USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 944 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 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 118 TYR OH : rot 165:sc=-0.00134 USER MOD Single : A 5 LYS NZ :NH3+ -148:sc= -0.148 (180deg=-1.07) USER MOD Single : A 12 GLN : amide:sc= -0.181 X(o=-0.18,f=-0.18) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= -0.586 K(o=-0.59,f=-0.061) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot -27:sc= -3.66! USER MOD Single : A 29 GLN : amide:sc= -0.168 K(o=-0.17,f=-2.2!) USER MOD Single : A 30 THR OG1 : rot -140:sc= -0.238 USER MOD Single : A 32 GLN : amide:sc= -0.487 K(o=-0.49,f=-2.9!) USER MOD Single : A 35 ASN : amide:sc= -0.908! C(o=-0.91!,f=-5!) USER MOD Single : A 38 GLN : amide:sc= -1.64! K(o=-1.6!,f=-0.95) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 MET CE :methyl -173:sc= -0.238 (180deg=-0.276) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -154:sc= -12.2! (180deg=-12.5!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -143:sc= -10.8! (180deg=-12.8!) USER MOD Single : A 70 LYS NZ :NH3+ 148:sc= 0.233 (180deg=-0.00491) USER MOD Single : A 75 ASN : amide:sc= -1.19 K(o=-1.2,f=-2.4!) USER MOD Single : A 81 MET CE :methyl -145:sc= -2.13! (180deg=-2.93!) USER MOD Single : A 82 THR OG1 : rot -54:sc= 0.657 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HE2:sc= -34.6! C(o=-35!,f=-41!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ -154:sc= 0.0528 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 51 N GLU A 4 3.474 -12.100 -1.408 1.00 0.00 N ATOM 52 CA GLU A 4 2.643 -10.947 -1.857 1.00 0.00 C ATOM 53 C GLU A 4 3.353 -9.638 -1.505 1.00 0.00 C ATOM 54 O GLU A 4 3.407 -9.240 -0.358 1.00 0.00 O ATOM 55 CB GLU A 4 1.284 -10.995 -1.157 1.00 0.00 C ATOM 56 CG GLU A 4 0.717 -12.414 -1.240 1.00 0.00 C ATOM 57 CD GLU A 4 -0.744 -12.354 -1.687 1.00 0.00 C ATOM 58 OE1 GLU A 4 -1.338 -11.295 -1.566 1.00 0.00 O ATOM 59 OE2 GLU A 4 -1.247 -13.368 -2.144 1.00 0.00 O ATOM 0 HA GLU A 4 2.498 -11.002 -2.936 1.00 0.00 H new ATOM 0 HB2 GLU A 4 1.389 -10.694 -0.115 1.00 0.00 H new ATOM 0 HB3 GLU A 4 0.597 -10.290 -1.624 1.00 0.00 H new ATOM 0 HG2 GLU A 4 1.299 -13.009 -1.943 1.00 0.00 H new ATOM 0 HG3 GLU A 4 0.792 -12.904 -0.269 1.00 0.00 H new ATOM 66 N LYS A 5 3.896 -8.965 -2.482 1.00 0.00 N ATOM 67 CA LYS A 5 4.600 -7.682 -2.201 1.00 0.00 C ATOM 68 C LYS A 5 4.168 -6.630 -3.224 1.00 0.00 C ATOM 69 O LYS A 5 4.106 -6.892 -4.409 1.00 0.00 O ATOM 70 CB LYS A 5 6.112 -7.898 -2.299 1.00 0.00 C ATOM 71 CG LYS A 5 6.645 -8.396 -0.954 1.00 0.00 C ATOM 72 CD LYS A 5 7.714 -9.464 -1.192 1.00 0.00 C ATOM 73 CE LYS A 5 7.135 -10.845 -0.878 1.00 0.00 C ATOM 74 NZ LYS A 5 6.734 -10.901 0.556 1.00 0.00 N ATOM 0 H LYS A 5 3.883 -9.248 -3.462 1.00 0.00 H new ATOM 0 HA LYS A 5 4.346 -7.340 -1.198 1.00 0.00 H new ATOM 0 HB2 LYS A 5 6.337 -8.622 -3.082 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.606 -6.967 -2.576 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.066 -7.565 -0.388 1.00 0.00 H new ATOM 0 HG3 LYS A 5 5.831 -8.808 -0.358 1.00 0.00 H new ATOM 0 HD2 LYS A 5 8.055 -9.428 -2.227 1.00 0.00 H new ATOM 0 HD3 LYS A 5 8.583 -9.271 -0.563 1.00 0.00 H new ATOM 0 HE2 LYS A 5 6.274 -11.043 -1.516 1.00 0.00 H new ATOM 0 HE3 LYS A 5 7.874 -11.618 -1.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 6.860 -11.869 0.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 7.326 -10.248 1.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 5.735 -10.625 0.648 1.00 0.00 H new ATOM 88 N ILE A 6 3.867 -5.443 -2.776 1.00 0.00 N ATOM 89 CA ILE A 6 3.437 -4.375 -3.723 1.00 0.00 C ATOM 90 C ILE A 6 4.269 -3.114 -3.482 1.00 0.00 C ATOM 91 O ILE A 6 4.879 -2.950 -2.444 1.00 0.00 O ATOM 92 CB ILE A 6 1.956 -4.062 -3.500 1.00 0.00 C ATOM 93 CG1 ILE A 6 1.122 -5.306 -3.810 1.00 0.00 C ATOM 94 CG2 ILE A 6 1.531 -2.920 -4.424 1.00 0.00 C ATOM 95 CD1 ILE A 6 -0.327 -5.072 -3.375 1.00 0.00 C ATOM 0 H ILE A 6 3.900 -5.166 -1.795 1.00 0.00 H new ATOM 0 HA ILE A 6 3.585 -4.716 -4.748 1.00 0.00 H new ATOM 0 HB ILE A 6 1.798 -3.767 -2.463 1.00 0.00 H new ATOM 0 HG12 ILE A 6 1.161 -5.526 -4.877 1.00 0.00 H new ATOM 0 HG13 ILE A 6 1.533 -6.171 -3.290 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.476 -2.697 -4.265 1.00 0.00 H new ATOM 0 HG22 ILE A 6 2.126 -2.034 -4.205 1.00 0.00 H new ATOM 0 HG23 ILE A 6 1.687 -3.214 -5.462 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -0.921 -5.959 -3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -0.358 -4.873 -2.304 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -0.736 -4.218 -3.915 1.00 0.00 H new ATOM 107 N LEU A 7 4.301 -2.223 -4.434 1.00 0.00 N ATOM 108 CA LEU A 7 5.095 -0.974 -4.261 1.00 0.00 C ATOM 109 C LEU A 7 4.246 0.233 -4.667 1.00 0.00 C ATOM 110 O LEU A 7 3.876 0.385 -5.815 1.00 0.00 O ATOM 111 CB LEU A 7 6.342 -1.042 -5.147 1.00 0.00 C ATOM 112 CG LEU A 7 7.344 0.026 -4.706 1.00 0.00 C ATOM 113 CD1 LEU A 7 6.775 1.415 -4.997 1.00 0.00 C ATOM 114 CD2 LEU A 7 7.607 -0.111 -3.205 1.00 0.00 C ATOM 0 H LEU A 7 3.811 -2.306 -5.325 1.00 0.00 H new ATOM 0 HA LEU A 7 5.392 -0.872 -3.217 1.00 0.00 H new ATOM 0 HB2 LEU A 7 6.796 -2.031 -5.079 1.00 0.00 H new ATOM 0 HB3 LEU A 7 6.068 -0.889 -6.191 1.00 0.00 H new ATOM 0 HG LEU A 7 8.277 -0.106 -5.254 1.00 0.00 H new ATOM 0 HD11 LEU A 7 7.490 2.175 -4.682 1.00 0.00 H new ATOM 0 HD12 LEU A 7 6.587 1.515 -6.066 1.00 0.00 H new ATOM 0 HD13 LEU A 7 5.841 1.547 -4.451 1.00 0.00 H new ATOM 0 HD21 LEU A 7 8.321 0.650 -2.890 1.00 0.00 H new ATOM 0 HD22 LEU A 7 6.673 0.019 -2.659 1.00 0.00 H new ATOM 0 HD23 LEU A 7 8.015 -1.100 -2.996 1.00 0.00 H new ATOM 126 N ILE A 8 3.934 1.092 -3.737 1.00 0.00 N ATOM 127 CA ILE A 8 3.111 2.287 -4.073 1.00 0.00 C ATOM 128 C ILE A 8 4.006 3.527 -4.125 1.00 0.00 C ATOM 129 O ILE A 8 4.423 4.046 -3.109 1.00 0.00 O ATOM 130 CB ILE A 8 2.033 2.482 -3.004 1.00 0.00 C ATOM 131 CG1 ILE A 8 1.463 1.120 -2.602 1.00 0.00 C ATOM 132 CG2 ILE A 8 0.910 3.358 -3.564 1.00 0.00 C ATOM 133 CD1 ILE A 8 0.199 1.322 -1.763 1.00 0.00 C ATOM 0 H ILE A 8 4.213 1.018 -2.759 1.00 0.00 H new ATOM 0 HA ILE A 8 2.638 2.139 -5.044 1.00 0.00 H new ATOM 0 HB ILE A 8 2.471 2.967 -2.131 1.00 0.00 H new ATOM 0 HG12 ILE A 8 1.232 0.534 -3.491 1.00 0.00 H new ATOM 0 HG13 ILE A 8 2.204 0.558 -2.033 1.00 0.00 H new ATOM 0 HG21 ILE A 8 0.143 3.497 -2.802 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.315 4.328 -3.852 1.00 0.00 H new ATOM 0 HG23 ILE A 8 0.472 2.874 -4.437 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -0.207 0.352 -1.477 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.444 1.891 -0.866 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -0.542 1.867 -2.347 1.00 0.00 H new ATOM 145 N VAL A 9 4.304 4.005 -5.302 1.00 0.00 N ATOM 146 CA VAL A 9 5.173 5.210 -5.419 1.00 0.00 C ATOM 147 C VAL A 9 4.303 6.467 -5.423 1.00 0.00 C ATOM 148 O VAL A 9 3.877 6.935 -6.460 1.00 0.00 O ATOM 149 CB VAL A 9 5.971 5.139 -6.723 1.00 0.00 C ATOM 150 CG1 VAL A 9 6.965 6.301 -6.776 1.00 0.00 C ATOM 151 CG2 VAL A 9 6.734 3.815 -6.782 1.00 0.00 C ATOM 0 H VAL A 9 3.983 3.613 -6.188 1.00 0.00 H new ATOM 0 HA VAL A 9 5.860 5.246 -4.574 1.00 0.00 H new ATOM 0 HB VAL A 9 5.289 5.204 -7.570 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.534 6.251 -7.704 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.423 7.246 -6.733 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.647 6.235 -5.929 1.00 0.00 H new ATOM 0 HG21 VAL A 9 7.303 3.764 -7.711 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.416 3.750 -5.935 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.028 2.986 -6.743 1.00 0.00 H new ATOM 161 N ASP A 10 4.036 7.020 -4.272 1.00 0.00 N ATOM 162 CA ASP A 10 3.194 8.247 -4.213 1.00 0.00 C ATOM 163 C ASP A 10 3.925 9.328 -3.415 1.00 0.00 C ATOM 164 O ASP A 10 4.380 9.098 -2.313 1.00 0.00 O ATOM 165 CB ASP A 10 1.863 7.921 -3.533 1.00 0.00 C ATOM 166 CG ASP A 10 1.132 6.842 -4.331 1.00 0.00 C ATOM 167 OD1 ASP A 10 1.080 6.964 -5.545 1.00 0.00 O ATOM 168 OD2 ASP A 10 0.636 5.911 -3.716 1.00 0.00 O ATOM 0 H ASP A 10 4.365 6.675 -3.370 1.00 0.00 H new ATOM 0 HA ASP A 10 3.005 8.607 -5.224 1.00 0.00 H new ATOM 0 HB2 ASP A 10 2.038 7.578 -2.513 1.00 0.00 H new ATOM 0 HB3 ASP A 10 1.248 8.818 -3.466 1.00 0.00 H new ATOM 173 N ASP A 11 4.040 10.506 -3.963 1.00 0.00 N ATOM 174 CA ASP A 11 4.739 11.601 -3.235 1.00 0.00 C ATOM 175 C ASP A 11 3.701 12.524 -2.596 1.00 0.00 C ATOM 176 O ASP A 11 3.976 13.213 -1.634 1.00 0.00 O ATOM 177 CB ASP A 11 5.596 12.401 -4.218 1.00 0.00 C ATOM 178 CG ASP A 11 4.685 13.226 -5.131 1.00 0.00 C ATOM 179 OD1 ASP A 11 3.986 12.629 -5.932 1.00 0.00 O ATOM 180 OD2 ASP A 11 4.702 14.440 -5.008 1.00 0.00 O ATOM 0 H ASP A 11 3.680 10.757 -4.884 1.00 0.00 H new ATOM 0 HA ASP A 11 5.378 11.176 -2.460 1.00 0.00 H new ATOM 0 HB2 ASP A 11 6.276 13.057 -3.675 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.212 11.727 -4.813 1.00 0.00 H new ATOM 185 N GLN A 12 2.510 12.543 -3.126 1.00 0.00 N ATOM 186 CA GLN A 12 1.453 13.422 -2.553 1.00 0.00 C ATOM 187 C GLN A 12 0.773 12.709 -1.382 1.00 0.00 C ATOM 188 O GLN A 12 -0.007 11.796 -1.565 1.00 0.00 O ATOM 189 CB GLN A 12 0.416 13.738 -3.634 1.00 0.00 C ATOM 190 CG GLN A 12 -0.656 14.666 -3.057 1.00 0.00 C ATOM 191 CD GLN A 12 -0.014 15.992 -2.645 1.00 0.00 C ATOM 192 OE1 GLN A 12 0.146 16.264 -1.472 1.00 0.00 O ATOM 193 NE2 GLN A 12 0.361 16.836 -3.567 1.00 0.00 N ATOM 0 H GLN A 12 2.223 11.987 -3.932 1.00 0.00 H new ATOM 0 HA GLN A 12 1.903 14.349 -2.198 1.00 0.00 H new ATOM 0 HB2 GLN A 12 0.899 14.210 -4.489 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -0.041 12.817 -3.995 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -1.437 14.842 -3.797 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -1.133 14.197 -2.196 1.00 0.00 H new ATOM 0 HE21 GLN A 12 0.227 16.608 -4.552 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.788 17.724 -3.303 1.00 0.00 H new ATOM 202 N TYR A 13 1.067 13.121 -0.180 1.00 0.00 N ATOM 203 CA TYR A 13 0.444 12.477 1.012 1.00 0.00 C ATOM 204 C TYR A 13 -1.046 12.238 0.739 1.00 0.00 C ATOM 205 O TYR A 13 -1.655 12.910 -0.068 1.00 0.00 O ATOM 206 CB TYR A 13 0.617 13.404 2.224 1.00 0.00 C ATOM 207 CG TYR A 13 -0.374 13.050 3.311 1.00 0.00 C ATOM 208 CD1 TYR A 13 -1.717 13.425 3.184 1.00 0.00 C ATOM 209 CD2 TYR A 13 0.052 12.355 4.449 1.00 0.00 C ATOM 210 CE1 TYR A 13 -2.633 13.103 4.193 1.00 0.00 C ATOM 211 CE2 TYR A 13 -0.863 12.034 5.458 1.00 0.00 C ATOM 212 CZ TYR A 13 -2.207 12.408 5.330 1.00 0.00 C ATOM 213 OH TYR A 13 -3.109 12.091 6.325 1.00 0.00 O ATOM 0 H TYR A 13 1.715 13.880 0.030 1.00 0.00 H new ATOM 0 HA TYR A 13 0.924 11.520 1.217 1.00 0.00 H new ATOM 0 HB2 TYR A 13 1.633 13.321 2.610 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.475 14.441 1.919 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -2.047 13.963 2.307 1.00 0.00 H new ATOM 0 HD2 TYR A 13 1.088 12.066 4.548 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -3.669 13.391 4.093 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -0.533 11.498 6.336 1.00 0.00 H new ATOM 0 HH TYR A 13 -2.648 11.607 7.042 1.00 0.00 H new ATOM 223 N GLY A 14 -1.634 11.284 1.409 1.00 0.00 N ATOM 224 CA GLY A 14 -3.082 11.002 1.190 1.00 0.00 C ATOM 225 C GLY A 14 -3.239 9.669 0.458 1.00 0.00 C ATOM 226 O GLY A 14 -3.922 8.775 0.918 1.00 0.00 O ATOM 0 H GLY A 14 -1.175 10.688 2.098 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -3.605 10.968 2.146 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -3.535 11.804 0.607 1.00 0.00 H new ATOM 230 N ILE A 15 -2.612 9.528 -0.677 1.00 0.00 N ATOM 231 CA ILE A 15 -2.725 8.251 -1.438 1.00 0.00 C ATOM 232 C ILE A 15 -1.852 7.185 -0.769 1.00 0.00 C ATOM 233 O ILE A 15 -2.334 6.157 -0.337 1.00 0.00 O ATOM 234 CB ILE A 15 -2.256 8.480 -2.881 1.00 0.00 C ATOM 235 CG1 ILE A 15 -3.371 9.165 -3.673 1.00 0.00 C ATOM 236 CG2 ILE A 15 -1.917 7.141 -3.542 1.00 0.00 C ATOM 237 CD1 ILE A 15 -2.832 10.445 -4.314 1.00 0.00 C ATOM 0 H ILE A 15 -2.026 10.241 -1.111 1.00 0.00 H new ATOM 0 HA ILE A 15 -3.761 7.913 -1.445 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.366 9.110 -2.871 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.750 8.493 -4.442 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.207 9.400 -3.015 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.585 7.314 -4.566 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.122 6.649 -2.981 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -2.802 6.505 -3.550 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.627 10.932 -4.878 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.474 11.119 -3.536 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.010 10.197 -4.986 1.00 0.00 H new ATOM 249 N ARG A 16 -0.572 7.425 -0.686 1.00 0.00 N ATOM 250 CA ARG A 16 0.340 6.431 -0.050 1.00 0.00 C ATOM 251 C ARG A 16 -0.315 5.845 1.204 1.00 0.00 C ATOM 252 O ARG A 16 -0.077 4.710 1.566 1.00 0.00 O ATOM 253 CB ARG A 16 1.659 7.111 0.339 1.00 0.00 C ATOM 254 CG ARG A 16 1.428 8.601 0.606 1.00 0.00 C ATOM 255 CD ARG A 16 2.026 9.418 -0.541 1.00 0.00 C ATOM 256 NE ARG A 16 2.811 10.555 0.014 1.00 0.00 N ATOM 257 CZ ARG A 16 3.885 10.327 0.724 1.00 0.00 C ATOM 258 NH1 ARG A 16 4.276 9.102 0.949 1.00 0.00 N ATOM 259 NH2 ARG A 16 4.568 11.328 1.208 1.00 0.00 N ATOM 0 H ARG A 16 -0.117 8.269 -1.032 1.00 0.00 H new ATOM 0 HA ARG A 16 0.538 5.630 -0.762 1.00 0.00 H new ATOM 0 HB2 ARG A 16 2.074 6.635 1.228 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.390 6.986 -0.460 1.00 0.00 H new ATOM 0 HG2 ARG A 16 0.361 8.805 0.696 1.00 0.00 H new ATOM 0 HG3 ARG A 16 1.888 8.889 1.551 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.667 8.786 -1.156 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.232 9.792 -1.187 1.00 0.00 H new ATOM 0 HE ARG A 