11 3.846 -0.306 -24.355 1.00 0.00 C ATOM 0 H ILE A 11 6.771 -0.612 -26.159 1.00 0.00 H new ATOM 0 HA ILE A 11 6.270 -1.030 -23.524 1.00 0.00 H new ATOM 0 HB ILE A 11 5.618 -2.875 -25.861 1.00 0.00 H new ATOM 0 HG12 ILE A 11 4.878 -0.561 -26.204 1.00 0.00 H new ATOM 0 HG13 ILE A 11 3.517 -1.643 -25.984 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.728 -3.634 -24.474 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.293 -4.004 -23.711 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.320 -2.634 -23.126 1.00 0.00 H new ATOM 0 HD11 ILE A 11 3.178 0.451 -24.766 1.00 0.00 H new ATOM 0 HD12 ILE A 11 3.302 -0.917 -23.634 1.00 0.00 H new ATOM 0 HD13 ILE A 11 4.685 0.182 -23.858 1.00 0.00 H new ATOM 113 N PRO A 12 7.503 -2.950 -22.510 1.00 0.00 N ATOM 114 CA PRO A 12 8.315 -3.983 -21.861 1.00 0.00 C ATOM 115 C PRO A 12 7.780 -5.388 -22.119 1.00 0.00 C ATOM 116 O PRO A 12 6.570 -5.593 -22.223 1.00 0.00 O ATOM 117 CB PRO A 12 8.210 -3.636 -20.374 1.00 0.00 C ATOM 118 CG PRO A 12 6.922 -2.896 -20.248 1.00 0.00 C ATOM 119 CD PRO A 12 6.752 -2.140 -21.536 1.00 0.00 C ATOM 0 HA PRO A 12 9.337 -3.994 -22.239 1.00 0.00 H new ATOM 0 HB2 PRO A 12 8.213 -4.534 -19.757 1.00 0.00 H new ATOM 0 HB3 PRO A 12 9.052 -3.024 -20.050 1.00 0.00 H new ATOM 0 HG2 PRO A 12 6.091 -3.583 -20.086 1.00 0.00 H new ATOM 0 HG3 PRO A 12 6.944 -2.216 -19.396 1.00 0.00 H new ATOM 0 HD2 PRO A 12 5.702 -2.050 -21.813 1.00 0.00 H new ATOM 0 HD3 PRO A 12 7.150 -1.128 -21.463 1.00 0.00 H new ATOM 127 N HIS A 13 8.689 -6.352 -22.222 1.00 0.00 N ATOM 128 CA HIS A 13 8.307 -7.739 -22.467 1.00 0.00 C ATOM 129 C HIS A 13 8.237 -8.522 -21.159 1.00 0.00 C ATOM 130 O HIS A 13 9.231 -9.097 -20.715 1.00 0.00 O ATOM 131 CB HIS A 13 9.301 -8.403 -23.420 1.00 0.00 C ATOM 132 CG HIS A 13 9.209 -7.899 -24.828 1.00 0.00 C ATOM 133 ND1 HIS A 13 10.313 -7.546 -25.574 1.00 0.00 N ATOM 134 CD2 HIS A 13 8.135 -7.692 -25.625 1.00 0.00 C ATOM 135 CE1 HIS A 13 9.922 -7.141 -26.770 1.00 0.00 C ATOM 136 NE2 HIS A 13 8.605 -7.221 -26.826 1.00 0.00 N ATOM 0 H HIS A 13 9.694 -6.199 -22.140 1.00 0.00 H new ATOM 0 HA HIS A 13 7.318 -7.742 -22.926 1.00 0.00 H new ATOM 0 HB2 HIS A 13 10.313 -8.238 -23.049 1.00 0.00 H new ATOM 0 HB3 HIS A 13 9.131 -9.480 -23.416 1.00 0.00 H new ATOM 0 HD2 HIS A 13 7.101 -7.865 -25.365 1.00 0.00 H new ATOM 0 HE1 HIS A 13 10.569 -6.802 -27.566 1.00 0.00 H new ATOM 0 HE2 HIS A 13 8.030 -6.973 -27.631 1.00 0.00 H new ATOM 145 N ASP A 14 7.058 -8.540 -20.548 1.00 0.00 N ATOM 146 CA ASP A 14 6.858 -9.253 -19.292 1.00 0.00 C ATOM 147 C ASP A 14 5.386 -9.596 -19.090 1.00 0.00 C ATOM 148 O ASP A 14 4.527 -9.163 -19.857 1.00 0.00 O ATOM 149 CB ASP A 14 7.364 -8.413 -18.118 1.00 0.00 C ATOM 150 CG ASP A 14 6.946 -6.959 -18.224 1.00 0.00 C ATOM 151 OD1 ASP A 14 5.813 -6.700 -18.681 1.00 0.00 O ATOM 152 OD2 ASP A 14 7.751 -6.081 -17.850 1.00 0.00 O ATOM 0 H ASP A 14 6.226 -8.069 -20.902 1.00 0.00 H new ATOM 0 HA ASP A 14 7.426 -10.182 -19.336 1.00 0.00 H new ATOM 0 HB2 ASP A 14 6.984 -8.830 -17.186 1.00 0.00 H new ATOM 0 HB3 ASP A 14 8.451 -8.473 -18.074 1.00 0.00 H new ATOM 157 N ASN A 15 5.102 -10.379 -18.054 1.00 0.00 N ATOM 158 CA ASN A 15 3.734 -10.782 -17.752 1.00 0.00 C ATOM 159 C ASN A 15 3.373 -10.447 -16.308 1.00 0.00 C ATOM 160 O ASN A 15 2.906 -11.305 -15.558 1.00 0.00 O ATOM 161 CB ASN A 15 3.556 -12.282 -17.999 1.00 0.00 C ATOM 162 CG ASN A 15 4.604 -13.113 -17.286 1.00 0.00 C ATOM 163 OD1 ASN A 15 5.736 -13.239 -17.753 1.00 0.00 O ATOM 164 ND2 ASN A 15 4.230 -13.687 -16.148 1.00 0.00 N ATOM 0 H ASN A 15 5.802 -10.747 -17.410 1.00 0.00 H new ATOM 0 HA ASN A 15 3.065 -10.229 -18.412 1.00 0.00 H new ATOM 0 HB2 ASN A 15 2.565 -12.587 -17.664 1.00 0.00 H new ATOM 0 HB3 ASN A 15 3.606 -12.480 -19.070 1.00 0.00 H new ATOM 0 HD21 ASN A 15 4.892 -14.259 -15.624 1.00 0.00 H new ATOM 0 HD22 ASN A 15 3.281 -13.555 -15.798 1.00 0.00 H new ATOM 171 N LEU A 16 3.593 -9.194 -15.925 1.00 0.00 N ATOM 172 CA LEU A 16 3.291 -8.744 -14.570 1.00 0.00 C ATOM 173 C LEU A 16 1.785 -8.626 -14.359 1.00 0.00 C ATOM 174 O LEU A 16 1.023 -8.486 -15.315 1.00 0.00 O ATOM 175 CB LEU A 16 3.963 -7.397 -14.298 1.00 0.00 C ATOM 176 CG LEU A 16 5.371 -7.458 -13.704 1.00 0.00 C ATOM 177 CD1 LEU A 16 5.310 -7.778 -12.218 1.00 0.00 C ATOM 178 CD2 LEU A 16 6.216 -8.488 -14.439 1.00 0.00 C ATOM 0 H LEU A 16 3.979 -8.472 -16.533 1.00 0.00 H new ATOM 0 HA LEU A 16 3.680 -9.485 -13.872 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.009 -6.841 -15.234 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.328 -6.827 -13.619 1.00 0.00 H new ATOM 0 HG LEU A 16 5.838 -6.481 -13.825 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.321 -7.817 -11.812 1.00 0.00 H new ATOM 0 HD12 LEU A 16 4.742 -7.004 -11.702 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.823 -8.742 -12.073 1.00 0.00 H new ATOM 0 HD21 LEU A 16 7.214 -8.518 -14.003 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.752 -9.470 -14.350 1.00 0.00 H new ATOM 0 HD23 LEU A 16 6.288 -8.215 -15.492 1.00 0.00 H new ATOM 190 N VAL A 17 1.364 -8.680 -13.100 1.00 0.00 N ATOM 191 CA VAL A 17 -0.051 -8.576 -12.762 1.00 0.00 C ATOM 192 C VAL A 17 -0.408 -7.161 -12.320 1.00 0.00 C ATOM 193 O VAL A 17 0.160 -6.637 -11.361 1.00 0.00 O ATOM 194 CB VAL A 17 -0.435 -9.563 -11.644 1.00 0.00 C ATOM 195 CG1 VAL A 17 -1.900 -9.400 -11.267 1.00 0.00 C ATOM 196 CG2 VAL A 17 -0.143 -10.993 -12.072 1.00 0.00 C ATOM 0 H VAL A 17 1.982 -8.795 -12.297 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.611 -8.824 -13.664 1.00 0.00 H new ATOM 0 HB VAL A 17 0.169 -9.340 -10.764 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.153 -10.106 -10.476 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.074 -8.383 -10.916 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.524 -9.594 -12.139 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.420 -11.677 -11.270 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.719 -11.230 -12.966 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.920 -11.098 -12.287 1.00 0.00 H new ATOM 206 N LEU A 18 -1.351 -6.547 -13.026 1.00 0.00 N ATOM 207 CA LEU A 18 -1.785 -5.192 -12.707 1.00 0.00 C ATOM 208 C LEU A 18 -3.109 -5.208 -11.949 1.00 0.00 C ATOM 209 O LEU A 18 -4.070 -5.849 -12.373 1.00 0.00 O ATOM 210 CB LEU A 18 -1.928 -4.366 -13.987 1.00 0.00 C ATOM 211 CG LEU A 18 -2.499 -2.958 -13.817 1.00 0.00 C ATOM 212 CD1 LEU A 18 -1.426 -2.003 -13.319 1.00 0.00 C ATOM 213 CD2 LEU A 18 -3.091 -2.461 -15.128 1.00 0.00 C ATOM 0 H LEU A 18 -1.830 -6.966 -13.823 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.028 -4.736 -12.070 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.947 -4.284 -14.454 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.566 -4.914 -14.680 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.295 -2.997 -13.073 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.851 -1.006 -13.204 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -1.049 -2.350 -12.357 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.608 -1.968 -14.038 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.493 -1.457 -14.988 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -2.314 -2.438 -15.892 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.891 -3.131 -15.443 1.00 0.00 H new ATOM 225 N ILE A 19 -3.151 -4.497 -10.827 1.00 0.00 N ATOM 226 CA ILE A 19 -4.357 -4.427 -10.012 1.00 0.00 C ATOM 227 C ILE A 19 -5.117 -3.130 -10.265 1.00 0.00 C ATOM 228 O ILE A 19 -4.568 -2.038 -10.114 1.00 0.00 O ATOM 229 CB ILE A 19 -4.029 -4.533 -8.511 1.00 0.00 C ATOM 230 CG1 ILE A 19 -3.452 -5.913 -8.188 1.00 0.00 C ATOM 231 CG2 ILE A 19 -5.273 -4.265 -7.677 1.00 0.00 C ATOM 232 CD1 ILE A 19 -4.507 -6.984 -8.016 1.00 0.00 C ATOM 0 H ILE A 19 -2.363 -3.961 -10.462 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.982 -5.273 -10.299 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.280 -3.780 -8.264 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.772 -6.209 -8.986 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.861 -5.846 -7.274 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -5.025 -4.344 -6.618 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.644 -3.262 -7.889 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -6.042 -4.997 -7.925 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -4.026 -7.935 -7.789 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -5.174 -6.710 -7.198 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.083 -7.079 -8.937 1.00 0.00 H new ATOM 244 N ARG A 20 -6.383 -3.257 -10.648 1.00 0.00 N ATOM 245 CA ARG A 20 -7.219 -2.094 -10.921 1.00 0.00 C ATOM 246 C ARG A 20 -8.510 -2.150 -10.109 1.00 0.00 C ATOM 247 O ARG A 20 -9.197 -3.170 -10.086 1.00 0.00 O ATOM 248 CB ARG A 20 -7.546 -2.014 -12.413 1.00 0.00 C ATOM 249 CG ARG A 20 -6.316 -1.963 -13.305 1.00 0.00 C ATOM 250 CD ARG A 20 -6.692 -1.737 -14.761 1.00 0.00 C ATOM 251 NE ARG A 20 -7.426 -0.488 -14.949 1.00 0.00 N ATOM 252 CZ ARG A 20 -8.740 -0.377 -14.791 1.00 0.00 C ATOM 253 NH1 ARG A 20 -9.461 -1.434 -14.444 1.00 0.00 N ATOM 254 NH2 ARG A 20 -9.336 0.794 -14.981 1.00 0.00 N ATOM 0 H ARG A 20 -6.852 -4.153 -10.776 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.664 -1.202 -10.629 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -8.150 -2.878 -12.691 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.154 -1.128 -12.596 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -5.656 -1.163 -12.970 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.759 -2.896 -13.212 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -5.789 -1.722 -15.371 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -7.300 -2.571 -15.112 1.00 0.00 H new ATOM 0 HE ARG A 20 -6.901 0.344 -15.216 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -9.007 -2.335 -14.298 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -10.470 -1.346 -14.323 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -8.785 1.609 -15.249 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -10.345 0.878 -14.859 1.00 0.00 H new ATOM 268 N MET A 21 -8.832 -1.045 -9.443 1.00 0.00 N ATOM 269 CA MET A 21 -10.040 -0.968 -8.630 1.00 0.00 C ATOM 270 C MET A 21 -10.447 0.483 -8.398 1.00 0.00 C ATOM 271 O MET A 21 -9.749 1.409 -8.812 1.00 0.00 O ATOM 272 CB MET A 21 -9.823 -1.670 -7.288 1.00 0.00 C ATOM 273 CG MET A 21 -8.895 -0.916 -6.350 1.00 0.00 C ATOM 274 SD MET A 21 -7.164 -1.370 -6.572 1.00 0.00 S ATOM 275 CE MET A 21 -6.853 -2.268 -5.054 1.00 0.00 C ATOM 0 H MET A 21 -8.273 -0.192 -9.451 1.00 0.00 H new ATOM 0 HA MET A 21 -10.843 -1.471 -9.169 1.00 0.00 H new ATOM 0 HB2 MET A 21 -10.787 -1.807 -6.799 1.00 0.00 H new ATOM 0 HB3 MET A 21 -9.414 -2.664 -7.469 1.00 0.00 H new ATOM 0 HG2 MET A 21 -9.010 0.155 -6.515 1.00 0.00 H new ATOM 0 HG3 MET A 21 -9.189 -1.113 -5.319 1.00 0.00 H new ATOM 0 HE1 MET A 21 -5.781 -2.291 -4.858 1.00 0.00 H new ATOM 0 HE2 MET A 21 -7.363 -1.773 -4.227 1.00 0.00 H new ATOM 0 HE3 MET A 21 -7.226 -3.288 -5.152 1.00 0.00 H new ATOM 285 N LYS A 22 -11.581 0.675 -7.732 1.00 0.00 N ATOM 286 CA LYS A 22 -12.082 2.014 -7.443 1.00 0.00 C ATOM 287 C LYS A 22 -12.257 2.217 -5.942 1.00 0.00 C ATOM 288 O LYS A 22 -12.501 1.274 -5.188 1.00 0.00 O ATOM 289 CB LYS A 22 -13.414 2.248 -8.160 1.00 0.00 C ATOM 290 CG LYS A 22 -14.485 1.234 -7.799 1.00 0.00 C ATOM 291 CD LYS A 22 -15.723 1.398 -8.665 1.00 0.00 C ATOM 292 CE LYS A 22 -16.627 0.178 -8.582 1.00 0.00 C ATOM 293 NZ LYS A 22 -17.287 0.066 -7.252 1.00 0.00 N ATOM 0 H LYS A 22 -12.171 -0.080 -7.382 1.00 0.00 H new ATOM 0 HA LYS A 22 -11.350 2.735 -7.806 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -13.776 3.248 -7.919 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -13.247 2.220 -9.237 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -14.088 0.226 -7.918 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -14.756 1.348 -6.749 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -16.275 2.283 -8.349 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -15.425 1.561 -9.701 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -17.387 0.236 -9.361 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -16.042 -0.721 -8.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -17.894 -0.778 -7.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -16.562 -0.015 -6.