USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1104 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 45 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 84 HIS : no HE2:sc= -16.6! C(o=-17!,f=-18!) USER MOD Set 2.1: A 32 TYR OH : rot 117:sc= 0.224! USER MOD Set 2.2: A 34 SER OG : rot -46:sc= -3.13! USER MOD Set 2.3: A 36 HIS : no HD1:sc= -5.71! C(o=-8.6!,f=-8.2!) USER MOD Set 2.4: A 41 CYS SG : rot 160:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 169:sc= -0.215 (180deg=-1.05!) USER MOD Single : A 5 GLN : amide:sc= -0.133 K(o=-0.13,f=-1.2) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 159:sc= -0.631 (180deg=-1.61!) USER MOD Single : A 13 ASN : amide:sc= -1.38! K(o=-1.4!,f=-0.26) USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 ASN : amide:sc= -9.75! C(o=-9.8!,f=-3.6!) USER MOD Single : A 24 LYS NZ :NH3+ -122:sc= -0.0505 (180deg=-0.688) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 CYS SG : rot -40:sc= -8.89! USER MOD Single : A 51 MET CE :methyl -125:sc= -2.37 (180deg=-7.05!) USER MOD Single : A 52 TYR OH : rot 180:sc= -1.58 USER MOD Single : A 53 SER OG : rot 70:sc= 0.399! USER MOD Single : A 59 SER OG : rot -38:sc= 0.331! USER MOD Single : A 68 SER OG : rot -85:sc= -5.2! USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -164:sc= -0.118 USER MOD Single : A 76 MET CE :methyl -153:sc= -0.219 (180deg=-2.11) USER MOD Single : A 78 GLN : amide:sc= -0.268 K(o=-0.27,f=-3.2!) USER MOD Single : A 79 TYR OH : rot 140:sc= 0.851 USER MOD Single : A 80 MET CE :methyl 176:sc= -2.2! (180deg=-2.24!) USER MOD Single : A 81 MET CE :methyl 147:sc= -0.599 (180deg=-2.76!) USER MOD Single : A 83 SER OG : rot 100:sc= -0.126 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot -72:sc= -0.677 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.559 K(o=-0.56,f=-1.7) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.0309 USER MOD Single : A 103 LYS NZ :NH3+ 178:sc= -0.995 (180deg=-1.1) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -60:sc= 1.1 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -161:sc= -0.158 (180deg=-0.712) USER MOD Single : A 120 THR OG1 : rot -53:sc= 0.321 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 163:sc= -16.9! (180deg=-17.8!) USER MOD Single : A 125 ASN : amide:sc= -7.22! K(o=-7.2!,f=-2) USER MOD Single : A 131 GLN : amide:sc= -15.3! C(o=-15!,f=-26!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.0294 K(o=-0.029,f=-1) USER MOD Single : A 140 ASN : amide:sc= -1.5 K(o=-1.5,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 102.650 -12.565 9.268 1.00 0.00 N ATOM 2 CA MET A 1 102.202 -13.671 8.377 1.00 0.00 C ATOM 3 C MET A 1 101.199 -13.130 7.363 1.00 0.00 C ATOM 4 O MET A 1 99.988 -13.233 7.558 1.00 0.00 O ATOM 5 CB MET A 1 101.551 -14.769 9.221 1.00 0.00 C ATOM 6 CG MET A 1 101.425 -16.046 8.387 1.00 0.00 C ATOM 7 SD MET A 1 100.018 -15.894 7.258 1.00 0.00 S ATOM 8 CE MET A 1 98.757 -16.552 8.376 1.00 0.00 C ATOM 0 H1 MET A 1 103.183 -12.959 10.069 1.00 0.00 H new ATOM 0 H2 MET A 1 103.259 -11.914 8.733 1.00 0.00 H new ATOM 0 H3 MET A 1 101.821 -12.049 9.625 1.00 0.00 H new ATOM 0 HA MET A 1 103.058 -14.087 7.846 1.00 0.00 H new ATOM 0 HB2 MET A 1 102.149 -14.961 10.112 1.00 0.00 H new ATOM 0 HB3 MET A 1 100.567 -14.446 9.562 1.00 0.00 H new ATOM 0 HG2 MET A 1 102.342 -16.216 7.822 1.00 0.00 H new ATOM 0 HG3 MET A 1 101.289 -16.908 9.040 1.00 0.00 H new ATOM 0 HE1 MET A 1 97.789 -16.550 7.874 1.00 0.00 H new ATOM 0 HE2 MET A 1 99.017 -17.572 8.658 1.00 0.00 H new ATOM 0 HE3 MET A 1 98.704 -15.931 9.270 1.00 0.00 H new ATOM 20 N GLU A 2 101.712 -12.554 6.281 1.00 0.00 N ATOM 21 CA GLU A 2 100.852 -12.000 5.242 1.00 0.00 C ATOM 22 C GLU A 2 101.640 -11.782 3.953 1.00 0.00 C ATOM 23 O GLU A 2 101.162 -11.130 3.026 1.00 0.00 O ATOM 24 CB GLU A 2 100.257 -10.671 5.709 1.00 0.00 C ATOM 25 CG GLU A 2 101.371 -9.778 6.258 1.00 0.00 C ATOM 26 CD GLU A 2 101.917 -10.362 7.556 1.00 0.00 C ATOM 27 OE1 GLU A 2 101.241 -10.247 8.566 1.00 0.00 O ATOM 28 OE2 GLU A 2 103.002 -10.919 7.523 1.00 0.00 O ATOM 0 H GLU A 2 102.712 -12.459 6.101 1.00 0.00 H new ATOM 0 HA GLU A 2 100.047 -12.709 5.047 1.00 0.00 H new ATOM 0 HB2 GLU A 2 99.754 -10.174 4.879 1.00 0.00 H new ATOM 0 HB3 GLU A 2 99.505 -10.847 6.478 1.00 0.00 H new ATOM 0 HG2 GLU A 2 102.172 -9.690 5.524 1.00 0.00 H new ATOM 0 HG3 GLU A 2 100.988 -8.773 6.435 1.00 0.00 H new ATOM 35 N PHE A 3 102.848 -12.334 3.904 1.00 0.00 N ATOM 36 CA PHE A 3 103.693 -12.193 2.725 1.00 0.00 C ATOM 37 C PHE A 3 104.180 -10.755 2.582 1.00 0.00 C ATOM 38 O PHE A 3 103.656 -9.845 3.226 1.00 0.00 O ATOM 39 CB PHE A 3 102.915 -12.597 1.471 1.00 0.00 C ATOM 40 CG PHE A 3 101.763 -13.495 1.861 1.00 0.00 C ATOM 41 CD1 PHE A 3 101.979 -14.574 2.725 1.00 0.00 C ATOM 42 CD2 PHE A 3 100.481 -13.246 1.357 1.00 0.00 C ATOM 43 CE1 PHE A 3 100.913 -15.406 3.086 1.00 0.00 C ATOM 44 CE2 PHE A 3 99.414 -14.077 1.719 1.00 0.00 C ATOM 45 CZ PHE A 3 99.630 -15.158 2.583 1.00 0.00 C ATOM 0 H PHE A 3 103.261 -12.879 4.661 1.00 0.00 H new ATOM 0 HA PHE A 3 104.557 -12.847 2.842 1.00 0.00 H new ATOM 0 HB2 PHE A 3 102.542 -11.710 0.960 1.00 0.00 H new ATOM 0 HB3 PHE A 3 103.573 -13.114 0.772 1.00 0.00 H new ATOM 0 HD1 PHE A 3 102.968 -14.765 3.113 1.00 0.00 H new ATOM 0 HD2 PHE A 3 100.315 -12.413 0.689 1.00 0.00 H new ATOM 0 HE1 PHE A 3 101.080 -16.239 3.752 1.00 0.00 H new ATOM 0 HE2 PHE A 3 98.424 -13.884 1.332 1.00 0.00 H new ATOM 0 HZ PHE A 3 98.807 -15.800 2.861 1.00 0.00 H new ATOM 55 N ILE A 4 105.183 -10.556 1.733 1.00 0.00 N ATOM 56 CA ILE A 4 105.732 -9.222 1.513 1.00 0.00 C ATOM 57 C ILE A 4 104.704 -8.325 0.836 1.00 0.00 C ATOM 58 O ILE A 4 104.373 -7.250 1.338 1.00 0.00 O ATOM 59 CB ILE A 4 106.986 -9.310 0.642 1.00 0.00 C ATOM 60 CG1 ILE A 4 107.019 -10.665 -0.069 1.00 0.00 C ATOM 61 CG2 ILE A 4 108.230 -9.164 1.520 1.00 0.00 C ATOM 62 CD1 ILE A 4 107.996 -10.600 -1.244 1.00 0.00 C ATOM 0 H ILE A 4 105.630 -11.295 1.190 1.00 0.00 H new ATOM 0 HA ILE A 4 105.991 -8.793 2.481 1.00 0.00 H new ATOM 0 HB ILE A 4 106.970 -8.511 -0.099 1.00 0.00 H new ATOM 0 HG12 ILE A 4 107.323 -11.446 0.628 1.00 0.00 H new ATOM 0 HG13 ILE A 4 106.022 -10.925 -0.425 1.00 0.00 H new ATOM 0 HG21 ILE A 4 109.123 -9.227 0.899 1.00 0.00 H new ATOM 0 HG22 ILE A 4 108.207 -8.199 2.026 1.00 0.00 H new ATOM 0 HG23 ILE A 4 108.247 -9.962 2.262 1.00 0.00 H new ATOM 0 HD11 ILE A 4 108.020 -11.565 -1.751 1.00 0.00 H new ATOM 0 HD12 ILE A 4 107.672 -9.830 -1.944 1.00 0.00 H new ATOM 0 HD13 ILE A 4 108.993 -10.359 -0.875 1.00 0.00 H new ATOM 74 N GLN A 5 104.203 -8.774 -0.307 1.00 0.00 N ATOM 75 CA GLN A 5 103.213 -8.007 -1.054 1.00 0.00 C ATOM 76 C GLN A 5 102.300 -7.237 -0.104 1.00 0.00 C ATOM 77 O GLN A 5 101.791 -7.791 0.870 1.00 0.00 O ATOM 78 CB GLN A 5 102.372 -8.944 -1.922 1.00 0.00 C ATOM 79 CG GLN A 5 103.270 -9.624 -2.957 1.00 0.00 C ATOM 80 CD GLN A 5 102.459 -9.974 -4.201 1.00 0.00 C ATOM 81 OE1 GLN A 5 101.630 -9.180 -4.646 1.00 0.00 O ATOM 82 NE2 GLN A 5 102.650 -11.123 -4.791 1.00 0.00 N ATOM 0 H GLN A 5 104.464 -9.662 -0.736 1.00 0.00 H new ATOM 0 HA GLN A 5 103.739 -7.296 -1.690 1.00 0.00 H new ATOM 0 HB2 GLN A 5 101.884 -9.694 -1.299 1.00 0.00 H new ATOM 0 HB3 GLN A 5 101.583 -8.383 -2.422 1.00 0.00 H new ATOM 0 HG2 GLN A 5 104.095 -8.964 -3.224 1.00 0.00 H new ATOM 0 HG3 GLN A 5 103.709 -10.527 -2.533 1.00 0.00 H new ATOM 0 HE21 GLN A 5 103.338 -11.779 -4.420 1.00 0.00 H new ATOM 0 HE22 GLN A 5 102.112 -11.365 -5.623 1.00 0.00 H new ATOM 91 N GLY A 6 102.098 -5.955 -0.396 1.00 0.00 N ATOM 92 CA GLY A 6 101.245 -5.116 0.436 1.00 0.00 C ATOM 93 C GLY A 6 102.065 -4.053 1.160 1.00 0.00 C ATOM 94 O GLY A 6 101.513 -3.168 1.812 1.00 0.00 O ATOM 0 H GLY A 6 102.511 -5.478 -1.197 1.00 0.00 H new ATOM 0 HA2 GLY A 6 100.486 -4.637 -0.182 1.00 0.00 H new ATOM 0 HA3 GLY A 6 100.720 -5.734 1.164 1.00 0.00 H new ATOM 98 N ILE A 7 103.385 -4.150 1.042 1.00 0.00 N ATOM 99 CA ILE A 7 104.272 -3.201 1.687 1.00 0.00 C ATOM 100 C ILE A 7 104.801 -2.187 0.678 1.00 0.00 C ATOM 101 O ILE A 7 104.525 -2.282 -0.518 1.00 0.00 O ATOM 102 CB ILE A 7 105.442 -3.948 2.320 1.00 0.00 C ATOM 103 CG1 ILE A 7 106.158 -4.773 1.247 1.00 0.00 C ATOM 104 CG2 ILE A 7 104.924 -4.877 3.419 1.00 0.00 C ATOM 105 CD1 ILE A 7 107.285 -5.580 1.893 1.00 0.00 C ATOM 0 H ILE A 7 103.859 -4.876 0.506 1.00 0.00 H new ATOM 0 HA ILE A 7 103.713 -2.668 2.456 1.00 0.00 H new ATOM 0 HB ILE A 7 106.139 -3.231 2.754 1.00 0.00 H new ATOM 0 HG12 ILE A 7 105.452 -5.443 0.756 1.00 0.00 H new ATOM 0 HG13 ILE A 7 106.562 -4.116 0.477 1.00 0.00 H new ATOM 0 HG21 ILE A 7 105.761 -5.410 3.870 1.00 0.00 H new ATOM 0 HG22 ILE A 7 104.415 -4.289 4.182 1.00 0.00 H new ATOM 0 HG23 ILE A 7 104.226 -5.596 2.989 1.00 0.00 H new ATOM 0 HD11 ILE A 7 107.795 -6.168 1.130 1.00 0.00 H new ATOM 0 HD12 ILE A 7 107.996 -4.900 2.363 1.00 0.00 H new ATOM 0 HD13 ILE A 7 106.868 -6.248 2.647 1.00 0.00 H new ATOM 117 N LYS A 8 105.571 -1.221 1.169 1.00 0.00 N ATOM 118 CA LYS A 8 106.143 -0.196 0.305 1.00 0.00 C ATOM 119 C LYS A 8 107.473 -0.673 -0.271 1.00 0.00 C ATOM 120 O LYS A 8 108.011 -1.694 0.156 1.00 0.00 O ATOM 121 CB LYS A 8 106.358 1.096 1.096 1.00 0.00 C ATOM 122 CG LYS A 8 107.584 0.947 1.997 1.00 0.00 C ATOM 123 CD LYS A 8 107.393 -0.253 2.926 1.00 0.00 C ATOM 124 CE LYS A 8 108.437 -0.206 4.044 1.00 0.00 C ATOM 125 NZ LYS A 8 107.917 -0.929 5.239 1.00 0.00 N ATOM 0 H LYS A 8 105.812 -1.127 2.156 1.00 0.00 H new ATOM 0 HA LYS A 8 105.450 -0.004 -0.514 1.00 0.00 H new ATOM 0 HB2 LYS A 8 106.496 1.934 0.413 1.00 0.00 H new ATOM 0 HB3 LYS A 8 105.476 1.317 1.698 1.00 0.00 H new ATOM 0 HG2 LYS A 8 108.480 0.812 1.391 1.00 0.00 H new ATOM 0 HG3 LYS A 8 107.730 1.854 2.583 1.00 0.00 H new ATOM 0 HD2 LYS A 8 106.389 -0.241 3.351 1.00 0.00 H new ATOM 0 HD3 LYS A 8 107.490 -1.181 2.363 1.00 0.00 H new ATOM 0 HE2 LYS A 8 109.368 -0.662 3.706 1.00 0.00 H new ATOM 0 HE3 LYS A 8 108.664 0.829 4.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 108.626 -0.898 5.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 107.040 -0.475 5.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 107.722 -1.919 4.988 1.00 0.00 H new ATOM 139 N LEU A 9 108.000 0.074 -1.236 1.00 0.00 N ATOM 140 CA LEU A 9 109.272 -0.282 -1.857 1.00 0.00 C ATOM 141 C LEU A 9 109.930 0.955 -2.462 1.00 0.00 C ATOM 142 O LEU A 9 109.259 1.948 -2.741 1.00 0.00 O ATOM 143 CB LEU A 9 109.049 -1.336 -2.944 1.00 0.00 C ATOM 144 CG LEU A 9 109.897 -2.574 -2.641 1.00 0.00 C ATOM 145 CD1 LEU A 9 109.367 -3.265 -1.385 1.00 0.00 C ATOM 146 CD2 LEU A 9 109.819 -3.544 -3.821 1.00 0.00 C ATOM 0 H LEU A 9 107.570 0.923 -1.603 1.00 0.00 H new ATOM 0 HA LEU A 9 109.930 -0.693 -1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 9 107.994 -1.608 -2.990 1.00 0.00 H new ATOM 0 HB3 LEU A 9 109.317 -0.929 -3.919 1.00 0.00 H new ATOM 0 HG LEU A 9 110.932 -2.272 -2.480 1.00 0.00 H new ATOM 0 HD11 LEU A 9 109.972 -4.146 -1.171 1.00 0.00 H new ATOM 0 HD12 LEU A 9 109.418 -2.576 -0.542 1.00 0.00 H new ATOM 0 HD13 LEU A 9 108.332 -3.566 -1.545 1.00 0.00 H new ATOM 0 HD21 LEU A 9 110.422 -4.426 -3.607 1.00 0.00 H new ATOM 0 HD22 LEU A 9 108.783 -3.843 -3.979 1.00 0.00 H new ATOM 0 HD23 LEU A 9 110.196 -3.055 -4.719 1.00 0.00 H new ATOM 158 N VAL A 10 111.245 0.899 -2.658 1.00 0.00 N ATOM 159 CA VAL A 10 111.963 2.036 -3.225 1.00 0.00 C ATOM 160 C VAL A 10 112.626 1.666 -4.548 1.00 0.00 C ATOM 161 O VAL A 10 113.572 0.880 -4.583 1.00 0.00 O ATOM 162 CB VAL A 10 113.025 2.527 -2.240 1.00 0.00 C ATOM 163 CG1 VAL A 10 113.892 3.593 -2.914 1.00 0.00 C ATOM 164 CG2 VAL A 10 112.338 3.132 -1.013 1.00 0.00 C ATOM 0 H VAL A 10 111.827 0.091 -2.436 1.00 0.00 H new ATOM 0 HA VAL A 10 111.241 2.830 -3.412 1.00 0.00 H new ATOM 0 HB VAL A 10 113.652 1.690 -1.933 1.00 0.00 H new ATOM 0 HG11 VAL A 10 114.649 3.943 -2.212 1.00 0.00 H new ATOM 0 HG12 VAL A 10 114.379 3.165 -3.790 1.00 0.00 H new ATOM 0 HG13 VAL A 10 113.266 4.431 -3.220 1.00 0.00 H new ATOM 0 HG21 VAL A 10 113.093 3.483 -0.309 1.00 0.00 H new ATOM 0 HG22 VAL A 10 111.713 3.970 -1.322 1.00 0.00 H new ATOM 0 HG23 VAL A 10 111.718 2.375 -0.533 1.00 0.00 H new ATOM 174 N LYS A 11 112.125 2.246 -5.636 1.00 0.00 N ATOM 175 CA LYS A 11 112.676 1.981 -6.959 1.00 0.00 C ATOM 176 C LYS A 11 114.102 2.513 -7.062 1.00 0.00 C ATOM 177 O LYS A 11 114.403 3.606 -6.579 1.00 0.00 O ATOM 178 CB LYS A 11 111.807 2.643 -8.030 1.00 0.00 C ATOM 179 CG LYS A 11 110.411 2.018 -8.014 1.00 0.00 C ATOM 180 CD LYS A 11 109.688 2.350 -9.320 1.00 0.00 C ATOM 181 CE LYS A 11 110.447 1.730 -10.495 1.00 0.00 C ATOM 182 NZ LYS A 11 109.474 1.166 -11.472 1.00 0.00 N ATOM 0 H LYS A 11 111.342 2.899 -5.626 1.00 0.00 H new ATOM 0 HA LYS A 11 112.689 0.902 -7.116 1.00 0.00 H new ATOM 0 HB2 LYS A 11 111.739 3.715 -7.846 1.00 0.00 H new ATOM 0 HB3 LYS A 11 112.262 2.516 -9.012 1.00 0.00 H new ATOM 0 HG2 LYS A 11 110.486 0.937 -7.892 1.00 0.00 H new ATOM 0 HG3 LYS A 11 109.842 2.396 -7.165 1.00 0.00 H new ATOM 0 HD2 LYS A 11 108.667 1.968 -9.290 1.00 0.00 H new ATOM 0 HD3 LYS A 11 109.621 3.431 -9.446 1.00 0.00 H new ATOM 0 HE2 LYS A 11 111.069 2.483 -10.978 1.00 0.00 H new ATOM 0 HE3 LYS A 11 111.115 0.947 -10.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 109.989 0.744 -12.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 108.899 0.435 -11.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 108.854 1.924 -11.821 1.00 0.00 H new ATOM 196 N LYS A 12 114.975 1.732 -7.692 1.00 0.00 N ATOM 197 CA LYS A 12 116.368 2.132 -7.852 1.00 0.00 C ATOM 198 C LYS A 12 116.465 3.605 -8.237 1.00 0.00 C ATOM 199 O LYS A 12 117.399 4.300 -7.838 1.00 0.00 O ATOM 200 CB LYS A 12 117.035 1.275 -8.932 1.00 0.00 C ATOM 201 CG LYS A 12 116.898 1.965 -10.291 1.00 0.00 C ATOM 202 CD LYS A 12 117.285 0.987 -11.402 1.00 0.00 C ATOM 203 CE LYS A 12 116.643 1.429 -12.719 1.00 0.00 C ATOM 204 NZ LYS A 12 116.396 2.898 -12.684 1.00 0.00 N ATOM 0 H LYS A 12 114.744 0.825 -8.097 1.00 0.00 H new ATOM 0 HA LYS A 12 116.880 1.984 -6.901 1.00 0.00 H new ATOM 0 HB2 LYS A 12 118.088 1.125 -8.693 1.00 0.00 H new ATOM 0 HB3 LYS A 12 116.572 0.289 -8.965 1.00 0.00 H new ATOM 0 HG2 LYS A 12 115.873 2.308 -10.435 1.00 0.00 H new ATOM 0 HG3 LYS A 12 117.538 2.847 -10.329 1.00 0.00 H new ATOM 0 HD2 LYS A 12 118.369 0.951 -11.508 1.00 0.00 H new ATOM 0 HD3 LYS A 12 116.956 -0.020 -11.145 1.00 0.00 H new ATOM 0 HE2 LYS A 12 117.296 1.179 -13.556 1.00 0.00 H new ATOM 0 HE3 LYS A 12 115.705 0.896 -12.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 116.304 3.258 -13.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 115.519 3.090 -12.