16 2.510 11.514 -0.160 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.743 8.319 0.570 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.114 8.928 1.503 1.00 0.00 H new ATOM 0 HH21 ARG A 16 4.264 12.286 1.032 1.00 0.00 H new ATOM 0 HH22 ARG A 16 5.406 11.153 1.762 1.00 0.00 H new ATOM 273 N ILE A 17 -1.132 6.609 1.874 1.00 0.00 N ATOM 274 CA ILE A 17 -1.791 6.091 3.108 1.00 0.00 C ATOM 275 C ILE A 17 -3.128 5.435 2.751 1.00 0.00 C ATOM 276 O ILE A 17 -3.529 4.459 3.351 1.00 0.00 O ATOM 277 CB ILE A 17 -2.035 7.245 4.080 1.00 0.00 C ATOM 278 CG1 ILE A 17 -0.906 8.272 3.941 1.00 0.00 C ATOM 279 CG2 ILE A 17 -2.067 6.707 5.511 1.00 0.00 C ATOM 280 CD1 ILE A 17 -0.947 9.248 5.117 1.00 0.00 C ATOM 0 H ILE A 17 -1.372 7.568 1.622 1.00 0.00 H new ATOM 0 HA ILE A 17 -1.142 5.350 3.574 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.989 7.721 3.852 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.058 7.764 3.911 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -1.010 8.815 3.002 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.241 7.529 6.205 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -2.869 5.975 5.607 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.114 6.232 5.743 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -0.142 9.976 5.014 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -1.906 9.766 5.127 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -0.822 8.699 6.050 1.00 0.00 H new ATOM 292 N LEU A 18 -3.823 5.968 1.787 1.00 0.00 N ATOM 293 CA LEU A 18 -5.137 5.376 1.402 1.00 0.00 C ATOM 294 C LEU A 18 -4.924 3.974 0.826 1.00 0.00 C ATOM 295 O LEU A 18 -5.437 2.998 1.336 1.00 0.00 O ATOM 296 CB LEU A 18 -5.807 6.261 0.350 1.00 0.00 C ATOM 297 CG LEU A 18 -7.109 6.831 0.915 1.00 0.00 C ATOM 298 CD1 LEU A 18 -8.067 5.685 1.245 1.00 0.00 C ATOM 299 CD2 LEU A 18 -6.806 7.623 2.189 1.00 0.00 C ATOM 0 H LEU A 18 -3.540 6.787 1.248 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.774 5.311 2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.138 7.072 0.062 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.012 5.682 -0.550 1.00 0.00 H new ATOM 0 HG LEU A 18 -7.569 7.488 0.177 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.995 6.091 1.648 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -8.282 5.118 0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.608 5.028 1.984 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.733 8.030 2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.347 6.964 2.926 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.122 8.439 1.956 1.00 0.00 H new ATOM 311 N LEU A 19 -4.174 3.866 -0.236 1.00 0.00 N ATOM 312 CA LEU A 19 -3.933 2.528 -0.848 1.00 0.00 C ATOM 313 C LEU A 19 -3.161 1.645 0.134 1.00 0.00 C ATOM 314 O LEU A 19 -3.170 0.434 0.034 1.00 0.00 O ATOM 315 CB LEU A 19 -3.118 2.698 -2.131 1.00 0.00 C ATOM 316 CG LEU A 19 -4.003 3.313 -3.216 1.00 0.00 C ATOM 317 CD1 LEU A 19 -4.210 4.800 -2.926 1.00 0.00 C ATOM 318 CD2 LEU A 19 -3.327 3.150 -4.580 1.00 0.00 C ATOM 0 H LEU A 19 -3.717 4.647 -0.707 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.888 2.058 -1.081 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.255 3.337 -1.945 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.735 1.733 -2.462 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.968 2.807 -3.225 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.841 5.237 -3.700 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.692 4.918 -1.955 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.245 5.306 -2.916 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.958 3.588 -5.353 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.361 3.655 -4.570 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.180 2.090 -4.789 1.00 0.00 H new ATOM 330 N ASN A 20 -2.491 2.241 1.080 1.00 0.00 N ATOM 331 CA ASN A 20 -1.716 1.435 2.066 1.00 0.00 C ATOM 332 C ASN A 20 -2.683 0.698 2.997 1.00 0.00 C ATOM 333 O ASN A 20 -2.719 -0.516 3.034 1.00 0.00 O ATOM 334 CB ASN A 20 -0.822 2.362 2.891 1.00 0.00 C ATOM 335 CG ASN A 20 -0.249 1.594 4.084 1.00 0.00 C ATOM 336 OD1 ASN A 20 0.622 0.762 3.924 1.00 0.00 O ATOM 337 ND2 ASN A 20 -0.707 1.837 5.282 1.00 0.00 N ATOM 0 H ASN A 20 -2.446 3.251 1.214 1.00 0.00 H new ATOM 0 HA ASN A 20 -1.098 0.710 1.536 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -0.013 2.749 2.272 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -1.395 3.221 3.240 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -0.334 1.329 6.084 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -1.438 2.535 5.417 1.00 0.00 H new ATOM 344 N GLU A 21 -3.466 1.422 3.749 1.00 0.00 N ATOM 345 CA GLU A 21 -4.428 0.763 4.677 1.00 0.00 C ATOM 346 C GLU A 21 -5.337 -0.180 3.887 1.00 0.00 C ATOM 347 O GLU A 21 -5.593 -1.296 4.293 1.00 0.00 O ATOM 348 CB GLU A 21 -5.278 1.829 5.371 1.00 0.00 C ATOM 349 CG GLU A 21 -4.489 2.434 6.535 1.00 0.00 C ATOM 350 CD GLU A 21 -5.365 3.452 7.270 1.00 0.00 C ATOM 351 OE1 GLU A 21 -5.539 4.540 6.747 1.00 0.00 O ATOM 352 OE2 GLU A 21 -5.843 3.125 8.344 1.00 0.00 O ATOM 0 H GLU A 21 -3.481 2.442 3.761 1.00 0.00 H new ATOM 0 HA GLU A 21 -3.878 0.193 5.425 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.554 2.608 4.661 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -6.205 1.388 5.737 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -4.172 1.648 7.221 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.585 2.917 6.164 1.00 0.00 H new ATOM 359 N VAL A 22 -5.829 0.260 2.761 1.00 0.00 N ATOM 360 CA VAL A 22 -6.721 -0.612 1.947 1.00 0.00 C ATOM 361 C VAL A 22 -6.011 -1.935 1.652 1.00 0.00 C ATOM 362 O VAL A 22 -6.462 -2.992 2.046 1.00 0.00 O ATOM 363 CB VAL A 22 -7.059 0.090 0.631 1.00 0.00 C ATOM 364 CG1 VAL A 22 -8.064 -0.753 -0.155 1.00 0.00 C ATOM 365 CG2 VAL A 22 -7.668 1.462 0.928 1.00 0.00 C ATOM 0 H VAL A 22 -5.652 1.185 2.370 1.00 0.00 H new ATOM 0 HA VAL A 22 -7.640 -0.808 2.500 1.00 0.00 H new ATOM 0 HB VAL A 22 -6.150 0.214 0.042 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -8.304 -0.252 -1.093 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.632 -1.731 -0.366 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -8.973 -0.878 0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -7.909 1.964 -0.009 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -8.576 1.337 1.517 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -6.952 2.064 1.488 1.00 0.00 H new ATOM 375 N PHE A 23 -4.905 -1.884 0.963 1.00 0.00 N ATOM 376 CA PHE A 23 -4.168 -3.139 0.644 1.00 0.00 C ATOM 377 C PHE A 23 -3.642 -3.765 1.938 1.00 0.00 C ATOM 378 O PHE A 23 -3.192 -4.893 1.954 1.00 0.00 O ATOM 379 CB PHE A 23 -2.992 -2.819 -0.281 1.00 0.00 C ATOM 380 CG PHE A 23 -3.515 -2.390 -1.631 1.00 0.00 C ATOM 381 CD1 PHE A 23 -4.560 -3.100 -2.234 1.00 0.00 C ATOM 382 CD2 PHE A 23 -2.955 -1.283 -2.279 1.00 0.00 C ATOM 383 CE1 PHE A 23 -5.045 -2.703 -3.486 1.00 0.00 C ATOM 384 CE2 PHE A 23 -3.440 -0.886 -3.530 1.00 0.00 C ATOM 385 CZ PHE A 23 -4.486 -1.596 -4.134 1.00 0.00 C ATOM 0 H PHE A 23 -4.480 -1.028 0.607 1.00 0.00 H new ATOM 0 HA PHE A 23 -4.841 -3.839 0.148 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -2.380 -2.028 0.152 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -2.352 -3.694 -0.389 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.992 -3.954 -1.733 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -2.149 -0.735 -1.814 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -5.851 -3.251 -3.952 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -3.008 -0.032 -4.030 1.00 0.00 H new ATOM 0 HZ PHE A 23 -4.861 -1.289 -5.099 1.00 0.00 H new ATOM 395 N ASN A 24 -3.697 -3.041 3.022 1.00 0.00 N ATOM 396 CA ASN A 24 -3.201 -3.597 4.313 1.00 0.00 C ATOM 397 C ASN A 24 -4.194 -4.636 4.836 1.00 0.00 C ATOM 398 O ASN A 24 -3.861 -5.791 5.016 1.00 0.00 O ATOM 399 CB ASN A 24 -3.061 -2.466 5.335 1.00 0.00 C ATOM 400 CG ASN A 24 -1.589 -2.066 5.458 1.00 0.00 C ATOM 401 OD1 ASN A 24 -1.137 -1.688 6.520 1.00 0.00 O ATOM 402 ND2 ASN A 24 -0.818 -2.135 4.408 1.00 0.00 N ATOM 0 H ASN A 24 -4.063 -2.090 3.070 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.231 -4.068 4.157 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.657 -1.607 5.026 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -3.443 -2.788 6.304 1.00 0.00 H new ATOM 0 HD21 ASN A 24 0.165 -1.871 4.479 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.198 -2.453 3.516 1.00 0.00 H new ATOM 409 N LYS A 25 -5.413 -4.237 5.080 1.00 0.00 N ATOM 410 CA LYS A 25 -6.425 -5.204 5.589 1.00 0.00 C ATOM 411 C LYS A 25 -6.861 -6.130 4.453 1.00 0.00 C ATOM 412 O LYS A 25 -7.522 -7.126 4.668 1.00 0.00 O ATOM 413 CB LYS A 25 -7.640 -4.438 6.118 1.00 0.00 C ATOM 414 CG LYS A 25 -7.950 -4.893 7.546 1.00 0.00 C ATOM 415 CD LYS A 25 -9.068 -4.027 8.126 1.00 0.00 C ATOM 416 CE LYS A 25 -10.025 -4.903 8.936 1.00 0.00 C ATOM 417 NZ LYS A 25 -9.585 -4.938 10.359 1.00 0.00 N ATOM 0 H LYS A 25 -5.751 -3.284 4.949 1.00 0.00 H new ATOM 0 HA LYS A 25 -5.990 -5.797 6.394 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.443 -3.366 6.102 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.502 -4.613 5.474 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.249 -5.941 7.548 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.057 -4.815 8.166 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -8.646 -3.248 8.761 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.608 -3.526 7.323 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.040 -4.511 8.868 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.046 -5.913 8.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.236 -5.534 10.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.624 -5.332 10.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.587 -3.973 10.747 1.00 0.00 H new ATOM 431 N GLU A 26 -6.494 -5.810 3.241 1.00 0.00 N ATOM 432 CA GLU A 26 -6.886 -6.671 2.090 1.00 0.00 C ATOM 433 C GLU A 26 -6.011 -7.926 2.070 1.00 0.00 C ATOM 434 O GLU A 26 -6.438 -8.985 1.656 1.00 0.00 O ATOM 435 CB GLU A 26 -6.692 -5.895 0.786 1.00 0.00 C ATOM 436 CG GLU A 26 -7.977 -5.138 0.445 1.00 0.00 C ATOM 437 CD GLU A 26 -8.468 -5.563 -0.940 1.00 0.00 C ATOM 438 OE1 GLU A 26 -7.694 -5.466 -1.878 1.00 0.00 O ATOM 439 OE2 GLU A 26 -9.611 -5.979 -1.038 1.00 0.00 O ATOM 0 H GLU A 26 -5.939 -4.989 2.999 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.932 -6.959 2.191 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.862 -5.196 0.887 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.436 -6.580 -0.022 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.743 -5.344 1.193 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.794 -4.064 0.464 1.00 0.00 H new ATOM 446 N GLY A 27 -4.789 -7.814 2.515 1.00 0.00 N ATOM 447 CA GLY A 27 -3.887 -9.000 2.519 1.00 0.00 C ATOM 448 C GLY A 27 -2.725 -8.758 1.554 1.00 0.00 C ATOM 449 O GLY A 27 -2.327 -9.636 0.813 1.00 0.00 O ATOM 0 H GLY A 27 -4.377 -6.953 2.875 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.507 -9.179 3.525 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.440 -9.892 2.224 1.00 0.00 H new ATOM 453 N TYR A 28 -2.179 -7.573 1.554 1.00 0.00 N ATOM 454 CA TYR A 28 -1.044 -7.276 0.634 1.00 0.00 C ATOM 455 C TYR A 28 -0.024 -6.387 1.348 1.00 0.00 C ATOM 456 O TYR A 28 -0.372 -5.422 1.997 1.00 0.00 O ATOM 457 CB TYR A 28 -1.570 -6.547 -0.605 1.00 0.00 C ATOM 458 CG TYR A 28 -2.633 -7.385 -1.274 1.00 0.00 C ATOM 459 CD1 TYR A 28 -2.266 -8.401 -2.165 1.00 0.00 C ATOM 460 CD2 TYR A 28 -3.986 -7.144 -1.006 1.00 0.00 C ATOM 461 CE1 TYR A 28 -3.252 -9.174 -2.788 1.00 0.00 C ATOM 462 CE2 TYR A 28 -4.972 -7.918 -1.629 1.00 0.00 C ATOM 463 CZ TYR A 28 -4.605 -8.934 -2.521 1.00 0.00 C ATOM 464 OH TYR A 28 -5.577 -9.697 -3.135 1.00 0.00 O ATOM 0 H TYR A 28 -2.469 -6.798 2.150 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.567 -8.210 0.335 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -1.981 -5.578 -0.322 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.753 -6.355 -1.301 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -1.222 -8.588 -2.371 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -4.269 -6.361 -0.318 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -2.969 -9.957 -3.476 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -6.016 -7.732 -1.422 1.00 0.00 H new ATOM 0 HH TYR A 28 -5.238 -10.030 -3.992 1.00 0.00 H new ATOM 474 N GLN A 29 1.238 -6.702 1.226 1.00 0.00 N ATOM 475 CA GLN A 29 2.281 -5.872 1.892 1.00 0.00 C ATOM 476 C GLN A 29 2.795 -4.825 0.901 1.00 0.00 C ATOM 477 O GLN A 29 3.816 -5.004 0.268 1.00 0.00 O ATOM 478 CB GLN A 29 3.441 -6.766 2.337 1.00 0.00 C ATOM 479 CG GLN A 29 2.922 -7.832 3.303 1.00 0.00 C ATOM 480 CD GLN A 29 3.059 -7.327 4.741 1.00 0.00 C ATOM 481 OE1 GLN A 29 3.401 -6.183 4.966 1.00 0.00 O ATOM 482 NE2 GLN A 29 2.804 -8.137 5.731 1.00 0.00 N ATOM 0 H GLN A 29 1.591 -7.498 0.694 1.00 0.00 H new ATOM 0 HA GLN A 29 1.854 -5.376 2.764 1.00 0.00 H new ATOM 0 HB2 GLN A 29 3.903 -7.239 1.470 1.00 0.00 H new ATOM 0 HB3 GLN A 29 4.212 -6.166 2.821 1.00 0.00 H new ATOM 0 HG2 GLN A 29 1.879 -8.060 3.084 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.484 -8.758 3.176 1.00 0.00 H new ATOM 0 HE21 GLN A 29 2.517 -9.098 5.543 1.00 0.00 H new ATOM 0 HE22 GLN A 29 2.892 -7.810 6.693 1.00 0.00 H new ATOM 491 N THR A 30 2.090 -3.736 0.756 1.00 0.00 N ATOM 492 CA THR A 30 2.534 -2.682 -0.199 1.00 0.00 C ATOM 493 C THR A 30 3.451 -1.687 0.514 1.00 0.00 C ATOM 494 O THR A 30 3.312 -1.435 1.695 1.00 0.00 O ATOM 495 CB THR A 30 1.309 -1.941 -0.741 1.00 0.00 C ATOM 496 OG1 THR A 30 0.882 -0.978 0.213 1.00 0.00 O ATOM 497 CG2 THR A 30 0.179 -2.938 -1.000 1.00 0.00 C ATOM 0 H THR A 30 1.226 -3.531 1.258 1.00 0.00 H new ATOM 0 HA THR A 30 3.078 -3.148 -1.021 1.00 0.00 H new