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -17.866 0.913 -7.079 1.00 0.00 H new ATOM 307 N PRO A 23 -12.133 3.475 -5.495 1.00 0.00 N ATOM 308 CA PRO A 23 -12.276 3.831 -4.080 1.00 0.00 C ATOM 309 C PRO A 23 -13.714 3.696 -3.591 1.00 0.00 C ATOM 310 O PRO A 23 -14.660 3.921 -4.347 1.00 0.00 O ATOM 311 CB PRO A 23 -11.832 5.295 -4.036 1.00 0.00 C ATOM 312 CG PRO A 23 -12.082 5.809 -5.412 1.00 0.00 C ATOM 313 CD PRO A 23 -11.843 4.648 -6.337 1.00 0.00 C ATOM 0 HA PRO A 23 -11.693 3.175 -3.434 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -12.398 5.858 -3.294 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -10.779 5.381 -3.766 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -13.101 6.183 -5.510 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -11.415 6.638 -5.646 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -12.496 4.688 -7.209 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -10.818 4.633 -6.707 1.00 0.00 H new ATOM 321 N ASP A 24 -13.871 3.328 -2.325 1.00 0.00 N ATOM 322 CA ASP A 24 -15.195 3.165 -1.735 1.00 0.00 C ATOM 323 C ASP A 24 -15.863 4.518 -1.515 1.00 0.00 C ATOM 324 O ASP A 24 -15.308 5.559 -1.865 1.00 0.00 O ATOM 325 CB ASP A 24 -15.095 2.410 -0.408 1.00 0.00 C ATOM 326 CG ASP A 24 -16.358 1.635 -0.087 1.00 0.00 C ATOM 327 OD1 ASP A 24 -16.999 1.128 -1.030 1.00 0.00 O ATOM 328 OD2 ASP A 24 -16.707 1.537 1.109 1.00 0.00 O ATOM 0 H ASP A 24 -13.098 3.137 -1.687 1.00 0.00 H new ATOM 0 HA ASP A 24 -15.806 2.587 -2.429 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -14.250 1.722 -0.447 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -14.893 3.118 0.395 1.00 0.00 H new ATOM 333 N GLU A 25 -17.059 4.495 -0.934 1.00 0.00 N ATOM 334 CA GLU A 25 -17.803 5.721 -0.670 1.00 0.00 C ATOM 335 C GLU A 25 -16.994 6.669 0.211 1.00 0.00 C ATOM 336 O GLU A 25 -17.056 7.887 0.050 1.00 0.00 O ATOM 337 CB GLU A 25 -19.139 5.398 0.002 1.00 0.00 C ATOM 338 CG GLU A 25 -20.023 4.473 -0.816 1.00 0.00 C ATOM 339 CD GLU A 25 -20.652 5.168 -2.008 1.00 0.00 C ATOM 340 OE1 GLU A 25 -19.982 5.270 -3.057 1.00 0.00 O ATOM 341 OE2 GLU A 25 -21.814 5.611 -1.892 1.00 0.00 O ATOM 0 H GLU A 25 -17.533 3.642 -0.638 1.00 0.00 H new ATOM 0 HA GLU A 25 -17.994 6.213 -1.624 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -18.947 4.939 0.972 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -19.676 6.328 0.190 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -19.432 3.626 -1.165 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -20.810 4.071 -0.178 1.00 0.00 H new ATOM 348 N ASN A 26 -16.236 6.100 1.142 1.00 0.00 N ATOM 349 CA ASN A 26 -15.416 6.894 2.050 1.00 0.00 C ATOM 350 C ASN A 26 -13.996 7.043 1.511 1.00 0.00 C ATOM 351 O ASN A 26 -13.052 7.259 2.270 1.00 0.00 O ATOM 352 CB ASN A 26 -15.381 6.248 3.437 1.00 0.00 C ATOM 353 CG ASN A 26 -16.728 6.300 4.132 1.00 0.00 C ATOM 354 OD1 ASN A 26 -17.516 5.358 4.054 1.00 0.00 O ATOM 355 ND2 ASN A 26 -16.997 7.405 4.817 1.00 0.00 N ATOM 0 H ASN A 26 -16.172 5.092 1.288 1.00 0.00 H new ATOM 0 HA ASN A 26 -15.862 7.885 2.129 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -15.063 5.210 3.343 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -14.638 6.755 4.052 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -17.887 7.498 5.306 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -16.313 8.161 4.854 1.00 0.00 H new ATOM 362 N GLY A 27 -13.854 6.927 0.194 1.00 0.00 N ATOM 363 CA GLY A 27 -12.547 7.052 -0.425 1.00 0.00 C ATOM 364 C GLY A 27 -11.478 6.272 0.315 1.00 0.00 C ATOM 365 O GLY A 27 -10.469 6.836 0.737 1.00 0.00 O ATOM 0 H GLY A 27 -14.620 6.749 -0.455 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.601 6.700 -1.455 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.265 8.104 -0.462 1.00 0.00 H new ATOM 369 N ARG A 28 -11.701 4.971 0.473 1.00 0.00 N ATOM 370 CA ARG A 28 -10.750 4.113 1.170 1.00 0.00 C ATOM 371 C ARG A 28 -10.795 2.691 0.617 1.00 0.00 C ATOM 372 O ARG A 28 -11.836 2.228 0.149 1.00 0.00 O ATOM 373 CB ARG A 28 -11.048 4.098 2.670 1.00 0.00 C ATOM 374 CG ARG A 28 -12.330 3.365 3.029 1.00 0.00 C ATOM 375 CD ARG A 28 -12.380 3.022 4.510 1.00 0.00 C ATOM 376 NE ARG A 28 -11.418 1.981 4.863 1.00 0.00 N ATOM 377 CZ ARG A 28 -11.553 0.707 4.513 1.00 0.00 C ATOM 378 NH1 ARG A 28 -12.603 0.318 3.803 1.00 0.00 N ATOM 379 NH2 ARG A 28 -10.635 -0.182 4.872 1.00 0.00 N ATOM 0 H ARG A 28 -12.531 4.489 0.128 1.00 0.00 H new ATOM 0 HA ARG A 28 -9.750 4.516 1.010 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -10.214 3.631 3.193 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.114 5.125 3.029 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -13.189 3.983 2.768 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -12.405 2.451 2.440 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -12.177 3.918 5.097 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -13.385 2.691 4.772 1.00 0.00 H new ATOM 0 HE ARG A 28 -10.598 2.247 5.408 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -13.310 0.998 3.524 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -12.704 -0.661 3.536 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -9.825 0.113 5.417 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -10.740 -1.160 4.603 1.00 0.00 H new ATOM 393 N PHE A 29 -9.660 2.003 0.675 1.00 0.00 N ATOM 394 CA PHE A 29 -9.569 0.635 0.179 1.00 0.00 C ATOM 395 C PHE A 29 -9.548 -0.362 1.334 1.00 0.00 C ATOM 396 O PHE A 29 -9.677 0.016 2.497 1.00 0.00 O ATOM 397 CB PHE A 29 -8.314 0.463 -0.680 1.00 0.00 C ATOM 398 CG PHE A 29 -8.204 1.473 -1.787 1.00 0.00 C ATOM 399 CD1 PHE A 29 -7.825 2.778 -1.517 1.00 0.00 C ATOM 400 CD2 PHE A 29 -8.478 1.116 -3.098 1.00 0.00 C ATOM 401 CE1 PHE A 29 -7.723 3.709 -2.533 1.00 0.00 C ATOM 402 CE2 PHE A 29 -8.377 2.043 -4.119 1.00 0.00 C ATOM 403 CZ PHE A 29 -7.998 3.340 -3.836 1.00 0.00 C ATOM 0 H PHE A 29 -8.790 2.370 1.061 1.00 0.00 H new ATOM 0 HA PHE A 29 -10.449 0.438 -0.433 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -7.433 0.537 -0.042 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -8.312 -0.538 -1.111 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -7.607 3.071 -0.501 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -8.774 0.102 -3.325 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -7.429 4.724 -2.309 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -8.594 1.753 -5.136 1.00 0.00 H new ATOM 0 HZ PHE A 29 -7.917 4.065 -4.632 1.00 0.00 H new ATOM 413 N GLY A 30 -9.384 -1.639 1.003 1.00 0.00 N ATOM 414 CA GLY A 30 -9.349 -2.671 2.023 1.00 0.00 C ATOM 415 C GLY A 30 -8.146 -3.583 1.884 1.00 0.00 C ATOM 416 O GLY A 30 -8.289 -4.774 1.608 1.00 0.00 O ATOM 0 H GLY A 30 -9.275 -1.977 0.047 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -9.335 -2.204 3.008 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.261 -3.266 1.965 1.00 0.00 H new ATOM 420 N PHE A 31 -6.956 -3.023 2.076 1.00 0.00 N ATOM 421 CA PHE A 31 -5.723 -3.793 1.968 1.00 0.00 C ATOM 422 C PHE A 31 -4.589 -3.114 2.732 1.00 0.00 C ATOM 423 O PHE A 31 -4.318 -1.930 2.538 1.00 0.00 O ATOM 424 CB PHE A 31 -5.331 -3.966 0.500 1.00 0.00 C ATOM 425 CG PHE A 31 -4.733 -2.731 -0.111 1.00 0.00 C ATOM 426 CD1 PHE A 31 -3.431 -2.357 0.183 1.00 0.00 C ATOM 427 CD2 PHE A 31 -5.472 -1.943 -0.978 1.00 0.00 C ATOM 428 CE1 PHE A 31 -2.877 -1.222 -0.377 1.00 0.00 C ATOM 429 CE2 PHE A 31 -4.924 -0.806 -1.541 1.00 0.00 C ATOM 430 CZ PHE A 31 -3.625 -0.444 -1.240 1.00 0.00 C ATOM 0 H PHE A 31 -6.820 -2.039 2.307 1.00 0.00 H new ATOM 0 HA PHE A 31 -5.898 -4.775 2.408 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.616 -4.785 0.417 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -6.213 -4.254 -0.072 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -2.842 -2.960 0.858 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -6.488 -2.220 -1.217 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.861 -0.943 -0.141 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -5.511 -0.201 -2.216 1.00 0.00 H new ATOM 0 HZ PHE A 31 -3.195 0.445 -1.678 1.00 0.00 H new ATOM 440 N ASN A 32 -3.932 -3.874 3.602 1.00 0.00 N ATOM 441 CA ASN A 32 -2.828 -3.346 4.397 1.00 0.00 C ATOM 442 C ASN A 32 -1.488 -3.841 3.862 1.00 0.00 C ATOM 443 O ASN A 32 -1.357 -4.996 3.456 1.00 0.00 O ATOM 444 CB ASN A 32 -2.988 -3.754 5.863 1.00 0.00 C ATOM 445 CG ASN A 32 -2.194 -2.864 6.800 1.00 0.00 C ATOM 446 OD1 ASN A 32 -1.890 -1.716 6.475 1.00 0.00 O ATOM 447 ND2 ASN A 32 -1.854 -3.392 7.970 1.00 0.00 N ATOM 0 H ASN A 32 -4.144 -4.857 3.775 1.00 0.00 H new ATOM 0 HA ASN A 32 -2.848 -2.259 4.326 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -4.043 -3.715 6.135 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -2.665 -4.788 5.987 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -1.319 -2.842 8.642 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -2.128 -4.348 8.197 1.00 0.00 H new ATOM 454 N VAL A 33 -0.493 -2.959 3.866 1.00 0.00 N ATOM 455 CA VAL A 33 0.838 -3.305 3.383 1.00 0.00 C ATOM 456 C VAL A 33 1.866 -3.230 4.506 1.00 0.00 C ATOM 457 O VAL A 33 1.675 -2.517 5.492 1.00 0.00 O ATOM 458 CB VAL A 33 1.278 -2.377 2.235 1.00 0.00 C ATOM 459 CG1 VAL A 33 0.367 -2.549 1.030 1.00 0.00 C ATOM 460 CG2 VAL A 33 1.295 -0.928 2.699 1.00 0.00 C ATOM 0 H VAL A 33 -0.584 -1.999 4.199 1.00 0.00 H new ATOM 0 HA VAL A 33 0.784 -4.328 3.011 1.00 0.00 H new ATOM 0 HB VAL A 33 2.290 -2.651 1.937 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.694 -1.885 0.229 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.411 -3.582 0.685 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.657 -2.303 1.310 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.608 -0.286 1.876 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.296 -0.639 3.025 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.993 -0.820 3.529 1.00 0.00 H new ATOM 470 N LYS A 34 2.959 -3.970 4.351 1.00 0.00 N ATOM 471 CA LYS A 34 4.021 -3.987 5.350 1.00 0.00 C ATOM 472 C LYS A 34 5.390 -4.093 4.687 1.00 0.00 C ATOM 473 O LYS A 34 5.550 -4.773 3.675 1.00 0.00 O ATOM 474 CB LYS A 34 3.819 -5.154 6.318 1.00 0.00 C ATOM 475 CG LYS A 34 4.000 -6.517 5.673 1.00 0.00 C ATOM 476 CD LYS A 34 4.342 -7.581 6.704 1.00 0.00 C ATOM 477 CE LYS A 34 4.722 -8.897 6.042 1.00 0.00 C ATOM 478 NZ LYS A 34 5.526 -9.762 6.949 1.00 0.00 N ATOM 0 H LYS A 34 3.132 -4.566 3.542 1.00 0.00 H new ATOM 0 HA LYS A 34 3.978 -3.050 5.906 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.523 -5.056 7.144 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.817 -5.093 6.744 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.086 -6.797 5.149 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.792 -6.465 4.926 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.167 -7.234 7.326 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.489 -7.737 7.364 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.818 -9.427 5.742 1.00 0.00 H new ATOM 0 HE3 LYS A 34 5.290 -8.696 5.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 5.765 -10.649 6.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 6.401 -9.267 7.