USER MOD reduce.3.24.130724 H: found=0, std=0, add=901, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 903 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: B 15 CYS SG : rot 38:sc= 1.04 USER MOD Set 1.2: B 19 MET CE :methyl -144:sc= 0 (180deg=-0.326) USER MOD Set 2.1: A 15 CYS SG : rot -102:sc= 1.87 USER MOD Set 2.2: A 19 MET CE :methyl -167:sc=-0.00306 (180deg=-0.207) USER MOD Single : A 6 ASN : amide:sc= 1 K(o=1,f=-0.18) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -172:sc= -2.37! (180deg=-2.57) USER MOD Single : A 21 GLN :FLIP amide:sc= -1.56 F(o=-2.8!,f=-1.6) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= 0.0514 K(o=0.051,f=-6.5!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -177:sc= 1.18 (180deg=1.06) USER MOD Single : A 39 GLN : amide:sc= -0.859 K(o=-0.86,f=-1.5) USER MOD Single : A 44 THR OG1 : rot 77:sc= 1.31 USER MOD Single : A 45 HIS : no HD1:sc= -6.24! C(o=-6.2!,f=-7.2!) USER MOD Single : A 54 ASN : amide:sc= -0.0871 X(o=-0.087,f=-0.34) USER MOD Single : A 57 GLN :FLIP amide:sc= -0.686 F(o=-4.8!,f=-0.69) USER MOD Single : B 6 ASN : amide:sc= 1.08 K(o=1.1,f=-0.1) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 LYS NZ :NH3+ 141:sc= 0.862 (180deg=-1.19!) USER MOD Single : B 21 GLN : amide:sc= -1.68! C(o=-1.7!,f=-3.7!) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 ASN : amide:sc= -0.0658 K(o=-0.066,f=-3.6!) USER MOD Single : B 34 LYS NZ :NH3+ -160:sc= -1.33 (180deg=-2.13!) USER MOD Single : B 35 LYS NZ :NH3+ 168:sc= 1.72 (180deg=1.46) USER MOD Single : B 39 GLN : amide:sc= -1.51! K(o=-1.5!,f=-2.2) USER MOD Single : B 44 THR OG1 : rot -35:sc= 0.448 USER MOD Single : B 45 HIS :FLIP no HD1:sc= -1.23! C(o=-4.9!,f=-1.2!) USER MOD Single : B 54 ASN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : B 57 GLN :FLIP amide:sc= -0.351 F(o=-5.2!,f=-0.35) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 -6.855 -7.105 8.326 1.00 0.00 N ATOM 57 CA VAL A 5 -7.238 -5.783 7.915 1.00 0.00 C ATOM 58 C VAL A 5 -6.111 -4.818 8.120 1.00 0.00 C ATOM 59 O VAL A 5 -5.878 -4.319 9.230 1.00 0.00 O ATOM 60 CB VAL A 5 -8.536 -5.243 8.602 1.00 0.00 C ATOM 61 CG1 VAL A 5 -8.857 -3.833 8.107 1.00 0.00 C ATOM 62 CG2 VAL A 5 -9.720 -6.150 8.321 1.00 0.00 C ATOM 0 HA VAL A 5 -7.471 -5.868 6.854 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.354 -5.220 9.676 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -9.763 -3.473 8.595 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -8.028 -3.167 8.344 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -9.010 -3.852 7.028 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -10.608 -5.751 8.810 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -9.891 -6.203 7.246 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -9.512 -7.149 8.705 1.00 0.00 H new ATOM 72 N ASN A 6 -5.385 -4.593 7.081 1.00 0.00 N ATOM 73 CA ASN A 6 -4.349 -3.620 7.101 1.00 0.00 C ATOM 74 C ASN A 6 -4.593 -2.645 6.005 1.00 0.00 C ATOM 75 O ASN A 6 -4.360 -2.898 4.837 1.00 0.00 O ATOM 76 CB ASN A 6 -2.955 -4.248 7.019 1.00 0.00 