ATOM 0 HB THR A 30 1.570 -1.441 -1.674 1.00 0.00 H new ATOM 0 HG1 THR A 30 -0.097 -0.965 0.249 1.00 0.00 H new ATOM 0 HG21 THR A 30 -0.692 -2.408 -1.386 1.00 0.00 H new ATOM 0 HG22 THR A 30 0.507 -3.678 -1.730 1.00 0.00 H new ATOM 0 HG23 THR A 30 -0.084 -3.439 -0.069 1.00 0.00 H new ATOM 505 N PHE A 31 4.382 -1.115 -0.197 1.00 0.00 N ATOM 506 CA PHE A 31 5.306 -0.131 0.434 1.00 0.00 C ATOM 507 C PHE A 31 4.972 1.271 -0.083 1.00 0.00 C ATOM 508 O PHE A 31 3.944 1.487 -0.694 1.00 0.00 O ATOM 509 CB PHE A 31 6.751 -0.479 0.073 1.00 0.00 C ATOM 510 CG PHE A 31 7.016 -1.928 0.402 1.00 0.00 C ATOM 511 CD1 PHE A 31 6.841 -2.393 1.711 1.00 0.00 C ATOM 512 CD2 PHE A 31 7.440 -2.807 -0.602 1.00 0.00 C ATOM 513 CE1 PHE A 31 7.087 -3.738 2.016 1.00 0.00 C ATOM 514 CE2 PHE A 31 7.686 -4.151 -0.297 1.00 0.00 C ATOM 515 CZ PHE A 31 7.510 -4.616 1.011 1.00 0.00 C ATOM 0 H PHE A 31 4.543 -1.286 -1.189 1.00 0.00 H new ATOM 0 HA PHE A 31 5.190 -0.161 1.517 1.00 0.00 H new ATOM 0 HB2 PHE A 31 6.926 -0.298 -0.987 1.00 0.00 H new ATOM 0 HB3 PHE A 31 7.439 0.162 0.624 1.00 0.00 H new ATOM 0 HD1 PHE A 31 6.516 -1.714 2.486 1.00 0.00 H new ATOM 0 HD2 PHE A 31 7.577 -2.448 -1.611 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.950 -4.097 3.025 1.00 0.00 H new ATOM 0 HE2 PHE A 31 8.012 -4.829 -1.072 1.00 0.00 H new ATOM 0 HZ PHE A 31 7.701 -5.653 1.245 1.00 0.00 H new ATOM 525 N GLN A 32 5.829 2.226 0.156 1.00 0.00 N ATOM 526 CA GLN A 32 5.550 3.608 -0.325 1.00 0.00 C ATOM 527 C GLN A 32 6.795 4.182 -1.005 1.00 0.00 C ATOM 528 O GLN A 32 7.905 3.754 -0.754 1.00 0.00 O ATOM 529 CB GLN A 32 5.163 4.492 0.862 1.00 0.00 C ATOM 530 CG GLN A 32 3.743 4.149 1.315 1.00 0.00 C ATOM 531 CD GLN A 32 3.803 3.295 2.583 1.00 0.00 C ATOM 532 OE1 GLN A 32 4.867 2.894 3.009 1.00 0.00 O ATOM 533 NE2 GLN A 32 2.696 2.999 3.208 1.00 0.00 N ATOM 0 H GLN A 32 6.707 2.109 0.662 1.00 0.00 H new ATOM 0 HA GLN A 32 4.730 3.580 -1.043 1.00 0.00 H new ATOM 0 HB2 GLN A 32 5.864 4.343 1.683 1.00 0.00 H new ATOM 0 HB3 GLN A 32 5.222 5.543 0.580 1.00 0.00 H new ATOM 0 HG2 GLN A 32 3.180 5.063 1.506 1.00 0.00 H new ATOM 0 HG3 GLN A 32 3.218 3.610 0.526 1.00 0.00 H new ATOM 0 HE21 GLN A 32 1.802 3.336 2.850 1.00 0.00 H new ATOM 0 HE22 GLN A 32 2.725 2.431 4.055 1.00 0.00 H new ATOM 542 N ALA A 33 6.617 5.149 -1.862 1.00 0.00 N ATOM 543 CA ALA A 33 7.785 5.757 -2.559 1.00 0.00 C ATOM 544 C ALA A 33 7.410 7.158 -3.045 1.00 0.00 C ATOM 545 O ALA A 33 6.287 7.596 -2.894 1.00 0.00 O ATOM 546 CB ALA A 33 8.175 4.888 -3.755 1.00 0.00 C ATOM 0 H ALA A 33 5.711 5.545 -2.110 1.00 0.00 H new ATOM 0 HA ALA A 33 8.628 5.823 -1.871 1.00 0.00 H new ATOM 0 HB1 ALA A 33 9.030 5.333 -4.265 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.439 3.889 -3.408 1.00 0.00 H new ATOM 0 HB3 ALA A 33 7.335 4.822 -4.446 1.00 0.00 H new ATOM 552 N ALA A 34 8.338 7.867 -3.628 1.00 0.00 N ATOM 553 CA ALA A 34 8.026 9.238 -4.121 1.00 0.00 C ATOM 554 C ALA A 34 9.219 9.788 -4.904 1.00 0.00 C ATOM 555 O ALA A 34 9.067 10.357 -5.967 1.00 0.00 O ATOM 556 CB ALA A 34 7.733 10.152 -2.929 1.00 0.00 C ATOM 0 H ALA A 34 9.297 7.557 -3.784 1.00 0.00 H new ATOM 0 HA ALA A 34 7.154 9.198 -4.774 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.504 11.156 -3.288 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.880 9.763 -2.373 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.605 10.190 -2.276 1.00 0.00 H new ATOM 562 N ASN A 35 10.407 9.626 -4.387 1.00 0.00 N ATOM 563 CA ASN A 35 11.607 10.144 -5.104 1.00 0.00 C ATOM 564 C ASN A 35 12.035 9.142 -6.180 1.00 0.00 C ATOM 565 O ASN A 35 12.975 9.372 -6.915 1.00 0.00 O ATOM 566 CB ASN A 35 12.751 10.341 -4.107 1.00 0.00 C ATOM 567 CG ASN A 35 12.849 9.120 -3.192 1.00 0.00 C ATOM 568 OD1 ASN A 35 13.556 8.178 -3.492 1.00 0.00 O ATOM 569 ND2 ASN A 35 12.167 9.095 -2.081 1.00 0.00 N ATOM 0 H ASN A 35 10.598 9.158 -3.501 1.00 0.00 H new ATOM 0 HA ASN A 35 11.364 11.097 -5.573 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.691 10.485 -4.640 1.00 0.00 H new ATOM 0 HB3 ASN A 35 12.580 11.240 -3.514 1.00 0.00 H new ATOM 0 HD21 ASN A 35 12.227 8.285 -1.464 1.00 0.00 H new ATOM 0 HD22 ASN A 35 11.574 9.885 -1.829 1.00 0.00 H new ATOM 576 N GLY A 36 11.354 8.034 -6.281 1.00 0.00 N ATOM 577 CA GLY A 36 11.725 7.023 -7.312 1.00 0.00 C ATOM 578 C GLY A 36 12.821 6.109 -6.760 1.00 0.00 C ATOM 579 O GLY A 36 12.736 4.900 -6.846 1.00 0.00 O ATOM 0 H GLY A 36 10.557 7.785 -5.695 1.00 0.00 H new ATOM 0 HA2 GLY A 36 10.851 6.434 -7.590 1.00 0.00 H new ATOM 0 HA3 GLY A 36 12.074 7.521 -8.216 1.00 0.00 H new ATOM 583 N LEU A 37 13.852 6.677 -6.195 1.00 0.00 N ATOM 584 CA LEU A 37 14.952 5.839 -5.641 1.00 0.00 C ATOM 585 C LEU A 37 14.368 4.793 -4.690 1.00 0.00 C ATOM 586 O LEU A 37 14.730 3.634 -4.728 1.00 0.00 O ATOM 587 CB LEU A 37 15.935 6.730 -4.878 1.00 0.00 C ATOM 588 CG LEU A 37 17.310 6.660 -5.544 1.00 0.00 C ATOM 589 CD1 LEU A 37 17.196 7.106 -7.003 1.00 0.00 C ATOM 590 CD2 LEU A 37 18.281 7.584 -4.805 1.00 0.00 C ATOM 0 H LEU A 37 13.979 7.684 -6.094 1.00 0.00 H new ATOM 0 HA LEU A 37 15.473 5.337 -6.456 1.00 0.00 H new ATOM 0 HB2 LEU A 37 15.576 7.759 -4.867 1.00 0.00 H new ATOM 0 HB3 LEU A 37 16.005 6.406 -3.840 1.00 0.00 H new ATOM 0 HG LEU A 37 17.679 5.635 -5.505 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.176 7.056 -7.477 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.504 6.450 -7.531 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.826 8.131 -7.042 1.00 0.00 H new ATOM 0 HD21 LEU A 37 19.262 7.535 -5.279 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.910 8.608 -4.844 1.00 0.00 H new ATOM 0 HD23 LEU A 37 18.364 7.268 -3.765 1.00 0.00 H new ATOM 602 N GLN A 38 13.466 5.192 -3.836 1.00 0.00 N ATOM 603 CA GLN A 38 12.858 4.221 -2.884 1.00 0.00 C ATOM 604 C GLN A 38 11.989 3.227 -3.655 1.00 0.00 C ATOM 605 O GLN A 38 11.797 2.101 -3.238 1.00 0.00 O ATOM 606 CB GLN A 38 11.996 4.974 -1.868 1.00 0.00 C ATOM 607 CG GLN A 38 12.317 4.478 -0.456 1.00 0.00 C ATOM 608 CD GLN A 38 13.824 4.577 -0.209 1.00 0.00 C ATOM 609 OE1 GLN A 38 14.326 5.628 0.139 1.00 0.00 O ATOM 610 NE2 GLN A 38 14.570 3.521 -0.376 1.00 0.00 N ATOM 0 H GLN A 38 13.124 6.150 -3.757 1.00 0.00 H new ATOM 0 HA GLN A 38 13.648 3.682 -2.361 1.00 0.00 H new ATOM 0 HB2 GLN A 38 12.184 6.045 -1.940 1.00 0.00 H new ATOM 0 HB3 GLN A 38 10.939 4.820 -2.087 1.00 0.00 H new ATOM 0 HG2 GLN A 38 11.777 5.073 0.281 1.00 0.00 H new ATOM 0 HG3 GLN A 38 11.986 3.446 -0.338 1.00 0.00 H new ATOM 0 HE21 GLN A 38 14.148 2.639 -0.668 1.00 0.00 H new ATOM 0 HE22 GLN A 38 15.576 3.576 -0.215 1.00 0.00 H new ATOM 619 N ALA A 39 11.459 3.632 -4.776 1.00 0.00 N ATOM 620 CA ALA A 39 10.601 2.709 -5.571 1.00 0.00 C ATOM 621 C ALA A 39 11.471 1.626 -6.212 1.00 0.00 C ATOM 622 O ALA A 39 11.410 0.470 -5.846 1.00 0.00 O ATOM 623 CB ALA A 39 9.882 3.500 -6.666 1.00 0.00 C ATOM 0 H ALA A 39 11.583 4.562 -5.176 1.00 0.00 H new ATOM 0 HA ALA A 39 9.866 2.242 -4.916 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.254 2.826 -7.249 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.261 4.271 -6.210 1.00 0.00 H new ATOM 0 HB3 ALA A 39 10.618 3.967 -7.321 1.00 0.00 H new ATOM 629 N LEU A 40 12.280 1.991 -7.169 1.00 0.00 N ATOM 630 CA LEU A 40 13.152 0.981 -7.834 1.00 0.00 C ATOM 631 C LEU A 40 13.928 0.195 -6.774 1.00 0.00 C ATOM 632 O LEU A 40 13.994 -1.017 -6.813 1.00 0.00 O ATOM 633 CB LEU A 40 14.139 1.693 -8.763 1.00 0.00 C ATOM 634 CG LEU A 40 13.376 2.651 -9.680 1.00 0.00 C ATOM 635 CD1 LEU A 40 14.040 4.028 -9.645 1.00 0.00 C ATOM 636 CD2 LEU A 40 13.399 2.112 -11.111 1.00 0.00 C ATOM 0 H LEU A 40 12.375 2.944 -7.519 1.00 0.00 H new ATOM 0 HA LEU A 40 12.534 0.295 -8.414 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.875 2.243 -8.176 1.00 0.00 H new ATOM 0 HB3 LEU A 40 14.687 0.962 -9.358 1.00 0.00 H new ATOM 0 HG LEU A 40 12.344 2.736 -9.339 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.497 4.711 -10.298 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.026 4.413 -8.625 1.00 0.00 H new ATOM 0 HD13 LEU A 40 15.072 3.943 -9.986 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.856 2.794 -11.765 1.00 0.00 H new ATOM 0 HD22 LEU A 40 14.431 2.028 -11.451 1.00 0.00 H new ATOM 0 HD23 LEU A 40 12.927 1.130 -11.138 1.00 0.00 H new ATOM 648 N ASP A 41 14.516 0.876 -5.829 1.00 0.00 N ATOM 649 CA ASP A 41 15.287 0.165 -4.770 1.00 0.00 C ATOM 650 C ASP A 41 14.399 -0.894 -4.114 1.00 0.00 C ATOM 651 O ASP A 41 14.763 -2.049 -4.018 1.00 0.00 O ATOM 652 CB ASP A 41 15.747 1.171 -3.712 1.00 0.00 C ATOM 653 CG ASP A 41 16.924 0.587 -2.929 1.00 0.00 C ATOM 654 OD1 ASP A 41 16.914 -0.609 -2.687 1.00 0.00 O ATOM 655 OD2 ASP A 41 17.816 1.344 -2.585 1.00 0.00 O ATOM 0 H ASP A 41 14.496 1.892 -5.744 1.00 0.00 H new ATOM 0 HA ASP A 41 16.157 -0.317 -5.217 1.00 0.00 H new ATOM 0 HB2 ASP A 41 16.042 2.106 -4.188 1.00 0.00 H new ATOM 0 HB3 ASP A 41 14.925 1.403 -3.034 1.00 0.00 H new ATOM 660 N ILE A 42 13.238 -0.510 -3.659 1.00 0.00 N ATOM 661 CA ILE A 42 12.329 -1.497 -3.009 1.00 0.00 C ATOM 662 C ILE A 42 11.954 -2.585 -4.018 1.00 0.00 C ATOM 663 O ILE A 42 11.584 -3.683 -3.652 1.00 0.00 O ATOM 664 CB ILE A 42 11.063 -0.785 -2.527 1.00 0.00 C ATOM 665 CG1 ILE A 42 11.395 0.064 -1.298 1.00 0.00 C ATOM 666 CG2 ILE A 42 9.999 -1.821 -2.157 1.00 0.00 C ATOM 667 CD1 ILE A 42 10.439 1.256 -1.225 1.00 0.00 C ATOM 0 H ILE A 42 12.879 0.444 -3.709 1.00 0.00 H new ATOM 0 HA ILE A 42 12.834 -1.952 -2.157 1.00 0.00 H new ATOM 0 HB ILE A 42 10.683 -0.145 -3.323 1.00 0.00 H new ATOM 0 HG12 ILE A 42 11.311 -0.539 -0.394 1.00 0.00 H new ATOM 0 HG13 ILE A 42 12.426 0.414 -1.353 1.00 0.00 H new ATOM 0 HG21 ILE A 42 9.099 -1.311 -1.814 1.00 0.00 H new ATOM 0 HG22 ILE A 42 9.762 -2.427 -3.031 1.00 0.00 H new ATOM 0 HG23 ILE A 42 10.377 -2.463 -1.362 1.00 0.00 H new ATOM 0 HD11 ILE A 42 10.677 1.860 -0.349 1.00 0.00 H new ATOM 0 HD12 ILE A 42 10.545 1.863 -2.124 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.413 0.896 -1.150 1.00 0.00 H new ATOM 679 N VAL A 43 12.046 -2.291 -5.286 1.00 0.00 N ATOM 680 CA VAL A 43 11.696 -3.309 -6.314 1.00 0.00 C ATOM 681 C VAL A 43 12.851 -4.302 -6.462 1.00 0.00 C ATOM 682 O VAL A 43 12.662 -5.433 -6.865 1.00 0.00 O ATOM 683 CB VAL A 43 11.446 -2.615 -7.655 1.00 0.00 C ATOM 684 CG1 VAL A 43 11.035 -3.654 -8.699 1.00 0.00 C ATOM 685 CG2 VAL A 43 10.325 -1.586 -7.493 1.00 0.00 C ATOM 0 H VAL A 43 12.349 -1.389 -5.654 1.00 0.00 H new ATOM 0 HA VAL A 43 10.796 -3.841 -6.007 1.00 0.00 H new ATOM 0 HB VAL A 43 12.358 -2.114 -7.981 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.857 -3.160 -9.654 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.832 -4.389 -8.814 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.123 -4.155 -8.374 1.00 0.00 H new ATOM 0 HG21 VAL A 43 10.145 -1.090 -8.447 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.414 -2.089 -7.168 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.616 -0.845 -6.748 1.00 0.00 H new ATOM 695 N THR A 44 14.045 -3.888 -6.140 1.00 0.00 N ATOM 696 CA THR A 44 15.211 -4.808 -6.263 1.00 0.00 C ATOM 697 C THR A 44 15.403 -5.569 -4.949 1.00 0.00 C ATOM 698 O THR A 44 15.951 -6.653 -4.923 1.00 0.00 O ATOM 699 CB THR A 44 16.470 -3.994 -6.569 1.00 0.00 C ATOM 700 OG1 THR A 44 16.152 -2.961 -7.491 1.00 0.00 O ATOM 701 CG2 THR A 44 17.537 -4.909 -7.175 1.00 0.00 C ATOM 0 H THR A 44 14.264 -2.953 -5.797 1.00 0.00 H new ATOM 0 HA THR A 44 15.030 -5.518 -7.070 1.00 0.00 H new ATOM 0 HB THR A 44 16.851 -3.555 -5.647 1.00 0.00 H new ATOM 0 HG1 THR A 44 16.957 -2.438 -7.687 1.00 0.00 H new ATOM 0 HG21 THR A 44 18.433 -4.328 -7.393 1.00 0.00 H new ATOM 0 HG22 THR A 44 17.781 -5.702 -6.468 1.00 0.00 H new ATOM 0 HG23 THR A 44 17.157 -5.350 -8.097 1.00 0.00 H new ATOM 709 N LYS A 45 14.956 -5.010 -3.857 1.00 0.00 N ATOM 710 CA LYS A 45 15.115 -5.702 -2.547 1.00 0.00 C ATOM 711 C LYS A 45 13.895 -6.589 -2.284 1.00 0.00 C ATOM 712 O LYS A 45 13.975 -7.579 -1.587 1.00 0.00 O ATOM 713 CB LYS A 45 15.238 -4.661 -1.432 1.00 0.00 C ATOM 714 CG LYS A 45 13.881 -3.993 -1.203 1.00 0.00 C ATOM 715 CD LYS A 45 14.065 -2.743 -0.340 1.00 0.00 C ATOM 716 CE LYS A 45 14.442 -3.157 1.083 1.00 0.00 C ATOM 717 NZ LYS A 45 13.641 -2.364 2.058 1.00 0.00 N ATOM 0 H LYS A 45 14.488 -4.105 -3.816 1.00 0.00 H new ATOM 0 HA LYS A 45 16.013 -6.319 -2.570 1.00 0.00 H new ATOM 0 HB2 LYS A 45 15.581 -5.136 -0.513 1.00 0.00 H new ATOM 0 HB3 LYS A 45 15.983 -3.912 -1.700 1.00 0.00 H new ATOM 0 HG2 LYS A 45 13.430 -3.725 -2.158 1.00 0.00 H new ATOM 0 HG3 LYS A 45 13.200 -4.689 -0.713 1.00 0.00 H new ATOM 0 HD2 LYS A 45 14.843 -2.107 -0.763 1.00 0.00 H new ATOM 0 HD3 LYS A 45 13.146 -2.158 -0.328 1.00 0.00 H new ATOM 0 HE2 LYS A 45 14.257 -4.222 1.225 1.00 0.00 H new ATOM 0 HE3 LYS A 45 15.506 -2.993 1.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 13.896 -2.644 3.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.839 -1.351 1.