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 4.974 -9.975 7.805 1.00 0.00 H new ATOM 492 N GLY A 35 6.378 -3.416 5.266 1.00 0.00 N ATOM 493 CA GLY A 35 7.721 -3.449 4.719 1.00 0.00 C ATOM 494 C GLY A 35 8.093 -2.157 4.017 1.00 0.00 C ATOM 495 O GLY A 35 7.221 -1.388 3.616 1.00 0.00 O ATOM 0 H GLY A 35 6.271 -2.845 6.105 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.433 -3.640 5.522 1.00 0.00 H new ATOM 0 HA3 GLY A 35 7.803 -4.278 4.016 1.00 0.00 H new ATOM 499 N GLY A 36 9.393 -1.918 3.871 1.00 0.00 N ATOM 500 CA GLY A 36 9.855 -0.709 3.215 1.00 0.00 C ATOM 501 C GLY A 36 11.320 -0.427 3.484 1.00 0.00 C ATOM 502 O GLY A 36 12.011 -1.235 4.106 1.00 0.00 O ATOM 0 H GLY A 36 10.134 -2.540 4.195 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.697 -0.799 2.140 1.00 0.00 H new ATOM 0 HA3 GLY A 36 9.257 0.136 3.555 1.00 0.00 H new ATOM 506 N TYR A 37 11.796 0.720 3.014 1.00 0.00 N ATOM 507 CA TYR A 37 13.190 1.105 3.205 1.00 0.00 C ATOM 508 C TYR A 37 13.530 1.204 4.689 1.00 0.00 C ATOM 509 O TYR A 37 14.660 0.939 5.097 1.00 0.00 O ATOM 510 CB TYR A 37 13.471 2.441 2.515 1.00 0.00 C ATOM 511 CG TYR A 37 14.904 2.903 2.652 1.00 0.00 C ATOM 512 CD1 TYR A 37 15.936 2.229 2.012 1.00 0.00 C ATOM 513 CD2 TYR A 37 15.224 4.015 3.421 1.00 0.00 C ATOM 514 CE1 TYR A 37 17.247 2.648 2.136 1.00 0.00 C ATOM 515 CE2 TYR A 37 16.532 4.442 3.549 1.00 0.00 C ATOM 516 CZ TYR A 37 17.540 3.755 2.905 1.00 0.00 C ATOM 517 OH TYR A 37 18.844 4.176 3.029 1.00 0.00 O ATOM 0 H TYR A 37 11.238 1.400 2.498 1.00 0.00 H new ATOM 0 HA TYR A 37 13.818 0.334 2.758 1.00 0.00 H new ATOM 0 HB2 TYR A 37 13.226 2.352 1.457 1.00 0.00 H new ATOM 0 HB3 TYR A 37 12.811 3.202 2.932 1.00 0.00 H new ATOM 0 HD1 TYR A 37 15.710 1.363 1.407 1.00 0.00 H new ATOM 0 HD2 TYR A 37 14.437 4.555 3.927 1.00 0.00 H new ATOM 0 HE1 TYR A 37 18.038 2.111 1.633 1.00 0.00 H new ATOM 0 HE2 TYR A 37 16.764 5.309 4.150 1.00 0.00 H new ATOM 0 HH TYR A 37 18.878 4.969 3.603 1.00 0.00 H new ATOM 527 N ASP A 38 12.542 1.587 5.491 1.00 0.00 N ATOM 528 CA ASP A 38 12.735 1.720 6.930 1.00 0.00 C ATOM 529 C ASP A 38 13.255 0.418 7.532 1.00 0.00 C ATOM 530 O ASP A 38 14.142 0.429 8.384 1.00 0.00 O ATOM 531 CB ASP A 38 11.422 2.121 7.606 1.00 0.00 C ATOM 532 CG ASP A 38 11.442 1.872 9.102 1.00 0.00 C ATOM 533 OD1 ASP A 38 12.429 2.269 9.756 1.00 0.00 O ATOM 534 OD2 ASP A 38 10.471 1.281 9.617 1.00 0.00 O ATOM 0 H ASP A 38 11.600 1.811 5.169 1.00 0.00 H new ATOM 0 HA ASP A 38 13.477 2.500 7.102 1.00 0.00 H new ATOM 0 HB2 ASP A 38 11.228 3.177 7.419 1.00 0.00 H new ATOM 0 HB3 ASP A 38 10.600 1.562 7.158 1.00 0.00 H new ATOM 539 N GLN A 39 12.695 -0.700 7.082 1.00 0.00 N ATOM 540 CA GLN A 39 13.102 -2.010 7.578 1.00 0.00 C ATOM 541 C GLN A 39 13.858 -2.787 6.506 1.00 0.00 C ATOM 542 O GLN A 39 13.855 -4.018 6.498 1.00 0.00 O ATOM 543 CB GLN A 39 11.879 -2.807 8.036 1.00 0.00 C ATOM 544 CG GLN A 39 11.518 -2.583 9.496 1.00 0.00 C ATOM 545 CD GLN A 39 12.260 -3.517 10.431 1.00 0.00 C ATOM 546 OE1 GLN A 39 12.794 -4.542 10.008 1.00 0.00 O ATOM 547 NE2 GLN A 39 12.296 -3.167 11.712 1.00 0.00 N ATOM 0 H GLN A 39 11.959 -0.725 6.376 1.00 0.00 H new ATOM 0 HA GLN A 39 13.768 -1.859 8.428 1.00 0.00 H new ATOM 0 HB2 GLN A 39 11.026 -2.537 7.414 1.00 0.00 H new ATOM 0 HB3 GLN A 39 12.067 -3.869 7.876 1.00 0.00 H new ATOM 0 HG2 GLN A 39 11.741 -1.551 9.767 1.00 0.00 H new ATOM 0 HG3 GLN A 39 10.445 -2.722 9.626 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.839 -2.308 12.019 1.00 0.00 H new ATOM 0 HE22 GLN A 39 12.780 -3.757 12.389 1.00 0.00 H new ATOM 556 N LYS A 40 14.505 -2.060 5.601 1.00 0.00 N ATOM 557 CA LYS A 40 15.267 -2.680 4.524 1.00 0.00 C ATOM 558 C LYS A 40 14.563 -3.931 4.009 1.00 0.00 C ATOM 559 O LYS A 40 15.208 -4.918 3.658 1.00 0.00 O ATOM 560 CB LYS A 40 16.675 -3.037 5.007 1.00 0.00 C ATOM 561 CG LYS A 40 17.688 -1.925 4.802 1.00 0.00 C ATOM 562 CD LYS A 40 18.776 -1.959 5.863 1.00 0.00 C ATOM 563 CE LYS A 40 19.950 -2.823 5.430 1.00 0.00 C ATOM 564 NZ LYS A 40 19.656 -4.275 5.582 1.00 0.00 N ATOM 0 H LYS A 40 14.517 -1.040 5.592 1.00 0.00 H new ATOM 0 HA LYS A 40 15.341 -1.963 3.706 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.634 -3.289 6.067 1.00 0.00 H new ATOM 0 HB3 LYS A 40 17.015 -3.929 4.481 1.00 0.00 H new ATOM 0 HG2 LYS A 40 18.139 -2.020 3.814 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.181 -0.960 4.830 1.00 0.00 H new ATOM 0 HD2 LYS A 40 19.123 -0.945 6.062 1.00 0.00 H new ATOM 0 HD3 LYS A 40 18.364 -2.344 6.796 1.00 0.00 H new ATOM 0 HE2 LYS A 40 20.194 -2.609 4.389 1.00 0.00 H new ATOM 0 HE3 LYS A 40 20.828 -2.566 6.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 20.547 -4.812 5.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 19.161 -4.437 6.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 19.055 -4.592 4.795 1.00 0.00 H new ATOM 578 N MET A 41 13.235 -3.882 3.966 1.00 0.00 N ATOM 579 CA MET A 41 12.444 -5.011 3.491 1.00 0.00 C ATOM 580 C MET A 41 11.451 -4.568 2.422 1.00 0.00 C ATOM 581 O MET A 41 11.033 -3.411 2.370 1.00 0.00 O ATOM 582 CB MET A 41 11.698 -5.665 4.657 1.00 0.00 C ATOM 583 CG MET A 41 10.365 -5.007 4.970 1.00 0.00 C ATOM 584 SD MET A 41 9.374 -5.964 6.134 1.00 0.00 S ATOM 585 CE MET A 41 8.371 -6.931 5.009 1.00 0.00 C ATOM 0 H MET A 41 12.685 -3.073 4.254 1.00 0.00 H new ATOM 0 HA MET A 41 13.125 -5.739 3.050 1.00 0.00 H new ATOM 0 HB2 MET A 41 11.529 -6.717 4.426 1.00 0.00 H new ATOM 0 HB3 MET A 41 12.328 -5.631 5.546 1.00 0.00 H new ATOM 0 HG2 MET A 41 10.542 -4.013 5.381 1.00 0.00 H new ATOM 0 HG3 MET A 41 9.804 -4.874 4.045 1.00 0.00 H new ATOM 0 HE1 MET A 41 8.196 -7.919 5.435 1.00 0.00 H new ATOM 0 HE2 MET A 41 7.416 -6.430 4.851 1.00 0.00 H new ATOM 0 HE3 MET A 41 8.889 -7.034 4.056 1.00 0.00 H new ATOM 595 N PRO A 42 11.063 -5.508 1.547 1.00 0.00 N ATOM 596 CA PRO A 42 10.115 -5.236 0.463 1.00 0.00 C ATOM 597 C PRO A 42 8.700 -4.993 0.977 1.00 0.00 C ATOM 598 O PRO A 42 8.345 -5.424 2.075 1.00 0.00 O ATOM 599 CB PRO A 42 10.164 -6.513 -0.380 1.00 0.00 C ATOM 600 CG PRO A 42 10.597 -7.577 0.569 1.00 0.00 C ATOM 601 CD PRO A 42 11.521 -6.907 1.549 1.00 0.00 C ATOM 0 HA PRO A 42 10.376 -4.333 -0.089 1.00 0.00 H new ATOM 0 HB2 PRO A 42 9.189 -6.740 -0.811 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.864 -6.413 -1.209 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.740 -8.017 1.079 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.105 -8.385 0.043 1.00 0.00 H new ATOM 0 HD2 PRO A 42 11.447 -7.353 2.541 1.00 0.00 H new ATOM 0 HD3 PRO A 42 12.563 -6.989 1.240 1.00 0.00 H new ATOM 609 N VAL A 43 7.896 -4.299 0.178 1.00 0.00 N ATOM 610 CA VAL A 43 6.519 -4.000 0.553 1.00 0.00 C ATOM 611 C VAL A 43 5.566 -5.080 0.053 1.00 0.00 C ATOM 612 O VAL A 43 5.414 -5.278 -1.153 1.00 0.00 O ATOM 613 CB VAL A 43 6.069 -2.636 -0.005 1.00 0.00 C ATOM 614 CG1 VAL A 43 4.669 -2.295 0.481 1.00 0.00 C ATOM 615 CG2 VAL A 43 7.058 -1.548 0.387 1.00 0.00 C ATOM 0 H VAL A 43 8.174 -3.933 -0.733 1.00 0.00 H new ATOM 0 HA VAL A 43 6.488 -3.968 1.642 1.00 0.00 H new ATOM 0 HB VAL A 43 6.044 -2.699 -1.093 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.369 -1.328 0.077 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.971 -3.062 0.145 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.663 -2.250 1.570 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.725 -0.591 -0.015 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.117 -1.484 1.474 1.00 0.00 H new ATOM 0 HG23 VAL A 43 8.042 -1.788 -0.016 1.00 0.00 H new ATOM 625 N ILE A 44 4.926 -5.775 0.987 1.00 0.00 N ATOM 626 CA ILE A 44 3.986 -6.834 0.641 1.00 0.00 C ATOM 627 C ILE A 44 2.700 -6.714 1.451 1.00 0.00 C ATOM 628 O ILE A 44 2.733 -6.471 2.658 1.00 0.00 O ATOM 629 CB ILE A 44 4.598 -8.228 0.875 1.00 0.00 C ATOM 630 CG1 ILE A 44 5.861 -8.403 0.029 1.00 0.00 C ATOM 631 CG2 ILE A 44 3.583 -9.313 0.551 1.00 0.00 C ATOM 632 CD1 ILE A 44 7.123 -7.939 0.724 1.00 0.00 C ATOM 0 H ILE A 44 5.041 -5.624 1.989 1.00 0.00 H new ATOM 0 HA ILE A 44 3.757 -6.719 -0.419 1.00 0.00 H new ATOM 0 HB ILE A 44 4.872 -8.316 1.926 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.968 -9.455 -0.237 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.744 -7.849 -0.903 1.00 0.00 H new ATOM 0 HG21 ILE A 44 4.030 -10.292 0.721 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.709 -9.197 1.192 1.00 0.00 H new ATOM 0 HG23 ILE A 44 3.281 -9.229 -0.493 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.978 -8.093 0.066 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.037 -6.880 0.966 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.264 -8.510 1.642 1.00 0.00 H new ATOM 644 N VAL A 45 1.566 -6.887 0.780 1.00 0.00 N ATOM 645 CA VAL A 45 0.267 -6.801 1.437 1.00 0.00 C ATOM 646 C VAL A 45 0.217 -7.692 2.674 1.00 0.00 C ATOM 647 O VAL A 45 0.288 -8.916 2.573 1.00 0.00 O ATOM 648 CB VAL A 45 -0.873 -7.203 0.482 1.00 0.00 C ATOM 649 CG1 VAL A 45 -2.196 -7.271 1.229 1.00 0.00 C ATOM 650 CG2 VAL A 45 -0.958 -6.230 -0.684 1.00 0.00 C ATOM 0 H VAL A 45 1.520 -7.088 -0.219 1.00 0.00 H new ATOM 0 HA VAL A 45 0.131 -5.761 1.735 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.658 -8.194 0.083 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -2.990 -7.556 0.538 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -2.126 -8.011 2.027 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.422 -6.295 1.658 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.768 -6.529 -1.349 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.150 -5.226 -0.307 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.017 -6.237 -1.233 1.00 0.00 H new ATOM 660 N SER A 46 0.095 -7.067 3.841 1.00 0.00 N ATOM 661 CA SER A 46 0.038 -7.803 5.099 1.00 0.00 C ATOM 662 C SER A 46 -1.262 -8.594 5.208 1.00 0.00 C ATOM 663 O SER A 46 -1.249 -9.823 5.281 1.00 0.00 O ATOM 664 CB SER A 46 0.164 -6.841 6.282 1.00 0.00 C ATOM 665 OG SER A 46 -0.402 -5.579 5.976 1.00 0.00 O ATOM 0 H SER A 46 0.034 -6.054 3.942 1.00 0.00 H new ATOM 0 HA SER A 46 0.872 -8.505 5.119 1.00 0.00 H new ATOM 0 HB2 SER A 46 -0.334 -7.265 7.154 1.00 0.00 H new ATOM 0 HB3 SER A 46 1.215 -6.718 6.544 1.00 0.00 H new ATOM 0 HG SER A 46 -0.172 -4.938 6.680 1.00 0.00 H new ATOM 671 N ARG A 47 -2.382 -7.880 5.218 1.00 0.00 N ATOM 672 CA ARG A 47 -3.691 -8.514 5.319 1.00 0.00 C ATOM 673 C ARG A 47 -4.735 -7.736 4.524 1.00 0.00 C ATOM 674 O ARG A 47 -4.651 -6.514 4.397 1.00 0.00 O ATOM 675 CB ARG A 47 -4.121 -8.615 6.784 1.00 0.00 C ATOM 676 CG ARG A 47 -5.013 -9.810 7.077 1.00 0.00 C ATOM 677 CD ARG A 47 -6.484 -9.461 6.913 1.00 0.00 C ATOM 678 NE ARG A 47 -6.993 -8.693 8.046 1.00 0.00 N ATOM 679 CZ ARG A 47 -7.389 -9.244 9.189 1.00 0.00 C ATOM 680 NH1 ARG A 47 -7.333 -10.559 9.349 1.00 0.00 N ATOM 681 NH2 ARG A 47 -7.841 -8.479 10.174 1.00 0.00 N ATOM 0 H ARG A 47 -2.410 -6.862 5.157 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.614 -9.517 4.900 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.232 -8.674 7.411 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.648 -7.702 7.063 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -4.756 -10.630 6.407 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.832 -10.160 8.093 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.621 -8.888 5.996 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.064 -10.377 6.806 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.048 -7.679 7.955 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -6.985 -11.150 8.594 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -7.637 -10.979 10.227 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.885 -7.467 10.055 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -8.145 -8.903 11.051 1.00 0.00 H new ATOM 695 N VAL A 48 -5.720 -8.452 3.990 1.00 0.00 N ATOM 696 CA VAL A 48 -6.781 -7.829 3.208 1.00 0.00 C ATOM 697 C VAL A 48 -8.153 -8.153 3.787 1.00 0.00 C ATOM 698 O VAL A 48 -8.541 -9.317 3.879 1.00 0.00 O ATOM 699 CB VAL A 48 -6.736 -8.285 1.738 1.00 0.00 C ATOM 700 CG1 VAL A 48 -7.860 -7.638 0.943 1.00 0.00 C ATOM 701 CG2 VAL A 48 -5.383 -7.964 1.122 1.00 0.00 C ATOM 0 H VAL A 48 -5.805 -9.464 4.085 1.00 0.00 H new ATOM 0 HA VAL A 48 -6.616 -6.752 3.252 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.877 -9.365 1.707 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.812 -7.972 -0.093 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -8.820 -7.924 1.372 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -7.754 -6.554 0.980 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.369 -8.293 0.083 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.210 -6.889 1.164 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.599 -8.480 1.677 1.00 0.00 H new ATOM 711 N ALA A 49 -8.885 -7.114 4.177 1.00 0.00 N ATOM 712 CA ALA A 49 -10.216 -7.287 4.745 1.00 0.00 C ATOM 713 C ALA A 49 -11.243 -7.588 3.658 1.00 0.00 C ATOM 714 O ALA A 49 -11.177 -7.062 2.546 1.00 0.00 O ATOM 715 CB ALA A 49 -10.621 -6.047 5.528 1.00 0.00 C ATOM 0 H ALA A 49 -8.578 -6.144 4.110 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.186 -8.139 5.425 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -11.617 -6.190 5.947 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -9.909 -5.878 6.336 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -10.628 -5.183 4.863 1.00 0.00 H new ATOM 721 N PRO A 50 -12.214 -8.454 3.983 1.00 0.00 N ATOM 722 CA PRO A 50 -13.272 -8.844 3.047 1.00 0.00 C ATOM 723 C PRO A 50 -14.247 -7.705 2.767 1.00 0.00 C ATOM 724 O PRO A 50 -14.176 -6.646 3.390 1.00 0.00 O ATOM 725 CB PRO A 50 -13.983 -9.989 3.772 1.00 0.00 C ATOM 726 CG PRO A 50 -13.719 -9.744 5.218 1.00 0.00 C ATOM 727 CD PRO A 50 -12.353 -9.119 5.289 1.00 0.00 C ATOM 0 HA PRO A 50 -12.871 -9.122 2.072 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.052 -9.989 3.559 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -13.595 -10.958 3.457 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -14.473 -9.084 5.646 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -13.752 -10.675 5.784 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.279 -8.408 6.112 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -11.576 -9.868 5.443 1.00 0.00 H new ATOM 735 N GLY A 51 -15.159 -7.930 1.825 1.00 0.00 N ATOM 736 CA GLY A 51 -16.135 -6.913 1.480 1.00 0.00 C ATOM 737 C GLY A 51 -15.494 -5.574 1.176 1.00 0.00 C ATOM 738 O GLY A 51 -15.950 -4.535 1.654 1.00 0.00 O ATOM 0 H GLY A 51 -15.239 -8.798 1.295 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -16.708 -7.243 0.614 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.840 -6.796 2.303 1.00 0.00 H new ATOM 742 N THR A 52 -14.431 -5.596 0.378 1.00 0.00 N ATOM 743 CA THR A 52 -13.724 -4.374 0.012 1.00 0.00 C ATOM 744 C THR A 52 -13.485 -4.307 -1.492 1.00 0.00 C ATOM 745 O THR A 52 -13.444 -5.324 -2.184 1.00 0.00 O ATOM 746 CB THR A 52 -12.371 -4.269 0.741 1.00 0.00 C ATOM 747 OG1 THR A 52 -11.693 -5.529 0.701 1.00 0.00 O ATOM 748 CG2 THR A 52 -12.568 -3.839 2.187 1.00 0.00 C ATOM 0 H THR A 52 -14.040 -6.447 -0.027 1.00 0.00 H new ATOM 0 HA THR A 52 -14.357 -3.539 0.314 1.00 0.00 H new ATOM 0 HB THR A 52 -11.767 -3.517 0.233 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.820 -5.996 1.553 1.00 0.00 H new ATOM 0 HG21 THR A 52 -11.599 -3.772 2.682 1.00 0.00 H new ATOM 0 HG22 THR A 52 -13.058 -2.865 2.214 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.189 -4.571 2.703 1.00 0.00 H new ATOM 756 N PRO A 53 -13.322 -3.081 -2.011 1.00 0.00 N ATOM 757 CA PRO A 53 -13.083 -2.852 -3.439 1.00 0.00 C ATOM 758 C PRO A 53 -11.703 -3.328 -3.879 1.00 0.00 C ATOM 759 O PRO A 53 -11.384 -3.323 -5.068 1.00 0.00 O ATOM 760 CB PRO A 53 -13.193 -1.331 -3.578 1.00 0.00 C ATOM 761 CG PRO A 53 -12.857 -0.802 -2.227 1.00 0.00 C ATOM 762 CD PRO A 53 -13.359 -1.824 -1.245 1.00 0.00 C ATOM 0 HA PRO A 53 -13.786 -3.403 -4.063 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.505 -0.952 -4.334 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -14.196 -1.033 -3.882 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.782 -0.655 -2.122 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.329 0.166 -2.058 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -12.726 -1.875 -0.359 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.368 -1.591 -0.903 1.00 0.00 H new ATOM 770 N ALA A 54 -10.888 -3.740 -2.913 1.00 0.00 N ATOM 771 CA ALA A 54 -9.543 -4.222 -3.202 1.00 0.00 C ATOM 772 C ALA A 54 -9.526 -5.738 -3.361 1.00 0.00 C ATOM 773 O ALA A 54 -8.598 -6.300 -3.943 1.00 0.00 O ATOM 774 CB ALA A 54 -8.582 -3.793 -2.103 1.00 0.00 C ATOM 0 H ALA A 54 -11.136 -3.750 -1.924 1.00 0.00 H new ATOM 0 HA ALA A 54 -9.220 -3.781 -4.145 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.581 -4.160 -2.331 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.564 -2.705 -2.039 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -8.911 -4.207 -1.150 1.00 0.00 H new ATOM 780 N ASP A 55 -10.556 -6.395 -2.840 1.00 0.00 N ATOM 781 CA ASP A 55 -10.659 -7.847 -2.925 1.00 0.00 C ATOM 782 C ASP A 55 -11.596 -8.260 -4.055 1.00 0.00 C ATOM 783 O ASP A 55 -11.180 -8.911 -5.015 1.00 0.00 O ATOM 784 CB ASP A 55 -11.156 -8.423 -1.598 1.00 0.00 C ATOM 785 CG ASP A 55 -10.702 -9.853 -1.381 1.00 0.00 C ATOM 786 OD1 ASP A 55 -9.494 -10.062 -1.144 1.00 0.00 O ATOM 787 OD2 ASP A 55 -11.554 -10.763 -1.448 1.00 0.00 O ATOM 0 H ASP A 55 -11.332 -5.945 -2.354 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.666 -8.245 -3.136 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -10.795 -7.802 -0.778 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -12.245 -8.383 -1.573 1.00 0.00 H new ATOM 792 N LEU A 56 -12.863 -7.880 -3.935 1.00 0.00 N ATOM 793 CA LEU A 56 -13.861 -8.212 -4.946 1.00 0.00 C ATOM 794 C LEU A 56 -13.334 -7.920 -6.348 1.00 0.00 C ATOM 795 O LEU A 56 -13.835 -8.458 -7.335 1.00 0.00 O ATOM 796 CB LEU A 56 -15.149 -7.424 -4.699 1.00 0.00 C ATOM 797 CG LEU A 56 -15.769 -7.571 -3.309 1.00 0.00 C ATOM 798 CD1 LEU A 56 -16.515 -6.304 -2.921 1.00 0.00 C ATOM 799 CD2 LEU A 56 -16.698 -8.775 -3.264 1.00 0.00 C ATOM 0 H LEU A 56 -13.224 -7.342 -3.147 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.075 -9.278 -4.873 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.944 -6.368 -4.874 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.888 -7.732 -5.439 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.966 -7.730 -2.589 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -16.950 -6.427 -1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -15.822 -5.462 -2.912 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.308 -6.113 -3.644 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.130 -8.864 -2.267 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.496 -8.646 -3.995 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -16.134 -9.678 -3.497 1.00 0.00 H new ATOM 811 N CYS A 57 -12.320 -7.066 -6.426 1.00 0.00 N ATOM 812 CA CYS A 57 -11.723 -6.703 -7.707 1.00 0.00 C ATOM 813 C CYS A 57 -10.984 -7.889 -8.318 1.00 0.00 C ATOM 814 O CYS A 57 -10.754 -8.900 -7.654 1.00 0.00 O ATOM 815 CB CYS A 57 -10.764 -5.524 -7.531 1.00 0.00 C ATOM 816 SG CYS A 57 -9.108 -5.996 -6.981 1.00 0.00 S ATOM 0 H CYS A 57 -11.894 -6.612 -5.618 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.526 -6.411 -8.384 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -10.682 -4.991 -8.478 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -11.190 -4.827 -6.809 1.00 0.00 H new ATOM 0 HG CYS A 57 -9.123 -6.216 -5.700 1.00 0.00 H new ATOM 822 N VAL A 58 -10.614 -7.759 -9.588 1.00 0.00 N ATOM 823 CA VAL A 58 -9.901 -8.820 -10.289 1.00 0.00 C ATOM 824 C VAL A 58 -8.696 -8.267 -11.043 1.00 0.00 C ATOM 825 O VAL A 58 -8.797 -7.307 -11.806 1.00 0.00 O ATOM 826 CB VAL A 58 -10.822 -9.553 -11.282 1.00 0.00 C ATOM 827 CG1 VAL A 58 -11.700 -8.561 -12.029 1.00 0.00 C ATOM 828 CG2 VAL A 58 -10.000 -10.387 -12.254 1.00 0.00 C ATOM 0 H VAL A 58 -10.796 -6.929 -10.152 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.560 -9.526 -9.532 1.00 0.00 H new ATOM 0 HB VAL A 58 -11.471 -10.225 -10.720 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -12.344 -9.098 -12.726 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -12.315 -8.011 -11.317 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -11.071 -7.862 -12.581 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -10.666 -10.898 -12.949 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -9.325 -9.737 -12.811 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -9.419 -11.124 -11.700 1.00 0.00 H new ATOM 838 N PRO A 59 -7.527 -8.887 -10.825 1.00 0.00 N ATOM 839 CA PRO A 59 -7.394 -10.031 -9.917 1.00 0.00 C ATOM 840 C PRO A 59 -7.569 -9.634 -8.455 1.00 0.00 C ATOM 841 O PRO A 59 -7.020 -8.628 -8.006 1.00 0.00 O ATOM 842 CB PRO A 59 -5.967 -10.522 -10.172 1.00 0.00 C ATOM 843 CG PRO A 59 -5.237 -9.323 -10.671 1.00 0.00 C ATOM 844 CD PRO A 59 -6.244 -8.519 -11.447 1.00 0.00 C ATOM 0 HA PRO A 59 -8.158 -10.787 -10.099 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -5.513 -10.911 -9.260 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -5.951 -11.329 -10.905 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.828 -8.743 -9.844 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -4.398 -9.612 -11.303 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -6.051 -7.449 -11.368 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -6.226 -8.768 -12.508 1.00 0.00 H new ATOM 852 N ARG A 60 -8.334 -10.431 -7.718 1.00 0.00 N ATOM 853 CA ARG A 60 -8.581 -10.162 -6.306 1.00 0.00 C ATOM 854 C ARG A 60 -7.268 -10.050 -5.537 1.00 0.00 C ATOM 855 O ARG A 60 -6.492 -11.004 -5.468 1.00 0.00 O ATOM 856 CB ARG A 60 -9.448 -11.267 -5.698 1.00 0.00 C ATOM 857 CG ARG A 60 -9.469 -11.257 -4.179 1.00 0.00 C ATOM 858 CD ARG A 60 -10.013 -12.563 -3.621 1.00 0.00 C ATOM 859 NE ARG A 60 -9.749 -12.700 -2.191 1.00 0.00 N ATOM 860 CZ ARG A 60 -9.707 -13.868 -1.560 1.00 0.00 C ATOM 861 NH1 ARG A 60 -9.910 -14.994 -2.229 1.00 0.00 N ATOM 862 NH2 ARG A 60 -9.461 -13.910 -0.257 1.00 0.00 N ATOM 0 H ARG A 60 -8.794 -11.269 -8.075 1.00 0.00 H new ATOM 0 HA ARG A 60 -9.110 -9.212 -6.230 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -10.468 -11.162 -6.068 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -9.082 -12.235 -6.042 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.460 -11.091 -3.801 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -10.082 -10.427 -3.828 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -11.087 -12.613 -3.798 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.563 -13.400 -4.154 1.00 0.00 H new ATOM 0 HE ARG A 60 -9.588 -11.852 -1.647 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -10.099 -14.965 -3.231 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.877 -15.890 -1.742 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -9.304 -13.045 0.261 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -9.429 -14.807 0.227 1.00 0.00 H new ATOM 876 N LEU A 61 -7.025 -8.878 -4.960 1.00 0.00 N ATOM 877 CA LEU A 61 -5.805 -8.640 -4.195 1.00 0.00 C ATOM 878 C LEU A 61 -5.787 -9.483 -2.924 1.00 0.00 C ATOM 879 O LEU A 61 -6.538 -9.223 -1.985 1.00 0.00 O ATOM 880 CB LEU A 61 -5.684 -7.157 -3.840 1.00 0.00 C ATOM 881 CG LEU A 61 -4.327 -6.705 -3.301 1.00 0.00 C ATOM 882 CD1 LEU A 61 -3.386 -6.359 -4.446 1.00 0.00 C ATOM 883 CD2 LEU A 61 -4.493 -5.515 -2.367 1.00 0.00 C ATOM 0 H LEU A 61 -7.656 -8.078 -5.007 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.955 -8.930 -4.813 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.912 -6.571 -4.730 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.445 -6.918 -3.097 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.891 -7.528 -2.735 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.425 -6.039 -4.043 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.242 -7.237 -5.076 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.817 -5.553 -5.040 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.517 -5.207 -1.993 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.951 -4.688 -2.909 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.130 -5.797 -1.529 1.00 0.00 H new ATOM 895 N ASN A 62 -4.921 -10.491 -2.901 1.00 0.00 N ATOM 896 CA ASN A 62 -4.803 -11.371 -1.744 1.00 0.00 C ATOM 897 C ASN A 62 -3.470 -11.159 -1.033 1.00 0.00 C ATOM 898 O ASN A 62 -2.409 -11.212 -1.655 1.00 0.00 O ATOM 899 CB ASN A 62 -4.938 -12.833 -2.173 1.00 0.00 C ATOM 900 CG ASN A 62 -4.136 -13.146 -3.422 1.00 0.00 C ATOM 901 OD1 ASN A 62 -4.824 -13.561 -4.479 1.00 0.00 O flip ATOM 902 ND2 ASN A 62 -2.912 -13.015 -3.435 1.00 0.00 N flip ATOM 0 H ASN A 62 -4.291 -10.719 -3.670 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.608 -11.127 -1.050 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -4.606 -13.479 -1.360 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.989 -13.060 -2.353 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -2.425 -12.693 -2.599 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.385 -13.228 -4.282 1.00 0.00 H new ATOM 909 N GLU A 63 -3.533 -10.919 0.273 1.00 0.00 N ATOM 910 CA GLU A 63 -2.331 -10.698 1.067 1.00 0.00 C ATOM 911 C GLU A 63 -1.171 -11.541 0.544 1.00 0.00 C ATOM 912 O GLU A 63 -1.372 -12.629 0.007 1.00 0.00 O ATOM 913 CB GLU A 63 -2.596 -11.033 2.537 1.00 0.00 C ATOM 914 CG GLU A 63 -3.450 -12.273 2.735 1.00 0.00 C ATOM 915 CD GLU A 63 -2.639 -13.554 2.691 1.00 0.00 C ATOM 916 OE1 GLU A 63 -1.816 -13.765 3.607 1.00 0.00 O ATOM 917 OE2 GLU A 63 -2.827 -14.344 1.743 1.00 0.00 O ATOM 0 H GLU A 63 -4.403 -10.873 0.803 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.060 -9.646 0.984 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.643 -11.174 3.046 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.088 -10.184 3.011 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -3.964 -12.206 3.694 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.218 -12.307 1.963 1.00 0.00 H new ATOM 924 N GLY A 64 0.045 -11.027 0.704 1.00 0.00 N ATOM 925 CA GLY A 64 1.220 -11.744 0.242 1.00 0.00 C ATOM 926 C GLY A 64 1.755 -11.197 -1.067 1.00 0.00 C ATOM 927 O GLY A 64 2.864 -11.534 -1.480 1.00 0.00 O ATOM 0 H GLY A 64 