C ATOM 77 CG ASN A 6 -2.600 -4.981 8.288 1.00 0.00 C ATOM 78 OD1 ASN A 6 -2.058 -4.402 9.234 1.00 0.00 O ATOM 79 ND2 ASN A 6 -2.866 -6.245 8.332 1.00 0.00 N ATOM 0 H ASN A 6 -5.493 -5.080 6.191 1.00 0.00 H new ATOM 0 HA ASN A 6 -4.370 -3.098 8.058 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -2.915 -4.938 6.176 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -2.216 -3.470 6.829 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -2.628 -6.788 9.162 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -3.314 -6.700 7.537 1.00 0.00 H new ATOM 86 N VAL A 7 -5.155 -1.574 6.395 1.00 0.00 N ATOM 87 CA VAL A 7 -5.493 -0.488 5.507 1.00 0.00 C ATOM 88 C VAL A 7 -4.716 0.743 5.952 1.00 0.00 C ATOM 89 O VAL A 7 -4.788 1.120 7.134 1.00 0.00 O ATOM 90 CB VAL A 7 -7.022 -0.181 5.558 1.00 0.00 C ATOM 91 CG1 VAL A 7 -7.377 1.033 4.713 1.00 0.00 C ATOM 92 CG2 VAL A 7 -7.841 -1.391 5.120 1.00 0.00 C ATOM 0 H VAL A 7 -5.410 -1.401 7.367 1.00 0.00 H new ATOM 0 HA VAL A 7 -5.237 -0.763 4.484 1.00 0.00 H new ATOM 0 HB VAL A 7 -7.270 0.046 6.595 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -8.450 1.217 4.773 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.838 1.905 5.084 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.098 0.849 3.676 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.903 -1.148 5.166 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.574 -1.660 4.098 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -7.632 -2.231 5.783 1.00 0.00 H new ATOM 102 N LEU A 8 -4.007 1.372 5.063 1.00 0.00 N ATOM 103 CA LEU A 8 -3.199 2.519 5.435 1.00 0.00 C ATOM 104 C LEU A 8 -2.770 3.280 4.201 1.00 0.00 C ATOM 105 O LEU A 8 -3.057 2.854 3.077 1.00 0.00 O ATOM 106 CB LEU A 8 -1.965 2.105 6.270 1.00 0.00 C ATOM 107 CG LEU A 8 -0.873 1.305 5.585 1.00 0.00 C ATOM 108 CD1 LEU A 8 0.271 1.141 6.533 1.00 0.00 C ATOM 109 CD2 LEU A 8 -1.340 -0.065 5.119 1.00 0.00 C ATOM 0 H LEU A 8 -3.964 1.120 4.076 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.814 3.168 6.058 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.513 3.013 6.669 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.319 1.524 7.122 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.574 1.858 4.694 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.063 0.567 6.052 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.654 2.122 6.815 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.068 0.614 7.425 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.513 -0.587 4.637 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.684 -0.643 5.977 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.158 0.052 4.408 1.00 0.00 H new ATOM 121 N LYS A 9 -2.094 4.389 4.398 1.00 0.00 N ATOM 122 CA LYS A 9 -1.684 5.219 3.295 1.00 0.00 C ATOM 123 C LYS A 9 -0.183 5.356 3.196 1.00 0.00 C ATOM 124 O LYS A 9 0.548 5.204 4.196 1.00 0.00 O ATOM 125 CB LYS A 9 -2.288 6.582 3.388 1.00 0.00 C ATOM 126 CG LYS A 9 -1.871 7.362 4.626 1.00 0.00 C ATOM 127 CD LYS A 9 -2.124 8.836 4.455 1.00 0.00 C ATOM 128 CE LYS A 9 -3.585 9.125 4.151 1.00 0.00 C ATOM 129 NZ LYS A 9 -3.827 10.555 3.949 1.00 0.00 N ATOM 0 H LYS A 9 -1.817 4.736 5.316 1.00 0.00 H new ATOM 0 HA LYS A 9 -2.043 4.716 2.397 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -2.010 7.152 2.502 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -3.374 6.488 3.379 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -2.421 6.995 5.492 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -0.813 7.193 4.825 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -1.830 9.363 5.363 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.501 9.221 3.647 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -3.886 8.576 3.259 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -4.205 8.764 4.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -4.835 10.711 3.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -3.564 11.077 4.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -3.255 10.894 3.150 1.00 0.00 H new ATOM 143 N GLY A 10 0.265 5.651 2.003 1.00 0.00 N ATOM 144 CA GLY A 10 1.643 5.829 1.737 1.00 0.00 C ATOM 145 C GLY A 10 1.964 5.466 0.316 1.00 0.00 C ATOM 146 O GLY A 10 1.221 5.820 -0.613 1.00 0.00 O ATOM 0 H GLY A 10 -0.336 5.773 1.188 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.923 6.866 1.924 1.00 0.00 H new ATOM 0 HA3 GLY A 10 2.232 5.212 2.416 1.00 0.00 H new ATOM 150 N VAL A 11 3.030 4.752 0.152 1.00 0.00 N ATOM 151 CA VAL A 11 3.509 4.325 -1.120 1.00 0.00 C ATOM 152 C VAL A 11 3.617 2.801 -1.128 1.00 0.00 C ATOM 153 O VAL A 11 4.212 2.187 -0.234 1.00 0.00 O ATOM 154 CB VAL A 11 4.894 4.966 -1.459 1.00 0.00 C ATOM 155 CG1 VAL A 11 5.422 4.484 -2.803 1.00 0.00 C ATOM 156 CG2 VAL A 11 4.804 6.488 -1.451 1.00 0.00 C ATOM 0 H VAL A 11 3.611 4.439 0.930 1.00 0.00 H new ATOM 0 HA VAL A 11 2.803 4.652 -1.883 1.00 0.00 H new ATOM 0 HB VAL A 11 5.594 4.648 -0.686 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.386 4.951 -3.004 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.541 3.401 -2.780 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.717 4.754 -3.589 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.780 6.911 -1.690 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.076 6.813 -2.194 1.00 0.00 H new ATOM 0 HG23 VAL A 11 4.492 6.829 -0.464 1.00 0.00 H new ATOM 166 N LEU A 12 3.037 2.229 -2.117 1.00 0.00 N ATOM 167 CA LEU A 12 3.019 0.817 -2.343 1.00 0.00 C ATOM 168 C LEU A 12 4.118 0.502 -3.316 1.00 0.00 C ATOM 169 O LEU A 12 4.077 0.960 -4.419 1.00 0.00 O ATOM 170 CB LEU A 12 1.668 0.436 -2.969 1.00 0.00 C ATOM 171 CG LEU A 12 1.557 -0.975 -3.533 1.00 0.00 C ATOM 172 CD1 LEU A 12 1.826 -2.027 -2.471 1.00 0.00 C ATOM 173 CD2 LEU A 12 0.202 -1.192 -4.143 1.00 0.00 C ATOM 0 H LEU A 12 2.533 2.753 -2.833 1.00 0.00 H new ATOM 0 HA LEU A 12 3.158 0.268 -1.412 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.893 0.564 -2.213 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.451 1.142 -3.770 1.00 0.00 H new ATOM 0 HG LEU A 12 2.318 -1.079 -4.307 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.737 -3.020 -2.912 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.833 -1.895 -2.074 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.101 -1.923 -1.664 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.140 -2.205 -4.541 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.566 -1.054 -3.382 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.047 -0.475 -4.949 1.00 0.00 H new ATOM 185 N ILE A 13 5.088 -0.253 -2.925 1.00 0.00 N ATOM 186 CA ILE A 13 6.173 -0.518 -3.815 1.00 0.00 C ATOM 187 C ILE A 13 6.330 -1.994 -4.172 1.00 0.00 C ATOM 188 O ILE A 13 6.371 -2.865 -3.310 1.00 0.00 O ATOM 189 CB ILE A 13 7.518 0.128 -3.334 1.00 0.00 C ATOM 190 CG1 ILE A 13 8.653 -0.146 -4.337 1.00 0.00 C ATOM 191 CG2 ILE A 13 7.901 -0.344 -1.932 1.00 0.00 C ATOM 192 CD1 ILE A 13 9.894 0.679 -4.099 1.00 0.00 C ATOM 0 H ILE A 13 5.155 -0.694 -2.008 1.00 0.00 H new ATOM 0 HA ILE A 13 5.904 -0.023 -4.748 1.00 0.00 H new ATOM 0 HB ILE A 13 7.362 1.206 -3.285 1.00 0.00 H new ATOM 0 HG12 ILE A 13 8.917 -1.203 -4.292 1.00 0.00 H new ATOM 0 HG13 ILE A 13 8.288 0.048 -5.345 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.838 0.125 -1.634 1.00 0.00 H new ATOM 0 HG22 ILE A 13 7.116 -0.067 -1.228 1.00 0.00 H new ATOM 0 HG23 ILE A 13 8.022 -1.427 -1.933 1.00 0.00 H new ATOM 0 HD11 ILE A 13 10.647 0.428 -4.846 1.00 0.00 H new ATOM 0 HD12 ILE A 13 9.647 1.738 -4.174 1.00 0.00 H new ATOM 0 HD13 ILE A 13 10.286 0.468 -3.104 1.00 0.00 H new ATOM 204 N GLU A 14 6.292 -2.252 -5.448 1.00 0.00 N ATOM 205 CA GLU A 14 6.639 -3.523 -6.017 1.00 0.00 C ATOM 206 C GLU A 14 7.677 -3.234 -7.021 1.00 0.00 C ATOM 207 O GLU A 14 7.582 -2.232 -7.739 1.00 0.00 O ATOM 208 CB GLU A 14 5.484 -4.179 -6.753 1.00 0.00 C ATOM 209 CG GLU A 14 5.850 -5.481 -7.496 1.00 0.00 C ATOM 210 CD GLU A 14 4.751 -5.980 -8.400 1.00 0.00 C ATOM 211 OE1 GLU A 14 4.514 -5.370 -9.443 1.00 0.00 O ATOM 212 OE2 GLU A 14 4.067 -6.953 -8.049 1.00 0.00 O ATOM 0 H GLU A 14 6.010 -1.561 -6.143 1.00 0.00 H new ATOM 0 HA GLU A 14 6.948 -4.197 -5.218 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.691 -4.396 -6.037 1.00 0.00 H new ATOM 0 HB3 GLU A 14 5.078 -3.468 -7.472 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.750 -5.313 -8.088 1.00 0.00 H new ATOM 0 HG3 GLU A 14 6.089 -6.254 -6.765 1.00 0.00 H new ATOM 219 N CYS A 15 8.602 -4.070 -7.096 1.00 0.00 N ATOM 220 CA CYS A 15 9.654 -3.968 -8.004 1.00 0.00 C ATOM 221 C CYS A 15 10.135 -5.365 -8.143 1.00 0.00 C ATOM 222 O CYS A 15 9.394 -6.300 -7.825 1.00 0.00 O ATOM 223 CB CYS A 15 10.756 -3.094 -7.404 1.00 0.00 C ATOM 224 SG CYS A 15 12.001 -2.481 -8.584 1.00 0.00 S ATOM 0 H CYS A 15 8.658 -4.893 -6.497 1.00 0.00 H new ATOM 0 HA CYS A 15 9.364 -3.524 -8.956 1.00 0.00 H new ATOM 0 HB2 CYS A 15 10.291 -2.238 -6.916 1.00 0.00 H new ATOM 0 HB3 CYS A 15 11.266 -3.665 -6.628 1.00 0.00 H new ATOM 0 HG CYS A 15 13.086 -3.189 -8.477 1.00 0.00 H new ATOM 230 N ASP A 16 11.328 -5.520 -8.598 1.00 0.00 N ATOM 231 CA ASP A 16 11.962 -6.791 -8.641 1.00 0.00 C ATOM 232 C ASP A 16 11.995 -7.412 -7.236 1.00 0.00 C ATOM 233 O ASP A 16 12.183 -6.704 -6.234 1.00 0.00 O ATOM 234 CB ASP A 16 13.368 -6.656 -9.195 1.00 0.00 C ATOM 235 CG ASP A 16 14.193 -5.585 -8.517 1.00 0.00 C ATOM 236 OD1 ASP A 16 14.165 -4.410 -8.984 1.00 0.00 O ATOM 237 OD2 ASP A 16 14.889 -5.875 -7.551 1.00 0.00 O ATOM 0 H ASP A 16 11.900 -4.756 -8.957 1.00 0.00 H new ATOM 0 HA ASP A 16 11.393 -7.448 -9.298 1.00 0.00 H new ATOM 0 HB2 ASP A 16 13.881 -7.613 -9.096 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.309 -6.435 -10.261 1.00 0.00 H new ATOM 242 N PRO A 17 11.788 -8.732 -7.133 1.00 0.00 N ATOM 243 CA PRO A 17 11.768 -9.448 -5.838 1.00 0.00 C ATOM 244 C PRO A 17 13.122 -9.391 -5.136 1.00 0.00 C ATOM 245 O PRO A 17 13.234 -9.620 -3.918 1.00 0.00 O ATOM 246 CB PRO A 17 11.413 -10.873 -6.250 1.00 0.00 C ATOM 247 CG PRO A 17 10.722 -10.691 -7.548 1.00 0.00 C ATOM 248 CD PRO A 17 11.510 -9.654 -8.245 1.00 0.00 C ATOM 0 HA PRO A 17 11.069 -9.016 -5.121 1.00 0.00 H new ATOM 0 HB2 PRO A 17 12.302 -11.496 -6.351 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.768 -11.355 -5.515 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.697 -11.620 -8.118 1.00 0.00 H new ATOM 0 HG3 PRO A 17 9.688 -10.376 -7.406 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.422 -10.055 -8.688 1.00 0.00 H new ATOM 0 HD3 PRO A 17 10.948 -9.177 -9.048 1.00 0.00 H new ATOM 256 N ALA A 18 14.123 -9.040 -5.912 1.00 0.00 N ATOM 257 CA ALA A 18 15.468 -8.825 -5.456 1.00 0.00 C ATOM 258 C ALA A 18 15.481 -7.654 -4.487 1.00 0.00 C ATOM 259 O ALA A 18 16.049 -7.747 -3.379 1.00 0.00 O ATOM 260 CB ALA A 18 16.305 -8.504 -6.642 1.00 0.00 C ATOM 0 H ALA A 18 14.013 -8.892 -6.915 1.00 0.00 H new ATOM 0 HA ALA A 18 15.854 -9.710 -4.951 1.00 0.00 H new ATOM 0 HB1 ALA A 18 17.334 -8.335 -6.326 1.00 0.00 H new ATOM 0 HB2 ALA A 18 16.273 -9.336 -7.346 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.922 -7.605 -7.125 1.00 0.00 H new ATOM 266 N MET A 19 14.792 -6.566 -4.884 1.00 0.00 N ATOM 267 CA MET A 19 14.627 -5.390 -4.038 1.00 0.00 C ATOM 268 C MET A 19 13.934 -5.782 -2.804 1.00 0.00 C ATOM 269 O MET A 19 14.320 -5.397 -1.710 1.00 0.00 O ATOM 270 CB MET A 19 13.750 -4.319 -4.722 1.00 0.00 C ATOM 271 CG MET A 19 13.083 -3.368 -3.704 1.00 0.00 C ATOM 272 SD MET A 19 12.052 -2.088 -4.434 1.00 0.00 S ATOM 273 CE MET A 19 13.268 -1.118 -5.319 1.00 0.00 C ATOM 0 H MET A 19 14.341 -6.487 -5.795 1.00 0.00 H new ATOM 0 HA MET A 19 15.619 -4.983 -3.842 1.00 0.00 H new ATOM 0 HB2 MET A 19 14.362 -3.738 -5.411 1.00 0.00 H new ATOM 0 HB3 MET A 19 12.979 -4.810 -5.316 1.00 0.00 H new ATOM 0 HG2 MET A 19 12.474 -3.959 -3.020 1.00 0.00 H new ATOM 0 HG3 MET A 19 13.862 -2.892 -3.108 1.00 0.00 H new ATOM 0 HE1 MET A 19 12.824 -0.171 -5.627 1.00 0.00 H new ATOM 0 HE2 MET A 19 14.122 -0.925 -4.670 1.00 0.00 H new ATOM 0 HE3 MET A 19 13.600 -1.667 -6.201 1.00 0.00 H new ATOM 283 N LYS A 20 12.946 -6.580 -2.986 1.00 0.00 N ATOM 284 CA LYS A 20 12.152 -7.026 -1.933 1.00 0.00 C ATOM 285 C LYS A 20 12.984 -7.753 -0.856 1.00 0.00 C ATOM 286 