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 12.628 -2.542 1.902 1.00 0.00 H new ATOM 731 N GLU A 46 12.765 -6.240 -2.837 1.00 0.00 N ATOM 732 CA GLU A 46 11.543 -7.063 -2.618 1.00 0.00 C ATOM 733 C GLU A 46 11.047 -7.605 -3.958 1.00 0.00 C ATOM 734 O GLU A 46 10.409 -8.638 -4.020 1.00 0.00 O ATOM 735 CB GLU A 46 10.452 -6.199 -1.981 1.00 0.00 C ATOM 736 CG GLU A 46 10.935 -5.686 -0.624 1.00 0.00 C ATOM 737 CD GLU A 46 9.961 -6.134 0.468 1.00 0.00 C ATOM 738 OE1 GLU A 46 9.274 -7.118 0.253 1.00 0.00 O ATOM 739 OE2 GLU A 46 9.920 -5.486 1.501 1.00 0.00 O ATOM 0 H GLU A 46 12.636 -5.421 -3.431 1.00 0.00 H new ATOM 0 HA GLU A 46 11.780 -7.895 -1.955 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.210 -5.360 -2.634 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.538 -6.781 -1.858 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.934 -6.068 -0.414 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.006 -4.598 -0.639 1.00 0.00 H new ATOM 746 N ARG A 47 11.340 -6.915 -5.030 1.00 0.00 N ATOM 747 CA ARG A 47 10.893 -7.375 -6.378 1.00 0.00 C ATOM 748 C ARG A 47 9.482 -7.966 -6.288 1.00 0.00 C ATOM 749 O ARG A 47 9.306 -9.163 -6.390 1.00 0.00 O ATOM 750 CB ARG A 47 11.860 -8.437 -6.911 1.00 0.00 C ATOM 751 CG ARG A 47 12.264 -9.387 -5.780 1.00 0.00 C ATOM 752 CD ARG A 47 13.234 -10.438 -6.322 1.00 0.00 C ATOM 753 NE ARG A 47 12.475 -11.659 -6.716 1.00 0.00 N ATOM 754 CZ ARG A 47 13.098 -12.683 -7.233 1.00 0.00 C ATOM 755 NH1 ARG A 47 14.393 -12.644 -7.407 1.00 0.00 N ATOM 756 NH2 ARG A 47 12.429 -13.748 -7.576 1.00 0.00 N ATOM 0 H ARG A 47 11.874 -6.046 -5.029 1.00 0.00 H new ATOM 0 HA ARG A 47 10.882 -6.522 -7.057 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.389 -8.998 -7.718 1.00 0.00 H new ATOM 0 HB3 ARG A 47 12.745 -7.958 -7.330 1.00 0.00 H new ATOM 0 HG2 ARG A 47 12.732 -8.828 -4.970 1.00 0.00 H new ATOM 0 HG3 ARG A 47 11.381 -9.871 -5.364 1.00 0.00 H new ATOM 0 HD2 ARG A 47 13.775 -10.040 -7.181 1.00 0.00 H new ATOM 0 HD3 ARG A 47 13.977 -10.687 -5.565 1.00 0.00 H new ATOM 0 HE ARG A 47 11.465 -11.694 -6.581 1.00 0.00 H new ATOM 0 HH11 ARG A 47 14.919 -11.812 -7.139 1.00 0.00 H new ATOM 0 HH12 ARG A 47 14.878 -13.445 -7.811 1.00 0.00 H new ATOM 0 HH21 ARG A 47 11.419 -13.781 -7.440 1.00 0.00 H new ATOM 0 HH22 ARG A 47 12.916 -14.548 -7.980 1.00 0.00 H new ATOM 770 N PRO A 48 8.518 -7.101 -6.100 1.00 0.00 N ATOM 771 CA PRO A 48 7.104 -7.499 -5.992 1.00 0.00 C ATOM 772 C PRO A 48 6.531 -7.808 -7.377 1.00 0.00 C ATOM 773 O PRO A 48 7.246 -7.866 -8.357 1.00 0.00 O ATOM 774 CB PRO A 48 6.430 -6.267 -5.382 1.00 0.00 C ATOM 775 CG PRO A 48 7.353 -5.065 -5.695 1.00 0.00 C ATOM 776 CD PRO A 48 8.751 -5.646 -5.978 1.00 0.00 C ATOM 0 HA PRO A 48 6.954 -8.398 -5.395 1.00 0.00 H new ATOM 0 HB2 PRO A 48 5.438 -6.116 -5.808 1.00 0.00 H new ATOM 0 HB3 PRO A 48 6.300 -6.388 -4.306 1.00 0.00 H new ATOM 0 HG2 PRO A 48 6.984 -4.507 -6.555 1.00 0.00 H new ATOM 0 HG3 PRO A 48 7.384 -4.371 -4.855 1.00 0.00 H new ATOM 0 HD2 PRO A 48 9.177 -5.232 -6.892 1.00 0.00 H new ATOM 0 HD3 PRO A 48 9.448 -5.420 -5.171 1.00 0.00 H new ATOM 784 N ASP A 49 5.244 -8.011 -7.467 1.00 0.00 N ATOM 785 CA ASP A 49 4.630 -8.319 -8.789 1.00 0.00 C ATOM 786 C ASP A 49 3.635 -7.217 -9.161 1.00 0.00 C ATOM 787 O ASP A 49 3.124 -7.177 -10.262 1.00 0.00 O ATOM 788 CB ASP A 49 3.899 -9.661 -8.711 1.00 0.00 C ATOM 789 CG ASP A 49 4.914 -10.802 -8.788 1.00 0.00 C ATOM 790 OD1 ASP A 49 5.283 -11.168 -9.892 1.00 0.00 O ATOM 791 OD2 ASP A 49 5.307 -11.291 -7.741 1.00 0.00 O ATOM 0 H ASP A 49 4.593 -7.977 -6.683 1.00 0.00 H new ATOM 0 HA ASP A 49 5.411 -8.373 -9.548 1.00 0.00 H new ATOM 0 HB2 ASP A 49 3.334 -9.725 -7.781 1.00 0.00 H new ATOM 0 HB3 ASP A 49 3.181 -9.744 -9.527 1.00 0.00 H new ATOM 796 N LEU A 50 3.357 -6.323 -8.252 1.00 0.00 N ATOM 797 CA LEU A 50 2.394 -5.227 -8.557 1.00 0.00 C ATOM 798 C LEU A 50 2.996 -3.885 -8.136 1.00 0.00 C ATOM 799 O LEU A 50 3.263 -3.650 -6.974 1.00 0.00 O ATOM 800 CB LEU A 50 1.092 -5.464 -7.792 1.00 0.00 C ATOM 801 CG LEU A 50 -0.011 -4.580 -8.375 1.00 0.00 C ATOM 802 CD1 LEU A 50 -0.661 -5.290 -9.564 1.00 0.00 C ATOM 803 CD2 LEU A 50 -1.070 -4.312 -7.302 1.00 0.00 C ATOM 0 H LEU A 50 3.754 -6.304 -7.313 1.00 0.00 H new ATOM 0 HA LEU A 50 2.189 -5.213 -9.627 1.00 0.00 H new ATOM 0 HB2 LEU A 50 0.805 -6.513 -7.858 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.233 -5.238 -6.735 1.00 0.00 H new ATOM 0 HG LEU A 50 0.419 -3.635 -8.707 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.447 -4.659 -9.979 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.092 -5.482 -10.329 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.091 -6.235 -9.233 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.857 -3.682 -7.717 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.499 -5.257 -6.970 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.609 -3.806 -6.454 1.00 0.00 H new ATOM 815 N VAL A 51 3.211 -3.001 -9.072 1.00 0.00 N ATOM 816 CA VAL A 51 3.794 -1.674 -8.725 1.00 0.00 C ATOM 817 C VAL A 51 2.833 -0.567 -9.161 1.00 0.00 C ATOM 818 O VAL A 51 1.989 -0.764 -10.014 1.00 0.00 O ATOM 819 CB VAL A 51 5.133 -1.500 -9.444 1.00 0.00 C ATOM 820 CG1 VAL A 51 5.939 -0.395 -8.760 1.00 0.00 C ATOM 821 CG2 VAL A 51 5.916 -2.814 -9.384 1.00 0.00 C ATOM 0 H VAL A 51 3.008 -3.140 -10.062 1.00 0.00 H new ATOM 0 HA VAL A 51 3.951 -1.616 -7.648 1.00 0.00 H new ATOM 0 HB VAL A 51 4.955 -1.229 -10.485 1.00 0.00 H new ATOM 0 HG11 VAL A 51 6.893 -0.271 -9.272 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.381 0.540 -8.800 1.00 0.00 H new ATOM 0 HG13 VAL A 51 6.118 -0.666 -7.720 1.00 0.00 H new ATOM 0 HG21 VAL A 51 6.871 -2.692 -9.896 1.00 0.00 H new ATOM 0 HG22 VAL A 51 6.094 -3.084 -8.343 1.00 0.00 H new ATOM 0 HG23 VAL A 51 5.342 -3.602 -9.870 1.00 0.00 H new ATOM 831 N LEU A 52 2.952 0.597 -8.584 1.00 0.00 N ATOM 832 CA LEU A 52 2.044 1.714 -8.968 1.00 0.00 C ATOM 833 C LEU A 52 2.858 2.998 -9.141 1.00 0.00 C ATOM 834 O LEU A 52 3.437 3.508 -8.203 1.00 0.00 O ATOM 835 CB LEU A 52 0.996 1.919 -7.871 1.00 0.00 C ATOM 836 CG LEU A 52 0.276 0.597 -7.600 1.00 0.00 C ATOM 837 CD1 LEU A 52 0.556 0.151 -6.163 1.00 0.00 C ATOM 838 CD2 LEU A 52 -1.230 0.789 -7.788 1.00 0.00 C ATOM 0 H LEU A 52 3.638 0.823 -7.864 1.00 0.00 H new ATOM 0 HA LEU A 52 1.546 1.471 -9.907 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.474 2.279 -6.960 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.278 2.680 -8.177 1.00 0.00 H new ATOM 0 HG LEU A 52 0.636 -0.162 -8.295 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.044 -0.791 -5.968 1.00 0.00 H new ATOM 0 HD12 LEU A 52 1.629 0.016 -6.027 1.00 0.00 H new ATOM 0 HD13 LEU A 52 0.195 0.911 -5.469 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.744 -0.153 -7.595 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.590 1.548 -7.093 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.431 1.109 -8.810 1.00 0.00 H new ATOM 850 N LEU A 53 2.904 3.524 -10.335 1.00 0.00 N ATOM 851 CA LEU A 53 3.680 4.775 -10.567 1.00 0.00 C ATOM 852 C LEU A 53 2.719 5.962 -10.647 1.00 0.00 C ATOM 853 O LEU A 53 1.777 5.960 -11.415 1.00 0.00 O ATOM 854 CB LEU A 53 4.460 4.660 -11.880 1.00 0.00 C ATOM 855 CG LEU A 53 5.243 3.344 -11.908 1.00 0.00 C ATOM 856 CD1 LEU A 53 5.936 3.124 -10.560 1.00 0.00 C ATOM 857 CD2 LEU A 53 4.283 2.183 -12.181 1.00 0.00 C ATOM 0 H LEU A 53 2.439 3.142 -11.158 1.00 0.00 H new ATOM 0 HA LEU A 53 4.378 4.926 -9.744 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.774 4.703 -12.726 1.00 0.00 H new ATOM 0 HB3 LEU A 53 5.144 5.502 -11.982 1.00 0.00 H new ATOM 0 HG LEU A 53 5.994 3.391 -12.697 1.00 0.00 H new ATOM 0 HD11 LEU A 53 6.492 2.187 -10.585 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.623 3.948 -10.365 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.187 3.081 -9.769 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.841 1.247 -12.201 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.530 2.140 -11.394 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.794 2.334 -13.143 1.00 0.00 H new ATOM 869 N ASP A 54 2.948 6.977 -9.860 1.00 0.00 N ATOM 870 CA ASP A 54 2.047 8.163 -9.892 1.00 0.00 C ATOM 871 C ASP A 54 2.759 9.326 -10.588 1.00 0.00 C ATOM 872 O ASP A 54 3.655 9.935 -10.039 1.00 0.00 O ATOM 873 CB ASP A 54 1.687 8.569 -8.461 1.00 0.00 C ATOM 874 CG ASP A 54 0.447 9.465 -8.480 1.00 0.00 C ATOM 875 OD1 ASP A 54 0.001 9.803 -9.565 1.00 0.00 O ATOM 876 OD2 ASP A 54 -0.035 9.798 -7.410 1.00 0.00 O ATOM 0 H ASP A 54 3.720 7.036 -9.196 1.00 0.00 H new ATOM 0 HA ASP A 54 1.138 7.914 -10.439 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.498 7.682 -7.857 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.522 9.096 -8.000 1.00 0.00 H new ATOM 881 N MET A 55 2.365 9.638 -11.793 1.00 0.00 N ATOM 882 CA MET A 55 3.020 10.761 -12.521 1.00 0.00 C ATOM 883 C MET A 55 2.848 12.055 -11.723 1.00 0.00 C ATOM 884 O MET A 55 3.515 13.041 -11.968 1.00 0.00 O ATOM 885 CB MET A 55 2.373 10.922 -13.898 1.00 0.00 C ATOM 886 CG MET A 55 2.444 9.594 -14.654 1.00 0.00 C ATOM 887 SD MET A 55 4.168 9.232 -15.076 1.00 0.00 S ATOM 888 CE MET A 55 4.136 7.471 -14.660 1.00 0.00 C ATOM 0 H MET A 55 1.619 9.165 -12.303 1.00 0.00 H new ATOM 0 HA MET A 55 4.082 10.546 -12.641 1.00 0.00 H new ATOM 0 HB2 MET A 55 1.335 11.236 -13.789 1.00 0.00 H new ATOM 0 HB3 MET A 55 2.884 11.702 -14.463 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.032 8.792 -14.042 1.00 0.00 H new ATOM 0 HG3 MET A 55 1.840 9.646 -15.560 1.00 0.00 H new ATOM 0 HE1 MET A 55 5.144 7.063 -14.728 1.00 0.00 H new ATOM 0 HE2 MET A 55 3.760 7.344 -13.645 1.00 0.00 H new ATOM 0 HE3 MET A 55 3.484 6.944 -15.357 1.00 0.00 H new ATOM 898 N LYS A 56 1.959 12.059 -10.768 1.00 0.00 N ATOM 899 CA LYS A 56 1.744 13.290 -9.955 1.00 0.00 C ATOM 900 C LYS A 56 3.082 13.770 -9.392 1.00 0.00 C ATOM 901 O LYS A 56 3.336 14.955 -9.302 1.00 0.00 O ATOM 902 CB LYS A 56 0.788 12.977 -8.801 1.00 0.00 C ATOM 903 CG LYS A 56 -0.653 12.986 -9.315 1.00 0.00 C ATOM 904 CD LYS A 56 -0.958 14.340 -9.960 1.00 0.00 C ATOM 905 CE LYS A 56 -0.940 14.197 -11.482 1.00 0.00 C ATOM 906 NZ LYS A 56 -0.894 15.548 -12.108 1.00 0.00 N ATOM 0 H LYS A 56 1.372 11.264 -10.515 1.00 0.00 H new ATOM 0 HA LYS A 56 1.314 14.070 -10.583 1.00 0.00 H new ATOM 0 HB2 LYS A 56 1.026 12.004 -8.371 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.907 13.714 -8.007 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.796 12.185 -10.041 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -1.344 12.799 -8.493 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -1.932 14.701 -9.630 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.221 15.079 -9.645 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -0.075 13.611 -11.793 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.827 13.659 -11.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -0.882 15.451 -13.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.733 16.092 -11.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -0.035 16.046 -11.797 1.00 0.00 H new ATOM 920 N ILE A 57 3.939 12.858 -9.013 1.00 0.00 N ATOM 921 CA ILE A 57 5.265 13.256 -8.454 1.00 0.00 C ATOM 922 C ILE A 57 5.835 14.428 -9.261 1.00 0.00 C ATOM 923 O ILE A 57 6.363 14.234 -10.338 1.00 0.00 O ATOM 924 CB ILE A 57 6.225 12.067 -8.538 1.00 0.00 C ATOM 925 CG1 ILE A 57 5.627 10.876 -7.785 1.00 0.00 C ATOM 926 CG2 ILE A 57 7.565 12.447 -7.906 1.00 0.00 C ATOM 927 CD1 ILE A 57 6.625 9.717 -7.786 1.00 0.00 C ATOM 0 H ILE A 57 3.777 11.852 -9.067 1.00 0.00 H new ATOM 0 HA ILE A 57 5.144 13.559 -7.414 1.00 0.00 H new ATOM 0 HB ILE A 57 6.379 11.798 -9.583 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.388 11.163 -6.761 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.694 10.566 -8.255 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.249 11.600 -7.966 1.00 0.00 H new ATOM 0 HG22 ILE A 57 7.991 13.296 -8.440 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.411 12.716 -6.861 1.00 0.00 H new ATOM 0 HD11 ILE A 57 6.199 8.869 -7.250 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.842 9.425 -8.813 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.547 10.030 -7.296 1.00 0.00 H new ATOM 939 N PRO A 58 5.709 15.614 -8.717 1.00 0.00 N ATOM 940 CA PRO A 58 6.201 16.841 -9.369 1.00 0.00 C ATOM 941 C PRO A 58 7.715 16.981 -9.177 1.00 0.00 C ATOM 942 O PRO A 58 8.402 17.552 -10.000 1.00 0.00 O ATOM 943 CB PRO A 58 5.455 17.958 -8.635 1.00 0.00 C ATOM 944 CG PRO A 58 5.033 17.377 -7.265 1.00 0.00 C ATOM 945 CD PRO A 58 5.065 15.844 -7.407 1.00 0.00 C ATOM 0 HA PRO A 58 6.030 16.853 -10.445 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.094 18.832 -8.506 1.00 0.00 H new ATOM 0 HB3 PRO A 58 4.584 18.282 -9.204 1.00 0.00 H new ATOM 0 HG2 PRO A 58 5.712 17.707 -6.479 1.00 0.00 H new ATOM 0 HG3 PRO A 58 4.036 17.720 -6.990 1.00 0.00 H new ATOM 0 HD2 PRO A 58 5.631 15.381 -6.598 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.061 15.420 -7.377 1.00 0.00 H new ATOM 953 N GLY A 59 8.236 16.468 -8.098 1.00 0.00 N ATOM 954 CA GLY A 59 9.703 16.578 -7.854 1.00 0.00 C ATOM 955 C GLY A 59 10.435 15.447 -8.578 1.00 0.00 C ATOM 956 O GLY A 59 11.648 15.379 -8.576 1.00 0.00 O ATOM 0 H GLY A 59 7.711 15.977 -7.374 1.00 0.00 H new ATOM 0 HA2 GLY A 59 10.068 17.543 -8.205 1.00 0.00 H new ATOM 0 HA3 GLY A 59 9.908 16.530 -6.784 1.00 0.00 H new ATOM 960 N MET A 60 9.711 14.556 -9.198 1.00 0.00 N ATOM 961 CA MET A 60 10.373 13.433 -9.920 1.00 0.00 C ATOM 962 C MET A 60 9.431 12.888 -10.996 1.00 0.00 C ATOM 963 O MET A 60 8.238 12.782 -10.795 1.00 0.00 O ATOM 964 CB MET A 60 10.709 12.318 -8.926 1.00 0.00 C ATOM 965 CG MET A 60 11.308 11.130 -9.677 1.00 0.00 C ATOM 966 SD MET A 60 10.815 9.591 -8.864 1.00 0.00 S ATOM 967 CE MET A 60 9.065 9.643 -9.322 1.00 0.00 C ATOM 0 H MET A 60 8.692 14.557 -9.236 1.00 0.00 H new ATOM 0 HA MET A 60 11.288 13.793 -10.389 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.414 12.683 -8.179 1.00 0.00 H new ATOM 0 HB3 MET A 60 9.810 12.009 -8.392 1.00 0.00 H new ATOM 0 HG2 MET A 60 10.968 11.132 -10.713 1.00 0.00 H new ATOM 0 HG3 MET A 60 12.395 11.210 -9.699 1.00 0.00 H new ATOM 0 HE1 MET A 60 8.480 9.087 -8.589 1.00 0.00 H new ATOM 0 HE2 MET A 60 8.726 10.679 -9.346 1.00 0.00 H new ATOM 0 HE3 MET A 60 8.933 9.195 -10.307 1.00 0.00 H new ATOM 977 N ASP A 61 9.960 12.540 -12.137 1.00 0.00 N ATOM 978 CA ASP A 61 9.098 11.999 -13.225 1.00 0.00 C ATOM 979 C ASP A 61 9.008 10.478 -13.094 1.00 0.00 C ATOM 980 O ASP A 61 10.007 9.791 -13.026 1.00 0.00 O ATOM 981 CB ASP A 61 9.704 12.360 -14.583 1.00 0.00 C ATOM 982 CG ASP A 61 10.000 13.860 -14.629 1.00 0.00 C ATOM 983 OD1 ASP A 61 9.063 14.625 -14.788 1.00 0.00 O ATOM 984 