0.237 -10.128 1.145 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.999 -11.686 1.002 1.00 0.00 H new ATOM 0 HA3 GLY A 64 0.973 -12.798 0.118 1.00 0.00 H new ATOM 931 N ASP A 65 0.965 -10.353 -1.720 1.00 0.00 N ATOM 932 CA ASP A 65 1.365 -9.759 -2.991 1.00 0.00 C ATOM 933 C ASP A 65 2.365 -8.628 -2.770 1.00 0.00 C ATOM 934 O ASP A 65 2.112 -7.706 -1.995 1.00 0.00 O ATOM 935 CB ASP A 65 0.140 -9.234 -3.742 1.00 0.00 C ATOM 936 CG ASP A 65 -0.810 -8.473 -2.839 1.00 0.00 C ATOM 937 OD1 ASP A 65 -1.283 -9.061 -1.844 1.00 0.00 O ATOM 938 OD2 ASP A 65 -1.082 -7.288 -3.127 1.00 0.00 O ATOM 0 H ASP A 65 0.044 -10.064 -1.391 1.00 0.00 H new ATOM 0 HA ASP A 65 1.844 -10.533 -3.591 1.00 0.00 H new ATOM 0 HB2 ASP A 65 0.466 -8.583 -4.553 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -0.389 -10.071 -4.198 1.00 0.00 H new ATOM 943 N GLN A 66 3.501 -8.707 -3.456 1.00 0.00 N ATOM 944 CA GLN A 66 4.539 -7.690 -3.334 1.00 0.00 C ATOM 945 C GLN A 66 4.310 -6.556 -4.327 1.00 0.00 C ATOM 946 O GLN A 66 4.204 -6.784 -5.532 1.00 0.00 O ATOM 947 CB GLN A 66 5.919 -8.311 -3.558 1.00 0.00 C ATOM 948 CG GLN A 66 7.053 -7.298 -3.534 1.00 0.00 C ATOM 949 CD GLN A 66 8.420 -7.952 -3.566 1.00 0.00 C ATOM 950 OE1 GLN A 66 8.539 -9.174 -3.474 1.00 0.00 O ATOM 951 NE2 GLN A 66 9.462 -7.140 -3.698 1.00 0.00 N ATOM 0 H GLN A 66 3.726 -9.464 -4.101 1.00 0.00 H new ATOM 0 HA GLN A 66 4.493 -7.279 -2.326 1.00 0.00 H new ATOM 0 HB2 GLN A 66 6.099 -9.063 -2.790 1.00 0.00 H new ATOM 0 HB3 GLN A 66 5.924 -8.827 -4.518 1.00 0.00 H new ATOM 0 HG2 GLN A 66 6.955 -6.628 -4.388 1.00 0.00 H new ATOM 0 HG3 GLN A 66 6.969 -6.685 -2.637 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.318 -6.133 -3.771 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.407 -7.523 -3.727 1.00 0.00 H new ATOM 960 N VAL A 67 4.235 -5.332 -3.814 1.00 0.00 N ATOM 961 CA VAL A 67 4.020 -4.162 -4.656 1.00 0.00 C ATOM 962 C VAL A 67 5.335 -3.652 -5.235 1.00 0.00 C ATOM 963 O VAL A 67 6.136 -3.032 -4.535 1.00 0.00 O ATOM 964 CB VAL A 67 3.341 -3.023 -3.872 1.00 0.00 C ATOM 965 CG1 VAL A 67 2.826 -1.953 -4.822 1.00 0.00 C ATOM 966 CG2 VAL A 67 2.214 -3.569 -3.009 1.00 0.00 C ATOM 0 H VAL A 67 4.320 -5.125 -2.819 1.00 0.00 H new ATOM 0 HA VAL A 67 3.365 -4.474 -5.469 1.00 0.00 H new ATOM 0 HB VAL A 67 4.081 -2.565 -3.216 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.350 -1.157 -4.250 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.659 -1.541 -5.392 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.100 -2.393 -5.506 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.745 -2.751 -2.462 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.472 -4.053 -3.644 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.616 -4.295 -2.302 1.00 0.00 H new ATOM 976 N VAL A 68 5.552 -3.917 -6.520 1.00 0.00 N ATOM 977 CA VAL A 68 6.770 -3.483 -7.194 1.00 0.00 C ATOM 978 C VAL A 68 6.767 -1.976 -7.419 1.00 0.00 C ATOM 979 O VAL A 68 7.749 -1.291 -7.128 1.00 0.00 O ATOM 980 CB VAL A 68 6.943 -4.193 -8.550 1.00 0.00 C ATOM 981 CG1 VAL A 68 8.247 -3.772 -9.211 1.00 0.00 C ATOM 982 CG2 VAL A 68 6.890 -5.703 -8.371 1.00 0.00 C ATOM 0 H VAL A 68 4.901 -4.430 -7.114 1.00 0.00 H new ATOM 0 HA VAL A 68 7.604 -3.748 -6.544 1.00 0.00 H new ATOM 0 HB VAL A 68 6.121 -3.898 -9.202 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.352 -4.284 -10.168 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.241 -2.694 -9.375 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.084 -4.036 -8.565 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.014 -6.189 -9.339 1.00 0.00 H new ATOM 0 HG22 VAL A 68 7.690 -6.018 -7.702 1.00 0.00 H new ATOM 0 HG23 VAL A 68 5.928 -5.985 -7.944 1.00 0.00 H new ATOM 992 N LEU A 69 5.657 -1.463 -7.939 1.00 0.00 N ATOM 993 CA LEU A 69 5.525 -0.034 -8.203 1.00 0.00 C ATOM 994 C LEU A 69 4.075 0.415 -8.052 1.00 0.00 C ATOM 995 O LEU A 69 3.148 -0.317 -8.400 1.00 0.00 O ATOM 996 CB LEU A 69 6.028 0.293 -9.610 1.00 0.00 C ATOM 997 CG LEU A 69 7.517 0.051 -9.863 1.00 0.00 C ATOM 998 CD1 LEU A 69 7.782 -0.139 -11.348 1.00 0.00 C ATOM 999 CD2 LEU A 69 8.345 1.204 -9.314 1.00 0.00 C ATOM 0 H LEU A 69 4.836 -2.015 -8.186 1.00 0.00 H new ATOM 0 HA LEU A 69 6.131 0.503 -7.473 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.457 -0.299 -10.325 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.810 1.341 -9.818 1.00 0.00 H new ATOM 0 HG LEU A 69 7.811 -0.861 -9.343 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.846 -0.310 -11.509 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.218 -0.998 -11.711 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.472 0.754 -11.890 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.402 1.015 -9.503 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.049 2.131 -9.805 1.00 0.00 H new ATOM 0 HD23 LEU A 69 8.178 1.293 -8.240 1.00 0.00 H new ATOM 1011 N ILE A 70 3.887 1.624 -7.534 1.00 0.00 N ATOM 1012 CA ILE A 70 2.550 2.172 -7.341 1.00 0.00 C ATOM 1013 C ILE A 70 2.168 3.106 -8.485 1.00 0.00 C ATOM 1014 O ILE A 70 2.641 4.239 -8.559 1.00 0.00 O ATOM 1015 CB ILE A 70 2.443 2.940 -6.010 1.00 0.00 C ATOM 1016 CG1 ILE A 70 2.428 1.962 -4.833 1.00 0.00 C ATOM 1017 CG2 ILE A 70 1.195 3.810 -5.999 1.00 0.00 C ATOM 1018 CD1 ILE A 70 2.659 2.626 -3.493 1.00 0.00 C ATOM 0 H ILE A 70 4.643 2.242 -7.241 1.00 0.00 H new ATOM 0 HA ILE A 70 1.863 1.326 -7.320 1.00 0.00 H new ATOM 0 HB ILE A 70 3.314 3.588 -5.910 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.469 1.445 -4.813 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.195 1.204 -4.991 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.134 4.346 -5.052 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.244 4.526 -6.819 1.00 0.00 H new ATOM 0 HG23 ILE A 70 0.312 3.182 -6.118 1.00 0.00 H new ATOM 0 HD11 ILE A 70 2.635 1.873 -2.705 1.00 0.00 H new ATOM 0 HD12 ILE A 70 3.631 3.120 -3.494 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.877 3.364 -3.313 1.00 0.00 H new ATOM 1030 N ASN A 71 1.307 2.622 -9.374 1.00 0.00 N ATOM 1031 CA ASN A 71 0.860 3.413 -10.515 1.00 0.00 C ATOM 1032 C ASN A 71 2.042 4.076 -11.214 1.00 0.00 C ATOM 1033 O ASN A 71 1.954 5.222 -11.653 1.00 0.00 O ATOM 1034 CB ASN A 71 -0.142 4.477 -10.062 1.00 0.00 C ATOM 1035 CG ASN A 71 0.483 5.502 -9.135 1.00 0.00 C ATOM 1036 OD1 ASN A 71 1.382 6.245 -9.530 1.00 0.00 O ATOM 1037 ND2 ASN A 71 0.008 5.547 -7.896 1.00 0.00 N ATOM 0 H ASN A 71 0.905 1.686 -9.326 1.00 0.00 H new ATOM 0 HA ASN A 71 0.373 2.742 -11.223 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -0.550 4.983 -10.937 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -0.977 3.994 -9.555 1.00 0.00 H new ATOM 0 HD21 ASN A 71 0.389 6.217 -7.228 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -0.738 4.912 -7.612 1.00 0.00 H new ATOM 1044 N GLY A 72 3.150 3.347 -11.313 1.00 0.00 N ATOM 1045 CA GLY A 72 4.334 3.880 -11.960 1.00 0.00 C ATOM 1046 C GLY A 72 5.106 4.829 -11.064 1.00 0.00 C ATOM 1047 O GLY A 72 5.528 5.900 -11.500 1.00 0.00 O ATOM 0 H GLY A 72 3.248 2.396 -10.956 1.00 0.00 H new ATOM 0 HA2 GLY A 72 4.984 3.057 -12.258 1.00 0.00 H new ATOM 0 HA3 GLY A 72 4.043 4.402 -12.872 1.00 0.00 H new ATOM 1051 N ARG A 73 5.291 4.435 -9.808 1.00 0.00 N ATOM 1052 CA ARG A 73 6.016 5.259 -8.848 1.00 0.00 C ATOM 1053 C ARG A 73 6.963 4.409 -8.007 1.00 0.00 C ATOM 1054 O ARG A 73 6.538 3.470 -7.333 1.00 0.00 O ATOM 1055 CB ARG A 73 5.035 6.000 -7.938 1.00 0.00 C ATOM 1056 CG ARG A 73 4.195 7.039 -8.664 1.00 0.00 C ATOM 1057 CD ARG A 73 4.876 8.398 -8.674 1.00 0.00 C ATOM 1058 NE ARG A 73 5.849 8.515 -9.757 1.00 0.00 N ATOM 1059 CZ ARG A 73 5.518 8.762 -11.019 1.00 0.00 C ATOM 1060 NH1 ARG A 73 4.245 8.919 -11.356 1.00 0.00 N ATOM 1061 NH2 ARG A 73 6.462 8.854 -11.948 1.00 0.00 N ATOM 0 H ARG A 73 4.949 3.551 -9.432 1.00 0.00 H new ATOM 0 HA ARG A 73 6.607 5.987 -9.405 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.372 5.275 -7.466 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.592 6.490 -7.139 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.017 6.713 -9.689 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.221 7.122 -8.182 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.123 9.180 -8.777 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.376 8.560 -7.719 1.00 0.00 H new ATOM 0 HE ARG A 73 6.837 8.401 -9.531 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.517 8.850 -10.645 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.994 9.109 -12.326 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.442 8.735 -11.693 1.00 0.00 H new ATOM 0 HH22 ARG A 73 6.207 9.044 -12.917 1.00 0.00 H new ATOM 1075 N ASP A 74 8.248 4.744 -8.053 1.00 0.00 N ATOM 1076 CA ASP A 74 9.256 4.011 -7.295 1.00 0.00 C ATOM 1077 C ASP A 74 9.063 4.215 -5.796 1.00 0.00 C ATOM 1078 O ASP A 74 9.238 5.320 -5.282 1.00 0.00 O ATOM 1079 CB ASP A 74 10.659 4.460 -7.707 1.00 0.00 C ATOM 1080 CG ASP A 74 11.734 3.496 -7.243 1.00 0.00 C ATOM 1081 OD1 ASP A 74 11.512 2.271 -7.334 1.00 0.00 O ATOM 1082 OD2 ASP A 74 12.798 3.968 -6.789 1.00 0.00 O ATOM 0 H ASP A 74 8.616 5.518 -8.607 1.00 0.00 H new ATOM 0 HA ASP A 74 9.142 2.950 -7.516 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.703 4.555 -8.792 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.858 5.448 -7.293 1.00 0.00 H new ATOM 1087 N ILE A 75 8.700 3.142 -5.100 1.00 0.00 N ATOM 1088 CA ILE A 75 8.484 3.204 -3.660 1.00 0.00 C ATOM 1089 C ILE A 75 9.216 2.074 -2.945 1.00 0.00 C ATOM 1090 O ILE A 75 8.971 1.808 -1.769 1.00 0.00 O ATOM 1091 CB ILE A 75 6.985 3.129 -3.313 1.00 0.00 C ATOM 1092 CG1 ILE A 75 6.359 1.874 -3.925 1.00 0.00 C ATOM 1093 CG2 ILE A 75 6.266 4.378 -3.800 1.00 0.00 C ATOM 1094 CD1 ILE A 75 6.510 0.641 -3.061 1.00 0.00 C ATOM 0 H ILE A 75 8.550 2.220 -5.510 1.00 0.00 H new ATOM 0 HA ILE A 75 8.880 4.161 -3.322 1.00 0.00 H new ATOM 0 HB ILE A 75 6.880 3.072 -2.230 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.299 2.056 -4.102 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.817 1.686 -4.896 1.00 0.00 H new ATOM 0 HG21 ILE A 75 5.208 4.310 -3.548 1.00 0.00 H new ATOM 0 HG22 ILE A 75 6.698 5.257 -3.321 1.00 0.00 H new ATOM 0 HG23 ILE A 75 6.376 4.463 -4.881 1.00 0.00 H new ATOM 0 HD11 ILE A 75 6.043 -0.210 -3.557 1.00 0.00 H new ATOM 0 HD12 ILE A 75 7.569 0.434 -2.904 1.00 0.00 H new ATOM 0 HD13 ILE A 75 6.027 0.810 -2.099 1.00 0.00 H new ATOM 1106 N ALA A 76 10.118 1.413 -3.664 1.00 0.00 N ATOM 1107 CA ALA A 76 10.890 0.314 -3.098 1.00 0.00 C ATOM 1108 C ALA A 76 11.845 0.813 -2.019 1.00 0.00 C ATOM 1109 O ALA A 76 11.941 0.225 -0.942 1.00 0.00 O ATOM 1110 CB ALA A 76 11.659 -0.411 -4.192 1.00 0.00 C ATOM 0 H ALA A 76 10.332 1.620 -4.640 1.00 0.00 H new ATOM 0 HA ALA A 76 10.194 -0.385 -2.635 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.231 -1.229 -3.754 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.959 -0.810 -4.926 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.339 0.286 -4.681 1.00 0.00 H new ATOM 1116 N GLU A 77 12.550 1.900 -2.316 1.00 0.00 N ATOM 1117 CA GLU A 77 13.500 2.476 -1.371 1.00 0.00 C ATOM 1118 C GLU A 77 12.843 3.575 -0.542 1.00 0.00 C ATOM 1119 O GLU A 77 13.508 4.505 -0.084 1.00 0.00 O ATOM 1120 CB GLU A 77 14.715 3.038 -2.112 1.00 0.00 C ATOM 1121 CG GLU A 77 15.429 2.011 -2.975 1.00 0.00 C ATOM 1122 CD GLU A 77 16.146 0.957 -2.155 1.00 0.00 C ATOM 1123 OE1 GLU A 77 16.857 1.332 -1.199 1.00 0.00 O ATOM 1124 OE2 GLU A 77 15.996 -0.243 -2.468 1.00 0.00 O ATOM 0 H GLU A 77 12.481 2.399 -3.203 1.00 0.00 H new ATOM 0 HA GLU A 77 13.829 1.684 -0.698 1.00 0.00 H new ATOM 0 HB2 GLU A 77 14.395 3.869 -2.741 1.00 0.00 H new ATOM 0 HB3 GLU A 77 15.419 3.442 -1.385 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.705 1.526 -3.630 1.00 0.00 H new ATOM 0 HG3 GLU A 77 16.149 2.519 -3.617 1.00 0.00 H new ATOM 1131 N HIS A 78 11.532 3.463 -0.353 1.00 0.00 N ATOM 1132 CA HIS A 78 10.783 4.447 0.420 1.00 0.00 C ATOM 1133 C HIS A 78 10.343 3.865 1.760 1.00 0.00 C ATOM 1134 O HIS A 78 10.093 2.664 1.875 1.00 0.00 O ATOM 1135 CB HIS A 78 9.563 4.925 -0.367 1.00 0.00 C ATOM 1136 CG HIS A 78 9.163 6.335 -0.055 1.00 0.00 C ATOM 1137 ND1 HIS A 78 7.982 6.896 -0.491 1.00 0.00 N ATOM 1138 CD2 HIS A 78 9.795 7.297 0.657 1.00 0.00 C ATOM 1139 CE1 HIS A 78 7.905 8.143 -0.063 1.00 0.00 C ATOM 1140 NE2 HIS A 78 8.992 8.411 0.637 1.00 0.00 N ATOM 0 H HIS A 78 10.966 2.700 -0.725 1.00 0.00 H new ATOM 0 HA HIS