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 117.193 3.373 -12.213 1.00 0.00 H new ATOM 218 N ASN A 13 115.496 4.073 -9.016 1.00 0.00 N ATOM 219 CA ASN A 13 115.484 5.465 -9.450 1.00 0.00 C ATOM 220 C ASN A 13 115.208 6.388 -8.268 1.00 0.00 C ATOM 221 O ASN A 13 114.817 7.542 -8.446 1.00 0.00 O ATOM 222 CB ASN A 13 114.410 5.669 -10.520 1.00 0.00 C ATOM 223 CG ASN A 13 114.939 6.584 -11.620 1.00 0.00 C ATOM 224 OD1 ASN A 13 114.191 7.394 -12.168 1.00 0.00 O ATOM 225 ND2 ASN A 13 116.192 6.505 -11.977 1.00 0.00 N ATOM 0 H ASN A 13 114.714 3.514 -9.358 1.00 0.00 H new ATOM 0 HA ASN A 13 116.462 5.706 -9.867 1.00 0.00 H new ATOM 0 HB2 ASN A 13 114.119 4.708 -10.943 1.00 0.00 H new ATOM 0 HB3 ASN A 13 113.516 6.104 -10.072 1.00 0.00 H new ATOM 0 HD21 ASN A 13 116.553 7.115 -12.711 1.00 0.00 H new ATOM 0 HD22 ASN A 13 116.811 5.834 -11.522 1.00 0.00 H new ATOM 232 N ARG A 14 115.414 5.872 -7.061 1.00 0.00 N ATOM 233 CA ARG A 14 115.183 6.659 -5.856 1.00 0.00 C ATOM 234 C ARG A 14 113.699 6.972 -5.701 1.00 0.00 C ATOM 235 O ARG A 14 113.321 7.905 -4.993 1.00 0.00 O ATOM 236 CB ARG A 14 115.979 7.965 -5.925 1.00 0.00 C ATOM 237 CG ARG A 14 117.086 7.948 -4.869 1.00 0.00 C ATOM 238 CD ARG A 14 116.468 8.089 -3.477 1.00 0.00 C ATOM 239 NE ARG A 14 117.322 8.911 -2.626 1.00 0.00 N ATOM 240 CZ ARG A 14 117.121 10.219 -2.511 1.00 0.00 C ATOM 241 NH1 ARG A 14 116.147 10.790 -3.165 1.00 0.00 N ATOM 242 NH2 ARG A 14 117.898 10.933 -1.743 1.00 0.00 N ATOM 0 H ARG A 14 115.738 4.920 -6.892 1.00 0.00 H new ATOM 0 HA ARG A 14 115.513 6.079 -4.994 1.00 0.00 H new ATOM 0 HB2 ARG A 14 116.412 8.087 -6.918 1.00 0.00 H new ATOM 0 HB3 ARG A 14 115.317 8.815 -5.759 1.00 0.00 H new ATOM 0 HG2 ARG A 14 117.651 7.018 -4.935 1.00 0.00 H new ATOM 0 HG3 ARG A 14 117.788 8.762 -5.050 1.00 0.00 H new ATOM 0 HD2 ARG A 14 115.478 8.539 -3.555 1.00 0.00 H new ATOM 0 HD3 ARG A 14 116.336 7.104 -3.029 1.00 0.00 H new ATOM 0 HE ARG A 14 118.086 8.474 -2.111 1.00 0.00 H new ATOM 0 HH11 ARG A 14 115.539 10.232 -3.765 1.00 0.00 H new ATOM 0 HH12 ARG A 14 115.993 11.794 -3.076 1.00 0.00 H new ATOM 0 HH21 ARG A 14 118.659 10.487 -1.231 1.00 0.00 H new ATOM 0 HH22 ARG A 14 117.744 11.937 -1.654 1.00 0.00 H new ATOM 256 N CYS A 15 112.863 6.186 -6.373 1.00 0.00 N ATOM 257 CA CYS A 15 111.421 6.388 -6.308 1.00 0.00 C ATOM 258 C CYS A 15 110.786 5.415 -5.321 1.00 0.00 C ATOM 259 O CYS A 15 111.444 4.500 -4.827 1.00 0.00 O ATOM 260 CB CYS A 15 110.804 6.189 -7.693 1.00 0.00 C ATOM 261 SG CYS A 15 109.823 7.646 -8.132 1.00 0.00 S ATOM 0 H CYS A 15 113.157 5.409 -6.965 1.00 0.00 H new ATOM 0 HA CYS A 15 111.231 7.406 -5.968 1.00 0.00 H new ATOM 0 HB2 CYS A 15 111.588 6.029 -8.433 1.00 0.00 H new ATOM 0 HB3 CYS A 15 110.175 5.299 -7.698 1.00 0.00 H new ATOM 0 HG CYS A 15 109.300 7.478 -9.310 1.00 0.00 H new ATOM 267 N GLU A 16 109.504 5.617 -5.040 1.00 0.00 N ATOM 268 CA GLU A 16 108.789 4.751 -4.113 1.00 0.00 C ATOM 269 C GLU A 16 107.643 4.038 -4.823 1.00 0.00 C ATOM 270 O GLU A 16 107.088 4.548 -5.795 1.00 0.00 O ATOM 271 CB GLU A 16 108.240 5.570 -2.944 1.00 0.00 C ATOM 272 CG GLU A 16 107.539 6.815 -3.486 1.00 0.00 C ATOM 273 CD GLU A 16 106.863 7.570 -2.347 1.00 0.00 C ATOM 274 OE1 GLU A 16 107.477 7.695 -1.299 1.00 0.00 O ATOM 275 OE2 GLU A 16 105.742 8.012 -2.538 1.00 0.00 O ATOM 0 H GLU A 16 108.942 6.369 -5.439 1.00 0.00 H new ATOM 0 HA GLU A 16 109.487 4.005 -3.733 1.00 0.00 H new ATOM 0 HB2 GLU A 16 107.541 4.970 -2.361 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.050 5.857 -2.274 1.00 0.00 H new ATOM 0 HG2 GLU A 16 108.262 7.462 -3.984 1.00 0.00 H new ATOM 0 HG3 GLU A 16 106.799 6.529 -4.234 1.00 0.00 H new ATOM 282 N VAL A 17 107.295 2.855 -4.328 1.00 0.00 N ATOM 283 CA VAL A 17 106.216 2.071 -4.918 1.00 0.00 C ATOM 284 C VAL A 17 105.794 0.951 -3.973 1.00 0.00 C ATOM 285 O VAL A 17 106.446 0.703 -2.959 1.00 0.00 O ATOM 286 CB VAL A 17 106.673 1.467 -6.247 1.00 0.00 C ATOM 287 CG1 VAL A 17 106.715 2.555 -7.322 1.00 0.00 C ATOM 288 CG2 VAL A 17 108.070 0.866 -6.076 1.00 0.00 C ATOM 0 H VAL A 17 107.743 2.419 -3.522 1.00 0.00 H new ATOM 0 HA VAL A 17 105.366 2.731 -5.091 1.00 0.00 H new ATOM 0 HB VAL A 17 105.973 0.689 -6.550 1.00 0.00 H new ATOM 0 HG11 VAL A 17 107.041 2.120 -8.267 1.00 0.00 H new ATOM 0 HG12 VAL A 17 105.721 2.985 -7.444 1.00 0.00 H new ATOM 0 HG13 VAL A 17 107.413 3.336 -7.022 1.00 0.00 H new ATOM 0 HG21 VAL A 17 108.399 0.435 -7.021 1.00 0.00 H new ATOM 0 HG22 VAL A 17 108.767 1.647 -5.771 1.00 0.00 H new ATOM 0 HG23 VAL A 17 108.041 0.088 -5.313 1.00 0.00 H new ATOM 298 N ASN A 18 104.702 0.275 -4.314 1.00 0.00 N ATOM 299 CA ASN A 18 104.206 -0.818 -3.489 1.00 0.00 C ATOM 300 C ASN A 18 104.643 -2.162 -4.064 1.00 0.00 C ATOM 301 O ASN A 18 104.226 -2.545 -5.157 1.00 0.00 O ATOM 302 CB ASN A 18 102.680 -0.763 -3.410 1.00 0.00 C ATOM 303 CG ASN A 18 102.237 0.524 -2.723 1.00 0.00 C ATOM 304 OD1 ASN A 18 101.996 1.531 -3.388 1.00 0.00 O ATOM 305 ND2 ASN A 18 102.115 0.551 -1.425 1.00 0.00 N ATOM 0 H ASN A 18 104.148 0.463 -5.149 1.00 0.00 H new ATOM 0 HA ASN A 18 104.623 -0.712 -2.487 1.00 0.00 H new ATOM 0 HB2 ASN A 18 102.254 -0.815 -4.412 1.00 0.00 H new ATOM 0 HB3 ASN A 18 102.305 -1.626 -2.859 1.00 0.00 H new ATOM 0 HD21 ASN A 18 101.819 1.408 -0.958 1.00 0.00 H new ATOM 0 HD22 ASN A 18 102.315 -0.285 -0.876 1.00 0.00 H new ATOM 312 N ALA A 19 105.485 -2.872 -3.320 1.00 0.00 N ATOM 313 CA ALA A 19 105.974 -4.173 -3.764 1.00 0.00 C ATOM 314 C ALA A 19 104.887 -4.929 -4.521 1.00 0.00 C ATOM 315 O ALA A 19 105.179 -5.802 -5.338 1.00 0.00 O ATOM 316 CB ALA A 19 106.427 -4.998 -2.558 1.00 0.00 C ATOM 0 H ALA A 19 105.841 -2.571 -2.413 1.00 0.00 H new ATOM 0 HA ALA A 19 106.819 -4.012 -4.434 1.00 0.00 H new ATOM 0 HB1 ALA A 19 106.791 -5.968 -2.897 1.00 0.00 H new ATOM 0 HB2 ALA A 19 107.227 -4.472 -2.037 1.00 0.00 H new ATOM 0 HB3 ALA A 19 105.586 -5.143 -1.880 1.00 0.00 H new ATOM 322 N ASN A 20 103.633 -4.592 -4.239 1.00 0.00 N ATOM 323 CA ASN A 20 102.509 -5.249 -4.896 1.00 0.00 C ATOM 324 C ASN A 20 102.620 -5.125 -6.410 1.00 0.00 C ATOM 325 O ASN A 20 102.668 -6.126 -7.125 1.00 0.00 O ATOM 326 CB ASN A 20 101.196 -4.619 -4.427 1.00 0.00 C ATOM 327 CG ASN A 20 100.420 -5.611 -3.566 1.00 0.00 C ATOM 328 OD1 ASN A 20 99.369 -6.103 -3.978 1.00 0.00 O ATOM 329 ND2 ASN A 20 100.877 -5.933 -2.387 1.00 0.00 N ATOM 0 H ASN A 20 103.370 -3.873 -3.565 1.00 0.00 H new ATOM 0 HA ASN A 20 102.525 -6.306 -4.631 1.00 0.00 H new ATOM 0 HB2 ASN A 20 101.401 -3.713 -3.857 1.00 0.00 H new ATOM 0 HB3 ASN A 20 100.596 -4.325 -5.288 1.00 0.00 H new ATOM 0 HD21 ASN A 20 100.363 -6.594 -1.804 1.00 0.00 H new ATOM 0 HD22 ASN A 20 101.748 -5.524 -2.048 1.00 0.00 H new ATOM 336 N GLU A 21 102.654 -3.888 -6.894 1.00 0.00 N ATOM 337 CA GLU A 21 102.753 -3.641 -8.328 1.00 0.00 C ATOM 338 C GLU A 21 104.204 -3.422 -8.739 1.00 0.00 C ATOM 339 O GLU A 21 104.577 -3.663 -9.888 1.00 0.00 O ATOM 340 CB GLU A 21 101.923 -2.412 -8.704 1.00 0.00 C ATOM 341 CG GLU A 21 100.497 -2.577 -8.175 1.00 0.00 C ATOM 342 CD GLU A 21 99.635 -1.403 -8.628 1.00 0.00 C ATOM 343 OE1 GLU A 21 99.801 -0.972 -9.756 1.00 0.00 O ATOM 344 OE2 GLU A 21 98.821 -0.954 -7.838 1.00 0.00 O ATOM 0 H GLU A 21 102.615 -3.046 -6.319 1.00 0.00 H new ATOM 0 HA GLU A 21 102.369 -4.515 -8.854 1.00 0.00 H new ATOM 0 HB2 GLU A 21 102.375 -1.513 -8.286 1.00 0.00 H new ATOM 0 HB3 GLU A 21 101.908 -2.287 -9.787 1.00 0.00 H new ATOM 0 HG2 GLU A 21 100.072 -3.513 -8.538 1.00 0.00 H new ATOM 0 HG3 GLU A 21 100.508 -2.632 -7.086 1.00 0.00 H new ATOM 351 N ALA A 22 105.020 -2.963 -7.797 1.00 0.00 N ATOM 352 CA ALA A 22 106.429 -2.714 -8.078 1.00 0.00 C ATOM 353 C ALA A 22 107.141 -4.012 -8.446 1.00 0.00 C ATOM 354 O ALA A 22 108.054 -4.018 -9.269 1.00 0.00 O ATOM 355 CB ALA A 22 107.104 -2.089 -6.856 1.00 0.00 C ATOM 0 H ALA A 22 104.734 -2.757 -6.840 1.00 0.00 H new ATOM 0 HA ALA A 22 106.494 -2.026 -8.921 1.00 0.00 H new ATOM 0 HB1 ALA A 22 108.156 -1.907 -7.075 1.00 0.00 H new ATOM 0 HB2 ALA A 22 106.615 -1.146 -6.613 1.00 0.00 H new ATOM 0 HB3 ALA A 22 107.023 -2.769 -6.008 1.00 0.00 H new ATOM 361 N LEU A 23 106.714 -5.109 -7.832 1.00 0.00 N ATOM 362 CA LEU A 23 107.318 -6.407 -8.100 1.00 0.00 C ATOM 363 C LEU A 23 106.896 -6.921 -9.472 1.00 0.00 C ATOM 364 O LEU A 23 106.922 -8.123 -9.729 1.00 0.00 O ATOM 365 CB LEU A 23 106.898 -7.411 -7.025 1.00 0.00 C ATOM 366 CG LEU A 23 107.698 -7.154 -5.747 1.00 0.00 C ATOM 367 CD1 LEU A 23 107.010 -7.840 -4.566 1.00 0.00 C ATOM 368 CD2 LEU A 23 109.112 -7.717 -5.910 1.00 0.00 C ATOM 0 H LEU A 23 105.956 -5.126 -7.149 1.00 0.00 H new ATOM 0 HA LEU A 23 108.402 -6.292 -8.085 1.00 0.00 H new ATOM 0 HB2 LEU A 23 105.831 -7.319 -6.823 1.00 0.00 H new ATOM 0 HB3 LEU A 23 107.070 -8.429 -7.376 1.00 0.00 H new ATOM 0 HG LEU A 23 107.752 -6.081 -5.562 1.00 0.00 H new ATOM 0 HD11 LEU A 23 107.581 -7.656 -3.656 1.00 0.00 H new ATOM 0 HD12 LEU A 23 106.003 -7.440 -4.450 1.00 0.00 H new ATOM 0 HD13 LEU A 23 106.956 -8.913 -4.750 1.00 0.00 H new ATOM 0 HD21 LEU A 23 109.683 -7.535 -5.000 1.00 0.00 H new ATOM 0 HD22 LEU A 23 109.057 -8.790 -6.095 1.00 0.00 H new ATOM 0 HD23 LEU A 23 109.604 -7.228 -6.751 1.00 0.00 H new ATOM 380 N LYS A 24 106.507 -5.995 -10.345 1.00 0.00 N ATOM 381 CA LYS A 24 106.076 -6.349 -11.698 1.00 0.00 C ATOM 382 C LYS A 24 106.365 -7.818 -11.996 1.00 0.00 C ATOM 383 O LYS A 24 105.461 -8.578 -12.343 1.00 0.00 O ATOM 384 CB LYS A 24 106.796 -5.468 -12.719 1.00 0.00 C ATOM 385 CG LYS A 24 106.813 -6.169 -14.079 1.00 0.00 C ATOM 386 CD LYS A 24 107.311 -5.197 -15.150 1.00 0.00 C ATOM 387 CE LYS A 24 107.723 -5.978 -16.399 1.00 0.00 C ATOM 388 NZ LYS A 24 108.941 -6.783 -16.103 1.00 0.00 N ATOM 0 H LYS A 24 106.481 -4.996 -10.142 1.00 0.00 H new ATOM 0 HA LYS A 24 105.000 -6.187 -11.767 1.00 0.00 H new ATOM 0 HB2 LYS A 24 106.294 -4.504 -12.801 1.00 0.00 H new ATOM 0 HB3 LYS A 24 107.815 -5.269 -12.388 1.00 0.00 H new ATOM 0 HG2 LYS A 24 107.460 -7.046 -14.040 1.00 0.00 H new ATOM 0 HG3 LYS A 24 105.813 -6.522 -14.330 1.00 0.00 H new ATOM 0 HD2 LYS A 24 106.528 -4.481 -15.398 1.00 0.00 H new ATOM 0 HD3 LYS A 24 108.158 -4.625 -14.771 1.00 0.00 H new ATOM 0 HE2 LYS A 24 106.911 -6.632 -16.716 1.00 0.00 H new ATOM 0 HE3 LYS A 24 107.919 -5.291 -17.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 109.702 -6.516 -16.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 109.248 -6.601 -15.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 108.725 -7.794 -16.216 1.00 0.00 H new ATOM 402 N ASP A 25 107.629 -8.209 -11.857 1.00 0.00 N ATOM 403 CA ASP A 25 108.028 -9.591 -12.109 1.00 0.00 C ATOM 404 C ASP A 25 107.034 -10.284 -13.030 1.00 0.00 C ATOM 405 O ASP A 25 106.007 -10.792 -12.580 1.00 0.00 O ATOM 406 CB ASP A 25 108.115 -10.356 -10.787 1.00 0.00 C ATOM 407 CG ASP A 25 106.723 -10.527 -10.185 1.00 0.00 C ATOM 408 OD1 ASP A 25 105.825 -9.816 -10.603 1.00 0.00 O ATOM 409 OD2 ASP A 25 106.576 -11.369 -9.315 1.00 0.00 O ATOM 0 H ASP A 25 108.391 -7.593 -11.573 1.00 0.00 H new ATOM 0 HA ASP A 25 109.004 -9.581 -12.594 1.00 0.00 H new ATOM 0 HB2 ASP A 25 108.570 -11.332 -10.953 1.00 0.00 H new ATOM 0 HB3 ASP A 25 108.758 -9.819 -10.089 1.00 0.00 H new ATOM 414 N LYS A 26 107.348 -10.312 -14.320 1.00 0.00 N ATOM 415 CA LYS A 26 106.472 -10.959 -15.284 1.00 0.00 C ATOM 416 C LYS A 26 105.868 -12.213 -14.668 1.00 0.00 C ATOM 417 O LYS A 26 104.816 -12.685 -15.099 1.00 0.00 O ATOM 418 CB LYS A 26 107.255 -11.329 -16.544 1.00 0.00 C ATOM 419 CG LYS A 26 106.278 -11.721 -17.655 1.00 0.00 C ATOM 420 CD LYS A 26 107.005 -11.714 -19.001 1.00 0.00 C ATOM 421 CE LYS A 26 106.348 -12.725 -19.941 1.00 0.00 C ATOM 422 NZ LYS A 26 107.142 -13.986 -19.949 1.00 0.00 N ATOM 0 H LYS A 26 108.192 -9.899 -14.717 1.00 0.00 H new ATOM 0 HA LYS A 26 105.674 -10.268 -15.555 1.00 0.00 H new ATOM 0 HB2 LYS A 26 107.868 -10.487 -16.865 1.00 0.00 H new ATOM 0 HB3 LYS A 26 107.934 -12.155 -16.334 1.00 0.00 H new ATOM 0 HG2 LYS A 26 105.865 -12.710 -17.458 1.00 0.00 H new ATOM 0 HG3 LYS A 26 105.440 -11.025 -17.679 1.00 0.00 H new ATOM 0 HD2 LYS A 26 106.970 -10.717 -19.440 1.00 0.00 H new ATOM 0 HD3 LYS A 26 108.057 -11.963 -18.860 1.00 0.00 H new ATOM 0 HE2 LYS A 26 105.327 -12.928 -19.618 1.00 0.00 H new ATOM 0 HE3 LYS A 26 106.288 -12.314 -20.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 106.695 -14.674 -20.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 108.108 -13.786 -20.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 107.178 -14.380 -18.987 1.00 0.00 H new ATOM 436 N ASP A 27 106.540 -12.744 -13.648 1.00 0.00 N ATOM 437 CA ASP A 27 106.057 -13.941 -12.974 1.00 0.00 C ATOM 438 C ASP A 27 107.190 -14.665 -12.249 1.00 0.00 C ATOM 439 O ASP A 27 107.025 -15.810 -11.827 1.00 0.00 O ATOM 440 CB ASP A 27 105.416 -14.889 -13.989 1.00 0.00 C ATOM 441 CG ASP A 27 106.155 -14.805 -15.321 1.00 0.00 C ATOM 442 OD1 ASP A 27 107.220 -14.210 -15.348 1.00 0.00 O ATOM 443 OD2 ASP A 27 105.645 -15.335 -16.294 1.00 0.00 O ATOM 0 H ASP A 27 107.411 -12.367 -13.275 1.00 0.00 H new ATOM 0 HA ASP A 27 105.316 -13.633 -12.236 1.00 0.00 H new ATOM 0 HB2 ASP A 27 105.444 -15.911 -13.612 1.00 0.00 H new ATOM 0 HB3 ASP A 27 104.367 -14.630 -14.129 1.00 0.00 H new ATOM 448 N ILE A 28 108.339 -14.004 -12.100 1.00 0.00 N ATOM 449 CA ILE A 28 109.481 -14.614 -11.421 1.00 0.00 C ATOM 450 C ILE A 28 110.231 -13.567 -10.601 1.00 0.00 C ATOM 451 O ILE A 28 110.338 -12.411 -11.007 1.00 0.00 O ATOM 452 CB ILE A 28 110.426 -15.219 -12.458 1.00 0.00 C ATOM 453 CG1 ILE A 28 109.701 -16.347 -13.196 1.00 0.00 C ATOM 454 CG2 ILE A 28 111.682 -15.764 -11.767 1.00 0.00 C ATOM 455 CD1 ILE A 28 110.624 -17.560 -13.338 1.00 0.00 C ATOM 0 H ILE A 28 108.502 -13.055 -12.437 1.00 0.00 H new ATOM 0 HA ILE A 28 109.118 -15.394 -10.752 1.00 0.00 H new ATOM 0 HB ILE A 28 110.727 -14.452 -13.171 1.00 0.00 H new ATOM 0 HG12 ILE A 28 108.799 -16.628 -12.652 1.00 0.00 H new ATOM 0 HG13 ILE A 28 109.385 -16.003 -14.181 1.00 0.00 H new ATOM 0 HG21 ILE A 28 112.350 -16.194 -12.513 1.00 0.00 H new ATOM 0 HG22 ILE A 28 112.192 -14.953 -11.247 1.00 0.00 H new ATOM 0 HG23 ILE A 28 111.398 -16.533 -11.049 1.00 0.00 H new ATOM 0 HD11 ILE A 28 110.099 -18.357 -13.864 1.00 0.00 H new ATOM 0 HD12 ILE A 28 111.513 -17.277 -13.902 1.00 0.00 H new ATOM 0 HD13 ILE A 28 110.918 -17.911 -12.349 1.00 0.00 H new ATOM 467 N ILE A 29 110.755 -13.974 -9.448 1.00 0.00 N ATOM 468 CA ILE A 29 111.492 -13.046 -8.595 1.00 0.00 C ATOM 469 C ILE A 29 112.782 -13.682 -8.084 1.00 0.00 C ATOM 470 O ILE A 29 112.820 -14.873 -7.773 1.00 0.00 O ATOM 471 CB ILE A 29 110.620 -12.622 -7.411 1.00 0.00 C ATOM 472 CG1 ILE A 29 109.892 -11.321 -7.759 1.00 0.00 C ATOM 473 CG2 ILE A 29 111.498 -12.395 -6.177 1.00 0.00 C ATOM 474 CD1 ILE A 29 108.463 -11.379 -7.224 1.00 0.00 C ATOM 0 H ILE A 29 110.685 -14.925 -9.087 1.00 0.00 H new ATOM 0 HA ILE A 29 111.752 -12.169 -9.188 1.00 0.00 H new ATOM 0 HB ILE A 29 109.894 -13.406 -7.199 1.00 0.00 H new ATOM 0 HG12 ILE A 29 110.419 -10.470 -7.327 1.00 0.00 H new ATOM 0 HG13 ILE A 29 109.882 -11.175 -8.839 1.00 0.00 H new ATOM 0 HG21 ILE A 29 110.873 -12.093 -5.336 1.00 0.00 H new ATOM 0 HG22 ILE A 29 112.021 -13.318 -5.928 1.00 0.00 H new ATOM 0 HG23 ILE A 29 112.226 -11.612 -6.388 1.00 0.00 H new ATOM 0 HD11 ILE A 29 107.944 -10.453 -7.471 1.00 0.00 H new ATOM 0 HD12 ILE A 29 107.939 -12.221 -7.677 1.00 0.00 H new ATOM 0 HD13 ILE A 29 108.485 -11.505 -6.141 1.00 0.00 H new ATOM 486 N GLY A 30 113.836 -12.875 -7.999 1.00 0.00 N ATOM 487 CA GLY A 30 115.124 -13.362 -7.523 1.00 0.00 C ATOM 488 C GLY A 30 115.647 -12.487 -6.388 1.00 0.00 C ATOM 489 O GLY A 30 115.929 -11.305 -6.586 1.00 0.00 O ATOM 0 H GLY A 30 113.823 -11.887 -8.252 1.00 0.00 H new ATOM 0 HA2 GLY A 30 115.024 -14.391 -7.179 1.00 0.00 H new ATOM 0 HA3 GLY A 30 115.841 -13.369 -8.344 1.00 0.00 H new ATOM 493 N PHE A 31 115.775 -13.073 -5.203 1.00 0.00 N ATOM 494 CA PHE A 31 116.265 -12.332 -4.047 1.00 0.00 C ATOM 495 C PHE A 31 117.783 -12.443 -3.947 1.00 0.00 C ATOM 496 O PHE A 31 118.326 -13.542 -3.832 1.00 0.00 O ATOM 497 CB PHE A 31 115.632 -12.877 -2.766 1.00 0.00 C ATOM 498 CG PHE A 31 114.152 -12.581 -2.751 1.00 0.00 C ATOM 499 CD1 PHE A 31 113.257 -13.447 -3.391 1.00 0.00 C ATOM 500 CD2 PHE A 31 113.671 -11.444 -2.087 1.00 0.00 C ATOM 501 CE1 PHE A 31 111.884 -13.178 -3.369 1.00 0.00 C ATOM 502 CE2 PHE A 31 112.298 -11.176 -2.064 1.00 0.00 C ATOM 503 CZ PHE A 31 111.404 -12.042 -2.705 1.00 0.00 C ATOM 0 H PHE A 31 115.549 -14.050 -5.018 1.00 0.00 H new ATOM 0 HA PHE A 31 115.991 -11.284 -4.170 1.00 0.00 H new ATOM 0 HB2 PHE A 31 115.796 -13.953 -2.699 1.00 0.00 H new ATOM 0 HB3 PHE A 31 116.109 -12.427 -1.896 1.00 0.00 H new ATOM 0 HD1 PHE A 31 113.627 -14.324 -3.902 1.00 0.00 H new ATOM 0 HD2 PHE A 31 114.360 -10.775 -1.593 1.00 0.00 H new ATOM 0 HE1 PHE A 31 111.195 -13.846 -3.864 1.00 0.00 H new ATOM 0 HE2 PHE A 31 111.928 -10.301 -1.551 1.00 0.00 H new ATOM 0 HZ PHE A 31 110.344 -11.834 -2.687 1.00 0.00 H new ATOM 513 N TYR A 32 118.465 -11.304 -3.995 1.00 0.00 N ATOM 514 CA TYR A 32 119.922 -11.300 -3.911 1.00 0.00 C ATOM 515 C TYR A 32 120.383 -10.799 -2.543 1.00 0.00 C ATOM 516 O TYR A 32 119.995 -9.715 -2.107 1.00 0.00 O ATOM 517 CB TYR A 32 120.503 -10.412 -5.017 1.00 0.00 C ATOM 518 CG TYR A 32 121.462 -9.407 -4.424 1.00 0.00 C ATOM 519 CD1 TYR A 32 120.979 -8.190 -3.925 1.00 0.00 C ATOM 520 CD2 TYR A 32 122.832 -9.690 -4.371 1.00 0.00 C ATOM 521 CE1 TYR A 32 121.867 -7.258 -3.376 1.00 0.00 C ATOM 522 CE2 TYR A 32 123.719 -8.758 -3.822 1.00 0.00 C ATOM 523 CZ TYR A 32 123.237 -7.542 -3.324 1.00 0.00 C ATOM 524 OH TYR A 32 124.112 -6.622 -2.782 1.00 0.00 O ATOM 0 H TYR A 32 118.040 -10.382 -4.090 1.00 0.00 H new ATOM 0 HA TYR A 32 120.280 -12.321 -4.042 1.00 0.00 H new ATOM 0 HB2 TYR A 32 121.018 -11.027 -5.755 1.00 0.00 H new ATOM 0 HB3 TYR A 32 119.698 -9.895 -5.539 1.00 0.00 H new ATOM 0 HD1 TYR A 32 119.922 -7.971 -3.964 1.00 0.00 H new ATOM 0 HD2 TYR A 32 123.204 -10.629 -4.754 1.00 0.00 H new ATOM 0 HE1 TYR A 32 121.495 -6.319 -2.992 1.00 0.00 H new ATOM 0 HE2 TYR A 32 124.776 -8.977 -3.782 1.00 0.00 H new ATOM 0 HH TYR A 32 124.537 -7.004 -1.986 1.00 0.00 H new ATOM 534 N PHE