OD2 ASP A 61 11.159 14.219 -14.504 1.00 0.00 O ATOM 0 H ASP A 61 10.952 12.607 -12.363 1.00 0.00 H new ATOM 0 HA ASP A 61 8.100 12.430 -13.147 1.00 0.00 H new ATOM 0 HB2 ASP A 61 10.620 11.793 -14.746 1.00 0.00 H new ATOM 0 HB3 ASP A 61 9.015 12.090 -15.384 1.00 0.00 H new ATOM 989 N GLY A 62 7.817 9.945 -13.056 1.00 0.00 N ATOM 990 CA GLY A 62 7.666 8.468 -12.928 1.00 0.00 C ATOM 991 C GLY A 62 7.800 7.817 -14.307 1.00 0.00 C ATOM 992 O GLY A 62 7.551 6.640 -14.474 1.00 0.00 O ATOM 0 H GLY A 62 6.943 10.468 -13.108 1.00 0.00 H new ATOM 0 HA2 GLY A 62 8.424 8.072 -12.252 1.00 0.00 H new ATOM 0 HA3 GLY A 62 6.695 8.228 -12.494 1.00 0.00 H new ATOM 996 N ILE A 63 8.193 8.573 -15.296 1.00 0.00 N ATOM 997 CA ILE A 63 8.341 7.995 -16.661 1.00 0.00 C ATOM 998 C ILE A 63 9.551 7.059 -16.688 1.00 0.00 C ATOM 999 O ILE A 63 9.492 5.968 -17.221 1.00 0.00 O ATOM 1000 CB ILE A 63 8.547 9.123 -17.673 1.00 0.00 C ATOM 1001 CG1 ILE A 63 7.232 9.886 -17.859 1.00 0.00 C ATOM 1002 CG2 ILE A 63 8.985 8.533 -19.014 1.00 0.00 C ATOM 1003 CD1 ILE A 63 6.106 8.895 -18.164 1.00 0.00 C ATOM 0 H ILE A 63 8.418 9.565 -15.217 1.00 0.00 H new ATOM 0 HA ILE A 63 7.442 7.436 -16.919 1.00 0.00 H new ATOM 0 HB ILE A 63 9.316 9.803 -17.307 1.00 0.00 H new ATOM 0 HG12 ILE A 63 6.998 10.453 -16.958 1.00 0.00 H new ATOM 0 HG13 ILE A 63 7.328 10.605 -18.672 1.00 0.00 H new ATOM 0 HG21 ILE A 63 9.132 9.337 -19.735 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.920 7.988 -18.884 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.216 7.853 -19.381 1.00 0.00 H new ATOM 0 HD11 ILE A 63 5.170 9.437 -18.296 1.00 0.00 H new ATOM 0 HD12 ILE A 63 6.340 8.348 -19.077 1.00 0.00 H new ATOM 0 HD13 ILE A 63 6.005 8.193 -17.336 1.00 0.00 H new ATOM 1015 N GLU A 64 10.648 7.475 -16.117 1.00 0.00 N ATOM 1016 CA GLU A 64 11.860 6.607 -16.111 1.00 0.00 C ATOM 1017 C GLU A 64 11.643 5.438 -15.149 1.00 0.00 C ATOM 1018 O GLU A 64 12.388 4.477 -15.146 1.00 0.00 O ATOM 1019 CB GLU A 64 13.071 7.425 -15.655 1.00 0.00 C ATOM 1020 CG GLU A 64 13.185 8.689 -16.510 1.00 0.00 C ATOM 1021 CD GLU A 64 14.434 8.599 -17.390 1.00 0.00 C ATOM 1022 OE1 GLU A 64 15.459 8.169 -16.887 1.00 0.00 O ATOM 1023 OE2 GLU A 64 14.344 8.964 -18.550 1.00 0.00 O ATOM 0 H GLU A 64 10.758 8.378 -15.655 1.00 0.00 H new ATOM 0 HA GLU A 64 12.038 6.224 -17.116 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.967 7.693 -14.603 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.980 6.830 -15.744 1.00 0.00 H new ATOM 0 HG2 GLU A 64 12.297 8.802 -17.131 1.00 0.00 H new ATOM 0 HG3 GLU A 64 13.241 9.570 -15.870 1.00 0.00 H new ATOM 1030 N ILE A 65 10.629 5.509 -14.332 1.00 0.00 N ATOM 1031 CA ILE A 65 10.364 4.401 -13.372 1.00 0.00 C ATOM 1032 C ILE A 65 9.799 3.197 -14.126 1.00 0.00 C ATOM 1033 O ILE A 65 10.355 2.117 -14.097 1.00 0.00 O ATOM 1034 CB ILE A 65 9.353 4.866 -12.322 1.00 0.00 C ATOM 1035 CG1 ILE A 65 9.788 6.222 -11.761 1.00 0.00 C ATOM 1036 CG2 ILE A 65 9.288 3.842 -11.188 1.00 0.00 C ATOM 1037 CD1 ILE A 65 11.023 6.037 -10.878 1.00 0.00 C ATOM 0 H ILE A 65 9.972 6.288 -14.288 1.00 0.00 H new ATOM 0 HA ILE A 65 11.294 4.117 -12.880 1.00 0.00 H new ATOM 0 HB ILE A 65 8.369 4.961 -12.782 1.00 0.00 H new ATOM 0 HG12 ILE A 65 10.011 6.910 -12.576 1.00 0.00 H new ATOM 0 HG13 ILE A 65 8.977 6.665 -11.182 1.00 0.00 H new ATOM 0 HG21 ILE A 65 8.568 4.173 -10.440 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.979 2.876 -11.587 1.00 0.00 H new ATOM 0 HG23 ILE A 65 10.271 3.746 -10.728 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.333 7.003 -10.479 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.784 5.364 -10.055 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.834 5.613 -11.470 1.00 0.00 H new ATOM 1049 N LEU A 66 8.698 3.373 -14.803 1.00 0.00 N ATOM 1050 CA LEU A 66 8.098 2.238 -15.559 1.00 0.00 C ATOM 1051 C LEU A 66 9.152 1.628 -16.484 1.00 0.00 C ATOM 1052 O LEU A 66 9.110 0.455 -16.803 1.00 0.00 O ATOM 1053 CB LEU A 66 6.920 2.746 -16.394 1.00 0.00 C ATOM 1054 CG LEU A 66 5.611 2.463 -15.655 1.00 0.00 C ATOM 1055 CD1 LEU A 66 4.454 3.151 -16.383 1.00 0.00 C ATOM 1056 CD2 LEU A 66 5.364 0.954 -15.618 1.00 0.00 C ATOM 0 H LEU A 66 8.188 4.254 -14.865 1.00 0.00 H new ATOM 0 HA LEU A 66 7.747 1.481 -14.858 1.00 0.00 H new ATOM 0 HB2 LEU A 66 7.024 3.816 -16.575 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.913 2.257 -17.368 1.00 0.00 H new ATOM 0 HG LEU A 66 5.678 2.846 -14.637 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.521 2.949 -15.856 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.630 4.226 -16.411 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.386 2.768 -17.401 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.431 0.751 -15.092 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.297 0.571 -16.636 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.188 0.463 -15.100 1.00 0.00 H new ATOM 1068 N LYS A 67 10.099 2.413 -16.919 1.00 0.00 N ATOM 1069 CA LYS A 67 11.155 1.876 -17.824 1.00 0.00 C ATOM 1070 C LYS A 67 12.103 0.979 -17.025 1.00 0.00 C ATOM 1071 O LYS A 67 12.116 -0.226 -17.186 1.00 0.00 O ATOM 1072 CB LYS A 67 11.944 3.038 -18.433 1.00 0.00 C ATOM 1073 CG LYS A 67 11.068 3.775 -19.447 1.00 0.00 C ATOM 1074 CD LYS A 67 11.209 3.114 -20.820 1.00 0.00 C ATOM 1075 CE LYS A 67 11.668 4.153 -21.842 1.00 0.00 C ATOM 1076 NZ LYS A 67 10.508 4.995 -22.252 1.00 0.00 N ATOM 0 H LYS A 67 10.187 3.402 -16.687 1.00 0.00 H new ATOM 0 HA LYS A 67 10.690 1.295 -18.621 1.00 0.00 H new ATOM 0 HB2 LYS A 67 12.266 3.723 -17.649 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.845 2.664 -18.919 1.00 0.00 H new ATOM 0 HG2 LYS A 67 10.026 3.754 -19.127 1.00 0.00 H new ATOM 0 HG3 LYS A 67 11.363 4.823 -19.504 1.00 0.00 H new ATOM 0 HD2 LYS A 67 11.928 2.296 -20.769 1.00 0.00 H new ATOM 0 HD3 LYS A 67 10.256 2.683 -21.127 1.00 0.00 H new ATOM 0 HE2 LYS A 67 12.451 4.778 -21.414 1.00 0.00 H new ATOM 0 HE3 LYS A 67 12.097 3.657 -22.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.821 5.702 -22.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.775 4.392 -22.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.118 5.479 -21.418 1.00 0.00 H new ATOM 1090 N ARG A 68 12.897 1.556 -16.165 1.00 0.00 N ATOM 1091 CA ARG A 68 13.843 0.735 -15.359 1.00 0.00 C ATOM 1092 C ARG A 68 13.112 -0.492 -14.811 1.00 0.00 C ATOM 1093 O ARG A 68 13.710 -1.514 -14.539 1.00 0.00 O ATOM 1094 CB ARG A 68 14.379 1.571 -14.194 1.00 0.00 C ATOM 1095 CG ARG A 68 15.861 1.873 -14.422 1.00 0.00 C ATOM 1096 CD ARG A 68 16.005 3.238 -15.097 1.00 0.00 C ATOM 1097 NE ARG A 68 17.138 3.981 -14.477 1.00 0.00 N ATOM 1098 CZ ARG A 68 17.569 5.091 -15.016 1.00 0.00 C ATOM 1099 NH1 ARG A 68 17.010 5.553 -16.102 1.00 0.00 N ATOM 1100 NH2 ARG A 68 18.561 5.738 -14.468 1.00 0.00 N ATOM 0 H ARG A 68 12.931 2.560 -15.986 1.00 0.00 H new ATOM 0 HA ARG A 68 14.673 0.414 -15.988 1.00 0.00 H new ATOM 0 HB2 ARG A 68 13.816 2.501 -14.110 1.00 0.00 H new ATOM 0 HB3 ARG A 68 14.247 1.033 -13.255 1.00 0.00 H new ATOM 0 HG2 ARG A 68 16.395 1.867 -13.472 1.00 0.00 H new ATOM 0 HG3 ARG A 68 16.309 1.099 -15.044 1.00 0.00 H new ATOM 0 HD2 ARG A 68 16.181 3.111 -16.165 1.00 0.00 H new ATOM 0 HD3 ARG A 68 15.081 3.807 -14.991 1.00 0.00 H new ATOM 0 HE ARG A 68 17.578 3.622 -13.630 1.00 0.00 H new ATOM 0 HH11 ARG A 68 16.235 5.047 -16.532 1.00 0.00 H new ATOM 0 HH12 ARG A 68 17.348 6.419 -16.521 1.00 0.00 H new ATOM 0 HH21 ARG A 68 18.999 5.377 -13.620 1.00 0.00 H new ATOM 0 HH22 ARG A 68 18.899 6.604 -14.887 1.00 0.00 H new ATOM 1114 N MET A 69 11.820 -0.401 -14.648 1.00 0.00 N ATOM 1115 CA MET A 69 11.052 -1.563 -14.118 1.00 0.00 C ATOM 1116 C MET A 69 10.956 -2.645 -15.196 1.00 0.00 C ATOM 1117 O MET A 69 11.222 -3.804 -14.949 1.00 0.00 O ATOM 1118 CB MET A 69 9.646 -1.108 -13.726 1.00 0.00 C ATOM 1119 CG MET A 69 9.742 0.034 -12.713 1.00 0.00 C ATOM 1120 SD MET A 69 9.525 -0.622 -11.040 1.00 0.00 S ATOM 1121 CE MET A 69 7.887 0.080 -10.732 1.00 0.00 C ATOM 0 H MET A 69 11.264 0.427 -14.859 1.00 0.00 H new ATOM 0 HA MET A 69 11.561 -1.966 -13.242 1.00 0.00 H new ATOM 0 HB2 MET A 69 9.099 -0.779 -14.610 1.00 0.00 H new ATOM 0 HB3 MET A 69 9.089 -1.941 -13.298 1.00 0.00 H new ATOM 0 HG2 MET A 69 10.709 0.529 -12.798 1.00 0.00 H new ATOM 0 HG3 MET A 69 8.980 0.785 -12.922 1.00 0.00 H new ATOM 0 HE1 MET A 69 7.814 0.390 -9.690 1.00 0.00 H new ATOM 0 HE2 MET A 69 7.734 0.943 -11.379 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.124 -0.670 -10.941 1.00 0.00 H new ATOM 1131 N LYS A 70 10.577 -2.277 -16.388 1.00 0.00 N ATOM 1132 CA LYS A 70 10.465 -3.286 -17.479 1.00 0.00 C ATOM 1133 C LYS A 70 11.843 -3.884 -17.765 1.00 0.00 C ATOM 1134 O LYS A 70 11.961 -4.965 -18.305 1.00 0.00 O ATOM 1135 CB LYS A 70 9.929 -2.612 -18.744 1.00 0.00 C ATOM 1136 CG LYS A 70 10.794 -1.395 -19.080 1.00 0.00 C ATOM 1137 CD LYS A 70 10.630 -1.044 -20.560 1.00 0.00 C ATOM 1138 CE LYS A 70 9.175 -0.665 -20.838 1.00 0.00 C ATOM 1139 NZ LYS A 70 8.988 -0.455 -22.302 1.00 0.00 N ATOM 0 H LYS A 70 10.340 -1.321 -16.654 1.00 0.00 H new ATOM 0 HA LYS A 70 9.782 -4.078 -17.172 1.00 0.00 H new ATOM 0 HB2 LYS A 70 9.936 -3.317 -19.575 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.894 -2.305 -18.595 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.503 -0.547 -18.460 1.00 0.00 H new ATOM 0 HG3 LYS A 70 11.840 -1.607 -18.860 1.00 0.00 H new ATOM 0 HD2 LYS A 70 11.289 -0.216 -20.823 1.00 0.00 H new ATOM 0 HD3 LYS A 70 10.920 -1.892 -21.180 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.509 -1.452 -20.485 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.914 0.242 -20.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 8.022 -0.731 -22.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 9.138 0.548 -22.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.673 -1.036 -22.826 1.00 0.00 H new ATOM 1153 N VAL A 71 12.888 -3.189 -17.405 1.00 0.00 N ATOM 1154 CA VAL A 71 14.257 -3.719 -17.657 1.00 0.00 C ATOM 1155 C VAL A 71 14.616 -4.742 -16.577 1.00 0.00 C ATOM 1156 O VAL A 71 15.125 -5.807 -16.862 1.00 0.00 O ATOM 1157 CB VAL A 71 15.264 -2.568 -17.623 1.00 0.00 C ATOM 1158 CG1 VAL A 71 16.640 -3.079 -18.053 1.00 0.00 C ATOM 1159 CG2 VAL A 71 14.809 -1.466 -18.582 1.00 0.00 C ATOM 0 H VAL A 71 12.852 -2.278 -16.948 1.00 0.00 H new ATOM 0 HA VAL A 71 14.286 -4.199 -18.635 1.00 0.00 H new ATOM 0 HB VAL A 71 15.325 -2.169 -16.610 1.00 0.00 H new ATOM 0 HG11 VAL A 71 17.357 -2.258 -18.029 1.00 0.00 H new ATOM 0 HG12 VAL A 71 16.965 -3.865 -17.372 1.00 0.00 H new ATOM 0 HG13 VAL A 71 16.580 -3.478 -19.066 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.526 -0.645 -18.559 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.748 -1.866 -19.594 1.00 0.00 H new ATOM 0 HG23 VAL A 71 13.828 -1.100 -18.277 1.00 0.00 H new ATOM 1169 N ILE A 72 14.355 -4.427 -15.337 1.00 0.00 N ATOM 1170 CA ILE A 72 14.682 -5.381 -14.241 1.00 0.00 C ATOM 1171 C ILE A 72 13.646 -6.507 -14.217 1.00 0.00 C ATOM 1172 O ILE A 72 13.843 -7.532 -13.595 1.00 0.00 O ATOM 1173 CB ILE A 72 14.664 -4.644 -12.901 1.00 0.00 C ATOM 1174 CG1 ILE A 72 15.612 -3.446 -12.962 1.00 0.00 C ATOM 1175 CG2 ILE A 72 15.113 -5.592 -11.788 1.00 0.00 C ATOM 1176 CD1 ILE A 72 16.952 -3.896 -13.536 1.00 0.00 C ATOM 0 H ILE A 72 13.929 -3.550 -15.037 1.00 0.00 H new ATOM 0 HA ILE A 72 15.673 -5.803 -14.411 1.00 0.00 H new ATOM 0 HB ILE A 72 13.652 -4.296 -12.695 1.00 0.00 H new ATOM 0 HG12 ILE A 72 15.183 -2.659 -13.582 1.00 0.00 H new ATOM 0 HG13 ILE A 72 15.752 -3.027 -11.966 1.00 0.00 H new ATOM 0 HG21 ILE A 72 15.100 -5.065 -10.834 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.436 -6.445 -11.741 1.00 0.00 H new ATOM 0 HG23 ILE A 72 16.124 -5.943 -11.995 1.00 0.00 H new ATOM 0 HD11 ILE A 72 17.632 -3.046 -13.582 1.00 0.00 H new ATOM 0 HD12 ILE A 72 17.380 -4.669 -12.898 1.00 0.00 H new ATOM 0 HD13 ILE A 72 16.802 -4.295 -14.539 1.00 0.00 H new ATOM 1188 N ASP A 73 12.543 -6.326 -14.891 1.00 0.00 N ATOM 1189 CA ASP A 73 11.496 -7.386 -14.905 1.00 0.00 C ATOM 1190 C ASP A 73 10.434 -7.041 -15.949 1.00 0.00 C ATOM 1191 O ASP A 73 9.759 -6.035 -15.854 1.00 0.00 O ATOM 1192 CB ASP A 73 10.844 -7.478 -13.524 1.00 0.00 C ATOM 1193 CG ASP A 73 11.303 -8.758 -12.824 1.00 0.00 C ATOM 1194 OD1 ASP A 73 11.685 -9.685 -13.520 1.00 0.00 O ATOM 1195 OD2 ASP A 73 11.266 -8.790 -11.605 1.00 0.00 O ATOM 0 H ASP A 73 12.322 -5.490 -15.432 1.00 0.00 H new ATOM 0 HA ASP A 73 11.953 -8.344 -15.155 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.113 -6.608 -12.925 1.00 0.00 H new ATOM 0 HB3 ASP A 73 9.758 -7.475 -13.622 1.00 0.00 H new ATOM 1200 N GLU A 74 10.278 -7.868 -16.947 1.00 0.00 N ATOM 1201 CA GLU A 74 9.259 -7.586 -17.997 1.00 0.00 C ATOM 1202 C GLU A 74 7.926 -8.224 -17.597 1.00 0.00 C ATOM 1203 O GLU A 74 6.880 -7.862 -18.099 1.00 0.00 O ATOM 1204 CB GLU A 74 9.725 -8.173 -19.330 1.00 0.00 C ATOM 1205 CG GLU A 74 9.815 -9.696 -19.215 1.00 0.00 C ATOM 1206 CD GLU A 74 9.092 -10.342 -20.399 1.00 0.00 C ATOM 1207 OE1 GLU A 74 7.936 -10.016 -20.612 1.00 0.00 O ATOM 1208 OE2 GLU A 74 9.707 -11.152 -21.073 1.00 0.00 O ATOM 0 H GLU A 74 10.812 -8.727 -17.080 1.00 0.00 H new ATOM 0 HA GLU A 74 9.131 -6.508 -18.100 1.00 0.00 H new ATOM 0 HB2 GLU A 74 9.030 -7.898 -20.123 1.00 0.00 H new ATOM 0 HB3 GLU A 74 10.697 -7.760 -19.601 1.00 0.00 H new ATOM 0 HG2 GLU A 74 10.859 -10.009 -19.198 1.00 0.00 H new ATOM 0 HG3 GLU A 74 9.368 -10.027 -18.278 1.00 0.00 H new ATOM 1215 N ASN A 75 7.955 -9.169 -16.699 1.00 0.00 N ATOM 1216 CA ASN A 75 6.689 -9.828 -16.269 1.00 0.00 C ATOM 1217 C ASN A 75 6.245 -9.250 -14.924 1.00 0.00 C ATOM 1218 O ASN A 75 5.928 -9.974 -14.001 1.00 0.00 O ATOM 1219 CB ASN A 75 6.920 -11.334 -16.126 1.00 0.00 C ATOM 1220 CG ASN A 75 7.458 -11.895 -17.444 1.00 0.00 C ATOM 1221 OD1 ASN A 75 8.654 -12.002 -17.630 