A 78 11.438 5.297 0.611 1.00 0.00 H new ATOM 0 HB2 HIS A 78 9.774 4.843 -1.433 1.00 0.00 H new ATOM 0 HB3 HIS A 78 8.723 4.263 -0.157 1.00 0.00 H new ATOM 0 HD1 HIS A 78 7.277 6.422 -1.056 1.00 0.00 H new ATOM 0 HD2 HIS A 78 10.752 7.206 1.149 1.00 0.00 H new ATOM 0 HE1 HIS A 78 7.091 8.827 -0.253 1.00 0.00 H new ATOM 1149 N THR A 79 10.251 4.722 2.772 1.00 0.00 N ATOM 1150 CA THR A 79 9.843 4.293 4.103 1.00 0.00 C ATOM 1151 C THR A 79 8.416 3.758 4.095 1.00 0.00 C ATOM 1152 O THR A 79 7.667 3.973 3.141 1.00 0.00 O ATOM 1153 CB THR A 79 9.942 5.446 5.120 1.00 0.00 C ATOM 1154 OG1 THR A 79 9.079 6.520 4.728 1.00 0.00 O ATOM 1155 CG2 THR A 79 11.373 5.951 5.228 1.00 0.00 C ATOM 0 H THR A 79 10.454 5.719 2.694 1.00 0.00 H new ATOM 0 HA THR A 79 10.525 3.496 4.401 1.00 0.00 H new ATOM 0 HB THR A 79 9.633 5.069 6.095 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.619 7.282 4.433 1.00 0.00 H new ATOM 0 HG21 THR A 79 11.418 6.765 5.952 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.022 5.138 5.555 1.00 0.00 H new ATOM 0 HG23 THR A 79 11.706 6.312 4.255 1.00 0.00 H new ATOM 1163 N HIS A 80 8.044 3.061 5.164 1.00 0.00 N ATOM 1164 CA HIS A 80 6.704 2.496 5.281 1.00 0.00 C ATOM 1165 C HIS A 80 5.666 3.597 5.476 1.00 0.00 C ATOM 1166 O HIS A 80 4.713 3.710 4.704 1.00 0.00 O ATOM 1167 CB HIS A 80 6.643 1.509 6.446 1.00 0.00 C ATOM 1168 CG HIS A 80 5.248 1.162 6.866 1.00 0.00 C ATOM 1169 ND1 HIS A 80 4.608 0.006 6.470 1.00 0.00 N ATOM 1170 CD2 HIS A 80 4.369 1.826 7.652 1.00 0.00 C ATOM 1171 CE1 HIS A 80 3.396 -0.025 6.994 1.00 0.00 C ATOM 1172 NE2 HIS A 80 3.226 1.068 7.716 1.00 0.00 N ATOM 0 H HIS A 80 8.652 2.874 5.962 1.00 0.00 H new ATOM 0 HA HIS A 80 6.478 1.967 4.355 1.00 0.00 H new ATOM 0 HB2 HIS A 80 7.167 0.595 6.165 1.00 0.00 H new ATOM 0 HB3 HIS A 80 7.175 1.932 7.298 1.00 0.00 H new ATOM 0 HD2 HIS A 80 4.536 2.776 8.139 1.00 0.00 H new ATOM 0 HE1 HIS A 80 2.668 -0.810 6.856 1.00 0.00 H new ATOM 0 HE2 HIS A 80 2.383 1.310 8.236 1.00 0.00 H new ATOM 1181 N ASP A 81 5.856 4.405 6.514 1.00 0.00 N ATOM 1182 CA ASP A 81 4.936 5.497 6.811 1.00 0.00 C ATOM 1183 C ASP A 81 4.529 6.227 5.535 1.00 0.00 C ATOM 1184 O ASP A 81 3.353 6.524 5.327 1.00 0.00 O ATOM 1185 CB ASP A 81 5.576 6.479 7.793 1.00 0.00 C ATOM 1186 CG ASP A 81 5.745 5.885 9.178 1.00 0.00 C ATOM 1187 OD1 ASP A 81 6.084 4.687 9.273 1.00 0.00 O ATOM 1188 OD2 ASP A 81 5.538 6.620 10.167 1.00 0.00 O ATOM 0 H ASP A 81 6.638 4.324 7.163 1.00 0.00 H new ATOM 0 HA ASP A 81 4.041 5.072 7.266 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.550 6.787 7.412 1.00 0.00 H new ATOM 0 HB3 ASP A 81 4.961 7.376 7.858 1.00 0.00 H new ATOM 1193 N GLN A 82 5.509 6.514 4.685 1.00 0.00 N ATOM 1194 CA GLN A 82 5.253 7.211 3.430 1.00 0.00 C ATOM 1195 C GLN A 82 4.371 6.371 2.511 1.00 0.00 C ATOM 1196 O GLN A 82 3.235 6.741 2.216 1.00 0.00 O ATOM 1197 CB GLN A 82 6.570 7.544 2.728 1.00 0.00 C ATOM 1198 CG GLN A 82 7.359 8.651 3.408 1.00 0.00 C ATOM 1199 CD GLN A 82 6.536 9.907 3.622 1.00 0.00 C ATOM 1200 OE1 GLN A 82 5.731 9.914 4.677 1.00 0.00 O flip ATOM 1201 NE2 GLN A 82 6.624 10.860 2.847 1.00 0.00 N flip ATOM 0 H GLN A 82 6.488 6.275 4.842 1.00 0.00 H new ATOM 0 HA GLN A 82 4.728 8.138 3.660 1.00 0.00 H new ATOM 0 HB2 GLN A 82 7.185 6.645 2.683 1.00 0.00 H new ATOM 0 HB3 GLN A 82 6.360 7.838 1.700 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.725 8.293 4.370 1.00 0.00 H new ATOM 0 HG3 GLN A 82 8.234 8.893 2.804 1.00 0.00 H new ATOM 0 HE21 GLN A 82 7.256 10.811 2.048 1.00 0.00 H new ATOM 0 HE22 GLN A 82 6.064 11.698 3.004 1.00 0.00 H new ATOM 1210 N VAL A 83 4.903 5.239 2.062 1.00 0.00 N ATOM 1211 CA VAL A 83 4.164 4.346 1.177 1.00 0.00 C ATOM 1212 C VAL A 83 2.685 4.310 1.543 1.00 0.00 C ATOM 1213 O VAL A 83 1.823 4.625 0.723 1.00 0.00 O ATOM 1214 CB VAL A 83 4.729 2.914 1.226 1.00 0.00 C ATOM 1215 CG1 VAL A 83 3.814 1.953 0.482 1.00 0.00 C ATOM 1216 CG2 VAL A 83 6.136 2.877 0.649 1.00 0.00 C ATOM 0 H VAL A 83 5.843 4.918 2.296 1.00 0.00 H new ATOM 0 HA VAL A 83 4.275 4.738 0.166 1.00 0.00 H new ATOM 0 HB VAL A 83 4.779 2.597 2.268 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.229 0.946 0.527 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.827 1.959 0.944 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.729 2.264 -0.559 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.520 1.858 0.691 1.00 0.00 H new ATOM 0 HG22 VAL A 83 6.113 3.213 -0.388 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.785 3.533 1.229 1.00 0.00 H new ATOM 1226 N VAL A 84 2.396 3.923 2.782 1.00 0.00 N ATOM 1227 CA VAL A 84 1.021 3.847 3.258 1.00 0.00 C ATOM 1228 C VAL A 84 0.244 5.109 2.900 1.00 0.00 C ATOM 1229 O VAL A 84 -0.906 5.041 2.464 1.00 0.00 O ATOM 1230 CB VAL A 84 0.966 3.638 4.783 1.00 0.00 C ATOM 1231 CG1 VAL A 84 -0.473 3.681 5.277 1.00 0.00 C ATOM 1232 CG2 VAL A 84 1.630 2.324 5.166 1.00 0.00 C ATOM 0 H VAL A 84 3.097 3.657 3.474 1.00 0.00 H new ATOM 0 HA VAL A 84 0.562 2.990 2.765 1.00 0.00 H new ATOM 0 HB VAL A 84 1.514 4.449 5.262 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.492 3.531 6.357 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.911 4.650 5.037 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.048 2.893 4.791 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.582 2.193 6.247 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.112 1.499 4.677 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.673 2.337 4.848 1.00 0.00 H new ATOM 1242 N LEU A 85 0.880 6.260 3.087 1.00 0.00 N ATOM 1243 CA LEU A 85 0.249 7.540 2.783 1.00 0.00 C ATOM 1244 C LEU A 85 0.129 7.744 1.276 1.00 0.00 C ATOM 1245 O LEU A 85 -0.849 8.314 0.792 1.00 0.00 O ATOM 1246 CB LEU A 85 1.052 8.686 3.401 1.00 0.00 C ATOM 1247 CG LEU A 85 0.791 8.965 4.882 1.00 0.00 C ATOM 1248 CD1 LEU A 85 1.858 9.889 5.447 1.00 0.00 C ATOM 1249 CD2 LEU A 85 -0.594 9.565 5.076 1.00 0.00 C ATOM 0 H LEU A 85 1.831 6.334 3.447 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.753 7.534 3.211 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.113 8.470 3.274 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.842 9.595 2.838 1.00 0.00 H new ATOM 0 HG LEU A 85 0.834 8.020 5.423 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.656 10.076 6.502 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.837 9.421 5.343 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.847 10.833 4.902 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.762 9.757 6.136 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.666 10.501 4.522 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.347 8.868 4.710 1.00 0.00 H new ATOM 1261 N PHE A 86 1.129 7.273 0.539 1.00 0.00 N ATOM 1262 CA PHE A 86 1.135 7.402 -0.914 1.00 0.00 C ATOM 1263 C PHE A 86 -0.202 6.965 -1.504 1.00 0.00 C ATOM 1264 O PHE A 86 -0.829 7.704 -2.263 1.00 0.00 O ATOM 1265 CB PHE A 86 2.269 6.569 -1.516 1.00 0.00 C ATOM 1266 CG PHE A 86 2.721 7.057 -2.863 1.00 0.00 C ATOM 1267 CD1 PHE A 86 1.822 7.171 -3.911 1.00 0.00 C ATOM 1268 CD2 PHE A 86 4.045 7.402 -3.080 1.00 0.00 C ATOM 1269 CE1 PHE A 86 2.236 7.620 -5.151 1.00 0.00 C ATOM 1270 CE2 PHE A 86 4.465 7.851 -4.318 1.00 0.00 C ATOM 1271 CZ PHE A 86 3.558 7.961 -5.355 1.00 0.00 C ATOM 0 H PHE A 86 1.946 6.798 0.924 1.00 0.00 H new ATOM 0 HA PHE A 86 1.295 8.452 -1.161 1.00 0.00 H new ATOM 0 HB2 PHE A 86 3.118 6.577 -0.832 1.00 0.00 H new ATOM 0 HB3 PHE A 86 1.941 5.533 -1.605 1.00 0.00 H new ATOM 0 HD1 PHE A 86 0.786 6.906 -3.757 1.00 0.00 H new ATOM 0 HD2 PHE A 86 4.757 7.319 -2.272 1.00 0.00 H new ATOM 0 HE1 PHE A 86 1.525 7.704 -5.960 1.00 0.00 H new ATOM 0 HE2 PHE A 86 5.500 8.115 -4.475 1.00 0.00 H new ATOM 0 HZ PHE A 86 3.883 8.313 -6.323 1.00 0.00 H new ATOM 1281 N ILE A 87 -0.631 5.758 -1.151 1.00 0.00 N ATOM 1282 CA ILE A 87 -1.893 5.222 -1.645 1.00 0.00 C ATOM 1283 C ILE A 87 -3.045 6.182 -1.367 1.00 0.00 C ATOM 1284 O ILE A 87 -3.771 6.579 -2.279 1.00 0.00 O ATOM 1285 CB ILE A 87 -2.213 3.856 -1.008 1.00 0.00 C ATOM 1286 CG1 ILE A 87 -1.164 2.820 -1.417 1.00 0.00 C ATOM 1287 CG2 ILE A 87 -3.606 3.396 -1.413 1.00 0.00 C ATOM 1288 CD1 ILE A 87 -1.022 1.683 -0.430 1.00 0.00 C ATOM 0 H ILE A 87 -0.123 5.133 -0.525 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.781 5.094 -2.722 1.00 0.00 H new ATOM 0 HB ILE A 87 -2.188 3.962 0.077 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.428 2.413 -2.393 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -0.200 3.316 -1.529 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.817 2.430 -0.955 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.342 4.126 -1.077 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.657 3.303 -2.498 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.262 0.987 -0.784 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -0.727 2.079 0.542 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.975 1.162 -0.335 1.00 0.00 H new ATOM 1300 N LYS A 88 -3.205 6.554 -0.102 1.00 0.00 N ATOM 1301 CA LYS A 88 -4.266 7.471 0.298 1.00 0.00 C ATOM 1302 C LYS A 88 -4.332 8.670 -0.642 1.00 0.00 C ATOM 1303 O LYS A 88 -5.371 8.944 -1.242 1.00 0.00 O ATOM 1304 CB LYS A 88 -4.041 7.947 1.735 1.00 0.00 C ATOM 1305 CG LYS A 88 -4.509 6.955 2.785 1.00 0.00 C ATOM 1306 CD LYS A 88 -4.120 7.399 4.185 1.00 0.00 C ATOM 1307 CE LYS A 88 -4.066 6.223 5.148 1.00 0.00 C ATOM 1308 NZ LYS A 88 -5.427 5.724 5.491 1.00 0.00 N ATOM 0 H LYS A 88 -2.613 6.234 0.665 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.214 6.937 0.243 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -2.979 8.144 1.881 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.564 8.892 1.882 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -5.592 6.844 2.725 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -4.077 5.976 2.580 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -3.148 7.891 4.155 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.838 8.135 4.547 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -3.485 5.416 4.703 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -3.549 6.523 6.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -5.347 4.923 6.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -5.974 6.487 5.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -5.911 5.413 4.625 1.00 0.00 H new ATOM 1322 N ALA A 89 -3.215 9.381 -0.766 1.00 0.00 N ATOM 1323 CA ALA A 89 -3.146 10.548 -1.636 1.00 0.00 C ATOM 1324 C ALA A 89 -3.954 10.332 -2.911 1.00 0.00 C ATOM 1325 O ALA A 89 -4.788 11.160 -3.277 1.00 0.00 O ATOM 1326 CB ALA A 89 -1.698 10.868 -1.975 1.00 0.00 C ATOM 0 H ALA A 89 -2.347 9.169 -0.275 1.00 0.00 H new ATOM 0 HA ALA A 89 -3.579 11.394 -1.102 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -1.661 11.742 -2.625 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -1.147 11.075 -1.058 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -1.247 10.017 -2.485 1.00 0.00 H new ATOM 1332 N SER A 90 -3.701 9.214 -3.584 1.00 0.00 N ATOM 1333 CA SER A 90 -4.402 8.891 -4.822 1.00 0.00 C ATOM 1334 C SER A 90 -5.850 9.368 -4.766 1.00 0.00 C ATOM 1335 O SER A 90 -6.352 9.975 -5.712 1.00 0.00 O ATOM 1336 CB SER A 90 -4.359 7.383 -5.078 1.00 0.00 C ATOM 1337 OG SER A 90 -3.048 6.874 -4.911 1.00 0.00 O ATOM 0 H SER A 90 -3.016 8.517 -3.293 1.00 0.00 H new ATOM 0 HA SER A 90 -3.900 9.406 -5.641 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.039 6.875 -4.394 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.708 7.173 -6.089 1.00 0.00 H new ATOM 0 HG SER A 90 -2.910 6.628 -3.973 1.00 0.00 H new ATOM 1343 N CYS A 91 -6.515 9.089 -3.650 1.00 0.00 N ATOM 1344 CA CYS A 91 -7.907 9.488 -3.470 1.00 0.00 C ATOM 1345 C CYS A 91 -8.006 10.970 -3.121 1.00 0.00 C ATOM 1346 O CYS A 91 -8.806 11.701 -3.703 1.00 0.00 O ATOM 1347 CB CYS A 91 -8.562 8.649 -2.372 1.00 0.00 C ATOM 1348 SG CYS A 91 -10.328 8.966 -2.154 1.00 0.00 S ATOM 0 H CYS A 91 -6.113 8.589 -2.857 1.00 0.00 H new ATOM 0 HA CYS A 91 -8.433 9.318 -4.410 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -8.419 7.593 -2.603 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -8.050 8.841 -1.429 1.00 0.00 H new ATOM 0 HG CYS A 91 -10.619 10.142 -2.624 1.00 0.00 H new ATOM 1354 N GLU A 92 -7.189 11.404 -2.167 1.00 0.00 N ATOM 1355 CA GLU A 92 -7.188 12.798 -1.740 1.00 0.00 C ATOM 1356 C GLU A 92 -7.195 13.736 -2.943 1.00 0.00 C ATOM 1357 O GLU A 92 -7.997 14.667 -3.014 1.00 0.00 O ATOM 1358 CB GLU A 92 -5.967 13.085 -0.863 1.00 0.00 C ATOM 1359 CG GLU A 92 -6.074 12.506 0.538 1.00 0.00 C ATOM 1360 CD GLU A 92 -4.909 12.902 1.423 1.00 0.00 C ATOM 1361 OE1 GLU A 92 -4.877 14.064 1.880 1.00 0.00 O ATOM 1362 OE2 GLU A 92 -4.028 12.049 1.660 1.00 0.00 O ATOM 0 H GLU A 92 -6.520 10.811 -1.676 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.093 12.974 -1.159 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.079 12.680 -1.348 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.827 14.164 -0.792 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -7.004 12.842 0.996 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.125 11.419 0.475 1.00 0.00 H new ATOM 1369 N ARG A 93 -6.294 13.484 -3.888 1.00 0.00 N ATOM 1370 CA ARG A 93 -6.194 14.306 -5.087 1.00 0.00 C ATOM 1371 C ARG A 93 -7.387 14.069 -6.010 1.00 0.00 C ATOM 1372 O ARG A 93 -8.207 13.183 -5.766 1.00 0.00 O ATOM 1373 CB ARG A 93 -4.892 14.005 -5.832 1.00 0.00 C ATOM 1374 CG ARG A 93 -4.773 12.560 -6.289 1.00 0.00 C ATOM 1375 CD ARG A 93 -3.320 12.159 -6.492 1.00 0.00 C ATOM 1376 NE ARG A 93 -2.731 12.807 -7.661 1.00 0.00 N ATOM 1377 CZ ARG A 93 -1.452 12.689 -8.001 1.00 0.00 C ATOM 1378 NH1 ARG A 93 -0.633 11.950 -7.265 1.00 0.00 N ATOM 1379 NH2 ARG A 93 -0.991 13.310 -9.079 1.00 0.00 N ATOM 0 H ARG A 93 -5.623 12.717 -3.846 1.00 0.00 H new ATOM 0 HA ARG A 93 -6.195 15.352 -4.780 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -4.821 14.659 -6.701 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.049 14.243 -5.184 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -5.233 11.904 -5.550 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -5.323 12.425 -7.221 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -2.744 12.421 -5.604 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -3.255 11.077 -6.606 1.00 0.00 H new ATOM 0 HE ARG A 93 -3.335 13.382 -8.249 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -0.985 11.471 -6.436 1.00 0.00 H new ATOM 0 HH12 ARG A 93 0.348 11.861 -7.528 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -1.619 13.879 -9.648 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -0.009 13.219 -9.339 1.00 0.00 H new ATOM 1393 N HIS A 94 -7.476 14.866 -7.070 1.00 0.00 N ATOM 1394 CA HIS A 94 -8.568 14.742 -8.029 1.00 0.00 C ATOM 1395 C HIS A 94 -8.635 13.327 -8.597 1.00 0.00 C ATOM 1396 O HIS A 94 -9.677 12.674 -8.542 1.00 0.00 O ATOM 1397 CB HIS A 94 -8.395 15.752 -9.164 1.00 0.00 C ATOM 1398 CG HIS A 94 -9.587 15.851 -10.065 1.00 0.00 C ATOM 1399 ND1 HIS A 94 -10.311 14.889 -10.684 1.00 0.00 N flip ATOM 1400 CD2 HIS A 94 -10.164 17.052 -10.421 1.00 0.00 C flip ATOM 1401 CE1 HIS A 94 -11.302 15.520 -11.395 1.00 0.00 C flip ATOM 1402 NE2 HIS A 94 -11.192 16.824 -11.219 1.00 0.00 N flip ATOM 0 H HIS A 94 -6.806 15.604 -7.286 1.00 0.00 H new ATOM 0 HA HIS A 94 -9.502 14.949 -7.507 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -8.190 16.734 -8.737 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.524 15.474 -9.757 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -9.828 18.026 -10.098 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -12.050 15.029 -12.000 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -11.798 17.535 -11.629 1.00 0.00 H new ATOM 1411 N SER A 95 -7.516 12.861 -9.143 1.00 0.00 N ATOM 1412 CA SER A 95 -7.449 11.525 -9.725 1.00 0.00 C ATOM 1413 C SER A 95 -8.308 10.544 -8.934 1.00 0.00 C ATOM 1414 O SER A 95 -8.271 10.520 -7.704 1.00 0.00 O ATOM 1415 CB SER A 95 -6.000 11.036 -9.764 1.00 0.00 C ATOM 1416 OG SER A 95 -5.202 11.871 -10.585 1.00 0.00 O ATOM 0 H SER A 95 -6.644 13.388 -9.195 1.00 0.00 H new ATOM 0 HA SER A 95 -7.835 11.579 -10.743 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.592 11.017 -8.753 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.968 10.013 -10.140 1.00 0.00 H new ATOM 0 HG SER A 95 -4.280 11.538 -10.592 1.00 0.00 H new ATOM 1422 N GLY A 96 -9.083 9.734 -9.650 1.00 0.00 N ATOM 1423 CA GLY A 96 -9.941 8.761 -8.999 1.00 0.00 C ATOM 1424 C GLY A 96 -9.710 7.352 -9.507 1.00 0.00 C ATOM 1425 O GLY A 96 -10.543 6.801 -10.226 1.00 0.00 O ATOM 0 H GLY A 96 -9.132 9.735 -10.669 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -9.766 8.789 -7.923 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -10.984 9.035 -9.160 1.00 0.00 H new ATOM 1429 N GLU A 97 -8.575 6.769 -9.135 1.00 0.00 N ATOM 1430 CA GLU A 97 -8.236 5.416 -9.561 1.00 0.00 C ATOM 1431 C GLU A 97 -6.976 4.923 -8.856 1.00 0.00 C ATOM 1432 O GLU A 97 -6.058 5.699 -8.585 1.00 0.00 O ATOM 1433 CB GLU A 97 -8.037 5.370 -11.077 1.00 0.00 C ATOM 1434 CG GLU A 97 -6.792 6.102 -11.550 1.00 0.00 C ATOM 1435 CD GLU A 97 -6.819 6.399 -13.037 1.00 0.00 C ATOM 1436 OE1 GLU A 97 -7.521 7.350 -13.438 1.00 0.00 O ATOM 1437 OE2 GLU A 97 -6.138 5.681 -13.798 1.00 0.00 O ATOM 0 H GLU A 97 -7.875 7.212 -8.540 1.00 0.00 H new ATOM 0 HA GLU A 97 -9.063 4.759 -9.290 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -7.980 4.329 -11.396 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -8.910 5.805 -11.563 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -6.693 7.037 -10.998 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -5.912 5.501 -11.319 1.00 0.00 H new ATOM 1444 N LEU A 98 -6.939 3.628 -8.561 1.00 0.00 N ATOM 1445 CA LEU A 98 -5.792 3.030 -7.887 1.00 0.00 C ATOM 1446 C LEU A 98 -5.195 1.902 -8.723 1.00 0.00 C ATOM 1447 O LEU A 98 -5.910 1.011 -9.180 1.00 0.00 O ATOM 1448 CB LEU A 98 -6.203 2.498 -6.513 1.00 0.00 C ATOM 1449 CG LEU A 98 -5.116 2.503 -5.438 1.00 0.00 C ATOM 1450 CD1 LEU A 98 -3.981 1.567 -5.822 1.00 0.00 C ATOM 1451 CD2 LEU A 98 -4.594 3.915 -5.215 1.00 0.00 C ATOM 0 H LEU A 98 -7.690 2.972 -8.778 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.034 3.803 -7.759 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.044 3.090 -6.153 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.561 1.476 -6.634 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.552 2.147 -4.505 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.217 1.584 -5.045 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.366 0.553 -5.930 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -3.545 1.892 -6.767 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.821 3.900 -4.447 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -4.174 4.299 -6.145 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.413 4.559 -4.894 1.00 0.00 H new ATOM 1463 N MET A 99 -3.881 1.948 -8.918 1.00 0.00 N ATOM 1464 CA MET A 99 -3.189 0.929 -9.697 1.00 0.00 C ATOM 1465 C MET A 99 -1.935 0.449 -8.972 1.00 0.00 C ATOM 1466 O MET A 99 -1.007 1.224 -8.737 1.00 0.00 O ATOM 1467 CB MET A 99 -2.817 1.475 -11.077 1.00 0.00 C ATOM 1468 CG MET A 99 -3.961 1.434 -12.076 1.00 0.00 C ATOM 1469 SD MET A 99 -3.645 2.442 -13.537 1.00 0.00 S ATOM 1470 CE MET A 99 -3.702 1.199 -14.825 1.00 0.00 C ATOM 0 H MET A 99 -3.275 2.680 -8.547 1.00 0.00 H new ATOM 0 HA MET A 99 -3.863 0.082 -9.820 1.00 0.00 H new ATOM 0 HB2 MET A 99 -2.475 2.505 -10.971 1.00 0.00 H new ATOM 0 HB3 MET A 99 -1.980 0.900 -11.472 1.00 0.00 H new ATOM 0 HG2 MET A 99 -4.134 0.402 -12.382 1.00 0.00 H new ATOM 0 HG3 MET A 99 -4.874 1.780 -11.591 1.00 0.00 H new ATOM 0 HE1 MET A 99 -3.898 1.678 -15.784 1.00 0.00 H new ATOM 0 HE2 MET A 99 -2.746 0.676 -14.869 1.00 0.00 H new ATOM 0 HE3 MET A 99 -4.496 0.485 -14.607 1.00 0.00 H new ATOM 1480 N LEU A 100 -1.914 -0.832 -8.621 1.00 0.00 N ATOM 1481 CA LEU A 100 -0.774 -1.415 -7.922 1.00 0.00 C ATOM 1482 C LEU A 100 -0.127 -2.515 -8.758 1.00 0.00 C ATOM 1483 O LEU A 100 -0.803 -3.432 -9.225 1.00 0.00 O ATOM 1484 CB LEU A 100 -1.213 -1.978 -6.569 1.00 0.00 C ATOM 1485 CG LEU A 100 -2.150 -1.093 -5.746 1.00 0.00 C ATOM 1486 CD1 LEU A 100 -2.963 -1.935 -4.775 1.00 0.00 C ATOM 1487 CD2 LEU A 100 -1.360 -0.028 -5.000 1.00 0.00 C ATOM 0 H LEU A 100 -2.673 -1.487 -8.809 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.038 -0.628 -7.759 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.706 -2.935 -6.739 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.321 -2.180 -5.975 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.839 -0.594 -6.427 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.624 -1.288 -4.198 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.558 -2.659 -5.331 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.290 -2.462 -4.099 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.043 0.592 -4.420 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.647 -0.507 -4.329 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.823 0.595 -5.716 1.00 0.00 H new ATOM 1499 N LEU A 101 1.185 -2.418 -8.941 1.00 0.00 N ATOM 1500 CA LEU A 101 1.924 -3.406 -9.718 1.00 0.00 C ATOM 1501 C LEU A 101 2.451 -4.522 -8.821 1.00 0.00 C ATOM 1502 O LEU A 101 3.402 -4.327 -8.064 1.00 0.00 O ATOM 1503 CB LEU A 101 3.086 -2.738 -10.456 1.00 0.00 C ATOM 1504 CG LEU A 101 3.595 -3.463 -11.702 1.00 0.00 C ATOM 1505 CD1 LEU A 101 2.526 -3.482 -12.783 1.00 0.00 C ATOM 1506 CD2 LEU A 101 4.867 -2.806 -12.219 1.00 0.00 C ATOM 0 H LEU A 101 1.759 -1.665 -8.562 1.00 0.00 H new ATOM 0 HA LEU A 101 1.241 -3.843 -10.447 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.777 -1.734 -10.745 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.917 -2.628 -9.759 1.00 0.00 H new ATOM 0 HG LEU A 101 3.826 -4.493 -11.430 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.907 -4.002 -13.662 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.641 -3.998 -12.411 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.263 -2.459 -13.052 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.215 -3.335 -13.106 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.662 -1.766 -12.474 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.636 -2.846 -11.448 1.00 0.00 H new ATOM 1518 N VAL A 102 1.827 -5.692 -8.914 1.00 0.00 N ATOM 1519 CA VAL A 102 2.235 -6.841 -8.113 1.00 0.00 C ATOM 1520 C VAL A 102 2.851 -7.928 -8.986 1.00 0.00 C ATOM 1521 O VAL A 102 2.566 -8.015 -10.181 1.00 0.00 O ATOM 1522 CB VAL A 102 1.044 -7.434 -7.337 1.00 0.00 C ATOM 1523 CG1 VAL A 102 0.377 -6.366 -6.484 1.00 0.00 C ATOM 1524 CG2 VAL A 102 0.045 -8.065 -8.295 1.00 0.00 C ATOM 0 H VAL A 102 1.038 -5.869 -9.535 1.00 0.00 H new ATOM 0 HA VAL A 102 2.981 -6.484 -7.403 1.00 0.00 H new ATOM 0 HB VAL A 102 1.417 -8.214 -6.673 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.462 -6.804 -5.943 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.099 -5.966 -5.772 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.016 -5.562 -7.125 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.790 -8.479 -7.730 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -0.325 -7.307 -8.986 1.00 0.00 H new ATOM 0 HG23 VAL A 102 0.533 -8.861 -8.857 1.00 0.00 H new ATOM 1534 N ARG A 103 3.697 -8.756 -8.382 1.00 0.00 N ATOM 1535 CA ARG A 103 4.354 -9.838 -9.104 1.00 0.00 C ATOM 1536 C ARG A 103 3.608 -11.155 -8.909 1.00 0.00 C ATOM 1537 O ARG A 103 3.194 -11.503 -7.803 1.00 0.00 O ATOM 1538 CB ARG A 103 5.803 -9.986 -8.636 1.00 0.00 C ATOM 1539 CG ARG A 103 6.706 -10.664 -9.653 1.00 0.00 C ATOM 1540 CD ARG A 103 8.166 -10.602 -9.231 1.00 0.00 C ATOM 1541 NE ARG A 103 9.068 -10.594 -10.380 1.00 0.00 N ATOM 1542 CZ ARG A 103 9.223 -9.550 -11.185 1.00 0.00 C ATOM 1543 NH1 ARG A 103 8.541 -8.434 -10.969 1.00 0.00 N ATOM 1544 NH2 ARG A 103 10.063 -9.620 -12.210 1.00 0.00 N ATOM 0 H ARG A 103 3.943 -8.698 -7.394 1.00 0.00 H new ATOM 0 HA ARG A 103 4.345 -9.590 -10.165 1.00 0.00 H new ATOM 0 HB2 ARG A 103 6.205 -8.999 -8.408 1.00 0.00 H new ATOM 0 HB3 ARG A 103 5.820 -10.559 -7.709 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.405 -11.705 -9.772 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.586 -10.184 -10.624 1.00 0.00 H new ATOM 0 HD2 ARG A 103 8.333 -9.706 -8.633 1.00 0.00 H new ATOM 0 HD3 ARG A 103 8.396 -11.457 -8.595 1.00 0.00 H new ATOM 0 HE ARG A 103 9.608 -11.437 -10.574 1.00 0.00 H new ATOM 0 HH11 ARG A 103 7.895 -8.376 -10.182 1.00 0.00 H new ATOM 0 HH12 ARG A 103 8.663 -7.634 -11.590 1.00 0.00 H new ATOM 0 HH21 ARG A 103 10.590 -10.477 -12.380 1.00 0.00 H new ATOM 0 HH22 ARG A 103 10.181 -8.817 -12.828 1.00 0.00 H new ATOM 1558 N PRO A 104 3.431 -11.903 -10.007 1.00 0.00 N ATOM 1559 CA PRO A 104 2.734 -13.193 -9.982 1.00 0.00 C ATOM 1560 C PRO A 104 3.534 -14.270 -9.258 1.00 0.00 C ATOM 1561 O PRO A 104 4.762 -14.293 -9.321 1.00 0.00 O ATOM 1562 CB PRO A 104 2.585 -13.544 -11.465 1.00 0.00 C ATOM 1563 CG PRO A 104 3.697 -12.818 -12.140 1.00 0.00 C ATOM 1564 CD PRO A 104 3.898 -11.549 -11.358 1.00 0.00 C ATOM 0 HA PRO A 104 1.787 -13.134 -9.446 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.659 -14.619 -11.627 1.00 0.00 H new ATOM 0 HB3 PRO A 104 1.615 -13.230 -11.851 1.00 0.00 H new ATOM 0 HG2 PRO A 104 4.606 -13.419 -12.149 1.00 0.00 H new ATOM 0 HG3 PRO A 104 3.448 -12.601 -13.179 1.00 0.00 H new ATOM 0 HD2 PRO A 104 4.944 -11.241 -11.354 1.00 0.00 H new ATOM 0 HD3 PRO A 104 3.324 -10.723 -11.778 1.00 0.00 H new ATOM 1572 N ASN A 105 2.828 -15.162 -8.570 1.00 0.00 N ATOM 1573 CA ASN A 105 3.473 -16.243 -7.832 1.00 0.00 C ATOM 1574 C ASN A 105 3.031 -17.603 -8.363 1.00 0.00 C ATOM 1575 O ASN A 105 2.149 -18.245 -7.795 1.00 0.00 O ATOM 1576 CB ASN A 105 3.150 -16.135 -6.341 1.00 0.00 C ATOM 1577 CG ASN A 105 4.132 -16.904 -5.479 1.00 0.00 C ATOM 1578 OD1 ASN A 105 4.497 -18.037 -5.794 1.00 0.00 O ATOM 1579 ND2 ASN A 105 4.566 -16.289 -4.385 1.00 0.00 N ATOM 0 H ASN A 105 1.810 -15.158 -8.508 1.00 0.00 H new ATOM 0 HA ASN A 105 4.550 -16.151 -7.970 1.00 0.00 H new ATOM 0 HB2 ASN A 105 3.156 -15.086 -6.046 1.00 0.00 H new ATOM 0 HB3 ASN A 105 2.142 -16.511 -6.162 1.00 0.00 H new ATOM 0 HD21 ASN A 105 5.229 -16.756 -3.766 1.00 0.00 H new ATOM 0 HD22 ASN A 105 4.236 -15.350 -4.163 1.00 0.00 H new ATOM 1586 N ALA A 106 3.651 -18.036 -9.456 1.00 0.00 N ATOM 1587 CA ALA A 106 3.324 -19.320 -10.062 1.00 0.00 C ATOM 1588 C ALA A 106 4.391 -20.363 -9.748 1.00 0.00 C ATOM 1589 O ALA A 106 5.575 -20.154 -10.015 1.00 0.00 O ATOM 1590 CB ALA A 106 3.159 -19.167 -11.567 1.00 0.00 C ATOM 0 H ALA A 106 4.383 -17.516 -9.940 1.00 0.00 H new ATOM 0 HA ALA A 106 2.381 -19.664 -9.638 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.915 -20.134 -12.006 1.00 0.00 H new ATOM 0 HB2 ALA A 106 2.355 -18.461 -11.775 1.00 0.00 H new ATOM 0 HB3 ALA A 106 4.089 -18.796 -11.999 1.00 0.00 H new ATOM 1596 N VAL A 107 3.966 -21.487 -9.180 1.00 0.00 N ATOM 1597 CA VAL A 107 4.885 -22.563 -8.830 1.00 0.00 C ATOM 1598 C VAL A 107 4.202 -23.922 -8.923 1.00 0.00 C ATOM 1599 O VAL A 107 3.137 -24.134 -8.341 1.00 0.00 O ATOM 1600 CB VAL A 107 5.449 -22.380 -7.408 1.00 0.00 C ATOM 1601 CG1 VAL A 107 6.430 -23.493 -7.075 1.00 0.00 C ATOM 1602 CG2 VAL A 107 6.110 -21.017 -7.269 1.00 0.00 C ATOM 0 H VAL A 107 2.990 -21.676 -8.952 1.00 0.00 H new ATOM 0 HA VAL A 107 5.706 -22.523 -9.546 1.00 0.00 H new ATOM 0 HB VAL A 107 4.623 -22.432 -6.699 1.00 0.00 H new ATOM 0 HG11 VAL A 107 6.818 -23.347 -6.067 1.00 0.00 H new ATOM 0 HG12 VAL A 107 5.921 -24.455 -7.132 1.00 0.00 H new ATOM 0 HG13 VAL A 107 7.255 -23.476 -7.787 1.00 0.00 H new ATOM 0 HG21 VAL A 107 6.503 -20.905 -6.259 1.00 0.00 H new ATOM 0 HG22 VAL A 107 6.926 -20.933 -7.987 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.376 -20.235 -7.462 1.00 0.00 H new ATOM 1612 N TYR A 108 4.820 -24.840 -9.657 1.00 0.00 N ATOM 1613 CA TYR A 108 4.270 -26.180 -9.828 1.00 0.00 C ATOM 1614 C TYR A 108 3.847 -26.770 -8.487 1.00 0.00 C ATOM 1615 O TYR A 108 4.636 -26.825 -7.543 1.00 0.00 O ATOM 1616 CB TYR A 108 5.297 -27.094 -10.499 1.00 0.00 C ATOM 1617 CG TYR A 108 5.139 -28.552 -10.133 1.00 0.00 C ATOM 1618 CD1 TYR A 108 5.776 -29.081 -9.017 1.00 0.00 C ATOM 1619 CD2 TYR A 108 4.355 -29.402 -10.904 1.00 0.00 C ATOM 1620 CE1 TYR A 108 5.636 -30.413 -8.679 1.00 0.00 C ATOM 1621 CE2 TYR A 108 4.209 -30.735 -10.573 1.00 0.00 C ATOM 1622 CZ TYR A 108 4.851 -31.236 -9.460 1.00 0.00 C ATOM 1623 OH TYR A 108 4.708 -32.564 -9.127 1.00 0.00 O ATOM 0 H TYR A 108 5.702 -24.681 -10.143 1.00 0.00 H new ATOM 0 HA TYR A 108 3.389 -26.105 -10.466 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.213 -26.988 -11.581 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.299 -26.765 -10.223 1.00 0.00 H new ATOM 0 HD1 TYR A 108 6.391 -28.440 -8.403 1.00 0.00 H new ATOM 0 HD2 TYR A 108 3.851 -29.014 -11.777 1.00 0.00 H new ATOM 0 HE1 TYR A 108 6.138 -30.808 -7.808 1.00 0.00 H new ATOM 0 HE2 TYR A 108 3.595 -31.382 -11.183 1.00 0.00 H new ATOM 0 HH TYR A 108 4.122 -33.003 -9.778 1.00 0.00 H new ATOM 1633 N ASP A 109 2.596 -27.211 -8.410 1.00 0.00 N ATOM 1634 CA ASP A 109 2.066 -27.800 -7.186 1.00 0.00 C ATOM 1635 C ASP A 109 1.248 -29.050 -7.493 1.00 0.00 C ATOM 1636 O ASP A 109 0.577 -29.128 -8.523 1.00 0.00 O ATOM 1637 CB ASP A 109 1.204 -26.782 -6.437 1.00 0.00 C ATOM 1638 CG ASP A 109 0.131 -26.173 -7.318 1.00 0.00 C ATOM 1639 OD1 ASP A 109 0.487 -25.462 -8.280 1.00 0.00 O ATOM 1640 OD2 ASP A 109 -1.065 -26.407 -7.044 1.00 0.00 O ATOM 0 H ASP A 109 1.930 -27.172 -9.181 1.00 0.00 H new ATOM 0 HA ASP A 109 2.908 -28.086 -6.556 1.00 0.00 H new ATOM 0 HB2 ASP A 109 0.735 -27.267 -5.581 1.00 0.00 H new ATOM 0 HB3 ASP A 109 1.841 -25.989 -6.045 1.00 0.00 H new ATOM 1645 N VAL A 110 1.308 -30.027 -6.594 1.00 0.00 N ATOM 1646 CA VAL A 110 0.573 -31.274 -6.769 1.00 0.00 C ATOM 1647 C VAL A 110 -0.324 -31.556 -5.569 1.00 0.00 C ATOM 1648 O VAL A 110 0.158 -31.832 -4.471 1.00 0.00 O ATOM 1649 CB VAL A 110 1.528 -32.465 -6.973 1.00 0.00 C ATOM 1650 CG1 VAL A 110 2.514 -32.563 -5.819 1.00 0.00 C ATOM 1651 CG2 VAL A 110 0.742 -33.758 -7.125 1.00 0.00 C ATOM 0 H VAL A 110 1.858 -29.979 -5.737 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.043 -31.156 -7.660 1.00 0.00 H new ATOM 0 HB VAL A 110 2.094 -32.301 -7.890 1.00 0.00 H new ATOM 0 HG11 VAL A 110 3.180 -33.410 -5.981 1.00 0.00 H new ATOM 0 HG12 VAL A 110 3.100 -31.646 -5.762 1.00 0.00 H new ATOM 0 HG13 VAL A 110 1.969 -32.703 -4.886 1.00 0.00 H new ATOM 0 HG21 VAL A 110 1.433 -34.589 -7.268 1.00 0.00 H new ATOM 0 HG22 VAL A 110 0.148 -33.930 -6.227 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.081 -33.683 -7.988 1.00 0.00 H new ATOM 1661 N VAL A 111 -1.634 -31.485 -5.787 1.00 0.00 N ATOM 1662 CA VAL A 111 -2.600 -31.735 -4.723 1.00 0.00 C ATOM 1663 C VAL A 111 -3.381 -33.018 -4.981 1.00 0.00 C ATOM 1664 O VAL A 111 -3.770 -33.302 -6.113 1.00 0.00 O ATOM 1665 CB VAL A 111 -3.590 -30.564 -4.579 1.00 0.00 C ATOM 1666 CG1 VAL A 111 -4.615 -30.862 -3.495 1.00 0.00 C ATOM 1667 CG2 VAL A 111 -2.846 -29.271 -4.280 1.00 0.00 C ATOM 0 H VAL A 111 -2.050 -31.257 -6.690 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.033 -31.838 -3.798 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.120 -30.441 -5.523 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.306 -30.024 -3.407 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -5.169 -31.763 -3.756 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.105 -31.013 -2.544 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -3.561 -28.454 -4.181 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -2.288 -29.379 -3.350 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -2.155 -29.052 -5.094 1.00 0.00 H new ATOM 1677 N GLU A 112 -3.609 -33.789 -3.922 1.00 0.00 N ATOM 1678 CA GLU A 112 -4.344 -35.043 -4.035 1.00 0.00 C ATOM 1679 C GLU A 112 -5.032 -35.390 -2.717 1.00 0.00 C ATOM 1680 O GLU A 112 -4.388 -35.468 -1.671 1.00 0.00 O ATOM 1681 CB GLU A 112 -3.403 -36.177 -4.446 1.00 0.00 C ATOM 1682 CG GLU A 112 -2.328 -36.480 -3.415 1.00 0.00 C ATOM 1683 CD GLU A 112 -1.158 -37.246 -4.001 1.00 0.00 C ATOM 1684 OE1 GLU A 112 -0.782 -36.961 -5.157 1.00 0.00 O ATOM 1685 OE2 GLU A 112 -0.619 -38.131 -3.304 1.00 0.00 O ATOM 0 H GLU A 112 -3.295 -33.567 -2.977 1.00 0.00 H new ATOM 0 HA GLU A 112 -5.108 -34.919 -4.803 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -3.990 -37.079 -4.623 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -2.926 -35.917 -5.391 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -1.967 -35.545 -2.986 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -2.764 -37.057 -2.600 1.00 0.00 H new ATOM 1692 N GLU A 113 -6.343 -35.598 -2.778 1.00 0.00 N ATOM 1693 CA GLU A 113 -7.118 -35.936 -1.590 1.00 0.00 C ATOM 1694 C GLU A 113 -8.528 -36.380 -1.968 1.00 0.00 C ATOM 1695 O GLU A 113 -9.325 -35.589 -2.472 1.00 0.00 O ATOM 1696 CB GLU A 113 -7.187 -34.737 -0.640 1.00 0.00 C ATOM 1697 CG GLU A 113 -7.166 -33.395 -1.352 1.00 0.00 C ATOM 1698 CD GLU A 113 -6.810 -32.249 -0.426 1.00 0.00 C ATOM 1699 OE1 GLU A 113 -7.680 -31.840 0.372 1.00 0.00 O ATOM 1700 OE2 GLU A 113 -5.663 -31.760 -0.498 1.00 0.00 O ATOM 0 H GLU A 113 -6.891 -35.539 -3.637 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.618 -36.763 -1.085 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -8.097 -34.808 -0.044 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -6.347 -34.784 0.053 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -6.447 -33.433 -2.170 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -8.144 -33.208 -1.796 1.00 0.00 H new ATOM 1707 N SER A 114 -8.828 -37.651 -1.721 1.00 0.00 N ATOM 1708 CA SER A 114 -10.140 -38.203 -2.039 1.00 0.00 C ATOM 1709 C SER A 114 -10.471 -39.378 -1.124 1.00 0.00 C ATOM 1710 O SER A 114 -9.599 -40.173 -0.775 1.00 0.00 O ATOM 1711 CB SER A 114 -10.187 -38.650 -3.501 1.00 0.00 C ATOM 1712 OG SER A 114 -9.557 -39.908 -3.670 1.00 0.00 O ATOM 0 H SER A 114 -8.180 -38.318 -1.302 1.00 0.00 H new ATOM 0 HA SER A 114 -10.884 -37.422 -1.881 1.00 0.00 H new ATOM 0 HB2 SER A 114 -11.224 -38.711 -3.833 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.695 -37.906 -4.128 1.00 0.00 H new ATOM 0 HG SER A 114 -9.602 -40.172 -4.613 1.00 0.00 H new ATOM 1718 N GLY A 115 -11.740 -39.482 -0.739 1.00 0.00 N ATOM 1719 CA GLY A 115 -12.165 -40.562 0.131 1.00 0.00 C ATOM 1720 C GLY A 115 -12.705 -40.061 1.456 1.00 0.00 C ATOM 1721 O GLY A 115 -13.118 -38.908 1.586 1.00 0.00 O ATOM 0 H GLY A 115 -12.481 -38.837 -1.015 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -12.933 -41.149 -0.372 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -11.323 -41.229 0.314 1.00 0.00 H new ATOM 1725 N PRO A 116 -12.708 -40.940 2.469 1.00 0.00 N ATOM 1726 CA PRO A 116 -13.200 -40.603 3.808 1.00 0.00 C ATOM 1727 C PRO A 116 -12.284 -39.622 4.532 1.00 0.00 C ATOM 1728 O PRO A 116 -11.250 -40.010 5.076 1.00 0.00 O ATOM 1729 CB PRO A 116 -13.216 -41.953 4.530 1.00 0.00 C ATOM 1730 CG PRO A 116 -12.194 -42.773 3.821 1.00 0.00 C ATOM 1731 CD PRO A 116 -12.231 -42.330 2.385 1.00 0.00 C ATOM 0 HA PRO A 116 -14.172 -40.111 3.774 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -12.970 -41.840 5.586 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -14.201 -42.417 4.480 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -11.204 -42.620 4.251 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -12.418 -43.836 3.907 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -11.247 -42.390 1.921 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -12.902 -42.950 1.790 1.00 0.00 H new ATOM 1739 N SER A 117 -12.670 -38.351 4.536 1.00 0.00 N ATOM 1740 CA SER A 117 -11.882 -37.314 5.191 1.00 0.00 C ATOM 1741 C SER A 117 -12.786 -36.305 5.892 1.00 0.00 C ATOM 1742 O SER A 117 -13.638 -35.676 5.264 1.00 0.00 O ATOM 1743 CB SER A 117 -10.994 -36.597 4.171 1.00 0.00 C ATOM 1744 OG SER A 117 -9.924 -37.427 3.755 1.00 0.00 O ATOM 0 H SER A 117 -13.525 -38.014 4.093 1.00 0.00 H new ATOM 0 HA SER A 117 -11.251 -37.792 5.940 1.00 0.00 H new ATOM 0 HB2 SER A 117 -11.590 -36.306 3.306 1.00 0.00 H new ATOM 0 HB3 SER A 117 -10.599 -35.680 4.609 1.00 0.00 H new ATOM 0 HG SER A 117 -9.372 -36.947 3.102 1.00 0.00 H new ATOM 1750 N SER A 118 -12.594 -36.156 7.199 1.00 0.00 N ATOM 1751 CA SER A 118 -13.394 -35.227 7.989 1.00 0.00 C ATOM 1752 C SER A 118 -12.716 -33.864 8.075 1.00 0.00 C ATOM 1753 O SER A 118 -13.309 -32.840 7.737 1.00 0.00 O ATOM 1754 CB SER A 118 -13.623 -35.785 9.394 1.00 0.00 C ATOM 1755 OG SER A 118 -14.242 -34.823 10.231 1.00 0.00 O ATOM 0 H SER A 118 -11.891 -36.667 7.733 1.00 0.00 H new ATOM 0 HA SER A 118 -14.357 -35.104 7.494 1.00 0.00 H new ATOM 0 HB2 SER A 118 -14.247 -36.677 9.337 1.00 0.00 H new ATOM 0 HB3 SER A 118 -12.670 -36.089 9.827 1.00 0.00 H new ATOM 0 HG SER A 118 -14.379 -35.205 11.123 1.00 0.00 H new ATOM 1761 N GLY A 119 -11.466 -33.859 8.530 1.00 0.00 N ATOM 1762 CA GLY A 119 -10.727 -32.616 8.654 1.00 0.00 C ATOM 1763 C GLY A 119 -11.282 -31.716 9.740 1.00 0.00 C ATOM 1764 O GLY A 119 -12.366 -31.965 10.268 1.00 0.00 O ATOM 0 H GLY A 119 -10.953 -34.693 8.815 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -9.682 -32.838 8.870 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -10.750 -32.087 7.701 1.00 0.00 H new TER 1768 GLY A 119