A 33 121.219 -11.590 -1.874 1.00 0.00 N ATOM 535 CA PHE A 33 121.731 -11.211 -0.563 1.00 0.00 C ATOM 536 C PHE A 33 123.251 -11.108 -0.600 1.00 0.00 C ATOM 537 O PHE A 33 123.945 -12.103 -0.819 1.00 0.00 O ATOM 538 CB PHE A 33 121.325 -12.247 0.489 1.00 0.00 C ATOM 539 CG PHE A 33 119.858 -12.566 0.358 1.00 0.00 C ATOM 540 CD1 PHE A 33 119.385 -13.215 -0.787 1.00 0.00 C ATOM 541 CD2 PHE A 33 118.970 -12.217 1.384 1.00 0.00 C ATOM 542 CE1 PHE A 33 118.026 -13.518 -0.906 1.00 0.00 C ATOM 543 CE2 PHE A 33 117.610 -12.520 1.263 1.00 0.00 C ATOM 544 CZ PHE A 33 117.137 -13.171 0.118 1.00 0.00 C ATOM 0 H PHE A 33 121.553 -12.491 -2.217 1.00 0.00 H new ATOM 0 HA PHE A 33 121.306 -10.242 -0.299 1.00 0.00 H new ATOM 0 HB2 PHE A 33 121.916 -13.155 0.365 1.00 0.00 H new ATOM 0 HB3 PHE A 33 121.535 -11.865 1.488 1.00 0.00 H new ATOM 0 HD1 PHE A 33 120.070 -13.482 -1.579 1.00 0.00 H new ATOM 0 HD2 PHE A 33 119.335 -11.715 2.267 1.00 0.00 H new ATOM 0 HE1 PHE A 33 117.661 -14.021 -1.789 1.00 0.00 H new ATOM 0 HE2 PHE A 33 116.925 -12.252 2.053 1.00 0.00 H new ATOM 0 HZ PHE A 33 116.087 -13.405 0.025 1.00 0.00 H new ATOM 554 N SER A 34 123.765 -9.902 -0.386 1.00 0.00 N ATOM 555 CA SER A 34 125.205 -9.685 -0.398 1.00 0.00 C ATOM 556 C SER A 34 125.524 -8.195 -0.381 1.00 0.00 C ATOM 557 O SER A 34 125.599 -7.555 -1.430 1.00 0.00 O ATOM 558 CB SER A 34 125.818 -10.324 -1.643 1.00 0.00 C ATOM 559 OG SER A 34 126.542 -9.339 -2.369 1.00 0.00 O ATOM 0 H SER A 34 123.210 -9.066 -0.203 1.00 0.00 H new ATOM 0 HA SER A 34 125.629 -10.145 0.494 1.00 0.00 H new ATOM 0 HB2 SER A 34 126.480 -11.142 -1.358 1.00 0.00 H new ATOM 0 HB3 SER A 34 125.035 -10.752 -2.269 1.00 0.00 H new ATOM 0 HG SER A 34 126.001 -8.525 -2.445 1.00 0.00 H new ATOM 565 N ALA A 35 125.714 -7.646 0.815 1.00 0.00 N ATOM 566 CA ALA A 35 126.031 -6.230 0.950 1.00 0.00 C ATOM 567 C ALA A 35 127.394 -5.939 0.335 1.00 0.00 C ATOM 568 O ALA A 35 128.153 -5.113 0.841 1.00 0.00 O ATOM 569 CB ALA A 35 126.040 -5.830 2.426 1.00 0.00 C ATOM 0 H ALA A 35 125.655 -8.155 1.697 1.00 0.00 H new ATOM 0 HA ALA A 35 125.269 -5.651 0.427 1.00 0.00 H new ATOM 0 HB1 ALA A 35 126.278 -4.770 2.514 1.00 0.00 H new ATOM 0 HB2 ALA A 35 125.058 -6.019 2.860 1.00 0.00 H new ATOM 0 HB3 ALA A 35 126.790 -6.416 2.957 1.00 0.00 H new ATOM 575 N HIS A 36 127.697 -6.634 -0.755 1.00 0.00 N ATOM 576 CA HIS A 36 128.972 -6.459 -1.436 1.00 0.00 C ATOM 577 C HIS A 36 129.158 -5.014 -1.890 1.00 0.00 C ATOM 578 O HIS A 36 130.043 -4.723 -2.696 1.00 0.00 O ATOM 579 CB HIS A 36 129.045 -7.387 -2.649 1.00 0.00 C ATOM 580 CG HIS A 36 129.082 -8.817 -2.186 1.00 0.00 C ATOM 581 ND1 HIS A 36 129.039 -9.160 -0.843 1.00 0.00 N ATOM 582 CD2 HIS A 36 129.160 -10.003 -2.873 1.00 0.00 C ATOM 583 CE1 HIS A 36 129.090 -10.502 -0.765 1.00 0.00 C ATOM 584 NE2 HIS A 36 129.165 -11.065 -1.975 1.00 0.00 N ATOM 0 H HIS A 36 127.078 -7.322 -1.185 1.00 0.00 H new ATOM 0 HA HIS A 36 129.768 -6.707 -0.734 1.00 0.00 H new ATOM 0 HB2 HIS A 36 128.183 -7.225 -3.296 1.00 0.00 H new ATOM 0 HB3 HIS A 36 129.933 -7.162 -3.239 1.00 0.00 H new ATOM 0 HD2 HIS A 36 129.210 -10.097 -3.948 1.00 0.00 H new ATOM 0 HE1 HIS A 36 129.072 -11.057 0.162 1.00 0.00 H new ATOM 0 HE2 HIS A 36 129.215 -12.060 -2.193 1.00 0.00 H new ATOM 593 N TRP A 37 128.331 -4.109 -1.373 1.00 0.00 N ATOM 594 CA TRP A 37 128.443 -2.709 -1.750 1.00 0.00 C ATOM 595 C TRP A 37 129.547 -2.029 -0.946 1.00 0.00 C ATOM 596 O TRP A 37 130.336 -1.255 -1.491 1.00 0.00 O ATOM 597 CB TRP A 37 127.109 -1.997 -1.527 1.00 0.00 C ATOM 598 CG TRP A 37 127.047 -1.454 -0.136 1.00 0.00 C ATOM 599 CD1 TRP A 37 126.256 -1.937 0.847 1.00 0.00 C ATOM 600 CD2 TRP A 37 127.787 -0.339 0.443 1.00 0.00 C ATOM 601 NE1 TRP A 37 126.450 -1.181 1.990 1.00 0.00 N ATOM 602 CE2 TRP A 37 127.389 -0.189 1.793 1.00 0.00 C ATOM 603 CE3 TRP A 37 128.753 0.548 -0.065 1.00 0.00 C ATOM 604 CZ2 TRP A 37 127.930 0.803 2.609 1.00 0.00 C ATOM 605 CZ3 TRP A 37 129.300 1.549 0.755 1.00 0.00 C ATOM 606 CH2 TRP A 37 128.889 1.676 2.090 1.00 0.00 C ATOM 0 H TRP A 37 127.590 -4.317 -0.704 1.00 0.00 H new ATOM 0 HA TRP A 37 128.700 -2.651 -2.808 1.00 0.00 H new ATOM 0 HB2 TRP A 37 126.994 -1.188 -2.248 1.00 0.00 H new ATOM 0 HB3 TRP A 37 126.285 -2.691 -1.693 1.00 0.00 H new ATOM 0 HD1 TRP A 37 125.582 -2.776 0.756 1.00 0.00 H new ATOM 0 HE1 TRP A 37 125.959 -1.338 2.870 1.00 0.00 H new ATOM 0 HE3 TRP A 37 129.076 0.459 -1.092 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 127.610 0.896 3.636 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 130.041 2.225 0.355 1.00 0.00 H new ATOM 0 HH2 TRP A 37 129.313 2.447 2.716 1.00 0.00 H new ATOM 617 N CYS A 38 129.607 -2.329 0.347 1.00 0.00 N ATOM 618 CA CYS A 38 130.630 -1.744 1.206 1.00 0.00 C ATOM 619 C CYS A 38 131.969 -2.446 0.990 1.00 0.00 C ATOM 620 O CYS A 38 133.000 -1.797 0.811 1.00 0.00 O ATOM 621 CB CYS A 38 130.216 -1.862 2.676 1.00 0.00 C ATOM 622 SG CYS A 38 128.527 -2.502 2.781 1.00 0.00 S ATOM 0 H CYS A 38 128.967 -2.967 0.819 1.00 0.00 H new ATOM 0 HA CYS A 38 130.737 -0.690 0.948 1.00 0.00 H new ATOM 0 HB2 CYS A 38 130.901 -2.525 3.205 1.00 0.00 H new ATOM 0 HB3 CYS A 38 130.277 -0.888 3.161 1.00 0.00 H new ATOM 0 HG CYS A 38 127.798 -1.958 1.852 1.00 0.00 H new ATOM 628 N PRO A 39 131.967 -3.753 1.002 1.00 0.00 N ATOM 629 CA PRO A 39 133.188 -4.570 0.801 1.00 0.00 C ATOM 630 C PRO A 39 133.448 -4.860 -0.676 1.00 0.00 C ATOM 631 O PRO A 39 132.580 -4.644 -1.523 1.00 0.00 O ATOM 632 CB PRO A 39 132.877 -5.858 1.567 1.00 0.00 C ATOM 633 CG PRO A 39 131.380 -5.954 1.643 1.00 0.00 C ATOM 634 CD PRO A 39 130.793 -4.604 1.209 1.00 0.00 C ATOM 0 HA PRO A 39 134.089 -4.065 1.149 1.00 0.00 H new ATOM 0 HB2 PRO A 39 133.296 -6.725 1.056 1.00 0.00 H new ATOM 0 HB3 PRO A 39 133.316 -5.833 2.564 1.00 0.00 H new ATOM 0 HG2 PRO A 39 131.017 -6.753 0.996 1.00 0.00 H new ATOM 0 HG3 PRO A 39 131.065 -6.197 2.658 1.00 0.00 H new ATOM 0 HD2 PRO A 39 130.205 -4.700 0.296 1.00 0.00 H new ATOM 0 HD3 PRO A 39 130.132 -4.193 1.972 1.00 0.00 H new ATOM 642 N PRO A 40 134.619 -5.342 -0.994 1.00 0.00 N ATOM 643 CA PRO A 40 135.004 -5.669 -2.399 1.00 0.00 C ATOM 644 C PRO A 40 134.082 -6.716 -3.021 1.00 0.00 C ATOM 645 O PRO A 40 133.018 -6.385 -3.546 1.00 0.00 O ATOM 646 CB PRO A 40 136.439 -6.200 -2.285 1.00 0.00 C ATOM 647 CG PRO A 40 136.640 -6.535 -0.842 1.00 0.00 C ATOM 648 CD PRO A 40 135.706 -5.626 -0.049 1.00 0.00 C ATOM 0 HA PRO A 40 134.925 -4.799 -3.050 1.00 0.00 H new ATOM 0 HB2 PRO A 40 136.581 -7.079 -2.913 1.00 0.00 H new ATOM 0 HB3 PRO A 40 137.159 -5.452 -2.616 1.00 0.00 H new ATOM 0 HG2 PRO A 40 136.413 -7.584 -0.653 1.00 0.00 H new ATOM 0 HG3 PRO A 40 137.677 -6.376 -0.548 1.00 0.00 H new ATOM 0 HD2 PRO A 40 135.337 -6.117 0.851 1.00 0.00 H new ATOM 0 HD3 PRO A 40 136.209 -4.713 0.270 1.00 0.00 H new ATOM 656 N CYS A 41 134.495 -7.978 -2.962 1.00 0.00 N ATOM 657 CA CYS A 41 133.695 -9.060 -3.527 1.00 0.00 C ATOM 658 C CYS A 41 133.309 -8.742 -4.968 1.00 0.00 C ATOM 659 O CYS A 41 132.263 -9.175 -5.452 1.00 0.00 O ATOM 660 CB CYS A 41 132.431 -9.268 -2.691 1.00 0.00 C ATOM 661 SG CYS A 41 132.707 -10.604 -1.501 1.00 0.00 S ATOM 0 H CYS A 41 135.371 -8.276 -2.533 1.00 0.00 H new ATOM 0 HA CYS A 41 134.291 -9.973 -3.515 1.00 0.00 H new ATOM 0 HB2 CYS A 41 132.173 -8.348 -2.167 1.00 0.00 H new ATOM 0 HB3 CYS A 41 131.589 -9.512 -3.339 1.00 0.00 H new ATOM 0 HG CYS A 41 131.842 -10.510 -0.535 1.00 0.00 H new ATOM 667 N ARG A 42 134.161 -7.980 -5.645 1.00 0.00 N ATOM 668 CA ARG A 42 133.904 -7.600 -7.030 1.00 0.00 C ATOM 669 C ARG A 42 134.304 -8.722 -7.985 1.00 0.00 C ATOM 670 O ARG A 42 135.221 -9.494 -7.704 1.00 0.00 O ATOM 671 CB ARG A 42 134.687 -6.332 -7.377 1.00 0.00 C ATOM 672 CG ARG A 42 134.332 -5.886 -8.797 1.00 0.00 C ATOM 673 CD ARG A 42 134.182 -4.364 -8.832 1.00 0.00 C ATOM 674 NE ARG A 42 132.822 -3.982 -8.467 1.00 0.00 N ATOM 675 CZ ARG A 42 132.212 -2.958 -9.056 1.00 0.00 C ATOM 676 NH1 ARG A 42 132.831 -2.272 -9.978 1.00 0.00 N ATOM 677 NH2 ARG A 42 130.995 -2.637 -8.712 1.00 0.00 N ATOM 0 H ARG A 42 135.032 -7.614 -5.260 1.00 0.00 H new ATOM 0 HA ARG A 42 132.836 -7.413 -7.139 1.00 0.00 H new ATOM 0 HB2 ARG A 42 134.451 -5.540 -6.666 1.00 0.00 H new ATOM 0 HB3 ARG A 42 135.758 -6.521 -7.301 1.00 0.00 H new ATOM 0 HG2 ARG A 42 135.109 -6.201 -9.493 1.00 0.00 H new ATOM 0 HG3 ARG A 42 133.405 -6.361 -9.117 1.00 0.00 H new ATOM 0 HD2 ARG A 42 134.893 -3.906 -8.145 1.00 0.00 H new ATOM 0 HD3 ARG A 42 134.417 -3.991 -9.829 1.00 0.00 H new ATOM 0 HE ARG A 42 132.330 -4.510 -7.746 1.00 0.00 H new ATOM 0 HH11 ARG A 42 133.783 -2.522 -10.247 1.00 0.00 H new ATOM 0 HH12 ARG A 42 132.363 -1.486 -10.430 1.00 0.00 H new ATOM 0 HH21 ARG A 42 130.511 -3.172 -7.991 1.00 0.00 H new ATOM 0 HH22 ARG A 42 130.528 -1.851 -9.164 1.00 0.00 H new ATOM 691 N GLY A 43 133.612 -8.799 -9.118 1.00 0.00 N ATOM 692 CA GLY A 43 133.902 -9.825 -10.115 1.00 0.00 C ATOM 693 C GLY A 43 132.661 -10.654 -10.432 1.00 0.00 C ATOM 694 O GLY A 43 132.449 -11.053 -11.578 1.00 0.00 O ATOM 0 H GLY A 43 132.851 -8.167 -9.368 1.00 0.00 H new ATOM 0 HA2 GLY A 43 134.271 -9.356 -11.027 1.00 0.00 H new ATOM 0 HA3 GLY A 43 134.695 -10.478 -9.749 1.00 0.00 H new ATOM 698 N PHE A 44 131.839 -10.904 -9.419 1.00 0.00 N ATOM 699 CA PHE A 44 130.620 -11.681 -9.618 1.00 0.00 C ATOM 700 C PHE A 44 129.484 -10.768 -10.071 1.00 0.00 C ATOM 701 O PHE A 44 128.555 -11.201 -10.752 1.00 0.00 O ATOM 702 CB PHE A 44 130.227 -12.392 -8.319 1.00 0.00 C ATOM 703 CG PHE A 44 128.833 -12.965 -8.447 1.00 0.00 C ATOM 704 CD1 PHE A 44 128.362 -13.407 -9.691 1.00 0.00 C ATOM 705 CD2 PHE A 44 128.010 -13.056 -7.317 1.00 0.00 C ATOM 706 CE1 PHE A 44 127.071 -13.938 -9.803 1.00 0.00 C ATOM 707 CE2 PHE A 44 126.718 -13.588 -7.431 1.00 0.00 C ATOM 708 CZ PHE A 44 126.250 -14.029 -8.674 1.00 0.00 C ATOM 0 H PHE A 44 131.991 -10.585 -8.462 1.00 0.00 H new ATOM 0 HA PHE A 44 130.806 -12.429 -10.389 1.00 0.00 H new ATOM 0 HB2 PHE A 44 130.938 -13.189 -8.101 1.00 0.00 H new ATOM 0 HB3 PHE A 44 130.267 -11.692 -7.485 1.00 0.00 H new ATOM 0 HD1 PHE A 44 128.995 -13.338 -10.563 1.00 0.00 H new ATOM 0 HD2 PHE A 44 128.371 -12.716 -6.358 1.00 0.00 H new ATOM 0 HE1 PHE A 44 126.709 -14.278 -10.762 1.00 0.00 H new ATOM 0 HE2 PHE A 44 126.084 -13.658 -6.560 1.00 0.00 H new ATOM 0 HZ PHE A 44 125.255 -14.440 -8.762 1.00 0.00 H new ATOM 718 N THR A 45 129.568 -9.503 -9.678 1.00 0.00 N ATOM 719 CA THR A 45 128.545 -8.528 -10.037 1.00 0.00 C ATOM 720 C THR A 45 128.438 -8.376 -11.550 1.00 0.00 C ATOM 721 O THR A 45 127.376 -8.607 -12.129 1.00 0.00 O ATOM 722 CB THR A 45 128.857 -7.172 -9.396 1.00 0.00 C ATOM 723 OG1 THR A 45 128.336 -7.146 -8.074 1.00 0.00 O ATOM 724 CG2 THR A 45 128.215 -6.051 -10.218 1.00 0.00 C ATOM 0 H THR A 45 130.330 -9.129 -9.113 1.00 0.00 H new ATOM 0 HA THR A 45 127.588 -8.890 -9.661 1.00 0.00 H new ATOM 0 HB THR A 45 129.937 -7.025 -9.369 1.00 0.00 H new ATOM 0 HG1 THR A 45 128.535 -6.280 -7.661 1.00 0.00 H new ATOM 0 HG21 THR A 45 128.439 -5.088 -9.758 1.00 0.00 H new ATOM 0 HG22 THR A 45 128.613 -6.070 -11.233 1.00 0.00 H new ATOM 0 HG23 THR A 45 127.135 -6.195 -10.249 1.00 0.00 H new ATOM 732 N PRO A 46 129.505 -7.996 -12.200 1.00 0.00 N ATOM 733 CA PRO A 46 129.515 -7.814 -13.678 1.00 0.00 C ATOM 734 C PRO A 46 128.963 -9.035 -14.403 1.00 0.00 C ATOM 735 O PRO A 46 128.687 -8.984 -15.601 1.00 0.00 O ATOM 736 CB PRO A 46 130.993 -7.582 -14.027 1.00 0.00 C ATOM 737 CG PRO A 46 131.771 -7.880 -12.785 1.00 0.00 C ATOM 738 CD PRO A 46 130.813 -7.698 -11.611 1.00 0.00 C ATOM 0 HA PRO A 46 128.879 -6.985 -13.988 1.00 0.00 H new ATOM 0 HB2 PRO A 46 131.305 -8.230 -14.846 1.00 0.00 H new ATOM 0 HB3 PRO A 46 131.159 -6.555 -14.352 1.00 0.00 H new ATOM 0 HG2 PRO A 46 132.164 -8.896 -12.809 1.00 0.00 H new ATOM 0 HG3 PRO A 46 132.626 -7.210 -12.694 1.00 0.00 H new ATOM 0 HD2 PRO A 46 131.049 -8.375 -10.790 1.00 0.00 H new ATOM 0 HD3 PRO A 46 130.854 -6.685 -11.211 1.00 0.00 H new ATOM 746 N ILE A 47 128.796 -10.129 -13.667 1.00 0.00 N ATOM 747 CA ILE A 47 128.266 -11.349 -14.256 1.00 0.00 C ATOM 748 C ILE A 47 126.745 -11.323 -14.220 1.00 0.00 C ATOM 749 O ILE A 47 126.084 -11.577 -15.227 1.00 0.00 O ATOM 750 CB ILE A 47 128.774 -12.569 -13.489 1.00 0.00 C ATOM 751 CG1 ILE A 47 130.305 -12.550 -13.465 1.00 0.00 C ATOM 752 CG2 ILE A 47 128.286 -13.842 -14.181 1.00 0.00 C ATOM 753 CD1 ILE A 47 130.841 -13.978 -13.600 1.00 0.00 C ATOM 0 H ILE A 47 129.018 -10.194 -12.674 1.00 0.00 H new ATOM 0 HA ILE A 47 128.603 -11.413 -15.291 1.00 0.00 H new ATOM 0 HB ILE A 47 128.395 -12.545 -12.467 1.00 0.00 H new ATOM 0 HG12 ILE A 47 130.683 -11.931 -14.278 1.00 0.00 H new ATOM 0 HG13 ILE A 47 130.658 -12.105 -12.535 1.00 0.00 H new ATOM 0 HG21 ILE A 47 128.647 -14.714 -13.636 1.00 0.00 H new ATOM 0 HG22 ILE A 47 127.196 -13.851 -14.199 1.00 0.00 H new ATOM 0 HG23 ILE A 47 128.666 -13.870 -15.202 1.00 0.00 H new ATOM 0 HD11 ILE A 47 131.931 -13.961 -13.583 1.00 0.00 H new ATOM 0 HD12 ILE A 47 130.474 -14.584 -12.772 1.00 0.00 H new ATOM 0 HD13 ILE A 47 130.500 -14.407 -14.542 1.00 0.00 H new ATOM 765 N LEU A 48 126.199 -11.004 -13.053 1.00 0.00 N ATOM 766 CA LEU A 48 124.757 -10.935 -12.897 1.00 0.00 C ATOM 767 C LEU A 48 124.208 -9.742 -13.671 1.00 0.00 C ATOM 768 O LEU A 48 123.090 -9.783 -14.180 1.00 0.00 O ATOM 769 CB LEU A 48 124.397 -10.829 -11.409 1.00 0.00 C ATOM 770 CG LEU A 48 123.546 -9.583 -11.156 1.00 0.00 C ATOM 771 CD1 LEU A 48 122.197 -9.731 -11.860 1.00 0.00 C ATOM 772 CD2 LEU A 48 123.318 -9.425 -9.652 1.00 0.00 C ATOM 0 H LEU A 48 126.730 -10.791 -12.209 1.00 0.00 H new ATOM 0 HA LEU A 48 124.307 -11.843 -13.297 1.00 0.00 H new ATOM 0 HB2 LEU A 48 123.852 -11.720 -11.095 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.307 -10.784 -10.810 1.00 0.00 H new ATOM 0 HG LEU A 48 124.062 -8.705 -11.545 1.00 0.00 H new ATOM 0 HD11 LEU A 48 121.592 -8.842 -11.678 1.00 0.00 H new ATOM 0 HD12 LEU A 48 122.357 -9.848 -12.932 1.00 0.00 H new ATOM 0 HD13 LEU A 48 121.679 -10.608 -11.472 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.712 -8.538 -9.467 1.00 0.00 H new ATOM 0 HD22 LEU A 48 122.801 -10.304 -9.268 1.00 0.00 H new ATOM 0 HD23 LEU A 48 124.278 -9.320 -9.147 1.00 0.00 H new ATOM 784 N ALA A 49 125.005 -8.680 -13.766 1.00 0.00 N ATOM 785 CA ALA A 49 124.579 -7.491 -14.493 1.00 0.00 C ATOM 786 C ALA A 49 124.502 -7.786 -15.985 1.00 0.00 C ATOM 787 O ALA A 49 123.682 -7.214 -16.704 1.00 0.00 O ATOM 788 CB ALA A 49 125.555 -6.341 -14.241 1.00 0.00 C ATOM 0 H ALA A 49 125.936 -8.620 -13.354 1.00 0.00 H new ATOM 0 HA ALA A 49 123.590 -7.201 -14.138 1.00 0.00 H new ATOM 0 HB1 ALA A 49 125.226 -5.458 -14.789 1.00 0.00 H new ATOM 0 HB2 ALA A 49 125.585 -6.116 -13.175 1.00 0.00 H new ATOM 0 HB3 ALA A 49 126.551 -6.628 -14.579 1.00 0.00 H new ATOM 794 N ASP A 50 125.346 -8.695 -16.449 1.00 0.00 N ATOM 795 CA ASP A 50 125.333 -9.062 -17.854 1.00 0.00 C ATOM 796 C ASP A 50 124.184 -10.024 -18.109 1.00 0.00 C ATOM 797 O ASP A 50 123.618 -10.065 -19.203 1.00 0.00 O ATOM 798 CB ASP A 50 126.659 -9.718 -18.245 1.00 0.00 C ATOM 799 CG ASP A 50 127.031 -9.331 -19.672 1.00 0.00 C ATOM 800 OD1 ASP A 50 126.132 -9.017 -20.434 1.00 0.00 O ATOM 801 OD2 ASP A 50 128.212 -9.355 -19.982 1.00 0.00 O ATOM 0 H ASP A 50 126.038 -9.185 -15.882 1.00 0.00 H new ATOM 0 HA ASP A 50 125.200 -8.164 -18.458 1.00 0.00 H new ATOM 0 HB2 ASP A 50 127.445 -9.406 -17.558 1.00 0.00 H new ATOM 0 HB3 ASP A 50 126.576 -10.802 -18.163 1.00 0.00 H new ATOM 806 N MET A 51 123.835 -10.788 -17.079 1.00 0.00 N ATOM 807 CA MET A 51 122.745 -11.743 -17.186 1.00 0.00 C ATOM 808 C MET A 51 121.403 -11.030 -17.141 1.00 0.00 C ATOM 809 O MET A 51 120.568 -11.204 -18.028 1.00 0.00 O ATOM 810 CB MET A 51 122.829 -12.761 -16.053 1.00 0.00 C ATOM 811 CG MET A 51 122.370 -14.121 -16.571 1.00 0.00 C ATOM 812 SD MET A 51 122.358 -15.308 -15.212 1.00 0.00 S ATOM 813 CE MET A 51 120.809 -14.753 -14.463 1.00 0.00 C ATOM 0 H MET A 51 124.290 -10.763 -16.167 1.00 0.00 H new ATOM 0 HA MET A 51 122.833 -12.261 -18.141 1.00 0.00 H new ATOM 0 HB2 MET A 51 123.851 -12.826 -15.680 1.00 0.00 H new ATOM 0 HB3 MET A 51 122.204 -12.446 -15.217 1.00 0.00 H new ATOM 0 HG2 MET A 51 121.374 -14.039 -17.006 1.00 0.00 H new ATOM 0 HG3 MET A 51 123.036 -14.465 -17.362 1.00 0.00 H new ATOM 0 HE1 MET A 51 120.979 -14.508 -13.415 1.00 0.00 H new ATOM 0 HE2 MET A 51 120.447 -13.869 -14.988 1.00 0.00 H new