1.00 0.00 O ATOM 1222 ND2 ASN A 75 6.618 -12.262 -18.373 1.00 0.00 N ATOM 0 H ASN A 75 8.800 -9.514 -16.244 1.00 0.00 H new ATOM 0 HA ASN A 75 5.915 -9.649 -17.015 1.00 0.00 H new ATOM 0 HB2 ASN A 75 7.627 -11.529 -15.320 1.00 0.00 H new ATOM 0 HB3 ASN A 75 5.988 -11.832 -15.860 1.00 0.00 H new ATOM 0 HD21 ASN A 75 6.966 -12.639 -19.255 1.00 0.00 H new ATOM 0 HD22 ASN A 75 5.614 -12.172 -18.217 1.00 0.00 H new ATOM 1229 N ILE A 76 6.218 -7.951 -14.806 1.00 0.00 N ATOM 1230 CA ILE A 76 5.793 -7.328 -13.520 1.00 0.00 C ATOM 1231 C ILE A 76 4.594 -6.411 -13.768 1.00 0.00 C ATOM 1232 O ILE A 76 4.685 -5.434 -14.483 1.00 0.00 O ATOM 1233 CB ILE A 76 6.950 -6.510 -12.945 1.00 0.00 C ATOM 1234 CG1 ILE A 76 6.455 -5.706 -11.740 1.00 0.00 C ATOM 1235 CG2 ILE A 76 7.478 -5.549 -14.013 1.00 0.00 C ATOM 1236 CD1 ILE A 76 7.133 -6.223 -10.469 1.00 0.00 C ATOM 0 H ILE A 76 6.472 -7.294 -15.544 1.00 0.00 H new ATOM 0 HA ILE A 76 5.512 -8.109 -12.813 1.00 0.00 H new ATOM 0 HB ILE A 76 7.749 -7.182 -12.633 1.00 0.00 H new ATOM 0 HG12 ILE A 76 6.677 -4.648 -11.879 1.00 0.00 H new ATOM 0 HG13 ILE A 76 5.372 -5.795 -11.650 1.00 0.00 H new ATOM 0 HG21 ILE A 76 8.303 -4.966 -13.602 1.00 0.00 H new ATOM 0 HG22 ILE A 76 7.829 -6.119 -14.873 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.679 -4.877 -14.325 1.00 0.00 H new ATOM 0 HD11 ILE A 76 6.781 -5.651 -9.610 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.888 -7.276 -10.329 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.213 -6.111 -10.562 1.00 0.00 H new ATOM 1248 N ARG A 77 3.468 -6.720 -13.183 1.00 0.00 N ATOM 1249 CA ARG A 77 2.266 -5.863 -13.386 1.00 0.00 C ATOM 1250 C ARG A 77 2.609 -4.415 -13.035 1.00 0.00 C ATOM 1251 O ARG A 77 3.170 -4.134 -11.994 1.00 0.00 O ATOM 1252 CB ARG A 77 1.132 -6.353 -12.483 1.00 0.00 C ATOM 1253 CG ARG A 77 0.476 -7.585 -13.110 1.00 0.00 C ATOM 1254 CD ARG A 77 0.218 -8.634 -12.026 1.00 0.00 C ATOM 1255 NE ARG A 77 0.175 -9.988 -12.645 1.00 0.00 N ATOM 1256 CZ ARG A 77 1.283 -10.596 -12.975 1.00 0.00 C ATOM 1257 NH1 ARG A 77 2.436 -10.020 -12.763 1.00 0.00 N ATOM 1258 NH2 ARG A 77 1.238 -11.783 -13.516 1.00 0.00 N ATOM 0 H ARG A 77 3.329 -7.527 -12.575 1.00 0.00 H new ATOM 0 HA ARG A 77 1.950 -5.919 -14.428 1.00 0.00 H new ATOM 0 HB2 ARG A 77 1.520 -6.598 -11.494 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.393 -5.563 -12.348 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -0.461 -7.306 -13.591 1.00 0.00 H new ATOM 0 HG3 ARG A 77 1.121 -7.999 -13.885 1.00 0.00 H new ATOM 0 HD2 ARG A 77 1.003 -8.593 -11.271 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -0.724 -8.424 -11.519 1.00 0.00 H new ATOM 0 HE ARG A 77 -0.723 -10.442 -12.812 1.00 0.00 H new ATOM 0 HH11 ARG A 77 2.473 -9.093 -12.339 1.00 0.00 H new ATOM 0 HH12 ARG A 77 3.300 -10.497 -13.022 1.00 0.00 H new ATOM 0 HH21 ARG A 77 0.338 -12.235 -13.681 1.00 0.00 H new ATOM 0 HH22 ARG A 77 2.102 -12.259 -13.774 1.00 0.00 H new ATOM 1272 N VAL A 78 2.281 -3.491 -13.898 1.00 0.00 N ATOM 1273 CA VAL A 78 2.592 -2.062 -13.613 1.00 0.00 C ATOM 1274 C VAL A 78 1.354 -1.204 -13.878 1.00 0.00 C ATOM 1275 O VAL A 78 0.865 -1.129 -14.988 1.00 0.00 O ATOM 1276 CB VAL A 78 3.737 -1.598 -14.517 1.00 0.00 C ATOM 1277 CG1 VAL A 78 5.076 -1.903 -13.843 1.00 0.00 C ATOM 1278 CG2 VAL A 78 3.661 -2.335 -15.856 1.00 0.00 C ATOM 0 H VAL A 78 1.812 -3.665 -14.787 1.00 0.00 H new ATOM 0 HA VAL A 78 2.887 -1.958 -12.569 1.00 0.00 H new ATOM 0 HB VAL A 78 3.652 -0.525 -14.687 1.00 0.00 H new ATOM 0 HG11 VAL A 78 5.891 -1.573 -14.487 1.00 0.00 H new ATOM 0 HG12 VAL A 78 5.131 -1.378 -12.889 1.00 0.00 H new ATOM 0 HG13 VAL A 78 5.161 -2.976 -13.672 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.476 -2.005 -16.500 1.00 0.00 H new ATOM 0 HG22 VAL A 78 3.745 -3.408 -15.686 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.708 -2.118 -16.337 1.00 0.00 H new ATOM 1288 N ILE A 79 0.845 -0.552 -12.868 1.00 0.00 N ATOM 1289 CA ILE A 79 -0.359 0.304 -13.062 1.00 0.00 C ATOM 1290 C ILE A 79 0.013 1.767 -12.816 1.00 0.00 C ATOM 1291 O ILE A 79 0.817 2.077 -11.961 1.00 0.00 O ATOM 1292 CB ILE A 79 -1.449 -0.120 -12.078 1.00 0.00 C ATOM 1293 CG1 ILE A 79 -1.971 -1.506 -12.462 1.00 0.00 C ATOM 1294 CG2 ILE A 79 -2.599 0.888 -12.125 1.00 0.00 C ATOM 1295 CD1 ILE A 79 -2.698 -2.127 -11.268 1.00 0.00 C ATOM 0 H ILE A 79 1.212 -0.576 -11.916 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.728 0.190 -14.081 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.035 -0.153 -11.070 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -2.648 -1.428 -13.313 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.144 -2.145 -12.770 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.377 0.586 -11.423 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.228 1.876 -11.852 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.013 0.921 -13.133 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.070 -3.114 -11.542 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.008 -2.219 -10.429 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.535 -1.491 -10.981 1.00 0.00 H new ATOM 1307 N ILE A 80 -0.567 2.670 -13.559 1.00 0.00 N ATOM 1308 CA ILE A 80 -0.245 4.114 -13.366 1.00 0.00 C ATOM 1309 C ILE A 80 -1.440 4.820 -12.723 1.00 0.00 C ATOM 1310 O ILE A 80 -2.559 4.349 -12.785 1.00 0.00 O ATOM 1311 CB ILE A 80 0.067 4.774 -14.718 1.00 0.00 C ATOM 1312 CG1 ILE A 80 -0.439 3.895 -15.867 1.00 0.00 C ATOM 1313 CG2 ILE A 80 1.578 4.960 -14.853 1.00 0.00 C ATOM 1314 CD1 ILE A 80 -0.069 4.539 -17.205 1.00 0.00 C ATOM 0 H ILE A 80 -1.249 2.471 -14.291 1.00 0.00 H new ATOM 0 HA ILE A 80 0.628 4.198 -12.719 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.433 5.742 -14.764 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.001 2.899 -15.797 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.520 3.773 -15.797 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.803 5.428 -15.811 1.00 0.00 H new ATOM 0 HG22 ILE A 80 1.940 5.596 -14.045 1.00 0.00 H new ATOM 0 HG23 ILE A 80 2.070 3.989 -14.799 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.429 3.913 -18.022 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.528 5.525 -17.274 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.014 4.638 -17.274 1.00 0.00 H new ATOM 1326 N MET A 81 -1.215 5.947 -12.102 1.00 0.00 N ATOM 1327 CA MET A 81 -2.341 6.677 -11.454 1.00 0.00 C ATOM 1328 C MET A 81 -2.225 8.174 -11.755 1.00 0.00 C ATOM 1329 O MET A 81 -1.575 8.910 -11.039 1.00 0.00 O ATOM 1330 CB MET A 81 -2.288 6.457 -9.940 1.00 0.00 C ATOM 1331 CG MET A 81 -1.750 5.057 -9.644 1.00 0.00 C ATOM 1332 SD MET A 81 -1.875 4.724 -7.870 1.00 0.00 S ATOM 1333 CE MET A 81 -0.407 5.652 -7.361 1.00 0.00 C ATOM 0 H MET A 81 -0.301 6.392 -12.016 1.00 0.00 H new ATOM 0 HA MET A 81 -3.287 6.301 -11.845 1.00 0.00 H new ATOM 0 HB2 MET A 81 -1.650 7.209 -9.475 1.00 0.00 H new ATOM 0 HB3 MET A 81 -3.283 6.574 -9.510 1.00 0.00 H new ATOM 0 HG2 MET A 81 -2.315 4.313 -10.205 1.00 0.00 H new ATOM 0 HG3 MET A 81 -0.712 4.979 -9.967 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.073 5.144 -6.524 1.00 0.00 H new ATOM 0 HE2 MET A 81 0.291 5.715 -8.196 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.699 6.657 -7.056 1.00 0.00 H new ATOM 1343 N THR A 82 -2.852 8.628 -12.806 1.00 0.00 N ATOM 1344 CA THR A 82 -2.783 10.077 -13.154 1.00 0.00 C ATOM 1345 C THR A 82 -3.532 10.319 -14.466 1.00 0.00 C ATOM 1346 O THR A 82 -3.113 11.102 -15.295 1.00 0.00 O ATOM 1347 CB THR A 82 -1.321 10.501 -13.317 1.00 0.00 C ATOM 1348 OG1 THR A 82 -1.259 11.903 -13.538 1.00 0.00 O ATOM 1349 CG2 THR A 82 -0.702 9.768 -14.509 1.00 0.00 C ATOM 0 H THR A 82 -3.410 8.057 -13.440 1.00 0.00 H new ATOM 0 HA THR A 82 -3.241 10.662 -12.356 1.00 0.00 H new ATOM 0 HB THR A 82 -0.767 10.249 -12.413 1.00 0.00 H new ATOM 0 HG1 THR A 82 -1.831 12.140 -14.298 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.339 10.072 -14.623 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.749 8.692 -14.339 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.254 10.017 -15.416 1.00 0.00 H new ATOM 1357 N ALA A 83 -4.635 9.652 -14.660 1.00 0.00 N ATOM 1358 CA ALA A 83 -5.410 9.841 -15.918 1.00 0.00 C ATOM 1359 C ALA A 83 -6.416 10.978 -15.734 1.00 0.00 C ATOM 1360 O ALA A 83 -7.560 10.879 -16.130 1.00 0.00 O ATOM 1361 CB ALA A 83 -6.157 8.550 -16.254 1.00 0.00 C ATOM 0 H ALA A 83 -5.034 8.983 -14.001 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.727 10.089 -16.731 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -6.725 8.687 -17.174 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.441 7.739 -16.387 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -6.839 8.302 -15.441 1.00 0.00 H new ATOM 1458 N ILE A 90 0.760 8.439 -21.351 1.00 0.00 N ATOM 1459 CA ILE A 90 -0.038 7.305 -20.793 1.00 0.00 C ATOM 1460 C ILE A 90 -0.573 6.455 -21.951 1.00 0.00 C ATOM 1461 O ILE A 90 -0.425 5.249 -21.965 1.00 0.00 O ATOM 1462 CB ILE A 90 -1.200 7.852 -19.930 1.00 0.00 C ATOM 1463 CG1 ILE A 90 -2.407 6.907 -19.989 1.00 0.00 C ATOM 1464 CG2 ILE A 90 -1.626 9.231 -20.429 1.00 0.00 C ATOM 1465 CD1 ILE A 90 -3.574 7.520 -19.213 1.00 0.00 C ATOM 0 HA ILE A 90 0.593 6.684 -20.157 1.00 0.00 H new ATOM 0 HB ILE A 90 -0.849 7.926 -18.901 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -2.697 6.734 -21.026 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.144 5.938 -19.566 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -2.444 9.604 -19.813 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -0.782 9.918 -20.366 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -1.956 9.157 -21.465 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -4.432 6.848 -19.255 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -3.281 7.670 -18.174 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.842 8.479 -19.656 1.00 0.00 H new ATOM 1477 N GLN A 91 -1.192 7.071 -22.920 1.00 0.00 N ATOM 1478 CA GLN A 91 -1.730 6.292 -24.069 1.00 0.00 C ATOM 1479 C GLN A 91 -0.658 5.326 -24.576 1.00 0.00 C ATOM 1480 O GLN A 91 -0.944 4.206 -24.952 1.00 0.00 O ATOM 1481 CB GLN A 91 -2.128 7.250 -25.194 1.00 0.00 C ATOM 1482 CG GLN A 91 -3.493 6.843 -25.753 1.00 0.00 C ATOM 1483 CD GLN A 91 -3.480 6.973 -27.278 1.00 0.00 C ATOM 1484 OE1 GLN A 91 -3.111 8.002 -27.808 1.00 0.00 O ATOM 1485 NE2 GLN A 91 -3.872 5.966 -28.009 1.00 0.00 N ATOM 0 H GLN A 91 -1.348 8.078 -22.965 1.00 0.00 H new ATOM 0 HA GLN A 91 -2.605 5.727 -23.747 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -2.167 8.272 -24.818 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -1.379 7.230 -25.985 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -3.724 5.817 -25.467 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -4.274 7.475 -25.330 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -4.182 5.102 -27.563 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -3.869 6.042 -29.026 1.00 0.00 H new ATOM 1494 N GLU A 92 0.576 5.750 -24.590 1.00 0.00 N ATOM 1495 CA GLU A 92 1.667 4.856 -25.071 1.00 0.00 C ATOM 1496 C GLU A 92 2.231 4.055 -23.896 1.00 0.00 C ATOM 1497 O GLU A 92 2.451 2.864 -23.992 1.00 0.00 O ATOM 1498 CB GLU A 92 2.782 5.702 -25.692 1.00 0.00 C ATOM 1499 CG GLU A 92 2.930 5.345 -27.172 1.00 0.00 C ATOM 1500 CD GLU A 92 2.840 6.617 -28.016 1.00 0.00 C ATOM 1501 OE1 GLU A 92 1.952 7.414 -27.759 1.00 0.00 O ATOM 1502 OE2 GLU A 92 3.660 6.774 -28.905 1.00 0.00 O ATOM 0 H GLU A 92 0.876 6.677 -24.289 1.00 0.00 H new ATOM 0 HA GLU A 92 1.269 4.170 -25.819 1.00 0.00 H new ATOM 0 HB2 GLU A 92 2.552 6.762 -25.584 1.00 0.00 H new ATOM 0 HB3 GLU A 92 3.722 5.525 -25.169 1.00 0.00 H new ATOM 0 HG2 GLU A 92 3.885 4.849 -27.343 1.00 0.00 H new ATOM 0 HG3 GLU A 92 2.149 4.644 -27.468 1.00 0.00 H new ATOM 1509 N SER A 93 2.469 4.699 -22.785 1.00 0.00 N ATOM 1510 CA SER A 93 3.020 3.975 -21.605 1.00 0.00 C ATOM 1511 C SER A 93 2.267 2.657 -21.411 1.00 0.00 C ATOM 1512 O SER A 93 2.792 1.705 -20.870 1.00 0.00 O ATOM 1513 CB SER A 93 2.861 4.841 -20.355 1.00 0.00 C ATOM 1514 OG SER A 93 3.989 5.696 -20.231 1.00 0.00 O ATOM 0 H SER A 93 2.305 5.696 -22.644 1.00 0.00 H new ATOM 0 HA SER A 93 4.077 3.766 -21.772 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.948 5.432 -20.422 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.769 4.210 -19.471 1.00 0.00 H new ATOM 0 HG SER A 93 3.890 6.254 -19.432 1.00 0.00 H new ATOM 1520 N LYS A 94 1.038 2.594 -21.846 1.00 0.00 N ATOM 1521 CA LYS A 94 0.255 1.336 -21.683 1.00 0.00 C ATOM 1522 C LYS A 94 0.956 0.198 -22.426 1.00 0.00 C ATOM 1523 O LYS A 94 1.394 -0.766 -21.831 1.00 0.00 O ATOM 1524 CB LYS A 94 -1.150 1.533 -22.258 1.00 0.00 C ATOM 1525 CG LYS A 94 -1.859 2.657 -21.501 1.00 0.00 C ATOM 1526 CD LYS A 94 -3.156 2.123 -20.890 1.00 0.00 C ATOM 1527 CE LYS A 94 -3.581 3.019 -19.725 1.00 0.00 C ATOM 1528 NZ LYS A 94 -4.672 3.929 -20.171 1.00 0.00 N ATOM 0 H LYS A 94 0.543 3.358 -22.306 1.00 0.00 H new ATOM 0 HA LYS A 94 0.183 1.087 -20.624 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.089 1.777 -23.319 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.721 0.608 -22.176 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.210 3.048 -20.718 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.077 3.484 -22.177 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.941 2.095 -21.646 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -3.012 1.100 -20.542 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.921 2.409 -18.888 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -2.730 3.601 -19.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.961 4.538 -19.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.332 4.520 -20.