ATOM 0 HE3 MET A 51 120.065 -15.547 -14.534 1.00 0.00 H new ATOM 823 N TYR A 52 121.200 -10.220 -16.110 1.00 0.00 N ATOM 824 CA TYR A 52 119.950 -9.489 -15.986 1.00 0.00 C ATOM 825 C TYR A 52 119.847 -8.470 -17.110 1.00 0.00 C ATOM 826 O TYR A 52 118.751 -8.090 -17.515 1.00 0.00 O ATOM 827 CB TYR A 52 119.856 -8.799 -14.622 1.00 0.00 C ATOM 828 CG TYR A 52 120.261 -7.350 -14.747 1.00 0.00 C ATOM 829 CD1 TYR A 52 121.476 -7.020 -15.349 1.00 0.00 C ATOM 830 CD2 TYR A 52 119.424 -6.342 -14.260 1.00 0.00 C ATOM 831 CE1 TYR A 52 121.858 -5.678 -15.467 1.00 0.00 C ATOM 832 CE2 TYR A 52 119.804 -4.999 -14.375 1.00 0.00 C ATOM 833 CZ TYR A 52 121.021 -4.668 -14.979 1.00 0.00 C ATOM 834 OH TYR A 52 121.395 -3.345 -15.095 1.00 0.00 O ATOM 0 H TYR A 52 121.872 -10.055 -15.361 1.00 0.00 H new ATOM 0 HA TYR A 52 119.119 -10.191 -16.061 1.00 0.00 H new ATOM 0 HB2 TYR A 52 118.838 -8.869 -14.239 1.00 0.00 H new ATOM 0 HB3 TYR A 52 120.502 -9.305 -13.904 1.00 0.00 H new ATOM 0 HD1 TYR A 52 122.122 -7.800 -15.724 1.00 0.00 H new ATOM 0 HD2 TYR A 52 118.484 -6.599 -13.795 1.00 0.00 H new ATOM 0 HE1 TYR A 52 122.798 -5.423 -15.934 1.00 0.00 H new ATOM 0 HE2 TYR A 52 119.158 -4.220 -13.998 1.00 0.00 H new ATOM 0 HH TYR A 52 120.700 -2.773 -14.706 1.00 0.00 H new ATOM 844 N SER A 53 120.998 -8.046 -17.627 1.00 0.00 N ATOM 845 CA SER A 53 121.010 -7.091 -18.723 1.00 0.00 C ATOM 846 C SER A 53 120.409 -7.732 -19.964 1.00 0.00 C ATOM 847 O SER A 53 119.552 -7.147 -20.625 1.00 0.00 O ATOM 848 CB SER A 53 122.440 -6.633 -19.013 1.00 0.00 C ATOM 849 OG SER A 53 122.773 -5.556 -18.147 1.00 0.00 O ATOM 0 H SER A 53 121.919 -8.345 -17.308 1.00 0.00 H new ATOM 0 HA SER A 53 120.416 -6.221 -18.442 1.00 0.00 H new ATOM 0 HB2 SER A 53 123.135 -7.460 -18.868 1.00 0.00 H new ATOM 0 HB3 SER A 53 122.530 -6.320 -20.053 1.00 0.00 H new ATOM 0 HG SER A 53 122.860 -5.889 -17.229 1.00 0.00 H new ATOM 855 N GLU A 54 120.847 -8.951 -20.262 1.00 0.00 N ATOM 856 CA GLU A 54 120.321 -9.669 -21.414 1.00 0.00 C ATOM 857 C GLU A 54 118.839 -9.939 -21.208 1.00 0.00 C ATOM 858 O GLU A 54 117.995 -9.513 -22.000 1.00 0.00 O ATOM 859 CB GLU A 54 121.063 -10.994 -21.601 1.00 0.00 C ATOM 860 CG GLU A 54 122.569 -10.755 -21.498 1.00 0.00 C ATOM 861 CD GLU A 54 123.226 -10.979 -22.857 1.00 0.00 C ATOM 862 OE1 GLU A 54 122.651 -10.562 -23.847 1.00 0.00 O ATOM 863 OE2 GLU A 54 124.296 -11.566 -22.885 1.00 0.00 O ATOM 0 H GLU A 54 121.555 -9.456 -19.729 1.00 0.00 H new ATOM 0 HA GLU A 54 120.463 -9.059 -22.306 1.00 0.00 H new ATOM 0 HB2 GLU A 54 120.745 -11.711 -20.844 1.00 0.00 H new ATOM 0 HB3 GLU A 54 120.818 -11.426 -22.571 1.00 0.00 H new ATOM 0 HG2 GLU A 54 122.762 -9.739 -21.155 1.00 0.00 H new ATOM 0 HG3 GLU A 54 123.003 -11.429 -20.759 1.00 0.00 H new ATOM 870 N LEU A 55 118.526 -10.638 -20.124 1.00 0.00 N ATOM 871 CA LEU A 55 117.142 -10.949 -19.809 1.00 0.00 C ATOM 872 C LEU A 55 116.320 -9.667 -19.773 1.00 0.00 C ATOM 873 O LEU A 55 115.174 -9.645 -20.219 1.00 0.00 O ATOM 874 CB LEU A 55 117.052 -11.660 -18.457 1.00 0.00 C ATOM 875 CG LEU A 55 116.958 -13.171 -18.680 1.00 0.00 C ATOM 876 CD1 LEU A 55 116.903 -13.887 -17.329 1.00 0.00 C ATOM 877 CD2 LEU A 55 115.689 -13.493 -19.475 1.00 0.00 C ATOM 0 H LEU A 55 119.207 -10.997 -19.455 1.00 0.00 H new ATOM 0 HA LEU A 55 116.746 -11.609 -20.581 1.00 0.00 H new ATOM 0 HB2 LEU A 55 117.927 -11.425 -17.852 1.00 0.00 H new ATOM 0 HB3 LEU A 55 116.180 -11.308 -17.906 1.00 0.00 H new ATOM 0 HG LEU A 55 117.833 -13.508 -19.236 1.00 0.00 H new ATOM 0 HD11 LEU A 55 116.836 -14.963 -17.490 1.00 0.00 H new ATOM 0 HD12 LEU A 55 117.805 -13.661 -16.760 1.00 0.00 H new ATOM 0 HD13 LEU A 55 116.029 -13.548 -16.773 1.00 0.00 H new ATOM 0 HD21 LEU A 55 115.622 -14.569 -19.634 1.00 0.00 H new ATOM 0 HD22 LEU A 55 114.815 -13.153 -18.919 1.00 0.00 H new ATOM 0 HD23 LEU A 55 115.725 -12.986 -20.439 1.00 0.00 H new ATOM 889 N VAL A 56 116.917 -8.596 -19.253 1.00 0.00 N ATOM 890 CA VAL A 56 116.227 -7.313 -19.181 1.00 0.00 C ATOM 891 C VAL A 56 115.826 -6.877 -20.577 1.00 0.00 C ATOM 892 O VAL A 56 114.666 -6.554 -20.833 1.00 0.00 O ATOM 893 CB VAL A 56 117.133 -6.257 -18.544 1.00 0.00 C ATOM 894 CG1 VAL A 56 116.653 -4.863 -18.948 1.00 0.00 C ATOM 895 CG2 VAL A 56 117.078 -6.389 -17.020 1.00 0.00 C ATOM 0 H VAL A 56 117.866 -8.592 -18.880 1.00 0.00 H new ATOM 0 HA VAL A 56 115.335 -7.422 -18.564 1.00 0.00 H new ATOM 0 HB VAL A 56 118.157 -6.404 -18.887 1.00 0.00 H new ATOM 0 HG11 VAL A 56 117.298 -4.110 -18.494 1.00 0.00 H new ATOM 0 HG12 VAL A 56 116.689 -4.766 -20.033 1.00 0.00 H new ATOM 0 HG13 VAL A 56 115.629 -4.717 -18.605 1.00 0.00 H new ATOM 0 HG21 VAL A 56 117.723 -5.637 -16.566 1.00 0.00 H new ATOM 0 HG22 VAL A 56 116.053 -6.242 -16.679 1.00 0.00 H new ATOM 0 HG23 VAL A 56 117.418 -7.383 -16.728 1.00 0.00 H new ATOM 905 N ASP A 57 116.790 -6.900 -21.481 1.00 0.00 N ATOM 906 CA ASP A 57 116.524 -6.536 -22.860 1.00 0.00 C ATOM 907 C ASP A 57 115.295 -7.290 -23.342 1.00 0.00 C ATOM 908 O ASP A 57 114.489 -6.771 -24.113 1.00 0.00 O ATOM 909 CB ASP A 57 117.727 -6.906 -23.722 1.00 0.00 C ATOM 910 CG ASP A 57 117.724 -6.084 -25.007 1.00 0.00 C ATOM 911 OD1 ASP A 57 117.980 -4.894 -24.926 1.00 0.00 O ATOM 912 OD2 ASP A 57 117.468 -6.657 -26.052 1.00 0.00 O ATOM 0 H ASP A 57 117.756 -7.165 -21.287 1.00 0.00 H new ATOM 0 HA ASP A 57 116.347 -5.463 -22.934 1.00 0.00 H new ATOM 0 HB2 ASP A 57 118.649 -6.727 -23.169 1.00 0.00 H new ATOM 0 HB3 ASP A 57 117.700 -7.969 -23.961 1.00 0.00 H new ATOM 917 N ASP A 58 115.164 -8.522 -22.861 1.00 0.00 N ATOM 918 CA ASP A 58 114.031 -9.363 -23.221 1.00 0.00 C ATOM 919 C ASP A 58 112.889 -9.150 -22.241 1.00 0.00 C ATOM 920 O ASP A 58 112.014 -10.003 -22.093 1.00 0.00 O ATOM 921 CB ASP A 58 114.450 -10.833 -23.202 1.00 0.00 C ATOM 922 CG ASP A 58 114.432 -11.402 -24.616 1.00 0.00 C ATOM 923 OD1 ASP A 58 115.249 -10.977 -25.416 1.00 0.00 O ATOM 924 OD2 ASP A 58 113.600 -12.256 -24.878 1.00 0.00 O ATOM 0 H ASP A 58 115.828 -8.959 -22.222 1.00 0.00 H new ATOM 0 HA ASP A 58 113.698 -9.093 -24.223 1.00 0.00 H new ATOM 0 HB2 ASP A 58 115.449 -10.929 -22.776 1.00 0.00 H new ATOM 0 HB3 ASP A 58 113.775 -11.403 -22.564 1.00 0.00 H new ATOM 929 N SER A 59 112.918 -8.016 -21.563 1.00 0.00 N ATOM 930 CA SER A 59 111.891 -7.702 -20.578 1.00 0.00 C ATOM 931 C SER A 59 112.062 -8.607 -19.369 1.00 0.00 C ATOM 932 O SER A 59 111.127 -8.836 -18.603 1.00 0.00 O ATOM 933 CB SER A 59 110.499 -7.896 -21.182 1.00 0.00 C ATOM 934 OG SER A 59 110.143 -9.270 -21.108 1.00 0.00 O ATOM 0 H SER A 59 113.636 -7.300 -21.673 1.00 0.00 H new ATOM 0 HA SER A 59 111.994 -6.661 -20.272 1.00 0.00 H new ATOM 0 HB2 SER A 59 109.769 -7.290 -20.645 1.00 0.00 H new ATOM 0 HB3 SER A 59 110.490 -7.561 -22.219 1.00 0.00 H new ATOM 0 HG SER A 59 110.931 -9.823 -21.292 1.00 0.00 H new ATOM 940 N ALA A 60 113.279 -9.113 -19.221 1.00 0.00 N ATOM 941 CA ALA A 60 113.622 -10.000 -18.116 1.00 0.00 C ATOM 942 C ALA A 60 112.375 -10.430 -17.350 1.00 0.00 C ATOM 943 O ALA A 60 111.922 -9.737 -16.439 1.00 0.00 O ATOM 944 CB ALA A 60 114.588 -9.291 -17.174 1.00 0.00 C ATOM 0 H ALA A 60 114.052 -8.922 -19.859 1.00 0.00 H new ATOM 0 HA ALA A 60 114.095 -10.893 -18.525 1.00 0.00 H new ATOM 0 HB1 ALA A 60 114.844 -9.955 -16.348 1.00 0.00 H new ATOM 0 HB2 ALA A 60 115.494 -9.021 -17.717 1.00 0.00 H new ATOM 0 HB3 ALA A 60 114.118 -8.389 -16.782 1.00 0.00 H new ATOM 950 N PRO A 61 111.823 -11.556 -17.709 1.00 0.00 N ATOM 951 CA PRO A 61 110.599 -12.111 -17.055 1.00 0.00 C ATOM 952 C PRO A 61 110.787 -12.351 -15.559 1.00 0.00 C ATOM 953 O PRO A 61 110.278 -13.330 -15.013 1.00 0.00 O ATOM 954 CB PRO A 61 110.359 -13.440 -17.783 1.00 0.00 C ATOM 955 CG PRO A 61 111.121 -13.345 -19.063 1.00 0.00 C ATOM 956 CD PRO A 61 112.304 -12.425 -18.791 1.00 0.00 C ATOM 0 HA PRO A 61 109.762 -11.416 -17.127 1.00 0.00 H new ATOM 0 HB2 PRO A 61 110.705 -14.282 -17.184 1.00 0.00 H new ATOM 0 HB3 PRO A 61 109.297 -13.597 -17.971 1.00 0.00 H new ATOM 0 HG2 PRO A 61 111.460 -14.329 -19.387 1.00 0.00 H new ATOM 0 HG3 PRO A 61 110.494 -12.946 -19.860 1.00 0.00 H new ATOM 0 HD2 PRO A 61 113.188 -12.987 -18.491 1.00 0.00 H new ATOM 0 HD3 PRO A 61 112.577 -11.850 -19.676 1.00 0.00 H new ATOM 964 N PHE A 62 111.506 -11.451 -14.897 1.00 0.00 N ATOM 965 CA PHE A 62 111.726 -11.589 -13.466 1.00 0.00 C ATOM 966 C PHE A 62 112.398 -10.347 -12.884 1.00 0.00 C ATOM 967 O PHE A 62 113.231 -9.714 -13.532 1.00 0.00 O ATOM 968 CB PHE A 62 112.566 -12.835 -13.196 1.00 0.00 C ATOM 969 CG PHE A 62 114.030 -12.488 -13.184 1.00 0.00 C ATOM 970 CD1 PHE A 62 114.602 -11.835 -14.280 1.00 0.00 C ATOM 971 CD2 PHE A 62 114.818 -12.833 -12.083 1.00 0.00 C ATOM 972 CE1 PHE A 62 115.965 -11.527 -14.275 1.00 0.00 C ATOM 973 CE2 PHE A 62 116.180 -12.525 -12.075 1.00 0.00 C ATOM 974 CZ PHE A 62 116.757 -11.871 -13.172 1.00 0.00 C ATOM 0 H PHE A 62 111.939 -10.631 -15.322 1.00 0.00 H new ATOM 0 HA PHE A 62 110.759 -11.695 -12.975 1.00 0.00 H new ATOM 0 HB2 PHE A 62 112.282 -13.273 -12.239 1.00 0.00 H new ATOM 0 HB3 PHE A 62 112.370 -13.586 -13.961 1.00 0.00 H new ATOM 0 HD1 PHE A 62 113.991 -11.569 -15.130 1.00 0.00 H new ATOM 0 HD2 PHE A 62 114.374 -13.338 -11.238 1.00 0.00 H new ATOM 0 HE1 PHE A 62 116.408 -11.024 -15.122 1.00 0.00 H new ATOM 0 HE2 PHE A 62 116.789 -12.791 -11.223 1.00 0.00 H new ATOM 0 HZ PHE A 62 117.810 -11.633 -13.167 1.00 0.00 H new ATOM 984 N GLU A 63 112.015 -10.003 -11.656 1.00 0.00 N ATOM 985 CA GLU A 63 112.565 -8.830 -10.979 1.00 0.00 C ATOM 986 C GLU A 63 113.580 -9.239 -9.916 1.00 0.00 C ATOM 987 O GLU A 63 113.459 -10.296 -9.296 1.00 0.00 O ATOM 988 CB GLU A 63 111.434 -8.038 -10.318 1.00 0.00 C ATOM 989 CG GLU A 63 110.931 -6.957 -11.277 1.00 0.00 C ATOM 990 CD GLU A 63 110.599 -7.571 -12.633 1.00 0.00 C ATOM 991 OE1 GLU A 63 111.502 -8.101 -13.259 1.00 0.00 O ATOM 992 OE2 GLU A 63 109.447 -7.499 -13.027 1.00 0.00 O ATOM 0 H GLU A 63 111.326 -10.520 -11.109 1.00 0.00 H new ATOM 0 HA GLU A 63 113.068 -8.212 -11.723 1.00 0.00 H new ATOM 0 HB2 GLU A 63 110.617 -8.708 -10.049 1.00 0.00 H new ATOM 0 HB3 GLU A 63 111.789 -7.581 -9.394 1.00 0.00 H new ATOM 0 HG2 GLU A 63 110.046 -6.475 -10.861 1.00 0.00 H new ATOM 0 HG3 GLU A 63 111.690 -6.184 -11.396 1.00 0.00 H new ATOM 999 N ILE A 64 114.578 -8.385 -9.708 1.00 0.00 N ATOM 1000 CA ILE A 64 115.610 -8.655 -8.714 1.00 0.00 C ATOM 1001 C ILE A 64 115.313 -7.898 -7.423 1.00 0.00 C ATOM 1002 O ILE A 64 115.091 -6.687 -7.440 1.00 0.00 O ATOM 1003 CB ILE A 64 116.982 -8.233 -9.251 1.00 0.00 C ATOM 1004 CG1 ILE A 64 117.815 -9.477 -9.561 1.00 0.00 C ATOM 1005 CG2 ILE A 64 117.713 -7.386 -8.207 1.00 0.00 C ATOM 1006 CD1 ILE A 64 117.148 -10.275 -10.681 1.00 0.00 C ATOM 0 H ILE A 64 114.693 -7.505 -10.211 1.00 0.00 H new ATOM 0 HA ILE A 64 115.618 -9.725 -8.506 1.00 0.00 H new ATOM 0 HB ILE A 64 116.843 -7.647 -10.159 1.00 0.00 H new ATOM 0 HG12 ILE A 64 118.823 -9.187 -9.858 1.00 0.00 H new ATOM 0 HG13 ILE A 64 117.911 -10.095 -8.668 1.00 0.00 H new ATOM 0 HG21 ILE A 64 118.687 -7.090 -8.596 1.00 0.00 H new ATOM 0 HG22 ILE A 64 117.125 -6.495 -7.985 1.00 0.00 H new ATOM 0 HG23 ILE A 64 117.848 -7.968 -7.296 1.00 0.00 H new ATOM 0 HD11 ILE A 64 117.743 -11.161 -10.901 1.00 0.00 H new ATOM 0 HD12 ILE A 64 116.149 -10.577 -10.367 1.00 0.00 H new ATOM 0 HD13 ILE A 64 117.075 -9.656 -11.575 1.00 0.00 H new ATOM 1018 N ILE A 65 115.319 -8.615 -6.306 1.00 0.00 N ATOM 1019 CA ILE A 65 115.058 -7.995 -5.013 1.00 0.00 C ATOM 1020 C ILE A 65 116.371 -7.568 -4.368 1.00 0.00 C ATOM 1021 O ILE A 65 117.349 -8.319 -4.378 1.00 0.00 O ATOM 1022 CB ILE A 65 114.326 -8.977 -4.098 1.00 0.00 C ATOM 1023 CG1 ILE A 65 113.477 -9.926 -4.947 1.00 0.00 C ATOM 1024 CG2 ILE A 65 113.423 -8.208 -3.132 1.00 0.00 C ATOM 1025 CD1 ILE A 65 112.424 -9.122 -5.713 1.00 0.00 C ATOM 0 H ILE A 65 115.500 -9.618 -6.269 1.00 0.00 H new ATOM 0 HA ILE A 65 114.431 -7.116 -5.163 1.00 0.00 H new ATOM 0 HB ILE A 65 115.055 -9.552 -3.527 1.00 0.00 H new ATOM 0 HG12 ILE A 65 114.111 -10.473 -5.645 1.00 0.00 H new ATOM 0 HG13 ILE A 65 112.993 -10.666 -4.310 1.00 0.00 H new ATOM 0 HG21 ILE A 65 112.903 -8.912 -2.482 1.00 0.00 H new ATOM 0 HG22 ILE A 65 114.029 -7.534 -2.527 1.00 0.00 H new ATOM 0 HG23 ILE A 65 112.693 -7.630 -3.698 1.00 0.00 H new ATOM 0 HD11 ILE A 65 111.819 -9.798 -6.318 1.00 0.00 H new ATOM 0 HD12 ILE A 65 111.783 -8.596 -5.006 1.00 0.00 H new ATOM 0 HD13 ILE A 65 112.919 -8.399 -6.362 1.00 0.00 H new ATOM 1037 N PHE A 66 116.390 -6.362 -3.809 1.00 0.00 N ATOM 1038 CA PHE A 66 117.596 -5.853 -3.168 1.00 0.00 C ATOM 1039 C PHE A 66 117.529 -6.033 -1.656 1.00 0.00 C ATOM 1040 O PHE A 66 116.753 -5.365 -0.972 1.00 0.00 O ATOM 1041 CB PHE A 66 117.776 -4.370 -3.499 1.00 0.00 C ATOM 1042 CG PHE A 66 119.041 -4.180 -4.302 1.00 0.00 C ATOM 1043 CD1 PHE A 66 119.107 -4.640 -5.622 1.00 0.00 C ATOM 1044 CD2 PHE A 66 120.147 -3.545 -3.726 1.00 0.00 C ATOM 1045 CE1 PHE A 66 120.281 -4.465 -6.366 1.00 0.00 C ATOM 1046 CE2 PHE A 66 121.320 -3.370 -4.468 1.00 0.00 C ATOM 1047 CZ PHE A 66 121.387 -3.831 -5.790 1.00 0.00 C ATOM 0 H PHE A 66 115.593 -5.726 -3.787 1.00 0.00 H new ATOM 0 HA PHE A 66 118.447 -6.419 -3.547 1.00 0.00 H new ATOM 0 HB2 PHE A 66 116.917 -4.006 -4.063 1.00 0.00 H new ATOM 0 HB3 PHE A 66 117.825 -3.785 -2.580 1.00 0.00 H new ATOM 0 HD1 PHE A 66 118.253 -5.130 -6.067 1.00 0.00 H new ATOM 0 HD2 PHE A 66 120.095 -3.190 -2.707 1.00 0.00 H new ATOM 0 HE1 PHE A 66 120.332 -4.820 -7.385 1.00 0.00 H new ATOM 0 HE2 PHE A 66 122.173 -2.880 -4.023 1.00 0.00 H new ATOM 0 HZ PHE A 66 122.292 -3.697 -6.364 1.00 0.00 H new ATOM 1057 N VAL A 67 118.356 -6.937 -1.141 1.00 0.00 N ATOM 1058 CA VAL A 67 118.397 -7.198 0.293 1.00 0.00 C ATOM 1059 C VAL A 67 119.836 -7.141 0.790 1.00 0.00 C ATOM 1060 O VAL A 67 120.683 -6.482 0.187 1.00 0.00 O ATOM 1061 CB VAL A 67 117.802 -8.575 0.592 1.00 0.00 C ATOM 1062 CG1 VAL A 67 117.222 -8.584 2.008 1.00 0.00 C ATOM 1063 CG2 VAL A 67 116.691 -8.879 -0.415 1.00 0.00 C ATOM 0 H VAL A 67 119.004 -7.499 -1.693 1.00 0.00 H new ATOM 0 HA VAL A 67 117.810 -6.437 0.807 1.00 0.00 H new ATOM 0 HB VAL A 67 118.582 -9.333 0.514 1.00 0.00 H new ATOM 0 HG11 VAL A 67 116.798 -9.565 2.221 1.00 0.00 H new ATOM 0 HG12 VAL A 67 118.012 -8.366 2.726 1.00 0.00 H new ATOM 0 HG13 VAL A 67 116.442 -7.827 2.086 1.00 0.00 H new ATOM 0 HG21 VAL A 67 116.266 -9.860 -0.203 1.00 0.00 H new ATOM 0 HG22 VAL A 67 115.911 -8.121 -0.336 1.00 0.00 H new ATOM 0 HG23 VAL A 67 117.103 -8.872 -1.424 1.00 0.00 H new ATOM 1073 N SER A 68 120.114 -7.839 1.886 1.00 0.00 N ATOM 1074 CA SER A 68 121.464 -7.855 2.436 1.00 0.00 C ATOM 1075 C SER A 68 121.846 -6.477 2.965 1.00 0.00 C ATOM 1076 O SER A 68 121.375 -5.458 2.461 1.00 0.00 O ATOM 1077 CB SER A 68 122.459 -8.278 1.357 1.00 0.00 C ATOM 1078 OG SER A 68 123.554 -7.374 1.349 1.00 0.00 O ATOM 0 H SER A 68 119.433 -8.394 2.405 1.00 0.00 H new ATOM 0 HA SER A 68 121.491 -8.568 3.260 1.00 0.00 H new ATOM 0 HB2 SER A 68 122.811 -9.292 1.548 1.00 0.00 H new ATOM 0 HB3 SER A 68 121.973 -8.287 0.381 1.00 0.00 H new ATOM 0 HG SER A 68 123.336 -6.601 0.788 1.00 0.00 H new ATOM 1084 N SER A 69 122.698 -6.456 3.987 1.00 0.00 N ATOM 1085 CA SER A 69 123.140 -5.199 4.586 1.00 0.00 C ATOM 1086 C SER A 69 123.467 -4.161 3.514 1.00 0.00 C ATOM 1087 O SER A 69 124.628 -3.807 3.312 1.00 0.00 O ATOM 1088 CB SER A 69 124.375 -5.444 5.452 1.00 0.00 C ATOM 1089 OG SER A 69 123.976 -5.598 6.808 1.00 0.00 O ATOM 0 H SER A 69 123.095 -7.292 4.417 1.00 0.00 H new ATOM 0 HA SER A 69 122.327 -4.814 5.202 1.00 0.00 H new ATOM 0 HB2 SER A 69 124.900 -6.337 5.112 1.00 0.00 H new ATOM 0 HB3 SER A 69 125.070 -4.610 5.358 1.00 0.00 H new ATOM 0 HG SER A 69 124.766 -5.757 7.365 1.00 0.00 H new ATOM 1095 N ASP A 70 122.434 -3.673 2.841 1.00 0.00 N ATOM 1096 CA ASP A 70 122.607 -2.666 1.800 1.00 0.00 C ATOM 1097 C ASP A 70 122.018 -1.347 2.267 1.00 0.00 C ATOM 1098 O ASP A 70 121.857 -0.411 1.485 1.00 0.00 O ATOM 1099 CB ASP A 70 121.916 -3.104 0.511 1.00 0.00 C ATOM 1100 CG ASP A 70 122.307 -4.537 0.167 1.00 0.00 C ATOM 1101 OD1 ASP A 70 122.987 -5.153 0.970 1.00 0.00 O ATOM 1102 OD2 ASP A 70 121.921 -4.997 -0.895 1.00 0.00 O ATOM 0 H ASP A 70 121.467 -3.957 2.996 1.00 0.00 H new ATOM 0 HA ASP A 70 123.672 -2.546 1.603 1.00 0.00 H new ATOM 0 HB2 ASP A 70 120.835 -3.032 0.626 1.00 0.00 H new ATOM 0 HB3 ASP A 70 122.195 -2.437 -0.305 1.00 0.00 H new ATOM 1107 N ARG A 71 121.682 -1.303 3.548 1.00 0.00 N ATOM 1108 CA ARG A 71 121.087 -0.116 4.149 1.00 0.00 C ATOM 1109 C ARG A 71 121.649 1.163 3.539 1.00 0.00 C ATOM 1110 O ARG A 71 121.163 2.257 3.832 1.00 0.00 O ATOM 1111 CB ARG A 71 121.341 -0.116 5.657 1.00 0.00 C ATOM 1112 CG ARG A 71 122.819 0.178 5.926 1.00 0.00 C ATOM 1113 CD ARG A 71 122.966 1.599 6.471 1.00 0.00 C ATOM 1114 NE ARG A 71 124.321 1.811 6.970 1.00 0.00 N ATOM 1115 CZ ARG A 71 124.600 2.817 7.793 1.00 0.00 C ATOM 1116 NH1 ARG A 71 123.656 3.636 8.166 1.00 0.00 N ATOM 1117 NH2 ARG A 71 125.820 2.985 8.226 1.00 0.00 N ATOM 0 H ARG A 71 121.812 -2.080 4.196 1.00 0.00 H new ATOM 0 HA ARG A 71 120.015 -0.144 3.952 1.00 0.00 H new ATOM 0 HB2 ARG A 71 120.716 0.634 6.142 1.00 0.00 H new ATOM 0 HB3 ARG A 71 121.068 -1.082 6.082 1.00 0.00 H new ATOM 0 HG2 ARG A 71 123.219 -0.540 6.641 1.00 0.00 H new ATOM 0 HG3 ARG A 71 123.396 0.068 5.008 1.00 0.00 H new ATOM 0 HD2 ARG A 71 122.743 2.322 5.686 1.00 0.00 H new ATOM 0 HD3 ARG A 71 122.246 1.765 7.272 1.00 0.00 H new ATOM 0 HE ARG A 71 125.066 1.177 6.683 1.00 0.00 H new ATOM 0 HH11 ARG A 71 122.703 3.505 7.826 1.00 0.00 H new ATOM 0 HH12 ARG A 71 123.870 4.408 8.798 1.00 0.00 H new ATOM 0 HH21 ARG A 71 126.558 2.345 7.933 1.00 0.00 H new ATOM 0 HH22 ARG A 71 126.035 3.757 8.857 1.00 0.00 H new ATOM 1131 N SER A 72 122.660 1.037 2.684 1.00 0.00 N ATOM 1132 CA SER A 72 123.234 2.211 2.055 1.00 0.00 C ATOM 1133 C SER A 72 122.342 2.662 0.909 1.00 0.00 C ATOM 1134 O SER A 72 122.240 1.982 -0.111 1.00 0.00 O ATOM 1135 CB SER A 72 124.629 1.893 1.521 1.00 0.00 C ATOM 1136 OG SER A 72 124.719 0.501 1.242 1.00 0.00 O ATOM 0 H SER A 72 123.088 0.150 2.418 1.00 0.00 H new ATOM 0 HA SER A 72 123.310 3.008 2.795 1.00 0.00 H new ATOM 0 HB2 SER A 72 124.825 2.470 0.617 1.00 0.00 H new ATOM 0 HB3 SER A 72 125.385 2.179 2.252 1.00 0.00 H new ATOM 0 HG SER A 72 125.661 0.245 1.154 1.00 0.00 H new ATOM 1142 N GLU A 73 121.696 3.808 1.078 1.00 0.00 N ATOM 1143 CA GLU A 73 120.817 4.326 0.041 1.00 0.00 C ATOM 1144 C GLU A 73 121.633 4.757 -1.165 1.00 0.00 C ATOM 1145 O GLU A 73 121.166 4.696 -2.303 1.00 0.00 O ATOM 1146 CB GLU A 73 120.014 5.514 0.576 1.00 0.00 C ATOM 1147 CG GLU A 73 120.959 6.685 0.853 1.00 0.00 C ATOM 1148 CD GLU A 73 120.660 7.283 2.224 1.00 0.00 C ATOM 1149 OE1 GLU A 73 121.136 6.735 3.204 1.00 0.00 O ATOM 1150 OE2 GLU A 73 119.958 8.280 2.272 1.00 0.00 O ATOM 0 H GLU A 73 121.763 4.390 1.913 1.00 0.00 H new ATOM 0 HA GLU A 73 120.126 3.538 -0.259 1.00 0.00 H new ATOM 0 HB2 GLU A 73 119.255 5.809 -0.148 1.00 0.00 H new ATOM 0 HB3 GLU A 73 119.491 5.231 1.489 1.00 0.00 H new ATOM 0 HG2 GLU A 73 121.994 6.345 0.813 1.00 0.00 H new ATOM 0 HG3 GLU A 73 120.844 7.447 0.082 1.00 0.00 H new ATOM 1157 N ASP A 74 122.862 5.186 -0.908 1.00 0.00 N ATOM 1158 CA ASP A 74 123.740 5.618 -1.982 1.00 0.00 C ATOM 1159 C ASP A 74 124.377 4.414 -2.658 1.00 0.00 C ATOM 1160 O ASP A 74 124.422 4.336 -3.885 1.00 0.00 O ATOM 1161 CB ASP A 74 124.828 6.544 -1.437 1.00 0.00 C ATOM 1162 CG ASP A 74 125.894 6.779 -2.501 1.00 0.00 C ATOM 1163 OD1 ASP A 74 125.726 7.696 -3.288 1.00 0.00 O ATOM 1164 OD2 ASP A 74 126.863 6.039 -2.514 1.00 0.00 O ATOM 0 H ASP A 74 123.268 5.243 0.026 1.00 0.00 H new ATOM 0 HA ASP A 74 123.147 6.163 -2.716 1.00 0.00 H new ATOM 0 HB2 ASP A 74 124.389 7.495 -1.134 1.00 0.00 H new ATOM 0 HB3 ASP A 74 125.280 6.104 -0.548 1.00 0.00 H new ATOM 1169 N ASP A 75 124.862 3.468 -1.858 1.00 0.00 N ATOM 1170 CA ASP A 75 125.478 2.278 -2.419 1.00 0.00 C ATOM 1171 C ASP A 75 124.404 1.380 -3.015 1.00 0.00 C ATOM 1172 O ASP A 75 124.694 0.502 -3.828 1.00 0.00 O ATOM 1173 CB ASP A 75 126.253 1.527 -1.336 1.00 0.00 C ATOM 1174 CG ASP A 75 126.975 2.521 -0.434 1.00 0.00 C ATOM 1175 OD1 ASP A 75 127.527 3.475 -0.958 1.00 0.00 O ATOM 1176 OD2 ASP A 75 126.967 2.316 0.768 1.00 0.00 O ATOM 0 H ASP A 75 124.840 3.503 -0.839 1.00 0.00 H new ATOM 0 HA ASP A 75 126.174 2.571 -3.205 1.00 0.00 H new ATOM 0 HB2 ASP A 75 125.571 0.915 -0.746 1.00 0.00 H new ATOM 0 HB3 ASP A 75 126.973 0.849 -1.795 1.00 0.00 H new ATOM 1181 N MET A 76 123.159 1.620 -2.613 1.00 0.00 N ATOM 1182 CA MET A 76 122.043 0.839 -3.124 1.00 0.00 C ATOM 1183 C MET A 76 121.694 1.293 -4.537 1.00 0.00 C ATOM 1184 O MET A 76 121.642 0.481 -5.461 1.00 0.00 O ATOM 1185 CB MET A 76 120.823 1.002 -2.213 1.00 0.00 C ATOM 1186 CG MET A 76 119.636 0.229 -2.794 1.00 0.00 C ATOM 1187 SD MET A 76 118.101 0.824 -2.044 1.00 0.00 S ATOM 1188 CE MET A 76 118.559 0.526 -0.318 1.00 0.00 C ATOM 0 H MET A 76 122.901 2.343 -1.941 1.00 0.00 H new ATOM 0 HA MET A 76 122.332 -0.212 -3.146 1.00 0.00 H new ATOM 0 HB2 MET A 76 121.053 0.636 -1.213 1.00 0.00 H new ATOM 0 HB3 MET A 76 120.569 2.057 -2.115 1.00 0.00 H new ATOM 0 HG2 MET A 76 119.599 0.359 -3.876 1.00 0.00 H new ATOM 0 HG3 MET A 76 119.756 -0.838 -2.605 1.00 0.00 H new ATOM 0 HE1 MET A 76 117.659 0.359 0.274 1.00 0.00 H new ATOM 0 HE2 MET A 76 119.201 -0.353 -0.258 1.00 0.00 H new ATOM 0 HE3 MET A 76 119.094 1.392 0.071 1.00 0.00 H new ATOM 1198 N PHE A 77 121.455 2.592 -4.701 1.00 0.00 N ATOM 1199 CA PHE A 77 121.111 3.125 -6.014 1.00 0.00 C ATOM 1200 C PHE A 77 122.346 3.184 -6.908 1.00 0.00 C ATOM 1201 O PHE A 77 122.234 3.190 -8.134 1.00 0.00 O ATOM 1202 CB PHE A 77 120.510 4.525 -5.874 1.00 0.00 C ATOM 1203 CG PHE A 77 119.521 4.543 -4.730 1.00 0.00 C ATOM 1204 CD1 PHE A 77 118.627 3.480 -4.555 1.00 0.00 C ATOM 1205 CD2 PHE A 77 119.499 5.628 -3.845 1.00 0.00 C ATOM 1206 CE1 PHE A 77 117.711 3.503 -3.496 1.00 0.00 C ATOM 1207 CE2 PHE A 77 118.584 5.651 -2.787 1.00 0.00 C ATOM 1208 CZ PHE A 77 117.689 4.588 -2.612 1.00 0.00 C ATOM 0 H PHE A 77 121.492 3.285 -3.953 1.00 0.00 H new ATOM 0 HA PHE A 77 120.376 2.463 -6.471 1.00 0.00 H new ATOM 0 HB2 PHE A 77 121.300 5.254 -5.696 1.00 0.00 H new ATOM 0 HB3 PHE A 77 120.014 4.813 -6.801 1.00 0.00 H new ATOM 0 HD1 PHE A 77 118.644 2.642 -5.237 1.00 0.00 H new ATOM 0 HD2 PHE A 77 120.189 6.448 -3.979 1.00 0.00 H new ATOM 0 HE1 PHE A 77 117.021 2.683 -3.361 1.00 0.00 H new ATOM 0 HE2 PHE A 77 118.568 6.488 -2.105 1.00 0.00 H new ATOM 0 HZ PHE A 77 116.982 4.605 -1.795 1.00 0.00 H new ATOM 1218 N GLN A 78 123.521 3.223 -6.289 1.00 0.00 N ATOM 1219 CA GLN A 78 124.766 3.277 -7.045 1.00 0.00 C ATOM 1220 C GLN A 78 125.049 1.927 -7.692 1.00 0.00 C ATOM 1221 O GLN A 78 125.293 1.841 -8.896 1.00 0.00 O ATOM 1222 CB GLN A 78 125.926 3.660 -6.124 1.00 0.00 C ATOM 1223 CG GLN A 78 127.217 3.746 -6.937 1.00 0.00 C ATOM 1224 CD GLN A 78 128.067 4.914 -6.447 1.00 0.00 C ATOM 1225 OE1 GLN A 78 127.693 5.597 -5.492 1.00 0.00 O ATOM 1226 NE2 GLN A 78 129.194 5.186 -7.044 1.00 0.00 N ATOM 0 H GLN A 78 123.637 3.218 -5.276 1.00 0.00 H new ATOM 0 HA GLN A 78 124.665 4.031 -7.825 1.00 0.00 H new ATOM 0 HB2 GLN A 78 125.722 4.617 -5.644 1.00 0.00 H new ATOM 0 HB3 GLN A 78 126.033 2.921 -5.330 1.00 0.00 H new ATOM 0 HG2 GLN A 78 127.777 2.815 -6.845 1.00 0.00 H new ATOM 0 HG3 GLN A 78 126.983 3.874 -7.994 1.00 0.00 H new ATOM 0 HE21 GLN A 78 129.502 4.620 -7.834 1.00 0.00 H new ATOM 0 HE22 GLN A 78 129.767 5.965 -6.721 1.00 0.00 H new ATOM 1235 N TYR A 79 125.004 0.875 -6.886 1.00 0.00 N ATOM 1236 CA TYR A 79 125.246 -0.468 -7.393 1.00 0.00 C ATOM 1237 C TYR A 79 124.187 -0.830 -8.425 1.00 0.00 C ATOM 1238 O TYR A 79 124.484 -1.439 -9.452 1.00 0.00 O ATOM 1239 CB TYR A 79 125.215 -1.479 -6.245 1.00 0.00 C ATOM 1240 CG TYR A 79 126.628 -1.861 -5.872 1.00 0.00 C ATOM 1241 CD1 TYR A 79 127.634 -0.888 -5.854 1.00 0.00 C ATOM 1242 CD2 TYR A 79 126.931 -3.188 -5.546 1.00 0.00 C ATOM 1243 CE1 TYR A 79 128.944 -1.242 -5.510 1.00 0.00 C ATOM 1244 CE2 TYR A 79 128.241 -3.543 -5.201 1.00 0.00 C ATOM 1245 CZ TYR A 79 129.247 -2.569 -5.183 1.00 0.00 C ATOM 1246 OH TYR A 79 130.538 -2.918 -4.844 1.00 0.00 O ATOM 0 H TYR A 79 124.804 0.924 -5.887 1.00 0.00 H new ATOM 0 HA TYR A 79 126.230 -0.495 -7.862 1.00 0.00 H new ATOM 0 HB2 TYR A 79 124.703 -1.051 -5.383 1.00 0.00 H new ATOM 0 HB3 TYR A 79 124.654 -2.365 -6.542 1.00 0.00 H new ATOM 0 HD1 TYR A 79 127.400 0.136 -6.105 1.00 0.00 H new ATOM 0 HD2 TYR A 79 126.154 -3.938 -5.561 1.00 0.00 H new ATOM 0 HE1 TYR A 79 129.721 -0.492 -5.497 1.00 0.00 H new ATOM 0 HE2 TYR A 79 128.475 -4.567 -4.949 1.00 0.00 H new ATOM 0 HH TYR A 79 130.520 -3.552 -4.097 1.00 0.00 H new ATOM 1256 N MET A 80 122.948 -0.444 -8.142 1.00 0.00 N ATOM 1257 CA MET A 80 121.845 -0.724 -9.048 1.00 0.00 C ATOM 1258 C MET A 80 122.092 -0.069 -10.403 1.00 0.00 C ATOM 1259 O MET A 80 121.839 -0.667 -11.449 1.00 0.00 O ATOM 1260 CB MET A 80 120.536 -0.201 -8.458 1.00 0.00 C ATOM 1261 CG MET A 80 120.036 -1.169 -7.385 1.00 0.00 C ATOM 1262 SD MET A 80 118.506 -1.955 -7.948 1.00 0.00 S ATOM 1263 CE MET A 80 117.416 -1.255 -6.685 1.00 0.00 C ATOM 0 H MET A 80 122.685 0.061 -7.296 1.00 0.00 H new ATOM 0 HA MET A 80 121.774 -1.803 -9.183 1.00 0.00 H new ATOM 0 HB2 MET A 80 120.689 0.788 -8.027 1.00 0.00 H new ATOM 0 HB3 MET A 80 119.788 -0.094 -9.244 1.00 0.00 H new ATOM 0 HG2 MET A 80 120.793 -1.926 -7.182 1.00 0.00 H new ATOM 0 HG3 MET A 80 119.861 -0.635 -6.451 1.00 0.00 H new ATOM 0 HE1 MET A 80 116.388 -1.556 -6.884 1.00 0.00 H new ATOM 0 HE2 MET A 80 117.717 -1.619 -5.703 1.00 0.00 H new ATOM 0 HE3 MET A 80 117.486 -0.167 -6.706 1.00 0.00 H new ATOM 1273 N MET A 81 122.587 1.164 -10.374 1.00 0.00 N ATOM 1274 CA MET A 81 122.864 1.892 -11.606 1.00 0.00 C ATOM 1275 C MET A 81 124.069 1.291 -12.324 1.00 0.00 C ATOM 1276 O MET A 81 124.215 1.437 -13.537 1.00 0.00 O ATOM 1277 CB MET A 81 123.127 3.368 -11.289 1.00 0.00 C ATOM 1278 CG MET A 81 124.630 3.657 -11.350 1.00 0.00 C ATOM 1279 SD MET A 81 125.165 3.721 -13.078 1.00 0.00 S ATOM 1280 CE MET A 81 124.065 5.055 -13.610 1.00 0.00 C ATOM 0 H MET A 81 122.803 1.676 -9.519 1.00 0.00 H new ATOM 0 HA MET A 81 121.996 1.813 -12.261 1.00 0.00 H new ATOM 0 HB2 MET A 81 122.597 4.001 -12.001 1.00 0.00 H new ATOM 0 HB3 MET A 81 122.742 3.610 -10.299 1.00 0.00 H new ATOM 0 HG2 MET A 81 124.849 4.603 -10.855 1.00 0.00 H new ATOM 0 HG3 MET A 81 125.182 2.883 -10.816 1.00 0.00 H new ATOM 0 HE1 MET A 81 124.559 5.649 -14.379 1.00 0.00 H new ATOM 0 HE2 MET A 81 123.146 4.630 -14.014 1.00 0.00 H new ATOM 0 HE3 MET A 81 123.826 5.691 -12.758 1.00 0.00 H new ATOM 1290 N GLU A 82 124.930 0.616 -11.568 1.00 0.00 N ATOM 1291 CA GLU A 82 126.119 0.000 -12.145 1.00 0.00 C ATOM 1292 C GLU A 82 125.743 -1.114 -13.117 1.00 0.00 C ATOM 1293 O GLU A 82 126.570 -1.543 -13.920 1.00 0.00 O ATOM 1294 CB GLU A 82 127.004 -0.568 -11.033 1.00 0.00 C ATOM 1295 CG GLU A 82 128.209 0.348 -10.820 1.00 0.00 C ATOM 1296 CD GLU A 82 128.939 -0.040 -9.538 1.00 0.00 C ATOM 1297 OE1 GLU A 82 128.514 -0.991 -8.904 1.00 0.00 O ATOM 1298 OE2 GLU A 82 129.912 0.619 -9.210 1.00 0.00 O ATOM 0 H GLU A 82 124.828 0.483 -10.562 1.00 0.00 H new ATOM 0 HA GLU A 82 126.666 0.767 -12.693 1.00 0.00 H new ATOM 0 HB2 GLU A 82 126.433 -0.656 -10.109 1.00 0.00 H new ATOM 0 HB3 GLU A 82 127.339 -1.571 -11.297 1.00 0.00 H new ATOM 0 HG2 GLU A 82 128.887 0.275 -11.671 1.00 0.00 H new ATOM 0 HG3 GLU A 82 127.881 1.386 -10.762 1.00 0.00 H new ATOM 1305 N SER A 83 124.492 -1.572 -13.038 1.00 0.00 N ATOM 1306 CA SER A 83 124.000 -2.637 -13.917 1.00 0.00 C ATOM 1307 C SER A 83 123.470 -3.814 -13.100 1.00 0.00 C ATOM 1308 O SER A 83 123.083 -4.839 -13.655 1.00 0.00 O ATOM 1309 CB SER A 83 125.107 -3.130 -14.850 1.00 0.00 C ATOM 1310 OG SER A 83 125.534 -2.060 -15.682 1.00 0.00 O ATOM 0 H SER A 83 123.800 -1.223 -12.375 1.00 0.00 H new ATOM 0 HA SER A 83 123.189 -2.220 -14.514 1.00 0.00 H new ATOM 0 HB2 SER A 83 125.946 -3.510 -14.268 1.00 0.00 H new ATOM 0 HB3 SER A 83 124.742 -3.957 -15.460 1.00 0.00 H new ATOM 0 HG SER A 83 126.361 -1.676 -15.322 1.00 0.00 H new ATOM 1316 N HIS A 84 123.459 -3.662 -11.782 1.00 0.00 N ATOM 1317 CA HIS A 84 122.978 -4.725 -10.905 1.00 0.00 C ATOM 1318 C HIS A 84 121.481 -4.574 -10.644 1.00 0.00 C ATOM 1319 O HIS A 84 121.057 -3.686 -9.907 1.00 0.00 O ATOM 1320 CB HIS A 84 123.738 -4.688 -9.577 1.00 0.00 C ATOM 1321 CG HIS A 84 124.413 -6.011 -9.345 1.00 0.00 C ATOM 1322 ND1 HIS A 84 124.558 -6.555 -8.078 1.00 0.00 N ATOM 1323 CD2 HIS A 84 124.988 -6.912 -10.209 1.00 0.00 C ATOM 1324 CE1 HIS A 84 125.195 -7.731 -8.213 1.00 0.00 C ATOM 1325 NE2 HIS A 84 125.480 -7.998 -9.491 1.00 0.00 N ATOM 0 H HIS A 84 123.774 -2.821 -11.299 1.00 0.00 H new ATOM 0 HA HIS A 84 123.151 -5.682 -11.397 1.00 0.00 H new ATOM 0 HB2 HIS A 84 124.479 -3.888 -9.592 1.00 0.00 H new ATOM 0 HB3 HIS A 84 123.051 -4.471 -8.759 1.00 0.00 H new ATOM 0 HD1 HIS A 84 124.239 -6.139 -7.203 1.00 0.00 H new ATOM 0 HD2 HIS A 84 125.049 -6.795 -11.281 1.00 0.00 H new ATOM 0 HE1 HIS A 84 125.446 -8.381 -7.388 1.00 0.00 H new ATOM 1334 N GLY A 85 120.687 -5.449 -11.252 1.00 0.00 N ATOM 1335 CA GLY A 85 119.239 -5.402 -11.075 1.00 0.00 C ATOM 1336 C GLY A 85 118.697 -4.022 -11.426 1.00 0.00 C ATOM 1337 O GLY A 85 119.243 -3.007 -10.993 1.00 0.00 O ATOM 0 H GLY A 85 121.017 -6.193 -11.866 1.00 0.00 H new ATOM 0 HA2 GLY A 85 118.766 -6.155 -11.706 1.00 0.00 H new ATOM 0 HA3 GLY A 85 118.986 -5.646 -10.043 1.00 0.00 H new ATOM 1341 N ASP A 86 117.627 -3.981 -12.218 1.00 0.00 N ATOM 1342 CA ASP A 86 117.051 -2.699 -12.612 1.00 0.00 C ATOM 1343 C ASP A 86 115.545 -2.646 -12.360 1.00 0.00 C ATOM 1344 O ASP A 86 114.759 -2.538 -13.301 1.00 0.00 O ATOM 1345 CB ASP A 86 117.326 -2.438 -14.094 1.00 0.00 C ATOM 1346 CG ASP A 86 116.970 -3.672 -14.915 1.00 0.00 C ATOM 1347 OD1 ASP A 86 117.049 -4.763 -14.376 1.00 0.00 O ATOM 1348 OD2 ASP A 86 116.622 -3.507 -16.074 1.00 0.00 O ATOM 0 H ASP A 86 117.151 -4.802 -12.592 1.00 0.00 H new ATOM 0 HA ASP A 86 117.522 -1.929 -12.001 1.00 0.00 H new ATOM 0 HB2 ASP A 86 116.743 -1.583 -14.436 1.00 0.00 H new ATOM 0 HB3 ASP A 86 118.376 -2.185 -14.239 1.00 0.00 H new ATOM 1353 N TRP A 87 115.142 -2.704 -11.092 1.00 0.00 N ATOM 1354 CA TRP A 87 113.719 -2.639 -10.762 1.00 0.00 C ATOM 1355 C TRP A 87 113.484 -1.980 -9.405 1.00 0.00 C ATOM 1356 O TRP A 87 113.559 -0.757 -9.286 1.00 0.00 O ATOM 1357 CB TRP A 87 113.106 -4.036 -10.787 1.00 0.00 C ATOM 1358 CG TRP A 87 113.298 -4.605 -12.149 1.00 0.00 C ATOM 1359 CD1 TRP A 87 112.496 -4.375 -13.214 1.00 0.00 C ATOM 1360 CD2 TRP A 87 114.356 -5.479 -12.612 1.00 0.00 C ATOM 1361 NE1 TRP A 87 113.004 -5.056 -14.306 1.00 0.00 N ATOM 1362 CE2 TRP A 87 114.152 -5.752 -13.982 1.00 0.00 C ATOM 1363 CE3 TRP A 87 115.464 -6.056 -11.977 1.00 0.00 C ATOM 1364 CZ2 TRP A 87 115.023 -6.568 -14.699 1.00 0.00 C ATOM 1365 CZ3 TRP A 87 116.342 -6.876 -12.692 1.00 0.00 C ATOM 1366 CH2 TRP A 87 116.124 -7.132 -14.050 1.00 0.00 C ATOM 0 H TRP A 87 115.766 -2.794 -10.290 1.00 0.00 H new ATOM 0 HA TRP A 87 113.232 -2.022 -11.517 1.00 0.00 H new ATOM 0 HB2 TRP A 87 113.580 -4.672 -10.039 1.00 0.00 H new ATOM 0 HB3 TRP A 87 112.045 -3.990 -10.541 1.00 0.00 H new ATOM 0 HD1 TRP A 87 111.607 -3.762 -13.212 1.00 0.00 H new ATOM 0 HE1 TRP A 87 112.583 -5.045 -15.235 1.00 0.00 H new ATOM 0 HE3 TRP A 87 115.641 -5.866 -10.929 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 114.849 -6.763 -15.747 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 117.194 -7.314 -12.193 1.00 0.00 H new ATOM 0 HH2 TRP A 87 116.807 -7.766 -14.597 1.00 0.00 H new ATOM 1377 N LEU A 88 113.181 -2.780 -8.381 1.00 0.00 N ATOM 1378 CA LEU A 88 112.923 -2.219 -7.059 1.00 0.00 C ATOM 1379 C LEU A 88 113.844 -2.802 -5.990 1.00 0.00 C ATOM 1380 O LEU A 88 114.645 -3.701 -6.247 1.00 0.00 O ATOM 1381 CB LEU A 88 111.465 -2.448 -6.640 1.00 0.00 C ATOM 1382 CG LEU A 88 110.822 -3.583 -7.448 1.00 0.00 C ATOM 1383 CD1 LEU A 88 110.407 -3.068 -8.826 1.00 0.00 C ATOM 1384 CD2 LEU A 88 111.800 -4.755 -7.602 1.00 0.00 C ATOM 0 H LEU A 88 113.110 -3.796 -8.440 1.00 0.00 H new ATOM 0 HA LEU A 88 113.122 -1.150 -7.138 1.00 0.00 H new ATOM 0 HB2 LEU A 88 111.423 -2.687 -5.577 1.00 0.00 H new ATOM 0 HB3 LEU A 88 110.895 -1.530 -6.783 1.00 0.00 H new ATOM 0 HG LEU A 88 109.939 -3.935 -6.914 1.00 0.00 H new ATOM 0 HD11 LEU A 88 109.951 -3.878 -9.395 1.00 0.00 H new ATOM 0 HD12 LEU A 88 109.688 -2.257 -8.710 1.00 0.00 H new ATOM 0 HD13 LEU A 88 111.285 -2.701 -9.357 1.00 0.00 H new ATOM 0 HD21 LEU A 88 111.327 -5.551 -8.178 1.00 0.00 H new ATOM 0 HD22 LEU A 88 112.696 -4.415 -8.121 1.00 0.00 H new ATOM 0 HD23 LEU A 88 112.073 -5.133 -6.617 1.00 0.00 H new ATOM 1396 N ALA A 89 113.698 -2.262 -4.786 1.00 0.00 N ATOM 1397 CA ALA A 89 114.489 -2.696 -3.641 1.00 0.00 C ATOM 1398 C ALA A 89 113.684 -2.548 -2.356 1.00 0.00 C ATOM 1399 O ALA A 89 113.146 -1.479 -2.073 1.00 0.00 O ATOM 1400 CB ALA A 89 115.766 -1.860 -3.541 1.00 0.00 C ATOM 0 H ALA A 89 113.034 -1.517 -4.577 1.00 0.00 H new ATOM 0 HA ALA A 89 114.752 -3.745 -3.778 1.00 0.00 H new ATOM 0 HB1 ALA A 89 116.351 -2.191 -2.683 1.00 0.00 H new ATOM 0 HB2 ALA A 89 116.354 -1.984 -4.450 1.00 0.00 H new ATOM 0 HB3 ALA A 89 115.504 -0.809 -3.418 1.00 0.00 H new ATOM 1406 N ILE A 90 113.607 -3.624 -1.579 1.00 0.00 N ATOM 1407 CA ILE A 90 112.864 -3.589 -0.325 1.00 0.00 C ATOM 1408 C ILE A 90 113.627 -2.790 0.720 1.00 0.00 C ATOM 1409 O ILE A 90 114.697 -3.204 1.164 1.00 0.00 O ATOM 1410 CB ILE A 90 112.655 -4.998 0.213 1.00 0.00 C ATOM 1411 CG1 ILE A 90 112.580 -5.991 -0.952 1.00 0.00 C ATOM 1412 CG2 ILE A 90 111.356 -5.045 1.022 1.00 0.00 C ATOM 1413 CD1 ILE A 90 111.673 -7.165 -0.571 1.00 0.00 C ATOM 0 H ILE A 90 114.044 -4.521 -1.792 1.00 0.00 H new ATOM 0 HA ILE A 90 111.900 -3.121 -0.524 1.00 0.00 H new ATOM 0 HB ILE A 90 113.492 -5.270 0.857 1.00 0.00 H new ATOM 0 HG12 ILE A 90 112.194 -5.494 -1.842 1.00 0.00 H new ATOM 0 HG13 ILE A 90 113.578 -6.354 -1.198 1.00 0.00 H new ATOM 0 HG21 ILE A 90 111.204 -6.053 1.408 1.00 0.00 H new ATOM 0 HG22 ILE A 90 111.420 -4.343 1.854 1.00 0.00 H new ATOM 0 HG23 ILE A 90 110.518 -4.772 0.381 1.00 0.00 H new ATOM 0 HD11 ILE A 90 111.622 -7.869 -1.401 1.00 0.00 H new ATOM 0 HD12 ILE A 90 112.078 -7.668 0.307 1.00 0.00 H new ATOM 0 HD13 ILE A 90 110.673 -6.794 -0.347 1.00 0.00 H new ATOM 1425 N PRO A 91 113.103 -1.671 1.127 1.00 0.00 N ATOM 1426 CA PRO A 91 113.764 -0.829 2.150 1.00 0.00 C ATOM 1427 C PRO A 91 114.168 -1.653 3.369 1.00 0.00 C ATOM 1428 O PRO A 91 113.315 -2.116 4.123 1.00 0.00 O ATOM 1429 CB PRO A 91 112.708 0.216 2.515 1.00 0.00 C ATOM 1430 CG PRO A 91 111.780 0.278 1.347 1.00 0.00 C ATOM 1431 CD PRO A 91 111.839 -1.087 0.658 1.00 0.00 C ATOM 0 HA PRO A 91 114.686 -0.379 1.783 1.00 0.00 H new ATOM 0 HB2 PRO A 91 112.176 -0.066 3.423 1.00 0.00 H new ATOM 0 HB3 PRO A 91 113.166 1.187 2.703 1.00 0.00 H new ATOM 0 HG2 PRO A 91 110.764 0.502 1.673 1.00 0.00 H new ATOM 0 HG3 PRO A 91 112.077 1.070 0.660 1.00 0.00 H new ATOM 0 HD2 PRO A 91 110.987 -1.709 0.932 1.00 0.00 H new ATOM 0 HD3 PRO A 91 111.825 -0.987 -0.427 1.00 0.00 H new ATOM 1439 N TYR A 92 115.471 -1.844 3.547 1.00 0.00 N ATOM 1440 CA TYR A 92 115.972 -2.625 4.673 1.00 0.00 C ATOM 1441 C TYR A 92 115.031 -2.505 5.865 1.00 0.00 C ATOM 1442 O TYR A 92 114.953 -3.405 6.702 1.00 0.00 O ATOM 1443 CB TYR A 92 117.371 -2.146 5.070 1.00 0.00 C ATOM 1444 CG TYR A 92 117.527 -0.684 4.729 1.00 0.00 C ATOM 1445 CD1 TYR A 92 117.679 -0.286 3.395 1.00 0.00 C ATOM 1446 CD2 TYR A 92 117.526 0.276 5.749 1.00 0.00 C ATOM 1447 CE1 TYR A 92 117.828 1.071 3.081 1.00 0.00 C ATOM 1448 CE2 TYR A 92 117.675 1.631 5.435 1.00 0.00 C ATOM 1449 CZ TYR A 92 117.826 2.029 4.101 1.00 0.00 C ATOM 1450 OH TYR A 92 117.973 3.366 3.793 1.00 0.00 O ATOM 0 H TYR A 92 116.195 -1.472 2.932 1.00 0.00 H new ATOM 0 HA TYR A 92 116.025 -3.670 4.369 1.00 0.00 H new ATOM 0 HB2 TYR A 92 117.528 -2.299 6.138 1.00 0.00 H new ATOM 0 HB3 TYR A 92 118.128 -2.733 4.549 1.00 0.00 H new ATOM 0 HD1 TYR A 92 117.681 -1.026 2.608 1.00 0.00 H new ATOM 0 HD2 TYR A 92 117.410 -0.030 6.778 1.00 0.00 H new ATOM 0 HE1 TYR A 92 117.944 1.378 2.052 1.00 0.00 H new ATOM 0 HE2 TYR A 92 117.674 2.371 6.222 1.00 0.00 H new ATOM 0 HH TYR A 92 117.949 3.896 4.617 1.00 0.00 H new ATOM 1460 N ARG A 93 114.312 -1.391 5.928 1.00 0.00 N ATOM 1461 CA ARG A 93 113.368 -1.164 7.016 1.00 0.00 C ATOM 1462 C ARG A 93 112.026 -1.807 6.693 1.00 0.00 C ATOM 1463 O ARG A 93 110.988 -1.422 7.234 1.00 0.00 O ATOM 1464 CB ARG A 93 113.182 0.336 7.250 1.00 0.00 C ATOM 1465 CG ARG A 93 114.279 0.848 8.186 1.00 0.00 C ATOM 1466 CD ARG A 93 114.730 2.237 7.732 1.00 0.00 C ATOM 1467 NE ARG A 93 113.637 3.192 7.868 1.00 0.00 N ATOM 1468 CZ ARG A 93 113.871 4.498 7.952 1.00 0.00 C ATOM 1469 NH1 ARG A 93 115.096 4.944 7.915 1.00 0.00 N ATOM 1470 NH2 ARG A 93 112.876 5.333 8.071 1.00 0.00 N ATOM 0 H ARG A 93 114.363 -0.636 5.244 1.00 0.00 H new ATOM 0 HA ARG A 93 113.768 -1.618 7.923 1.00 0.00 H new ATOM 0 HB2 ARG A 93 113.221 0.870 6.301 1.00 0.00 H new ATOM 0 HB3 ARG A 93 112.201 0.528 7.684 1.00 0.00 H new ATOM 0 HG2 ARG A 93 113.907 0.891 9.210 1.00 0.00 H new ATOM 0 HG3 ARG A 93 115.125 0.160 8.183 1.00 0.00 H new ATOM 0 HD2 ARG A 93 115.583 2.563 8.327 1.00 0.00 H new ATOM 0 HD3 ARG A 93 115.062 2.198 6.694 1.00 0.00 H new ATOM 0 HE ARG A 93 112.676 2.852 7.899 1.00 0.00 H new ATOM 0 HH11 ARG A 93 115.874 4.291 7.822 1.00 0.00 H new ATOM 0 HH12 ARG A 93 115.276 5.946 7.979 1.00 0.00 H new ATOM 0 HH21 ARG A 93 111.918 4.984 8.100 1.00 0.00 H new ATOM 0 HH22 ARG A 93 113.056 6.335 8.135 1.00 0.00 H new ATOM 1484 N SER A 94 112.061 -2.785 5.800 1.00 0.00 N ATOM 1485 CA SER A 94 110.856 -3.488 5.386 1.00 0.00 C ATOM 1486 C SER A 94 110.772 -4.857 6.053 1.00 0.00 C ATOM 1487 O SER A 94 110.798 -5.885 5.380 1.00 0.00 O ATOM 1488 CB SER A 94 110.850 -3.658 3.868 1.00 0.00 C ATOM 1489 OG SER A 94 110.143 -4.845 3.530 1.00 0.00 O ATOM 0 H SER A 94 112.915 -3.111 5.347 1.00 0.00 H new ATOM 0 HA SER A 94 109.992 -2.897 5.691 1.00 0.00 H new ATOM 0 HB2 SER A 94 110.381 -2.795 3.396 1.00 0.00 H new ATOM 0 HB3 SER A 94 111.872 -3.710 3.493 1.00 0.00 H new ATOM 0 HG SER A 94 110.679 -5.627 3.779 1.00 0.00 H new ATOM 1495 N GLY A 95 110.675 -4.859 7.381 1.00 0.00 N ATOM 1496 CA GLY A 95 110.590 -6.103 8.142 1.00 0.00 C ATOM 1497 C GLY A 95 110.407 -7.315 7.231 1.00 0.00 C ATOM 1498 O GLY A 95 111.268 -8.195 7.178 1.00 0.00 O ATOM 0 H GLY A 95 110.653 -4.014 7.952 1.00 0.00 H new ATOM 0 HA2 GLY A 95 111.495 -6.228 8.736 1.00 0.00 H new ATOM 0 HA3 GLY A 95 109.756 -6.045 8.841 1.00 0.00 H new ATOM 1502 N PRO A 96 109.314 -7.378 6.515 1.00 0.00 N ATOM 1503 CA PRO A 96 109.023 -8.505 5.587 1.00 0.00 C ATOM 1504 C PRO A 96 110.273 -8.992 4.851 1.00 0.00 C ATOM 1505 O PRO A 96 110.347 -10.148 4.436 1.00 0.00 O ATOM 1506 CB PRO A 96 108.011 -7.902 4.617 1.00 0.00 C ATOM 1507 CG PRO A 96 107.276 -6.867 5.409 1.00 0.00 C ATOM 1508 CD PRO A 96 108.226 -6.385 6.514 1.00 0.00 C ATOM 0 HA PRO A 96 108.653 -9.388 6.109 1.00 0.00 H new ATOM 0 HB2 PRO A 96 108.508 -7.458 3.755 1.00 0.00 H new ATOM 0 HB3 PRO A 96 107.330 -8.663 4.235 1.00 0.00 H new ATOM 0 HG2 PRO A 96 106.974 -6.036 4.771 1.00 0.00 H new ATOM 0 HG3 PRO A 96 106.366 -7.285 5.839 1.00 0.00 H new ATOM 0 HD2 PRO A 96 108.602 -5.383 6.307 1.00 0.00 H new ATOM 0 HD3 PRO A 96 107.724 -6.344 7.481 1.00 0.00 H new ATOM 1516 N ALA A 97 111.251 -8.106 4.705 1.00 0.00 N ATOM 1517 CA ALA A 97 112.495 -8.458 4.031 1.00 0.00 C ATOM 1518 C ALA A 97 113.354 -9.329 4.938 1.00 0.00 C ATOM 1519 O ALA A 97 114.000 -10.274 4.482 1.00 0.00 O ATOM 1520 CB ALA A 97 113.264 -7.190 3.654 1.00 0.00 C ATOM 0 H ALA A 97 111.208 -7.144 5.042 1.00 0.00 H new ATOM 0 HA ALA A 97 112.257 -9.014 3.125 1.00 0.00 H new ATOM 0 HB1 ALA A 97 114.192 -7.463 3.151 1.00 0.00 H new ATOM 0 HB2 ALA A 97 112.655 -6.580 2.986 1.00 0.00 H new ATOM 0 HB3 ALA A 97 113.494 -6.622 4.556 1.00 0.00 H new ATOM 1526 N SER A 98 113.345 -9.017 6.231 1.00 0.00 N ATOM 1527 CA SER A 98 114.116 -9.798 7.187 1.00 0.00 C ATOM 1528 C SER A 98 113.467 -11.163 7.356 1.00 0.00 C ATOM 1529 O SER A 98 114.052 -12.188 7.011 1.00 0.00 O ATOM 1530 CB SER A 98 114.171 -9.080 8.536 1.00 0.00 C ATOM 1531 OG SER A 98 114.337 -10.038 9.572 1.00 0.00 O ATOM 0 H SER A 98 112.820 -8.241 6.634 1.00 0.00 H new ATOM 0 HA SER A 98 115.134 -9.918 6.815 1.00 0.00 H new ATOM 0 HB2 SER A 98 114.996 -8.368 8.548 1.00 0.00 H new ATOM 0 HB3 SER A 98 113.255 -8.510 8.695 1.00 0.00 H new ATOM 0 HG SER A 98 114.374 -9.580 10.438 1.00 0.00 H new ATOM 1537 N ASN A 99 112.246 -11.163 7.874 1.00 0.00 N ATOM 1538 CA ASN A 99 111.517 -12.409 8.065 1.00 0.00 C ATOM 1539 C ASN A 99 111.656 -13.269 6.816 1.00 0.00 C ATOM 1540 O ASN A 99 111.713 -14.495 6.894 1.00 0.00 O ATOM 1541 CB ASN A 99 110.039 -12.120 8.333 1.00 0.00 C ATOM 1542 CG ASN A 99 109.903 -10.931 9.278 1.00 0.00 C ATOM 1543 OD1 ASN A 99 110.769 -10.707 10.125 1.00 0.00 O ATOM 1544 ND2 ASN A 99 108.862 -10.150 9.184 1.00 0.00 N ATOM 0 H ASN A 99 111.744 -10.324 8.166 1.00 0.00 H new ATOM 0 HA ASN A 99 111.931 -12.939 8.923 1.00 0.00 H new ATOM 0 HB2 ASN A 99 109.525 -11.910 7.395 1.00 0.00 H new ATOM 0 HB3 ASN A 99 109.562 -12.998 8.769 1.00 0.00 H new ATOM 0 HD21 ASN A 99 108.764 -9.353 9.812 1.00 0.00 H new ATOM 0 HD22 ASN A 99 108.146 -10.337 8.482 1.00 0.00 H new ATOM 1551 N VAL A 100 111.725 -12.607 5.664 1.00 0.00 N ATOM 1552 CA VAL A 100 111.877 -13.302 4.394 1.00 0.00 C ATOM 1553 C VAL A 100 113.172 -14.109 4.398 1.00 0.00 C ATOM 1554 O VAL A 100 113.168 -15.318 4.172 1.00 0.00 O ATOM 1555 CB VAL A 100 111.907 -12.283 3.252 1.00 0.00 C ATOM 1556 CG1 VAL A 100 112.760 -12.817 2.100 1.00 0.00 C ATOM 1557 CG2 VAL A 100 110.482 -12.027 2.756 1.00 0.00 C ATOM 0 H VAL A 100 111.678 -11.591 5.586 1.00 0.00 H new ATOM 0 HA VAL A 100 111.035 -13.979 4.252 1.00 0.00 H new ATOM 0 HB VAL A 100 112.339 -11.351 3.616 1.00 0.00 H new ATOM 0 HG11 VAL A 100 112.777 -12.087 1.291 1.00 0.00 H new ATOM 0 HG12 VAL A 100 113.777 -12.993 2.451 1.00 0.00 H new ATOM 0 HG13 VAL A 100 112.335 -13.752 1.736 1.00 0.00 H new ATOM 0 HG21 VAL A 100 110.505 -11.301 1.943 1.00 0.00 H new ATOM 0 HG22 VAL A 100 110.048 -12.960 2.397 1.00 0.00 H new ATOM 0 HG23 VAL A 100 109.877 -11.637 3.574 1.00 0.00 H new ATOM 1567 N THR A 101 114.276 -13.421 4.667 1.00 0.00 N ATOM 1568 CA THR A 101 115.585 -14.064 4.715 1.00 0.00 C ATOM 1569 C THR A 101 115.623 -15.122 5.801 1.00 0.00 C ATOM 1570 O THR A 101 116.092 -16.241 5.594 1.00 0.00 O ATOM 1571 CB THR A 101 116.652 -13.023 5.040 1.00 0.00 C ATOM 1572 OG1 THR A 101 116.347 -11.805 4.374 1.00 0.00 O ATOM 1573 CG2 THR A 101 118.022 -13.531 4.589 1.00 0.00 C ATOM 0 H THR A 101 114.291 -12.419 4.855 1.00 0.00 H new ATOM 0 HA THR A 101 115.772 -14.524 3.745 1.00 0.00 H new ATOM 0 HB THR A 101 116.672 -12.849 6.116 1.00 0.00 H new ATOM 0 HG1 THR A 101 117.032 -11.137 4.585 1.00 0.00 H new ATOM 0 HG21 THR A 101 118.782 -12.785 4.823 1.00 0.00 H new ATOM 0 HG22 THR A 101 118.254 -14.461 5.108 1.00 0.00 H new ATOM 0 HG23 THR A 101 118.008 -13.710 3.514 1.00 0.00 H new ATOM 1581 N ALA A 102 115.127 -14.739 6.963 1.00 0.00 N ATOM 1582 CA ALA A 102 115.098 -15.625 8.110 1.00 0.00 C ATOM 1583 C ALA A 102 114.044 -16.709 7.916 1.00 0.00 C ATOM 1584 O ALA A 102 114.104 -17.769 8.540 1.00 0.00 O ATOM 1585 CB ALA A 102 114.801 -14.807 9.360 1.00 0.00 C ATOM 0 H ALA A 102 114.736 -13.813 7.137 1.00 0.00 H new ATOM 0 HA ALA A 102 116.066 -16.113 8.219 1.00 0.00 H new ATOM 0 HB1 ALA A 102 114.777 -15.465 10.228 1.00 0.00 H new ATOM 0 HB2 ALA A 102 115.578 -14.055 9.496 1.00 0.00 H new ATOM 0 HB3 ALA A 102 113.835 -14.314 9.251 1.00 0.00 H new ATOM 1591 N LYS A 103 113.086 -16.438 7.037 1.00 0.00 N ATOM 1592 CA LYS A 103 112.028 -17.399 6.755 1.00 0.00 C ATOM 1593 C LYS A 103 112.519 -18.444 5.758 1.00 0.00 C ATOM 1594 O LYS A 103 112.205 -19.628 5.878 1.00 0.00 O ATOM 1595 CB LYS A 103 110.801 -16.684 6.185 1.00 0.00 C ATOM 1596 CG LYS A 103 109.847 -17.715 5.576 1.00 0.00 C ATOM 1597 CD LYS A 103 108.480 -17.070 5.341 1.00 0.00 C ATOM 1598 CE LYS A 103 107.498 -18.126 4.832 1.00 0.00 C ATOM 1599 NZ LYS A 103 108.074 -19.484 5.042 1.00 0.00 N ATOM 0 H LYS A 103 113.020 -15.567 6.511 1.00 0.00 H new ATOM 0 HA LYS A 103 111.752 -17.893 7.687 1.00 0.00 H new ATOM 0 HB2 LYS A 103 110.295 -16.124 6.972 1.00 0.00 H new ATOM 0 HB3 LYS A 103 111.106 -15.963 5.427 1.00 0.00 H new ATOM 0 HG2 LYS A 103 110.251 -18.089 4.635 1.00 0.00 H new ATOM 0 HG3 LYS A 103 109.747 -18.572 6.243 1.00 0.00 H new ATOM 0 HD2 LYS A 103 108.110 -16.630 6.267 1.00 0.00 H new ATOM 0 HD3 LYS A 103 108.568 -16.260 4.616 1.00 0.00 H new ATOM 0 HE2 LYS A 103 106.548 -18.037 5.358 1.00 0.00 H new ATOM 0 HE3 LYS A 103 107.293 -17.966 3.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 107.392 -20.203 4.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 108.953 -19.577 4.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 108.280 -19.621 6.052 1.00 0.00 H new ATOM 1613 N TYR A 104 113.293 -17.996 4.773 1.00 0.00 N ATOM 1614 CA TYR A 104 113.822 -18.902 3.760 1.00 0.00 C ATOM 1615 C TYR A 104 114.990 -19.708 4.318 1.00 0.00 C ATOM 1616 O TYR A 104 115.463 -20.652 3.686 1.00 0.00 O ATOM 1617 CB TYR A 104 114.287 -18.105 2.540 1.00 0.00 C ATOM 1618 CG TYR A 104 113.127 -17.914 1.593 1.00 0.00 C ATOM 1619 CD1 TYR A 104 111.931 -17.353 2.054 1.00 0.00 C ATOM 1620 CD2 TYR A 104 113.248 -18.298 0.251 1.00 0.00 C ATOM 1621 CE1 TYR A 104 110.856 -17.176 1.177 1.00 0.00 C ATOM 1622 CE2 TYR A 104 112.173 -18.121 -0.626 1.00 0.00 C ATOM 1623 CZ TYR A 104 110.976 -17.560 -0.164 1.00 0.00 C ATOM 1624 OH TYR A 104 109.916 -17.386 -1.030 1.00 0.00 O ATOM 0 H TYR A 104 113.565 -17.020 4.656 1.00 0.00 H new ATOM 0 HA TYR A 104 113.029 -19.590 3.465 1.00 0.00 H new ATOM 0 HB2 TYR A 104 114.679 -17.137 2.852 1.00 0.00 H new ATOM 0 HB3 TYR A 104 115.099 -18.630 2.037 1.00 0.00 H new ATOM 0 HD1 TYR A 104 111.838 -17.056 3.088 1.00 0.00 H new ATOM 0 HD2 TYR A 104 114.171 -18.730 -0.106 1.00 0.00 H new ATOM 0 HE1 TYR A 104 109.933 -16.743 1.534 1.00 0.00 H new ATOM 0 HE2 TYR A 104 112.266 -18.417 -1.660 1.00 0.00 H new ATOM 0 HH TYR A 104 110.167 -17.704 -1.922 1.00 0.00 H new ATOM 1634 N GLY A 105 115.452 -19.329 5.506 1.00 0.00 N ATOM 1635 CA GLY A 105 116.566 -20.025 6.138 1.00 0.00 C ATOM 1636 C GLY A 105 117.878 -19.710 5.429 1.00 0.00 C ATOM 1637 O GLY A 105 118.789 -20.536 5.391 1.00 0.00 O ATOM 0 H GLY A 105 115.075 -18.550 6.046 1.00 0.00 H new ATOM 0 HA2 GLY A 105 116.635 -19.733 7.186 1.00 0.00 H new ATOM 0 HA3 GLY A 105 116.386 -21.100 6.118 1.00 0.00 H new ATOM 1641 N ILE A 106 117.966 -18.510 4.866 1.00 0.00 N ATOM 1642 CA ILE A 106 119.170 -18.093 4.159 1.00 0.00 C ATOM 1643 C ILE A 106 120.320 -17.891 5.141 1.00 0.00 C ATOM 1644 O ILE A 106 120.807 -18.848 5.743 1.00 0.00 O ATOM 1645 CB ILE A 106 118.897 -16.795 3.399 1.00 0.00 C ATOM 1646 CG1 ILE A 106 117.538 -16.896 2.691 1.00 0.00 C ATOM 1647 CG2 ILE A 106 120.002 -16.567 2.368 1.00 0.00 C ATOM 1648 CD1 ILE A 106 117.736 -17.307 1.230 1.00 0.00 C ATOM 0 H ILE A 106 117.222 -17.813 4.885 1.00 0.00 H new ATOM 0 HA ILE A 106 119.451 -18.872 3.451 1.00 0.00 H new ATOM 0 HB ILE A 106 118.879 -15.958 4.097 1.00 0.00 H new ATOM 0 HG12 ILE A 106 116.907 -17.625 3.200 1.00 0.00 H new ATOM 0 HG13 ILE A 106 117.021 -15.938 2.741 1.00 0.00 H new ATOM 0 HG21 ILE A 106 119.808 -15.642 1.826 1.00 0.00 H new ATOM 0 HG22 ILE A 106 120.964 -16.495 2.875 1.00 0.00 H new ATOM 0 HG23 ILE A 106 120.023 -17.401 1.667 1.00 0.00 H new ATOM 0 HD11 ILE A 106 116.766 -17.376 0.737 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.349 -16.562 0.722 1.00 0.00 H new ATOM 0 HD13 ILE A 106 118.234 -18.276 1.189 1.00 0.00 H new ATOM 1660 N THR A 107 120.749 -16.644 5.306 1.00 0.00 N ATOM 1661 CA THR A 107 121.838 -16.341 6.226 1.00 0.00 C ATOM 1662 C THR A 107 123.154 -16.917 5.712 1.00 0.00 C ATOM 1663 O THR A 107 124.210 -16.712 6.309 1.00 0.00 O ATOM 1664 CB THR A 107 121.526 -16.920 7.607 1.00 0.00 C ATOM 1665 OG1 THR A 107 122.142 -18.194 7.734 1.00 0.00 O ATOM 1666 CG2 THR A 107 120.012 -17.063 7.769 1.00 0.00 C ATOM 0 H THR A 107 120.363 -15.834 4.820 1.00 0.00 H new ATOM 0 HA THR A 107 121.938 -15.258 6.299 1.00 0.00 H new ATOM 0 HB THR A 107 121.910 -16.253 8.379 1.00 0.00 H new ATOM 0 HG1 THR A 107 121.801 -18.793 7.037 1.00 0.00 H new ATOM 0 HG21 THR A 107 119.789 -17.476 8.753 1.00 0.00 H new ATOM 0 HG22 THR A 107 119.542 -16.085 7.670 1.00 0.00 H new ATOM 0 HG23 THR A 107 119.625 -17.731 6.999 1.00 0.00 H new ATOM 1674 N GLY A 108 123.081 -17.637 4.597 1.00 0.00 N ATOM 1675 CA GLY A 108 124.273 -18.235 4.007 1.00 0.00 C ATOM 1676 C GLY A 108 124.969 -17.244 3.081 1.00 0.00 C ATOM 1677 O GLY A 108 125.812 -17.623 2.267 1.00 0.00 O ATOM 0 H GLY A 108 122.216 -17.819 4.087 1.00 0.00 H new ATOM 0 HA2 GLY A 108 124.958 -18.547 4.795 1.00 0.00 H new ATOM 0 HA3 GLY A 108 123.999 -19.131 3.450 1.00 0.00 H new ATOM 1681 N ILE A 109 124.606 -15.972 3.212 1.00 0.00 N ATOM 1682 CA ILE A 109 125.195 -14.927 2.387 1.00 0.00 C ATOM 1683 C ILE A 109 126.714 -15.085 2.318 1.00 0.00 C ATOM 1684 O ILE