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.486 3.365 -20.489 1.00 0.00 H new ATOM 1542 N GLU A 95 1.065 0.301 -23.722 1.00 0.00 N ATOM 1543 CA GLU A 95 1.737 -0.777 -24.501 1.00 0.00 C ATOM 1544 C GLU A 95 3.192 -0.906 -24.045 1.00 0.00 C ATOM 1545 O GLU A 95 3.792 -1.958 -24.142 1.00 0.00 O ATOM 1546 CB GLU A 95 1.699 -0.429 -25.991 1.00 0.00 C ATOM 1547 CG GLU A 95 2.366 0.930 -26.215 1.00 0.00 C ATOM 1548 CD GLU A 95 2.694 1.099 -27.699 1.00 0.00 C ATOM 1549 OE1 GLU A 95 3.604 0.433 -28.164 1.00 0.00 O ATOM 1550 OE2 GLU A 95 2.030 1.893 -28.346 1.00 0.00 O ATOM 0 H GLU A 95 0.718 1.085 -24.275 1.00 0.00 H new ATOM 0 HA GLU A 95 1.219 -1.722 -24.335 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.213 -1.198 -26.568 1.00 0.00 H new ATOM 0 HB3 GLU A 95 0.668 -0.402 -26.343 1.00 0.00 H new ATOM 0 HG2 GLU A 95 1.704 1.731 -25.884 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.276 1.003 -25.620 1.00 0.00 H new ATOM 1557 N LEU A 96 3.765 0.156 -23.547 1.00 0.00 N ATOM 1558 CA LEU A 96 5.179 0.093 -23.085 1.00 0.00 C ATOM 1559 C LEU A 96 5.274 -0.809 -21.853 1.00 0.00 C ATOM 1560 O LEU A 96 6.255 -1.495 -21.647 1.00 0.00 O ATOM 1561 CB LEU A 96 5.662 1.499 -22.726 1.00 0.00 C ATOM 1562 CG LEU A 96 5.511 2.417 -23.940 1.00 0.00 C ATOM 1563 CD1 LEU A 96 5.656 3.875 -23.500 1.00 0.00 C ATOM 1564 CD2 LEU A 96 6.597 2.085 -24.966 1.00 0.00 C ATOM 0 H LEU A 96 3.314 1.065 -23.441 1.00 0.00 H new ATOM 0 HA LEU A 96 5.803 -0.313 -23.881 1.00 0.00 H new ATOM 0 HB2 LEU A 96 5.085 1.890 -21.888 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.704 1.467 -22.409 1.00 0.00 H new ATOM 0 HG LEU A 96 4.528 2.269 -24.387 1.00 0.00 H new ATOM 0 HD11 LEU A 96 5.548 4.529 -24.366 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.884 4.113 -22.768 1.00 0.00 H new ATOM 0 HD13 LEU A 96 6.639 4.024 -23.053 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.491 2.738 -25.832 1.00 0.00 H new ATOM 0 HD22 LEU A 96 7.579 2.234 -24.517 1.00 0.00 H new ATOM 0 HD23 LEU A 96 6.495 1.046 -25.280 1.00 0.00 H new ATOM 1576 N GLY A 97 4.260 -0.813 -21.030 1.00 0.00 N ATOM 1577 CA GLY A 97 4.293 -1.670 -19.812 1.00 0.00 C ATOM 1578 C GLY A 97 3.348 -1.095 -18.756 1.00 0.00 C ATOM 1579 O GLY A 97 3.775 -0.586 -17.739 1.00 0.00 O ATOM 0 H GLY A 97 3.411 -0.260 -21.149 1.00 0.00 H new ATOM 0 HA2 GLY A 97 3.997 -2.689 -20.063 1.00 0.00 H new ATOM 0 HA3 GLY A 97 5.308 -1.721 -19.418 1.00 0.00 H new ATOM 1583 N ALA A 98 2.066 -1.173 -18.988 1.00 0.00 N ATOM 1584 CA ALA A 98 1.095 -0.630 -17.995 1.00 0.00 C ATOM 1585 C ALA A 98 -0.267 -1.299 -18.198 1.00 0.00 C ATOM 1586 O ALA A 98 -0.944 -1.061 -19.178 1.00 0.00 O ATOM 1587 CB ALA A 98 0.957 0.880 -18.190 1.00 0.00 C ATOM 0 H ALA A 98 1.649 -1.589 -19.821 1.00 0.00 H new ATOM 0 HA ALA A 98 1.453 -0.833 -16.986 1.00 0.00 H new ATOM 0 HB1 ALA A 98 0.247 1.277 -17.464 1.00 0.00 H new ATOM 0 HB2 ALA A 98 1.927 1.356 -18.046 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.598 1.085 -19.198 1.00 0.00 H new ATOM 1593 N LEU A 99 -0.674 -2.131 -17.279 1.00 0.00 N ATOM 1594 CA LEU A 99 -1.991 -2.811 -17.423 1.00 0.00 C ATOM 1595 C LEU A 99 -3.102 -1.761 -17.485 1.00 0.00 C ATOM 1596 O LEU A 99 -3.743 -1.578 -18.501 1.00 0.00 O ATOM 1597 CB LEU A 99 -2.229 -3.729 -16.221 1.00 0.00 C ATOM 1598 CG LEU A 99 -0.948 -4.504 -15.907 1.00 0.00 C ATOM 1599 CD1 LEU A 99 -0.538 -4.245 -14.456 1.00 0.00 C ATOM 1600 CD2 LEU A 99 -1.197 -6.001 -16.106 1.00 0.00 C ATOM 0 H LEU A 99 -0.152 -2.369 -16.436 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.994 -3.402 -18.339 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -2.532 -3.140 -15.355 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.042 -4.422 -16.435 1.00 0.00 H new ATOM 0 HG LEU A 99 -0.151 -4.175 -16.574 1.00 0.00 H new ATOM 0 HD11 LEU A 99 0.375 -4.797 -14.232 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.362 -3.179 -14.312 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.334 -4.574 -13.789 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.285 -6.554 -15.883 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.993 -6.329 -15.438 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.490 -6.187 -17.139 1.00 0.00 H new ATOM 1612 N THR A 100 -3.334 -1.066 -16.404 1.00 0.00 N ATOM 1613 CA THR A 100 -4.402 -0.028 -16.401 1.00 0.00 C ATOM 1614 C THR A 100 -3.849 1.269 -15.805 1.00 0.00 C ATOM 1615 O THR A 100 -2.853 1.267 -15.108 1.00 0.00 O ATOM 1616 CB THR A 100 -5.584 -0.515 -15.559 1.00 0.00 C ATOM 1617 OG1 THR A 100 -6.703 0.331 -15.784 1.00 0.00 O ATOM 1618 CG2 THR A 100 -5.206 -0.481 -14.077 1.00 0.00 C ATOM 0 H THR A 100 -2.830 -1.173 -15.524 1.00 0.00 H new ATOM 0 HA THR A 100 -4.736 0.155 -17.422 1.00 0.00 H new ATOM 0 HB THR A 100 -5.837 -1.536 -15.843 1.00 0.00 H new ATOM 0 HG1 THR A 100 -7.462 0.020 -15.247 1.00 0.00 H new ATOM 0 HG21 THR A 100 -6.048 -0.828 -13.479 1.00 0.00 H new ATOM 0 HG22 THR A 100 -4.347 -1.130 -13.906 1.00 0.00 H new ATOM 0 HG23 THR A 100 -4.953 0.539 -13.789 1.00 0.00 H new ATOM 1626 N HIS A 101 -4.487 2.375 -16.071 1.00 0.00 N ATOM 1627 CA HIS A 101 -3.996 3.668 -15.516 1.00 0.00 C ATOM 1628 C HIS A 101 -5.123 4.349 -14.737 1.00 0.00 C ATOM 1629 O HIS A 101 -5.944 5.048 -15.297 1.00 0.00 O ATOM 1630 CB HIS A 101 -3.546 4.578 -16.660 1.00 0.00 C ATOM 1631 CG HIS A 101 -2.778 5.743 -16.099 1.00 0.00 C ATOM 1632 ND1 HIS A 101 -1.877 6.471 -16.860 1.00 0.00 N ATOM 1633 CD2 HIS A 101 -2.765 6.317 -14.853 1.00 0.00 C ATOM 1634 CE1 HIS A 101 -1.365 7.432 -16.072 1.00 0.00 C ATOM 1635 NE2 HIS A 101 -1.873 7.384 -14.838 1.00 0.00 N ATOM 0 H HIS A 101 -5.326 2.440 -16.648 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.154 3.480 -14.849 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -2.923 4.020 -17.359 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.412 4.934 -17.218 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -1.645 6.307 -17.840 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -3.358 5.990 -14.011 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -0.632 8.155 -16.397 1.00 0.00 H new ATOM 1643 N PHE A 102 -5.170 4.150 -13.448 1.00 0.00 N ATOM 1644 CA PHE A 102 -6.244 4.785 -12.635 1.00 0.00 C ATOM 1645 C PHE A 102 -6.100 6.307 -12.698 1.00 0.00 C ATOM 1646 O PHE A 102 -5.223 6.832 -13.355 1.00 0.00 O ATOM 1647 CB PHE A 102 -6.123 4.322 -11.181 1.00 0.00 C ATOM 1648 CG PHE A 102 -6.737 2.950 -11.037 1.00 0.00 C ATOM 1649 CD1 PHE A 102 -8.128 2.809 -10.974 1.00 0.00 C ATOM 1650 CD2 PHE A 102 -5.914 1.819 -10.967 1.00 0.00 C ATOM 1651 CE1 PHE A 102 -8.697 1.537 -10.839 1.00 0.00 C ATOM 1652 CE2 PHE A 102 -6.483 0.548 -10.833 1.00 0.00 C ATOM 1653 CZ PHE A 102 -7.875 0.406 -10.769 1.00 0.00 C ATOM 0 H PHE A 102 -4.511 3.575 -12.923 1.00 0.00 H new ATOM 0 HA PHE A 102 -7.218 4.496 -13.030 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -5.075 4.296 -10.882 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -6.626 5.028 -10.520 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -8.762 3.681 -11.030 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.841 1.928 -11.016 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -9.770 1.428 -10.789 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.849 -0.324 -10.779 1.00 0.00 H new ATOM 0 HZ PHE A 102 -8.314 -0.575 -10.666 1.00 0.00 H new ATOM 1663 N ALA A 103 -6.956 7.019 -12.019 1.00 0.00 N ATOM 1664 CA ALA A 103 -6.874 8.506 -12.037 1.00 0.00 C ATOM 1665 C ALA A 103 -7.838 9.079 -10.997 1.00 0.00 C ATOM 1666 O ALA A 103 -8.223 8.410 -10.059 1.00 0.00 O ATOM 1667 CB ALA A 103 -7.255 9.023 -13.426 1.00 0.00 C ATOM 0 H ALA A 103 -7.711 6.634 -11.451 1.00 0.00 H new ATOM 0 HA ALA A 103 -5.856 8.817 -11.802 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.195 10.111 -13.438 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -6.569 8.613 -14.168 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -8.273 8.713 -13.663 1.00 0.00 H new ATOM 1673 N LYS A 104 -8.234 10.313 -11.155 1.00 0.00 N ATOM 1674 CA LYS A 104 -9.174 10.922 -10.173 1.00 0.00 C ATOM 1675 C LYS A 104 -10.600 10.867 -10.730 1.00 0.00 C ATOM 1676 O LYS A 104 -10.805 11.035 -11.916 1.00 0.00 O ATOM 1677 CB LYS A 104 -8.779 12.380 -9.925 1.00 0.00 C ATOM 1678 CG LYS A 104 -8.250 12.530 -8.497 1.00 0.00 C ATOM 1679 CD LYS A 104 -6.890 11.840 -8.380 1.00 0.00 C ATOM 1680 CE LYS A 104 -6.861 10.977 -7.118 1.00 0.00 C ATOM 1681 NZ LYS A 104 -5.498 10.400 -6.942 1.00 0.00 N ATOM 0 H LYS A 104 -7.948 10.924 -11.920 1.00 0.00 H new ATOM 0 HA LYS A 104 -9.128 10.369 -9.235 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -8.017 12.688 -10.641 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -9.640 13.032 -10.076 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.157 13.586 -8.242 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -8.954 12.092 -7.789 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -6.707 11.223 -9.259 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -6.095 12.585 -8.342 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -7.129 11.577 -6.248 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -7.599 10.178 -7.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -5.478 9.813 -6.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.260 9.814 -7.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -4.804 11.170 -6.851 1.00 0.00 H new ATOM 1695 N PRO A 105 -11.547 10.633 -9.856 1.00 0.00 N ATOM 1696 CA PRO A 105 -11.289 10.430 -8.418 1.00 0.00 C ATOM 1697 C PRO A 105 -10.764 9.012 -8.165 1.00 0.00 C ATOM 1698 O PRO A 105 -10.865 8.143 -9.008 1.00 0.00 O ATOM 1699 CB PRO A 105 -12.663 10.627 -7.776 1.00 0.00 C ATOM 1700 CG PRO A 105 -13.706 10.368 -8.889 1.00 0.00 C ATOM 1701 CD PRO A 105 -12.972 10.550 -10.231 1.00 0.00 C ATOM 0 HA PRO A 105 -10.536 11.108 -8.016 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -12.805 9.938 -6.943 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -12.764 11.636 -7.376 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -14.119 9.363 -8.807 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -14.541 11.064 -8.807 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -13.159 9.713 -10.904 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -13.302 11.452 -10.746 1.00 0.00 H new ATOM 1709 N PHE A 106 -10.206 8.774 -7.010 1.00 0.00 N ATOM 1710 CA PHE A 106 -9.677 7.415 -6.704 1.00 0.00 C ATOM 1711 C PHE A 106 -10.726 6.623 -5.920 1.00 0.00 C ATOM 1712 O PHE A 106 -10.973 6.883 -4.759 1.00 0.00 O ATOM 1713 CB PHE A 106 -8.403 7.540 -5.866 1.00 0.00 C ATOM 1714 CG PHE A 106 -7.341 6.617 -6.415 1.00 0.00 C ATOM 1715 CD1 PHE A 106 -6.913 6.752 -7.740 1.00 0.00 C ATOM 1716 CD2 PHE A 106 -6.784 5.628 -5.596 1.00 0.00 C ATOM 1717 CE1 PHE A 106 -5.927 5.898 -8.248 1.00 0.00 C ATOM 1718 CE2 PHE A 106 -5.797 4.774 -6.104 1.00 0.00 C ATOM 1719 CZ PHE A 106 -5.369 4.908 -7.429 1.00 0.00 C ATOM 0 H PHE A 106 -10.094 9.462 -6.265 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.451 6.896 -7.635 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -8.046 8.570 -5.880 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -8.614 7.290 -4.826 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.343 7.515 -8.371 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -7.115 5.524 -4.573 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -5.597 6.002 -9.271 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -5.366 4.011 -5.472 1.00 0.00 H new ATOM 0 HZ PHE A 106 -4.609 4.248 -7.820 1.00 0.00 H new ATOM 1729 N ASP A 107 -11.344 5.658 -6.544 1.00 0.00 N ATOM 1730 CA ASP A 107 -12.373 4.850 -5.831 1.00 0.00 C ATOM 1731 C ASP A 107 -11.702 3.650 -5.162 1.00 0.00 C ATOM 1732 O ASP A 107 -11.350 2.685 -5.807 1.00 0.00 O ATOM 1733 CB ASP A 107 -13.419 4.357 -6.834 1.00 0.00 C ATOM 1734 CG ASP A 107 -14.694 3.957 -6.088 1.00 0.00 C ATOM 1735 OD1 ASP A 107 -14.588 3.589 -4.930 1.00 0.00 O ATOM 1736 OD2 ASP A 107 -15.753 4.024 -6.689 1.00 0.00 O ATOM 0 H ASP A 107 -11.181 5.394 -7.516 1.00 0.00 H new ATOM 0 HA ASP A 107 -12.859 5.465 -5.073 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -13.640 5.140 -7.559 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -13.030 3.506 -7.393 1.00 0.00 H new ATOM 1741 N ILE A 108 -11.519 3.705 -3.871 1.00 0.00 N ATOM 1742 CA ILE A 108 -10.866 2.568 -3.161 1.00 0.00 C ATOM 1743 C ILE A 108 -11.477 1.244 -3.627 1.00 0.00 C ATOM 1744 O ILE A 108 -10.859 0.202 -3.541 1.00 0.00 O ATOM 1745 CB ILE A 108 -11.078 2.724 -1.653 1.00 0.00 C ATOM 1746 CG1 ILE A 108 -10.274 3.925 -1.148 1.00 0.00 C ATOM 1747 CG2 ILE A 108 -10.603 1.458 -0.938 1.00 0.00 C ATOM 1748 CD1 ILE A 108 -8.835 3.827 -1.653 1.00 0.00 C ATOM 0 H ILE A 108 -11.793 4.488 -3.277 1.00 0.00 H new ATOM 0 HA ILE A 108 -9.799 2.568 -3.385 1.00 0.00 H new ATOM 0 HB ILE A 108 -12.137 2.882 -1.449 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -10.730 4.852 -1.495 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -10.287 3.952 -0.058 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.754 1.568 0.136 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.173 0.601 -1.298 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -9.544 1.301 -1.142 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -8.264 4.683 -1.293 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.382 2.907 -1.284 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.831 3.821 -2.743 1.00 0.00 H new ATOM 1760 N ASP A 109 -12.687 1.274 -4.114 1.00 0.00 N ATOM 1761 CA ASP A 109 -13.332 0.013 -4.579 1.00 0.00 C ATOM 1762 C ASP A 109 -12.708 -0.430 -5.904 1.00 0.00 C ATOM 1763 O ASP A 109 -12.396 -1.587 -6.097 1.00 0.00 O ATOM 1764 CB ASP A 109 -14.831 0.252 -4.777 1.00 0.00 C ATOM 1765 CG ASP A 109 -15.404 0.953 -3.545 1.00 0.00 C ATOM 1766 OD1 ASP A 109 -15.209 0.444 -2.453 1.00 0.00 O ATOM 1767 OD2 ASP A 109 -16.029 1.987 -3.713 1.00 0.00 O ATOM 0 H ASP A 109 -13.256 2.115 -4.210 1.00 0.00 H new ATOM 0 HA ASP A 109 -13.180 -0.766 -3.832 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -14.999 0.861 -5.665 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -15.343 -0.697 -4.939 1.00 0.00 H new ATOM 1772 N GLU A 110 -12.527 0.480 -6.823 1.00 0.00 N ATOM 1773 CA GLU A 110 -11.927 0.106 -8.134 1.00 0.00 C ATOM 1774 C GLU A 110 -10.436 -0.193 -7.953 1.00 0.00 C ATOM 1775 O GLU A 110 -9.840 -0.915 -8.728 1.00 0.00 O ATOM 1776 CB GLU A 110 -12.097 1.262 -9.122 1.00 0.00 C ATOM 1777 CG GLU A 110 -12.385 0.705 -10.517 1.00 0.00 C ATOM 1778 CD GLU A 110 -13.542 1.481 -11.149 1.00 0.00 C ATOM 1779 OE1 GLU A 110 -14.013 2.417 -10.524 1.00 0.00 O ATOM 1780 OE2 GLU A 110 -13.937 1.128 -12.248 1.00 0.00 O ATOM 0 H GLU A 110 -12.769 1.466 -6.722 1.00 0.00 H new ATOM 0 HA GLU A 110 -12.430 -0.781 -8.520 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -12.913 1.910 -8.802 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -11.194 1.872 -9.142 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -11.496 0.784 -11.142 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -12.636 -0.354 -10.453 1.00 0.00 H new ATOM 1787 N ILE A 111 -9.829 0.355 -6.936 1.00 0.00 N ATOM 1788 CA ILE A 111 -8.377 0.100 -6.709 1.00 0.00 C ATOM 1789 C ILE A 111 -8.192 -1.299 -6.120 1.00 0.00 C ATOM 1790 O ILE A 111 -7.432 -2.101 -6.626 1.00 0.00 O ATOM 1791 CB ILE A 111 -7.825 1.140 -5.732 1.00 0.00 C ATOM 1792 CG1 ILE A 111 -8.279 2.539 -6.160 1.00 0.00 C ATOM 1793 CG2 ILE A 111 -6.295 1.077 -5.730 1.00 0.00 C ATOM 1794 CD1 ILE A 111 -7.513 2.971 -7.413 1.00 0.00 C ATOM 0 H ILE A 111 -10.275 0.968 -6.253 1.00 0.00 H new ATOM 0 HA ILE A 111 -7.843 0.170 -7.656 1.00 0.00 H new ATOM 0 HB ILE A 111 -8.199 0.930 -4.730 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -9.351 2.539 -6.360 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -8.105 3.251 -5.353 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -5.901 1.818 -5.034 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -5.972 0.082 -5.422 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -5.921 1.286 -6.732 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -7.839 3.967 -7.714 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -6.445 2.989 -7.198 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -7.709 2.266 -8.221 1.00 0.00 H new ATOM 1806 N ARG A 112 -8.880 -1.597 -5.052 1.00 0.00 N ATOM 1807 CA ARG A 112 -8.743 -2.943 -4.427 1.00 0.00 C ATOM 1808 C ARG A 112 -9.246 -4.013 -5.398 1.00 0.00 C ATOM 1809 O ARG A 112 -8.697 -5.093 -5.487 1.00 0.00 O ATOM 1810 CB ARG A 112 -9.574 -2.993 -3.142 1.00 0.00 C ATOM 1811 CG ARG A 112 -11.030 -2.650 -3.462 1.00 0.00 C ATOM 1812 CD ARG A 112 -11.769 -2.301 -2.169 1.00 0.00 C ATOM 1813 NE ARG A 112 -13.080 -3.007 -2.140 1.00 0.00 N ATOM 1814 CZ ARG A 112 -13.124 -4.306 -2.009 1.00 0.00 C ATOM 1815 NH1 ARG A 112 -12.018 -4.994 -1.902 1.00 0.00 N ATOM 1816 NH2 ARG A 112 -14.276 -4.919 -1.986 1.00 0.00 N ATOM 0 H ARG A 112 -9.531 -0.966 -4.585 1.00 0.00 H new ATOM 0 HA ARG A 112 -7.695 -3.129 -4.193 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -9.513 -3.985 -2.695 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -9.176 -2.289 -2.411 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -11.073 -1.810 -4.156 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -11.514 -3.494 -3.953 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -11.169 -2.590 -1.306 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -11.923 -1.224 -2.105 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.946 -2.475 -2.223 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -11.117 -4.517 -1.921 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -12.056 -6.008 -1.800 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -15.140 -4.384 -2.070 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -14.312 -5.933 -1.884 1.00 0.00 H new ATOM 1830 N ASP A 113 -10.288 -3.722 -6.128 1.00 0.00 N ATOM 1831 CA ASP A 113 -10.827 -4.723 -7.091 1.00 0.00 C ATOM 1832 C ASP A 113 -9.781 -5.013 -8.169 1.00 0.00 C ATOM 1833 O ASP A 113 -9.343 -6.133 -8.335 1.00 0.00 O ATOM 1834 CB ASP A 113 -12.094 -4.168 -7.746 1.00 0.00 C ATOM 1835 CG ASP A 113 -13.280 -4.346 -6.796 1.00 0.00 C ATOM 1836 OD1 ASP A 113 -13.555 -5.475 -6.429 1.00 0.00 O ATOM 1837 OD2 ASP A 113 -13.892 -3.348 -6.453 1.00 0.00 O ATOM 0 H ASP A 113 -10.789 -2.834 -6.099 1.00 0.00 H new ATOM 0 HA ASP A 113 -11.065 -5.645 -6.560 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -11.961 -3.113 -7.984 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -12.287 -4.685 -8.686 1.00 0.00 H new ATOM 1842 N ALA A 114 -9.380 -4.014 -8.906 1.00 0.00 N ATOM 1843 CA ALA A 114 -8.364 -4.235 -9.973 1.00 0.00 C ATOM 1844 C ALA A 114 -7.210 -5.073 -9.418 1.00 0.00 C ATOM 1845 O ALA A 114 -6.819 -6.068 -9.996 1.00 0.00 O ATOM 1846 CB ALA A 114 -7.827 -2.884 -10.452 1.00 0.00 C ATOM 0 H ALA A 114 -9.712 -3.054 -8.815 1.00 0.00 H new ATOM 0 HA ALA A 114 -8.825 -4.762 -10.808 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -7.083 -3.044 -11.233 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -8.647 -2.287 -10.849 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -7.367 -2.358 -9.615 1.00 0.00 H new ATOM 1852 N VAL A 115 -6.661 -4.678 -8.303 1.00 0.00 N ATOM 1853 CA VAL A 115 -5.531 -5.450 -7.714 1.00 0.00 C ATOM 1854 C VAL A 115 -5.928 -6.923 -7.584 1.00 0.00 C ATOM 1855 O VAL A 115 -5.206 -7.809 -7.999 1.00 0.00 O ATOM 1856 CB VAL A 115 -5.199 -4.888 -6.330 1.00 0.00 C ATOM 1857 CG1 VAL A 115 -4.251 -5.845 -5.603 1.00 0.00 C ATOM 1858 CG2 VAL A 115 -4.524 -3.523 -6.483 1.00 0.00 C ATOM 0 H VAL A 115 -6.946 -3.854 -7.774 1.00 0.00 H new ATOM 0 HA VAL A 115 -4.658 -5.366 -8.362 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.117 -4.778 -5.753 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.015 -5.444 -4.617 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -4.730 -6.818 -5.494 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -3.332 -5.955 -6.179 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -4.287 -3.122 -5.498 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -3.606 -3.634 -7.060 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.198 -2.840 -7.000 1.00 0.00 H new ATOM 1868 N LYS A 116 -7.068 -7.192 -7.010 1.00 0.00 N ATOM 1869 CA LYS A 116 -7.509 -8.607 -6.851 1.00 0.00 C ATOM 1870 C LYS A 116 -7.589 -9.276 -8.225 1.00 0.00 C ATOM 1871 O LYS A 116 -7.397 -10.468 -8.357 1.00 0.00 O ATOM 1872 CB LYS A 116 -8.888 -8.639 -6.189 1.00 0.00 C ATOM 1873 CG LYS A 116 -8.774 -8.137 -4.749 1.00 0.00 C ATOM 1874 CD LYS A 116 -10.026 -8.539 -3.966 1.00 0.00 C ATOM 1875 CE LYS A 116 -9.682 -9.674 -3.001 1.00 0.00 C ATOM 1876 NZ LYS A 116 -9.876 -9.210 -1.598 1.00 0.00 N ATOM 0 H LYS A 116 -7.714 -6.493 -6.644 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.792 -9.142 -6.228 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -9.586 -8.016 -6.748 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -9.286 -9.654 -6.201 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -7.886 -8.557 -4.276 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -8.658 -7.053 -4.739 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -10.413 -7.683 -3.414 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -10.811 -8.857 -4.653 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -10.315 -10.539 -3.200 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -8.650 -9.993 -3.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -9.262 -9.759 -0.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -9.632 -8.201 -1.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -10.869 -9.346 -1.322 1.00 0.00 H new ATOM 1890 N LYS A 117 -7.870 -8.519 -9.250 1.00 0.00 N ATOM 1891 CA LYS A 117 -7.961 -9.114 -10.612 1.00 0.00 C ATOM 1892 C LYS A 117 -6.553 -9.370 -11.150 1.00 0.00 C ATOM 1893 O LYS A 117 -6.338 -10.250 -11.962 1.00 0.00 O ATOM 1894 CB LYS A 117 -8.696 -8.147 -11.543 1.00 0.00 C ATOM 1895 CG LYS A 117 -8.673 -8.695 -12.971 1.00 0.00 C ATOM 1896 CD LYS A 117 -9.629 -7.882 -13.847 1.00 0.00 C ATOM 1897 CE LYS A 117 -8.862 -7.301 -15.037 1.00 0.00 C ATOM 1898 NZ LYS A 117 -8.945 -5.814 -15.003 1.00 0.00 N ATOM 0 H LYS A 117 -8.040 -7.514 -9.203 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.508 -10.056 -10.562 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.725 -8.016 -11.209 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -8.223 -7.165 -11.511 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.662 -8.645 -13.375 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -8.965 -9.745 -12.973 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -10.443 -8.515 -14.200 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -10.079 -7.079 -13.264 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -7.820 -7.619 -15.002 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -9.279 -7.678 -15.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -8.424 -5.419 -15.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -9.941 -5.521 -15.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -8.528 -5.463 -14.117 1.00 0.00 H new ATOM 1912 N TYR A 118 -5.591 -8.609 -10.706 1.00 0.00 N ATOM 1913 CA TYR A 118 -4.198 -8.809 -11.193 1.00 0.00 C ATOM 1914 C TYR A 118 -3.478 -9.809 -10.285 1.00 0.00 C ATOM 1915 O TYR A 118 -3.270 -10.949 -10.646 1.00 0.00 O ATOM 1916 CB TYR A 118 -3.453 -7.473 -11.176 1.00 0.00 C ATOM 1917 CG TYR A 118 -4.090 -6.530 -12.170 1.00 0.00 C ATOM 1918 CD1 TYR A 118 -4.214 -6.908 -13.511 1.00 0.00 C ATOM 1919 CD2 TYR A 118 -4.555 -5.278 -11.748 1.00 0.00 C ATOM 1920 CE1 TYR A 118 -4.804 -6.034 -14.433 1.00 0.00 C ATOM 1921 CE2 TYR A 118 -5.145 -4.405 -12.669 1.00 0.00 C ATOM 1922 CZ TYR A 118 -5.269 -4.783 -14.012 1.00 0.00 C ATOM 1923 OH TYR A 118 -5.851 -3.922 -14.920 1.00 0.00 O ATOM 0 H TYR A 118 -5.710 -7.857 -10.027 1.00 0.00 H new ATOM 0 HA TYR A 118 -4.222 -9.196 -12.212 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.483 -7.040 -10.176 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -2.403 -7.626 -11.425 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -3.855 -7.874 -13.835 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -4.458 -4.987 -10.713 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -4.900 -6.325 -15.468 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -5.505 -3.440 -12.344 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.329 -3.214 -14.440 1.00 0.00 H new ATOM 1933 N LEU A 119 -3.092 -9.389 -9.110 1.00 0.00 N ATOM 1934 CA LEU A 119 -2.385 -10.314 -8.179 1.00 0.00 C ATOM 1935 C LEU A 119 -3.409 -11.029 -7.286 1.00 0.00 C ATOM 1936 O LEU A 119 -4.034 -10.406 -6.452 1.00 0.00 O ATOM 1937 CB LEU A 119 -1.424 -9.509 -7.301 1.00 0.00 C ATOM 1938 CG LEU A 119 -0.362 -10.442 -6.717 1.00 0.00 C ATOM 1939 CD1 LEU A 119 0.914 -9.648 -6.434 1.00 0.00 C ATOM 1940 CD2 LEU A 119 -0.880 -11.052 -5.414 1.00 0.00 C ATOM 0 H LEU A 119 -3.236 -8.444 -8.755 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.828 -11.053 -8.755 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.949 -8.723 -7.889 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.973 -9.018 -6.498 1.00 0.00 H new ATOM 0 HG LEU A 119 -0.146 -11.237 -7.431 1.00 0.00 H new ATOM 0 HD11 LEU A 119 1.671 -10.312 -6.018 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.284 -9.212 -7.362 1.00 0.00 H new ATOM 0 HD13 LEU A 119 0.697 -8.853 -5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -0.123 -11.717 -4.998 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -1.096 -10.257 -4.701 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -1.790 -11.618 -5.614 1.00 0.00 H new ATOM 1952 N PRO A 120 -3.553 -12.318 -7.484 1.00 0.00 N ATOM 1953 CA PRO A 120 -4.498 -13.137 -6.704 1.00 0.00 C ATOM 1954 C PRO A 120 -3.901 -13.481 -5.334 1.00 0.00 C ATOM 1955 O PRO A 120 -2.700 -13.515 -5.162 1.00 0.00 O ATOM 1956 CB PRO A 120 -4.663 -14.400 -7.552 1.00 0.00 C ATOM 1957 CG PRO A 120 -3.405 -14.491 -8.449 1.00 0.00 C ATOM 1958 CD PRO A 120 -2.797 -13.077 -8.501 1.00 0.00 C ATOM 0 HA PRO A 120 -5.443 -12.631 -6.509 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.754 -15.283 -6.920 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.568 -14.346 -8.157 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.690 -15.205 -8.041 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -3.667 -14.837 -9.449 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -1.731 -13.094 -8.274 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.905 -12.633 -9.491 1.00 0.00 H new ATOM 1966 N LEU A 121 -4.733 -13.741 -4.362 1.00 0.00 N ATOM 1967 CA LEU A 121 -4.212 -14.089 -3.011 1.00 0.00 C ATOM 1968 C LEU A 121 -4.067 -15.613 -2.903 1.00 0.00 C ATOM 1969 O LEU A 121 -3.277 -16.214 -3.604 1.00 0.00 O ATOM 1970 CB LEU A 121 -5.174 -13.558 -1.942 1.00 0.00 C ATOM 1971 CG LEU A 121 -4.967 -12.051 -1.776 1.00 0.00 C ATOM 1972 CD1 LEU A 121 -6.215 -11.426 -1.149 1.00 0.00 C ATOM 1973 CD2 LEU A 121 -3.763 -11.802 -0.865 1.00 0.00 C ATOM 0 H LEU A 121 -5.749 -13.727 -4.446 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.235 -13.632 -2.857 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -6.205 -13.765 -2.229 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.999 -14.067 -0.994 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.788 -11.601 -2.752 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -6.065 -10.353 -1.032 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -7.075 -11.604 -1.795 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -6.396 -11.876 -0.173 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.613 -10.729 -0.745 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -3.945 -12.254 0.110 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -2.872 -12.245 -1.310 1.00 0.00 H new