A 109 127.349 -15.458 3.304 1.00 0.00 O ATOM 1685 CB ILE A 109 124.842 -13.563 2.982 1.00 0.00 C ATOM 1686 CG1 ILE A 109 123.765 -13.751 4.055 1.00 0.00 C ATOM 1687 CG2 ILE A 109 124.316 -12.628 1.889 1.00 0.00 C ATOM 1688 CD1 ILE A 109 122.566 -14.499 3.461 1.00 0.00 C ATOM 0 H ILE A 109 123.909 -15.642 3.880 1.00 0.00 H new ATOM 0 HA ILE A 109 124.797 -15.006 1.375 1.00 0.00 H new ATOM 0 HB ILE A 109 125.735 -13.120 3.423 1.00 0.00 H new ATOM 0 HG12 ILE A 109 124.172 -14.309 4.898 1.00 0.00 H new ATOM 0 HG13 ILE A 109 123.447 -12.781 4.438 1.00 0.00 H new ATOM 0 HG21 ILE A 109 124.068 -11.661 2.326 1.00 0.00 H new ATOM 0 HG22 ILE A 109 125.081 -12.496 1.124 1.00 0.00 H new ATOM 0 HG23 ILE A 109 123.423 -13.061 1.438 1.00 0.00 H new ATOM 0 HD11 ILE A 109 121.803 -14.630 4.228 1.00 0.00 H new ATOM 0 HD12 ILE A 109 122.153 -13.924 2.632 1.00 0.00 H new ATOM 0 HD13 ILE A 109 122.889 -15.475 3.100 1.00 0.00 H new ATOM 1700 N PRO A 110 127.301 -14.811 1.180 1.00 0.00 N ATOM 1701 CA PRO A 110 126.563 -14.357 -0.035 1.00 0.00 C ATOM 1702 C PRO A 110 125.801 -15.498 -0.706 1.00 0.00 C ATOM 1703 O PRO A 110 126.301 -16.620 -0.797 1.00 0.00 O ATOM 1704 CB PRO A 110 127.667 -13.829 -0.950 1.00 0.00 C ATOM 1705 CG PRO A 110 128.901 -14.568 -0.549 1.00 0.00 C ATOM 1706 CD PRO A 110 128.748 -14.909 0.935 1.00 0.00 C ATOM 0 HA PRO A 110 125.804 -13.611 0.202 1.00 0.00 H new ATOM 0 HB2 PRO A 110 127.426 -14.006 -1.998 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.796 -12.753 -0.829 1.00 0.00 H new ATOM 0 HG2 PRO A 110 129.020 -15.474 -1.144 1.00 0.00 H new ATOM 0 HG3 PRO A 110 129.789 -13.958 -0.716 1.00 0.00 H new ATOM 0 HD2 PRO A 110 129.122 -15.909 1.155 1.00 0.00 H new ATOM 0 HD3 PRO A 110 129.306 -14.215 1.563 1.00 0.00 H new ATOM 1714 N ALA A 111 124.591 -15.206 -1.173 1.00 0.00 N ATOM 1715 CA ALA A 111 123.775 -16.222 -1.829 1.00 0.00 C ATOM 1716 C ALA A 111 122.640 -15.579 -2.620 1.00 0.00 C ATOM 1717 O ALA A 111 122.223 -14.458 -2.327 1.00 0.00 O ATOM 1718 CB ALA A 111 123.194 -17.179 -0.787 1.00 0.00 C ATOM 0 H ALA A 111 124.157 -14.285 -1.111 1.00 0.00 H new ATOM 0 HA ALA A 111 124.411 -16.776 -2.519 1.00 0.00 H new ATOM 0 HB1 ALA A 111 122.586 -17.934 -1.285 1.00 0.00 H new ATOM 0 HB2 ALA A 111 124.006 -17.665 -0.247 1.00 0.00 H new ATOM 0 HB3 ALA A 111 122.575 -16.620 -0.085 1.00 0.00 H new ATOM 1724 N LEU A 112 122.146 -16.298 -3.623 1.00 0.00 N ATOM 1725 CA LEU A 112 121.059 -15.792 -4.453 1.00 0.00 C ATOM 1726 C LEU A 112 119.880 -16.761 -4.428 1.00 0.00 C ATOM 1727 O LEU A 112 120.047 -17.952 -4.679 1.00 0.00 O ATOM 1728 CB LEU A 112 121.551 -15.616 -5.891 1.00 0.00 C ATOM 1729 CG LEU A 112 120.700 -14.569 -6.609 1.00 0.00 C ATOM 1730 CD1 LEU A 112 121.527 -13.920 -7.720 1.00 0.00 C ATOM 1731 CD2 LEU A 112 119.471 -15.247 -7.219 1.00 0.00 C ATOM 0 H LEU A 112 122.479 -17.227 -3.880 1.00 0.00 H new ATOM 0 HA LEU A 112 120.732 -14.830 -4.060 1.00 0.00 H new ATOM 0 HB2 LEU A 112 122.597 -15.309 -5.891 1.00 0.00 H new ATOM 0 HB3 LEU A 112 121.497 -16.567 -6.422 1.00 0.00 H new ATOM 0 HG LEU A 112 120.381 -13.806 -5.899 1.00 0.00 H new ATOM 0 HD11 LEU A 112 120.923 -13.173 -8.234 1.00 0.00 H new ATOM 0 HD12 LEU A 112 122.405 -13.441 -7.287 1.00 0.00 H new ATOM 0 HD13 LEU A 112 121.843 -14.683 -8.431 1.00 0.00 H new ATOM 0 HD21 LEU A 112 118.862 -14.503 -7.732 1.00 0.00 H new ATOM 0 HD22 LEU A 112 119.791 -16.007 -7.931 1.00 0.00 H new ATOM 0 HD23 LEU A 112 118.884 -15.714 -6.429 1.00 0.00 H new ATOM 1743 N VAL A 113 118.690 -16.250 -4.117 1.00 0.00 N ATOM 1744 CA VAL A 113 117.505 -17.097 -4.060 1.00 0.00 C ATOM 1745 C VAL A 113 116.543 -16.765 -5.196 1.00 0.00 C ATOM 1746 O VAL A 113 116.287 -15.597 -5.489 1.00 0.00 O ATOM 1747 CB VAL A 113 116.800 -16.915 -2.709 1.00 0.00 C ATOM 1748 CG1 VAL A 113 115.279 -16.904 -2.898 1.00 0.00 C ATOM 1749 CG2 VAL A 113 117.186 -18.060 -1.767 1.00 0.00 C ATOM 0 H VAL A 113 118.524 -15.267 -3.904 1.00 0.00 H new ATOM 0 HA VAL A 113 117.819 -18.135 -4.169 1.00 0.00 H new ATOM 0 HB VAL A 113 117.111 -15.963 -2.278 1.00 0.00 H new ATOM 0 HG11 VAL A 113 114.793 -16.774 -1.931 1.00 0.00 H new ATOM 0 HG12 VAL A 113 115.000 -16.082 -3.557 1.00 0.00 H new ATOM 0 HG13 VAL A 113 114.960 -17.848 -3.340 1.00 0.00 H new ATOM 0 HG21 VAL A 113 116.684 -17.928 -0.809 1.00 0.00 H new ATOM 0 HG22 VAL A 113 116.884 -19.011 -2.207 1.00 0.00 H new ATOM 0 HG23 VAL A 113 118.265 -18.057 -1.614 1.00 0.00 H new ATOM 1759 N ILE A 114 116.016 -17.806 -5.830 1.00 0.00 N ATOM 1760 CA ILE A 114 115.081 -17.620 -6.932 1.00 0.00 C ATOM 1761 C ILE A 114 113.732 -18.255 -6.622 1.00 0.00 C ATOM 1762 O ILE A 114 113.643 -19.448 -6.328 1.00 0.00 O ATOM 1763 CB ILE A 114 115.647 -18.221 -8.219 1.00 0.00 C ATOM 1764 CG1 ILE A 114 117.080 -17.723 -8.429 1.00 0.00 C ATOM 1765 CG2 ILE A 114 114.782 -17.791 -9.406 1.00 0.00 C ATOM 1766 CD1 ILE A 114 117.075 -16.201 -8.590 1.00 0.00 C ATOM 0 H ILE A 114 116.218 -18.779 -5.602 1.00 0.00 H new ATOM 0 HA ILE A 114 114.937 -16.548 -7.067 1.00 0.00 H new ATOM 0 HB ILE A 114 115.647 -19.308 -8.142 1.00 0.00 H new ATOM 0 HG12 ILE A 114 117.703 -18.007 -7.581 1.00 0.00 H new ATOM 0 HG13 ILE A 114 117.513 -18.191 -9.313 1.00 0.00 H new ATOM 0 HG21 ILE A 114 115.185 -18.219 -10.324 1.00 0.00 H new ATOM 0 HG22 ILE A 114 113.761 -18.144 -9.259 1.00 0.00 H new ATOM 0 HG23 ILE A 114 114.783 -16.704 -9.482 1.00 0.00 H new ATOM 0 HD11 ILE A 114 118.095 -15.848 -8.739 1.00 0.00 H new ATOM 0 HD12 ILE A 114 116.467 -15.928 -9.452 1.00 0.00 H new ATOM 0 HD13 ILE A 114 116.660 -15.742 -7.693 1.00 0.00 H new ATOM 1778 N VAL A 115 112.681 -17.443 -6.693 1.00 0.00 N ATOM 1779 CA VAL A 115 111.329 -17.919 -6.427 1.00 0.00 C ATOM 1780 C VAL A 115 110.367 -17.379 -7.479 1.00 0.00 C ATOM 1781 O VAL A 115 110.619 -16.338 -8.085 1.00 0.00 O ATOM 1782 CB VAL A 115 110.879 -17.468 -5.036 1.00 0.00 C ATOM 1783 CG1 VAL A 115 112.105 -17.235 -4.151 1.00 0.00 C ATOM 1784 CG2 VAL A 115 110.082 -16.165 -5.150 1.00 0.00 C ATOM 0 H VAL A 115 112.740 -16.453 -6.932 1.00 0.00 H new ATOM 0 HA VAL A 115 111.327 -19.008 -6.468 1.00 0.00 H new ATOM 0 HB VAL A 115 110.251 -18.241 -4.594 1.00 0.00 H new ATOM 0 HG11 VAL A 115 111.783 -16.914 -3.160 1.00 0.00 H new ATOM 0 HG12 VAL A 115 112.673 -18.161 -4.065 1.00 0.00 H new ATOM 0 HG13 VAL A 115 112.734 -16.464 -4.596 1.00 0.00 H new ATOM 0 HG21 VAL A 115 109.763 -15.846 -4.158 1.00 0.00 H new ATOM 0 HG22 VAL A 115 110.709 -15.393 -5.595 1.00 0.00 H new ATOM 0 HG23 VAL A 115 109.206 -16.328 -5.778 1.00 0.00 H new ATOM 1794 N LYS A 116 109.265 -18.089 -7.695 1.00 0.00 N ATOM 1795 CA LYS A 116 108.281 -17.659 -8.680 1.00 0.00 C ATOM 1796 C LYS A 116 107.376 -16.578 -8.096 1.00 0.00 C ATOM 1797 O LYS A 116 107.126 -16.551 -6.891 1.00 0.00 O ATOM 1798 CB LYS A 116 107.437 -18.854 -9.122 1.00 0.00 C ATOM 1799 CG LYS A 116 108.314 -19.817 -9.927 1.00 0.00 C ATOM 1800 CD LYS A 116 107.429 -20.819 -10.672 1.00 0.00 C ATOM 1801 CE LYS A 116 107.814 -20.838 -12.151 1.00 0.00 C ATOM 1802 NZ LYS A 116 107.150 -19.703 -12.853 1.00 0.00 N ATOM 0 H LYS A 116 109.033 -18.954 -7.208 1.00 0.00 H new ATOM 0 HA LYS A 116 108.807 -17.247 -9.541 1.00 0.00 H new ATOM 0 HB2 LYS A 116 107.021 -19.362 -8.252 1.00 0.00 H new ATOM 0 HB3 LYS A 116 106.596 -18.517 -9.727 1.00 0.00 H new ATOM 0 HG2 LYS A 116 108.926 -19.260 -10.636 1.00 0.00 H new ATOM 0 HG3 LYS A 116 108.997 -20.345 -9.262 1.00 0.00 H new ATOM 0 HD2 LYS A 116 107.546 -21.814 -10.242 1.00 0.00 H new ATOM 0 HD3 LYS A 116 106.380 -20.546 -10.562 1.00 0.00 H new ATOM 0 HE2 LYS A 116 108.896 -20.762 -12.257 1.00 0.00 H new ATOM 0 HE3 LYS A 116 107.515 -21.784 -12.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 107.412 -19.716 -13.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 106.118 -19.795 -12.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 107.456 -18.805 -12.427 1.00 0.00 H new ATOM 1816 N LYS A 117 106.892 -15.688 -8.955 1.00 0.00 N ATOM 1817 CA LYS A 117 106.019 -14.608 -8.509 1.00 0.00 C ATOM 1818 C LYS A 117 104.916 -15.145 -7.602 1.00 0.00 C ATOM 1819 O LYS A 117 104.684 -14.618 -6.514 1.00 0.00 O ATOM 1820 CB LYS A 117 105.390 -13.913 -9.718 1.00 0.00 C ATOM 1821 CG LYS A 117 104.315 -12.934 -9.241 1.00 0.00 C ATOM 1822 CD LYS A 117 103.813 -12.109 -10.429 1.00 0.00 C ATOM 1823 CE LYS A 117 102.875 -11.010 -9.926 1.00 0.00 C ATOM 1824 NZ LYS A 117 101.956 -11.572 -8.897 1.00 0.00 N ATOM 0 H LYS A 117 107.087 -15.692 -9.956 1.00 0.00 H new ATOM 0 HA LYS A 117 106.619 -13.893 -7.947 1.00 0.00 H new ATOM 0 HB2 LYS A 117 106.155 -13.382 -10.284 1.00 0.00 H new ATOM 0 HB3 LYS A 117 104.952 -14.652 -10.389 1.00 0.00 H new ATOM 0 HG2 LYS A 117 103.487 -13.479 -8.787 1.00 0.00 H new ATOM 0 HG3 LYS A 117 104.722 -12.276 -8.473 1.00 0.00 H new ATOM 0 HD2 LYS A 117 104.656 -11.667 -10.961 1.00 0.00 H new ATOM 0 HD3 LYS A 117 103.291 -12.752 -11.137 1.00 0.00 H new ATOM 0 HE2 LYS A 117 103.454 -10.189 -9.502 1.00 0.00 H new ATOM 0 HE3 LYS A 117 102.301 -10.600 -10.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 101.132 -10.947 -8.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 101.638 -12.517 -9.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 102.456 -11.645 -7.988 1.00 0.00 H new ATOM 1838 N ASP A 118 104.241 -16.195 -8.057 1.00 0.00 N ATOM 1839 CA ASP A 118 103.165 -16.793 -7.276 1.00 0.00 C ATOM 1840 C ASP A 118 103.696 -17.308 -5.942 1.00 0.00 C ATOM 1841 O ASP A 118 102.929 -17.754 -5.088 1.00 0.00 O ATOM 1842 CB ASP A 118 102.533 -17.948 -8.057 1.00 0.00 C ATOM 1843 CG ASP A 118 101.911 -18.952 -7.093 1.00 0.00 C ATOM 1844 OD1 ASP A 118 102.659 -19.597 -6.376 1.00 0.00 O ATOM 1845 OD2 ASP A 118 100.696 -19.062 -7.086 1.00 0.00 O ATOM 0 H ASP A 118 104.418 -16.646 -8.955 1.00 0.00 H new ATOM 0 HA ASP A 118 102.411 -16.029 -7.084 1.00 0.00 H new ATOM 0 HB2 ASP A 118 101.772 -17.565 -8.737 1.00 0.00 H new ATOM 0 HB3 ASP A 118 103.289 -18.440 -8.670 1.00 0.00 H new ATOM 1850 N GLY A 119 105.012 -17.245 -5.772 1.00 0.00 N ATOM 1851 CA GLY A 119 105.635 -17.710 -4.538 1.00 0.00 C ATOM 1852 C GLY A 119 106.158 -19.131 -4.705 1.00 0.00 C ATOM 1853 O GLY A 119 106.659 -19.735 -3.757 1.00 0.00 O ATOM 0 H GLY A 119 105.664 -16.880 -6.467 1.00 0.00 H new ATOM 0 HA2 GLY A 119 106.454 -17.045 -4.265 1.00 0.00 H new ATOM 0 HA3 GLY A 119 104.911 -17.676 -3.724 1.00 0.00 H new ATOM 1857 N THR A 120 106.036 -19.658 -5.918 1.00 0.00 N ATOM 1858 CA THR A 120 106.498 -21.010 -6.205 1.00 0.00 C ATOM 1859 C THR A 120 108.020 -21.075 -6.175 1.00 0.00 C ATOM 1860 O THR A 120 108.694 -20.374 -6.928 1.00 0.00 O ATOM 1861 CB THR A 120 106.001 -21.451 -7.581 1.00 0.00 C ATOM 1862 OG1 THR A 120 104.947 -20.594 -8.000 1.00 0.00 O ATOM 1863 CG2 THR A 120 105.493 -22.891 -7.508 1.00 0.00 C ATOM 0 H THR A 120 105.623 -19.172 -6.714 1.00 0.00 H new ATOM 0 HA THR A 120 106.099 -21.677 -5.440 1.00 0.00 H new ATOM 0 HB THR A 120 106.821 -21.396 -8.297 1.00 0.00 H new ATOM 0 HG1 THR A 120 104.262 -20.552 -7.300 1.00 0.00 H new ATOM 0 HG21 THR A 120 105.139 -23.202 -8.491 1.00 0.00 H new ATOM 0 HG22 THR A 120 106.303 -23.547 -7.189 1.00 0.00 H new ATOM 0 HG23 THR A 120 104.674 -22.952 -6.792 1.00 0.00 H new ATOM 1871 N LEU A 121 108.556 -21.925 -5.308 1.00 0.00 N ATOM 1872 CA LEU A 121 110.001 -22.073 -5.199 1.00 0.00 C ATOM 1873 C LEU A 121 110.547 -22.816 -6.410 1.00 0.00 C ATOM 1874 O LEU A 121 109.928 -23.756 -6.909 1.00 0.00 O ATOM 1875 CB LEU A 121 110.358 -22.833 -3.921 1.00 0.00 C ATOM 1876 CG LEU A 121 111.626 -22.235 -3.309 1.00 0.00 C ATOM 1877 CD1 LEU A 121 112.768 -22.315 -4.322 1.00 0.00 C ATOM 1878 CD2 LEU A 121 111.374 -20.770 -2.942 1.00 0.00 C ATOM 0 H LEU A 121 108.017 -22.517 -4.676 1.00 0.00 H new ATOM 0 HA LEU A 121 110.450 -21.081 -5.160 1.00 0.00 H new ATOM 0 HB2 LEU A 121 109.535 -22.775 -3.209 1.00 0.00 H new ATOM 0 HB3 LEU A 121 110.512 -23.889 -4.144 1.00 0.00 H new ATOM 0 HG LEU A 121 111.894 -22.794 -2.413 1.00 0.00 H new ATOM 0 HD11 LEU A 121 113.672 -21.889 -3.886 1.00 0.00 H new ATOM 0 HD12 LEU A 121 112.949 -23.357 -4.585 1.00 0.00 H new ATOM 0 HD13 LEU A 121 112.499 -21.756 -5.218 1.00 0.00 H new ATOM 0 HD21 LEU A 121 112.277 -20.344 -2.506 1.00 0.00 H new ATOM 0 HD22 LEU A 121 111.105 -20.211 -3.839 1.00 0.00 H new ATOM 0 HD23 LEU A 121 110.560 -20.711 -2.220 1.00 0.00 H new ATOM 1890 N ILE A 122 111.705 -22.379 -6.882 1.00 0.00 N ATOM 1891 CA ILE A 122 112.331 -22.994 -8.043 1.00 0.00 C ATOM 1892 C ILE A 122 113.787 -23.320 -7.752 1.00 0.00 C ATOM 1893 O ILE A 122 114.187 -24.484 -7.719 1.00 0.00 O ATOM 1894 CB ILE A 122 112.260 -22.024 -9.220 1.00 0.00 C ATOM 1895 CG1 ILE A 122 113.195 -22.496 -10.329 1.00 0.00 C ATOM 1896 CG2 ILE A 122 112.681 -20.628 -8.761 1.00 0.00 C ATOM 1897 CD1 ILE A 122 112.557 -22.198 -11.685 1.00 0.00 C ATOM 0 H ILE A 122 112.230 -21.602 -6.480 1.00 0.00 H new ATOM 0 HA ILE A 122 111.804 -23.918 -8.282 1.00 0.00 H new ATOM 0 HB ILE A 122 111.238 -21.990 -9.596 1.00 0.00 H new ATOM 0 HG12 ILE A 122 114.158 -21.992 -10.248 1.00 0.00 H new ATOM 0 HG13 ILE A 122 113.385 -23.565 -10.230 1.00 0.00 H new ATOM 0 HG21 ILE A 122 112.630 -19.937 -9.603 1.00 0.00 H new ATOM 0 HG22 ILE A 122 112.012 -20.288 -7.971 1.00 0.00 H new ATOM 0 HG23 ILE A 122 113.702 -20.662 -8.382 1.00 0.00 H new ATOM 0 HD11 ILE A 122 113.221 -22.533 -12.481 1.00 0.00 H new ATOM 0 HD12 ILE A 122 111.605 -22.722 -11.762 1.00 0.00 H new ATOM 0 HD13 ILE A 122 112.389 -21.125 -11.780 1.00 0.00 H new ATOM 1909 N SER A 123 114.567 -22.275 -7.537 1.00 0.00 N ATOM 1910 CA SER A 123 115.985 -22.430 -7.243 1.00 0.00 C ATOM 1911 C SER A 123 116.418 -21.422 -6.183 1.00 0.00 C ATOM 1912 O SER A 123 116.057 -20.247 -6.248 1.00 0.00 O ATOM 1913 CB SER A 123 116.810 -22.225 -8.514 1.00 0.00 C ATOM 1914 OG SER A 123 117.779 -23.259 -8.616 1.00 0.00 O ATOM 0 H SER A 123 114.244 -21.308 -7.560 1.00 0.00 H new ATOM 0 HA SER A 123 116.153 -23.438 -6.865 1.00 0.00 H new ATOM 0 HB2 SER A 123 116.160 -22.233 -9.389 1.00 0.00 H new ATOM 0 HB3 SER A 123 117.301 -21.252 -8.490 1.00 0.00 H new ATOM 0 HG SER A 123 118.309 -23.132 -9.431 1.00 0.00 H new ATOM 1920 N MET A 124 117.189 -21.887 -5.209 1.00 0.00 N ATOM 1921 CA MET A 124 117.659 -21.010 -4.143 1.00 0.00 C ATOM 1922 C MET A 124 119.073 -20.525 -4.436 1.00 0.00 C ATOM 1923 O MET A 124 119.294 -19.799 -5.404 1.00 0.00 O ATOM 1924 CB MET A 124 117.622 -21.749 -2.803 1.00 0.00 C ATOM 1925 CG MET A 124 116.270 -22.448 -2.644 1.00 0.00 C ATOM 1926 SD MET A 124 115.138 -21.384 -1.711 1.00 0.00 S ATOM 1927 CE MET A 124 114.806 -20.180 -3.021 1.00 0.00 C ATOM 0 H MET A 124 117.500 -22.856 -5.134 1.00 0.00 H new ATOM 0 HA MET A 124 117.000 -20.143 -4.089 1.00 0.00 H new ATOM 0 HB2 MET A 124 118.429 -22.480 -2.756 1.00 0.00 H new ATOM 0 HB3 MET A 124 117.779 -21.047 -1.984 1.00 0.00 H new ATOM 0 HG2 MET A 124 115.849 -22.673 -3.624 1.00 0.00 H new ATOM 0 HG3 MET A 124 116.400 -23.399 -2.127 1.00 0.00 H new ATOM 0 HE1 MET A 124 113.912 -19.609 -2.772 1.00 0.00 H new ATOM 0 HE2 MET A 124 115.654 -19.502 -3.116 1.00 0.00 H new ATOM 0 HE3 MET A 124 114.652 -20.703 -3.965 1.00 0.00 H new ATOM 1937 N ASN A 125 120.026 -20.931 -3.604 1.00 0.00 N ATOM 1938 CA ASN A 125 121.413 -20.528 -3.797 1.00 0.00 C ATOM 1939 C ASN A 125 121.922 -21.039 -5.137 1.00 0.00 C ATOM 1940 O ASN A 125 122.992 -21.644 -5.217 1.00 0.00 O ATOM 1941 CB ASN A 125 122.282 -21.087 -2.669 1.00 0.00 C ATOM 1942 CG ASN A 125 123.713 -20.579 -2.813 1.00 0.00 C ATOM 1943 OD1 ASN A 125 124.538 -20.785 -1.924 1.00 0.00 O ATOM 1944 ND2 ASN A 125 124.057 -19.924 -3.887 1.00 0.00 N ATOM 0 H ASN A 125 119.865 -21.533 -2.797 1.00 0.00 H new ATOM 0 HA ASN A 125 121.468 -19.439 -3.785 1.00 0.00 H new ATOM 0 HB2 ASN A 125 121.876 -20.787 -1.703 1.00 0.00 H new ATOM 0 HB3 ASN A 125 122.270 -22.177 -2.695 1.00 0.00 H new ATOM 0 HD21 ASN A 125 125.012 -19.581 -3.991 1.00 0.00 H new ATOM 0 HD22 ASN A 125 123.371 -19.755 -4.623 1.00 0.00 H new ATOM 1951 N GLY A 126 121.148 -20.791 -6.187 1.00 0.00 N ATOM 1952 CA GLY A 126 121.527 -21.229 -7.520 1.00 0.00 C ATOM 1953 C GLY A 126 122.609 -20.324 -8.088 1.00 0.00 C ATOM 1954 O GLY A 126 122.803 -20.256 -9.302 1.00 0.00 O ATOM 0 H GLY A 126 120.260 -20.292 -6.140 1.00 0.00 H new ATOM 0 HA2 GLY A 126 121.887 -22.257 -7.483 1.00 0.00 H new ATOM 0 HA3 GLY A 126 120.655 -21.219 -8.174 1.00 0.00 H new ATOM 1958 N ARG A 127 123.304 -19.619 -7.203 1.00 0.00 N ATOM 1959 CA ARG A 127 124.356 -18.711 -7.639 1.00 0.00 C ATOM 1960 C ARG A 127 125.191 -19.355 -8.733 1.00 0.00 C ATOM 1961 O ARG A 127 124.943 -19.133 -9.919 1.00 0.00 O ATOM 1962 CB ARG A 127 125.251 -18.332 -6.457 1.00 0.00 C ATOM 1963 CG ARG A 127 126.337 -17.362 -6.928 1.00 0.00 C ATOM 1964 CD ARG A 127 127.703 -17.849 -6.443 1.00 0.00 C ATOM 1965 NE ARG A 127 128.717 -16.830 -6.683 1.00 0.00 N ATOM 1966 CZ ARG A 127 129.786 -16.726 -5.900 1.00 0.00 C ATOM 1967 NH1 ARG A 127 129.941 -17.544 -4.895 1.00 0.00 N ATOM 1968 NH2 ARG A 127 130.680 -15.804 -6.134 1.00 0.00 N ATOM 0 H ARG A 127 123.161 -19.657 -6.194 1.00 0.00 H new ATOM 0 HA ARG A 127 123.891 -17.809 -8.036 1.00 0.00 H new ATOM 0 HB2 ARG A 127 124.655 -17.872 -5.669 1.00 0.00 H new ATOM 0 HB3 ARG A 127 125.707 -19.226 -6.031 1.00 0.00 H new ATOM 0 HG2 ARG A 127 126.330 -17.292 -8.016 1.00 0.00 H new ATOM 0 HG3 ARG A 127 126.138 -16.362 -6.543 1.00 0.00 H new ATOM 0 HD2 ARG A 127 127.657 -18.083 -5.379 1.00 0.00 H new ATOM 0 HD3 ARG A 127 127.973 -18.770 -6.960 1.00 0.00 H new ATOM 0 HE ARG A 127 128.604 -16.185 -7.465 1.00 0.00 H new ATOM 0 HH11 ARG A 127 129.242 -18.263 -4.710 1.00 0.00 H new ATOM 0 HH12 ARG A 127 130.761 -17.464 -4.294 1.00 0.00 H new ATOM 0 HH21 ARG A 127 130.558 -15.163 -6.918 1.00 0.00 H new ATOM 0 HH22 ARG A 127 131.500 -15.725 -5.533 1.00 0.00 H new ATOM 1982 N GLY A 128 126.177 -20.157 -8.349 1.00 0.00 N ATOM 1983 CA GLY A 128 127.018 -20.815 -9.337 1.00 0.00 C ATOM 1984 C GLY A 128 126.166 -21.368 -10.470 1.00 0.00 C ATOM 1985 O GLY A 128 126.631 -21.506 -11.600 1.00 0.00 O ATOM 0 H GLY A 128 126.410 -20.364 -7.378 1.00 0.00 H new ATOM 0 HA2 GLY A 128 127.747 -20.108 -9.733 1.00 0.00 H new ATOM 0 HA3 GLY A 128 127.579 -21.623 -8.867 1.00 0.00 H new ATOM 1989 N GLU A 129 124.911 -21.677 -10.159 1.00 0.00 N ATOM 1990 CA GLU A 129 124.000 -22.204 -11.164 1.00 0.00 C ATOM 1991 C GLU A 129 123.821 -21.196 -12.287 1.00 0.00 C ATOM 1992 O GLU A 129 124.073 -21.503 -13.452 1.00 0.00 O ATOM 1993 CB GLU A 129 122.645 -22.525 -10.531 1.00 0.00 C ATOM 1994 CG GLU A 129 122.247 -23.962 -10.875 1.00 0.00 C ATOM 1995 CD GLU A 129 121.817 -24.049 -12.335 1.00 0.00 C ATOM 1996 OE1 GLU A 129 121.994 -23.071 -13.044 1.00 0.00 O ATOM 1997 OE2 GLU A 129 121.315 -25.090 -12.723 1.00 0.00 O ATOM 0 H GLU A 129 124.506 -21.572 -9.229 1.00 0.00 H new ATOM 0 HA GLU A 129 124.424 -23.120 -11.575 1.00 0.00 H new ATOM 0 HB2 GLU A 129 122.699 -22.400 -9.449 1.00 0.00 H new ATOM 0 HB3 GLU A 129 121.888 -21.830 -10.895 1.00 0.00 H new ATOM 0 HG2 GLU A 129 123.086 -24.634 -10.694 1.00 0.00 H new ATOM 0 HG3 GLU A 129 121.433 -24.287 -10.228 1.00 0.00 H new ATOM 2004 N VAL A 130 123.402 -19.988 -11.932 1.00 0.00 N ATOM 2005 CA VAL A 130 123.217 -18.950 -12.935 1.00 0.00 C ATOM 2006 C VAL A 130 124.556 -18.636 -13.594 1.00 0.00 C ATOM 2007 O VAL A 130 124.673 -18.634 -14.818 1.00 0.00 O ATOM 2008 CB VAL A 130 122.615 -17.694 -12.292 1.00 0.00 C ATOM 2009 CG1 VAL A 130 123.563 -16.503 -12.459 1.00 0.00 C ATOM 2010 CG2 VAL A 130 121.279 -17.377 -12.969 1.00 0.00 C ATOM 0 H VAL A 130 123.188 -19.707 -10.975 1.00 0.00 H new ATOM 0 HA VAL A 130 122.524 -19.302 -13.700 1.00 0.00 H new ATOM 0 HB VAL A 130 122.463 -17.876 -11.228 1.00 0.00 H new ATOM 0 HG11 VAL A 130 123.122 -15.619 -11.998 1.00 0.00 H new ATOM 0 HG12 VAL A 130 124.516 -16.726 -11.978 1.00 0.00 H new ATOM 0 HG13 VAL A 130 123.727 -16.315 -13.520 1.00 0.00 H new ATOM 0 HG21 VAL A 130 120.845 -16.485 -12.517 1.00 0.00 H new ATOM 0 HG22 VAL A 130 121.442 -17.202 -14.032 1.00 0.00 H new ATOM 0 HG23 VAL A 130 120.597 -18.218 -12.840 1.00 0.00 H new ATOM 2020 N GLN A 131 125.561 -18.378 -12.767 1.00 0.00 N ATOM 2021 CA GLN A 131 126.896 -18.073 -13.272 1.00 0.00 C ATOM 2022 C GLN A 131 127.414 -19.217 -14.139 1.00 0.00 C ATOM 2023 O GLN A 131 128.202 -19.002 -15.060 1.00 0.00 O ATOM 2024 CB GLN A 131 127.858 -17.845 -12.105 1.00 0.00 C ATOM 2025 CG GLN A 131 127.158 -17.029 -11.017 1.00 0.00 C ATOM 2026 CD GLN A 131 128.191 -16.371 -10.108 1.00 0.00 C ATOM 2027 OE1 GLN A 131 127.905 -16.090 -8.944 1.00 0.00 O ATOM 2028 NE2 GLN A 131 129.382 -16.105 -10.571 1.00 0.00 N ATOM 0 H GLN A 131 125.480 -18.373 -11.750 1.00 0.00 H new ATOM 0 HA GLN A 131 126.836 -17.168 -13.877 1.00 0.00 H new ATOM 0 HB2 GLN A 131 128.189 -18.802 -11.701 1.00 0.00 H new ATOM 0 HB3 GLN A 131 128.748 -17.320 -12.451 1.00 0.00 H new ATOM 0 HG2 GLN A 131 126.526 -16.267 -11.473 1.00 0.00 H new ATOM 0 HG3 GLN A 131 126.505 -17.675 -10.430 1.00 0.00 H new ATOM 0 HE21 GLN A 131 129.618 -16.338 -11.536 1.00 0.00 H new ATOM 0 HE22 GLN A 131 130.077 -15.664 -9.968 1.00 0.00 H new ATOM 2037 N SER A 132 126.969 -20.434 -13.837 1.00 0.00 N ATOM 2038 CA SER A 132 127.399 -21.602 -14.597 1.00 0.00 C ATOM 2039 C SER A 132 126.728 -21.631 -15.965 1.00 0.00 C ATOM 2040 O SER A 132 127.393 -21.760 -16.992 1.00 0.00 O ATOM 2041 CB SER A 132 127.051 -22.880 -13.833 1.00 0.00 C ATOM 2042 OG SER A 132 127.344 -24.008 -14.648 1.00 0.00 O ATOM 0 H SER A 132 126.317 -20.635 -13.079 1.00 0.00 H new ATOM 0 HA SER A 132 128.479 -21.542 -14.735 1.00 0.00 H new ATOM 0 HB2 SER A 132 127.621 -22.929 -12.905 1.00 0.00 H new ATOM 0 HB3 SER A 132 125.996 -22.878 -13.560 1.00 0.00 H new ATOM 0 HG SER A 132 127.124 -24.829 -14.161 1.00 0.00 H new ATOM 2048 N LEU A 133 125.404 -21.518 -15.970 1.00 0.00 N ATOM 2049 CA LEU A 133 124.651 -21.538 -17.216 1.00 0.00 C ATOM 2050 C LEU A 133 124.539 -20.138 -17.807 1.00 0.00 C ATOM 2051 O LEU A 133 124.131 -19.972 -18.957 1.00 0.00 O ATOM 2052 CB LEU A 133 123.248 -22.096 -16.965 1.00 0.00 C ATOM 2053 CG LEU A 133 123.245 -23.606 -17.206 1.00 0.00 C ATOM 2054 CD1 LEU A 133 121.848 -24.161 -16.924 1.00 0.00 C ATOM 2055 CD2 LEU A 133 123.621 -23.893 -18.662 1.00 0.00 C ATOM 0 H LEU A 133 124.834 -21.412 -15.130 1.00 0.00 H new ATOM 0 HA LEU A 133 125.181 -22.175 -17.924 1.00 0.00 H new ATOM 0 HB2 LEU A 133 122.938 -21.880 -15.943 1.00 0.00 H new ATOM 0 HB3 LEU A 133 122.529 -21.611 -17.625 1.00 0.00 H new ATOM 0 HG LEU A 133 123.969 -24.081 -16.544 1.00 0.00 H new ATOM 0 HD11 LEU A 133 121.843 -25.237 -17.095 1.00 0.00 H new ATOM 0 HD12 LEU A 133 121.578 -23.957 -15.888 1.00 0.00 H new ATOM 0 HD13 LEU A 133 121.126 -23.685 -17.588 1.00 0.00 H new ATOM 0 HD21 LEU A 133 123.619 -24.970 -18.833 1.00 0.00 H new ATOM 0 HD22 LEU A 133 122.897 -23.419 -19.325 1.00 0.00 H new ATOM 0 HD23 LEU A 133 124.615 -23.495 -18.866 1.00 0.00 H new ATOM 2067 N GLY A 134 124.897 -19.134 -17.016 1.00 0.00 N ATOM 2068 CA GLY A 134 124.824 -17.753 -17.479 1.00 0.00 C ATOM 2069 C GLY A 134 123.384 -17.368 -17.802 1.00 0.00 C ATOM 2070 O GLY A 134 122.446 -17.844 -17.163 1.00 0.00 O ATOM 0 H GLY A 134 125.237 -19.247 -16.061 1.00 0.00 H new ATOM 0 HA2 GLY A 134 125.221 -17.086 -16.714 1.00 0.00 H new ATOM 0 HA3 GLY A 134 125.447 -17.628 -18.365 1.00 0.00 H new ATOM 2074 N PRO A 135 123.198 -16.520 -18.776 1.00 0.00 N ATOM 2075 CA PRO A 135 121.842 -16.057 -19.195 1.00 0.00 C ATOM 2076 C PRO A 135 120.947 -17.213 -19.635 1.00 0.00 C ATOM 2077 O PRO A 135 119.736 -17.049 -19.781 1.00 0.00 O ATOM 2078 CB PRO A 135 122.113 -15.103 -20.365 1.00 0.00 C ATOM 2079 CG PRO A 135 123.559 -14.741 -20.273 1.00 0.00 C ATOM 2080 CD PRO A 135 124.260 -15.907 -19.582 1.00 0.00 C ATOM 0 HA PRO A 135 121.309 -15.581 -18.372 1.00 0.00 H new ATOM 0 HB2 PRO A 135 121.890 -15.582 -21.319 1.00 0.00 H new ATOM 0 HB3 PRO A 135 121.483 -14.216 -20.299 1.00 0.00 H new ATOM 0 HG2 PRO A 135 123.979 -14.570 -21.264 1.00 0.00 H new ATOM 0 HG3 PRO A 135 123.692 -13.819 -19.707 1.00 0.00 H new ATOM 0 HD2 PRO A 135 124.672 -16.612 -20.304 1.00 0.00 H new ATOM 0 HD3 PRO A 135 125.088 -15.566 -18.961 1.00 0.00 H new ATOM 2088 N ARG A 136 121.546 -18.382 -19.839 1.00 0.00 N ATOM 2089 CA ARG A 136 120.789 -19.551 -20.252 1.00 0.00 C ATOM 2090 C ARG A 136 120.200 -20.242 -19.027 1.00 0.00 C ATOM 2091 O ARG A 136 119.407 -21.174 -19.142 1.00 0.00 O ATOM 2092 CB ARG A 136 121.703 -20.510 -21.022 1.00 0.00 C ATOM 2093 CG ARG A 136 121.405 -21.952 -20.618 1.00 0.00 C ATOM 2094 CD ARG A 136 122.227 -22.906 -21.487 1.00 0.00 C ATOM 2095 NE ARG A 136 121.968 -24.289 -21.105 1.00 0.00 N ATOM 2096 CZ ARG A 136 122.517 -25.301 -21.769 1.00 0.00 C ATOM 2097 NH1 ARG A 136 123.303 -25.064 -22.784 1.00 0.00 N ATOM 2098 NH2 ARG A 136 122.271 -26.529 -21.406 1.00 0.00 N ATOM 0 H ARG A 136 122.547 -18.541 -19.725 1.00 0.00 H new ATOM 0 HA ARG A 136 119.972 -19.245 -20.906 1.00 0.00 H new ATOM 0 HB2 ARG A 136 121.553 -20.386 -22.095 1.00 0.00 H new ATOM 0 HB3 ARG A 136 122.747 -20.274 -20.816 1.00 0.00 H new ATOM 0 HG2 ARG A 136 121.646 -22.103 -19.566 1.00 0.00 H new ATOM 0 HG3 ARG A 136 120.342 -22.161 -20.735 1.00 0.00 H new ATOM 0 HD2 ARG A 136 121.977 -22.759 -22.538 1.00 0.00 H new ATOM 0 HD3 ARG A 136 123.289 -22.684 -21.378 1.00 0.00 H new ATOM 0 HE ARG A 136 121.354 -24.483 -20.314 1.00 0.00 H new ATOM 0 HH11 ARG A 136 123.495 -24.103 -23.067 1.00 0.00 H new ATOM 0 HH12 ARG A 136 123.725 -25.840 -23.294 1.00 0.00 H new ATOM 0 HH21 ARG A 136 121.657 -26.713 -20.612 1.00 0.00 H new ATOM 0 HH22 ARG A 136 122.692 -27.306 -21.916 1.00 0.00 H new ATOM 2112 N ALA A 137 120.591 -19.762 -17.850 1.00 0.00 N ATOM 2113 CA ALA A 137 120.095 -20.326 -16.603 1.00 0.00 C ATOM 2114 C ALA A 137 118.609 -20.028 -16.444 1.00 0.00 C ATOM 2115 O ALA A 137 117.885 -20.769 -15.781 1.00 0.00 O ATOM 2116 CB ALA A 137 120.866 -19.739 -15.420 1.00 0.00 C ATOM 0 H ALA A 137 121.246 -18.988 -17.736 1.00 0.00 H new ATOM 0 HA ALA A 137 120.240 -21.406 -16.627 1.00 0.00 H new ATOM 0 HB1 ALA A 137 120.488 -20.167 -14.491 1.00 0.00 H new ATOM 0 HB2 ALA A 137 121.925 -19.974 -15.523 1.00 0.00 H new ATOM 0 HB3 ALA A 137 120.735 -18.657 -15.401 1.00 0.00 H new ATOM 2122 N PHE A 138 118.158 -18.940 -17.063 1.00 0.00 N ATOM 2123 CA PHE A 138 116.754 -18.564 -16.981 1.00 0.00 C ATOM 2124 C PHE A 138 115.887 -19.816 -16.981 1.00 0.00 C ATOM 2125 O PHE A 138 114.761 -19.807 -16.483 1.00 0.00 O ATOM 2126 CB PHE A 138 116.376 -17.676 -18.168 1.00 0.00 C ATOM 2127 CG PHE A 138 114.882 -17.731 -18.384 1.00 0.00 C ATOM 2128 CD1 PHE A 138 114.332 -18.713 -19.216 1.00 0.00 C ATOM 2129 CD2 PHE A 138 114.049 -16.801 -17.750 1.00 0.00 C ATOM 2130 CE1 PHE A 138 112.947 -18.764 -19.416 1.00 0.00 C ATOM 2131 CE2 PHE A 138 112.664 -16.852 -17.951 1.00 0.00 C ATOM 2132 CZ PHE A 138 112.113 -17.834 -18.783 1.00 0.00 C ATOM 0 H PHE A 138 118.738 -18.312 -17.620 1.00 0.00 H new ATOM 0 HA PHE A 138 116.590 -18.009 -16.057 1.00 0.00 H new ATOM 0 HB2 PHE A 138 116.689 -16.649 -17.981 1.00 0.00 H new ATOM 0 HB3 PHE A 138 116.896 -18.010 -19.066 1.00 0.00 H new ATOM 0 HD1 PHE A 138 114.975 -19.431 -19.703 1.00 0.00 H new ATOM 0 HD2 PHE A 138 114.474 -16.045 -17.107 1.00 0.00 H new ATOM 0 HE1 PHE A 138 112.522 -19.521 -20.059 1.00 0.00 H new ATOM 0 HE2 PHE A 138 112.021 -16.134 -17.464 1.00 0.00 H new ATOM 0 HZ PHE A 138 111.045 -17.874 -18.937 1.00 0.00 H new ATOM 2142 N GLN A 139 116.429 -20.896 -17.535 1.00 0.00 N ATOM 2143 CA GLN A 139 115.708 -22.161 -17.591 1.00 0.00 C ATOM 2144 C GLN A 139 115.647 -22.788 -16.205 1.00 0.00 C ATOM 2145 O GLN A 139 114.589 -23.230 -15.758 1.00 0.00 O ATOM 2146 CB GLN A 139 116.403 -23.115 -18.563 1.00 0.00 C ATOM 2147 CG GLN A 139 116.226 -22.604 -19.993 1.00 0.00 C ATOM 2148 CD GLN A 139 116.577 -23.705 -20.987 1.00 0.00 C ATOM 2149 OE1 GLN A 139 116.232 -24.868 -20.776 1.00 0.00 O ATOM 2150 NE2 GLN A 139 117.247 -23.407 -22.067 1.00 0.00 N ATOM 0 H GLN A 139 117.361 -20.920 -17.949 1.00 0.00 H new ATOM 0 HA GLN A 139 114.693 -21.974 -17.941 1.00 0.00 H new ATOM 0 HB2 GLN A 139 117.463 -23.189 -18.321 1.00 0.00 H new ATOM 0 HB3 GLN A 139 115.983 -24.117 -18.469 1.00 0.00 H new ATOM 0 HG2 GLN A 139 115.197 -22.278 -20.147 1.00 0.00 H new ATOM 0 HG3 GLN A 139 116.864 -21.736 -20.159 1.00 0.00 H new ATOM 0 HE21 GLN A 139 117.532 -22.443 -22.241 1.00 0.00 H new ATOM 0 HE22 GLN A 139 117.485 -24.138 -22.737 1.00 0.00 H new ATOM 2159 N ASN A 140 116.787 -22.811 -15.526 1.00 0.00 N ATOM 2160 CA ASN A 140 116.851 -23.373 -14.183 1.00 0.00 C ATOM 2161 C ASN A 140 116.157 -22.436 -13.201 1.00 0.00 C ATOM 2162 O ASN A 140 115.406 -22.872 -12.329 1.00 0.00 O ATOM 2163 CB ASN A 140 118.308 -23.571 -13.763 1.00 0.00 C ATOM 2164 CG ASN A 140 118.816 -24.919 -14.266 1.00 0.00 C ATOM 2165 OD1 ASN A 140 119.123 -25.804 -13.468 1.00 0.00 O ATOM 2166 ND2 ASN A 140 118.924 -25.127 -15.550 1.00 0.00 N ATOM 0 H ASN A 140 117.673 -22.450 -15.880 1.00 0.00 H new ATOM 0 HA ASN A 140 116.347 -24.340 -14.180 1.00 0.00 H new ATOM 0 HB2 ASN A 140 118.924 -22.767 -14.166 1.00 0.00 H new ATOM 0 HB3 ASN A 140 118.392 -23.523 -12.677 1.00 0.00 H new ATOM 0 HD21 ASN A 140 119.264 -26.025 -15.894 1.00 0.00 H new ATOM 0 HD22 ASN A 140 118.669 -24.392 -16.209 1.00 0.00 H new ATOM 2173 N TRP A 141 116.410 -21.143 -13.365 1.00 0.00 N ATOM 2174 CA TRP A 141 115.804 -20.133 -12.508 1.00 0.00 C ATOM 2175 C TRP A 141 114.306 -20.040 -12.785 1.00 0.00 C ATOM 2176 O TRP A 141 113.538 -19.565 -11.947 1.00 0.00 O ATOM 2177 CB TRP A 141 116.449 -18.770 -12.775 1.00 0.00 C ATOM 2178 CG TRP A 141 117.682 -18.601 -11.941 1.00 0.00 C ATOM 2179 CD1 TRP A 141 118.433 -19.605 -11.426 1.00 0.00 C ATOM 2180 CD2 TRP A 141 118.323 -17.359 -11.526 1.00 0.00 C ATOM 2181 NE1 TRP A 141 119.487 -19.055 -10.718 1.00 0.00 N ATOM 2182 CE2 TRP A 141 119.462 -17.677 -10.750 1.00 0.00 C ATOM 2183 CE3 TRP A 141 118.025 -16.003 -11.743 1.00 0.00 C ATOM 2184 CZ2 TRP A 141 120.279 -16.683 -10.210 1.00 0.00 C ATOM 2185 CZ3 TRP A 141 118.846 -15.000 -11.202 1.00 0.00 C ATOM 2186 CH2 TRP A 141 119.970 -15.341 -10.438 1.00 0.00 C ATOM 0 H TRP A 141 117.031 -20.770 -14.083 1.00 0.00 H new ATOM 0 HA TRP A 141 115.963 -20.417 -11.468 1.00 0.00 H new ATOM 0 HB2 TRP A 141 116.702 -18.682 -13.831 1.00 0.00 H new ATOM 0 HB3 TRP A 141 115.739 -17.974 -12.550 1.00 0.00 H new ATOM 0 HD1 TRP A 141 118.240 -20.661 -11.548 1.00 0.00 H new ATOM 0 HE1 TRP A 141 120.197 -19.603 -10.231 1.00 0.00 H new ATOM 0 HE3 TRP A 141 117.160 -15.731 -12.329 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 121.144 -16.950 -9.620 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 118.610 -13.961 -11.376 1.00 0.00 H new ATOM 0 HH2 TRP A 141 120.598 -14.565 -10.025 1.00 0.00 H new ATOM 2197 N ALA A 142 113.898 -20.491 -13.970 1.00 0.00 N ATOM 2198 CA ALA A 142 112.491 -20.447 -14.351 1.00 0.00 C ATOM 2199 C ALA A 142 111.980 -21.836 -14.697 1.00 0.00 C ATOM 2200 O ALA A 142 110.852 -22.004 -15.163 1.00 0.00 O ATOM 2201 CB ALA A 142 112.293 -19.509 -15.543 1.00 0.00 C ATOM 0 H ALA A 142 114.518 -20.888 -14.677 1.00 0.00 H new ATOM 0 HA ALA A 142 111.922 -20.070 -13.501 1.00 0.00 H new ATOM 0 HB1 ALA A 142 111.238 -19.486 -15.817 1.00 0.00 H new ATOM 0 HB2 ALA A 142 112.620 -18.505 -15.274 1.00 0.00 H new ATOM 0 HB3 ALA A 142 112.879 -19.867 -16.389 1.00 0.00 H new ATOM 2207 N ARG A 143 112.823 -22.821 -14.463 1.00 0.00 N ATOM 2208 CA ARG A 143 112.471 -24.209 -14.743 1.00 0.00 C ATOM 2209 C ARG A 143 110.967 -24.420 -14.595 1.00 0.00 C ATOM 2210 O ARG A 143 110.428 -24.007 -13.582 1.00 0.00 O ATOM 2211 CB ARG A 143 113.216 -25.141 -13.786 1.00 0.00 C ATOM 2212 CG ARG A 143 114.143 -26.061 -14.583 1.00 0.00 C ATOM 2213 CD ARG A 143 115.005 -26.877 -13.619 1.00 0.00 C ATOM 2214 NE ARG A 143 115.259 -28.204 -14.169 1.00 0.00 N ATOM 2215 CZ ARG A 143 116.167 -29.011 -13.626 1.00 0.00 C ATOM 2216 NH1 ARG A 143 116.847 -28.619 -12.584 1.00 0.00 N ATOM 2217 NH2 ARG A 143 116.376 -30.193 -14.135 1.00 0.00 N ATOM 2218 OXT ARG A 143 110.377 -24.991 -15.498 1.00 0.00 O ATOM 0 H ARG A 143 113.759 -22.692 -14.079 1.00 0.00 H new ATOM 0 HA ARG A 143 112.760 -24.437 -15.769 1.00 0.00 H new ATOM 0 HB2 ARG A 143 113.794 -24.557 -13.070 1.00 0.00 H new ATOM 0 HB3 ARG A 143 112.504 -25.734 -13.212 1.00 0.00 H new ATOM 0 HG2 ARG A 143 113.556 -26.727 -15.215 1.00 0.00 H new ATOM 0 HG3 ARG A 143 114.777 -25.471 -15.244 1.00 0.00 H new ATOM 0 HD2 ARG A 143 115.949 -26.363 -13.440 1.00 0.00 H new ATOM 0 HD3 ARG A 143 114.502 -26.965 -12.656 1.00 0.00 H new ATOM 0 HE ARG A 143 114.732 -28.519 -14.984 1.00 0.00 H new ATOM 0 HH11 ARG A 143 116.682 -27.694 -12.186 1.00 0.00 H new ATOM 0 HH12 ARG A 143 117.543 -29.237 -12.167 1.00 0.00 H new ATOM 0 HH21 ARG A 143 115.844 -30.499 -14.949 1.00 0.00 H new ATOM 0 HH22 ARG A 143 117.072 -30.812 -13.719 1.00 0.00 H new TER 2232 ARG A 143