O LYS A 20 12.831 -7.473 0.361 1.00 0.00 O ATOM 287 CB LYS A 20 10.968 -7.836 -2.487 1.00 0.00 C ATOM 288 CG LYS A 20 10.202 -8.588 -1.457 1.00 0.00 C ATOM 289 CD LYS A 20 9.937 -7.739 -0.263 1.00 0.00 C ATOM 290 CE LYS A 20 9.437 -8.533 0.835 1.00 0.00 C ATOM 291 NZ LYS A 20 9.468 -7.720 2.033 1.00 0.00 N ATOM 0 H LYS A 20 12.671 -6.942 -3.899 1.00 0.00 H new ATOM 0 HA LYS A 20 11.724 -6.173 -1.406 1.00 0.00 H new ATOM 0 HB2 LYS A 20 10.289 -7.157 -3.003 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.341 -8.540 -3.231 1.00 0.00 H new ATOM 0 HG2 LYS A 20 9.258 -8.932 -1.880 1.00 0.00 H new ATOM 0 HG3 LYS A 20 10.760 -9.476 -1.160 1.00 0.00 H new ATOM 0 HD2 LYS A 20 10.854 -7.232 0.038 1.00 0.00 H new ATOM 0 HD3 LYS A 20 9.213 -6.965 -0.516 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.420 -8.868 0.629 1.00 0.00 H new ATOM 0 HE3 LYS A 20 10.047 -9.427 0.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 9.241 -8.310 2.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.417 -7.310 2.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 8.768 -6.955 1.952 1.00 0.00 H new ATOM 305 N GLN A 21 13.883 -8.598 -1.263 1.00 0.00 N ATOM 306 CA GLN A 21 14.659 -9.301 -0.287 1.00 0.00 C ATOM 307 C GLN A 21 15.639 -8.361 0.420 1.00 0.00 C ATOM 308 O GLN A 21 15.866 -8.491 1.628 1.00 0.00 O ATOM 309 CB GLN A 21 15.343 -10.530 -0.850 1.00 0.00 C ATOM 310 CG GLN A 21 14.415 -11.534 -1.529 1.00 0.00 C ATOM 311 CD GLN A 21 13.123 -11.805 -0.803 1.00 0.00 C ATOM 312 OE1 GLN A 21 12.083 -11.190 -1.251 1.00 0.00 O flip ATOM 313 NE2 GLN A 21 13.058 -12.652 0.075 1.00 0.00 N flip ATOM 0 H GLN A 21 14.094 -8.814 -2.237 1.00 0.00 H new ATOM 0 HA GLN A 21 13.962 -9.674 0.464 1.00 0.00 H new ATOM 0 HB2 GLN A 21 16.096 -10.210 -1.570 1.00 0.00 H new ATOM 0 HB3 GLN A 21 15.870 -11.036 -0.041 1.00 0.00 H new ATOM 0 HG2 GLN A 21 14.182 -11.170 -2.530 1.00 0.00 H new ATOM 0 HG3 GLN A 21 14.950 -12.476 -1.649 1.00 0.00 H new ATOM 0 HE21 GLN A 21 13.906 -13.115 0.401 1.00 0.00 H new ATOM 0 HE22 GLN A 21 12.155 -12.896 0.482 1.00 0.00 H new ATOM 322 N PHE A 22 16.188 -7.391 -0.306 1.00 0.00 N ATOM 323 CA PHE A 22 17.035 -6.407 0.340 1.00 0.00 C ATOM 324 C PHE A 22 16.275 -5.467 1.275 1.00 0.00 C ATOM 325 O PHE A 22 16.817 -5.009 2.228 1.00 0.00 O ATOM 326 CB PHE A 22 18.164 -5.740 -0.492 1.00 0.00 C ATOM 327 CG PHE A 22 17.776 -4.793 -1.591 1.00 0.00 C ATOM 328 CD1 PHE A 22 17.260 -3.539 -1.301 1.00 0.00 C ATOM 329 CD2 PHE A 22 17.984 -5.133 -2.911 1.00 0.00 C ATOM 330 CE1 PHE A 22 16.958 -2.649 -2.308 1.00 0.00 C ATOM 331 CE2 PHE A 22 17.678 -4.250 -3.922 1.00 0.00 C ATOM 332 CZ PHE A 22 17.164 -3.008 -3.621 1.00 0.00 C ATOM 0 H PHE A 22 16.064 -7.270 -1.311 1.00 0.00 H new ATOM 0 HA PHE A 22 17.649 -7.041 0.980 1.00 0.00 H new ATOM 0 HB2 PHE A 22 18.811 -5.200 0.199 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.764 -6.535 -0.935 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.093 -3.256 -0.272 1.00 0.00 H new ATOM 0 HD2 PHE A 22 18.392 -6.103 -3.155 1.00 0.00 H new ATOM 0 HE1 PHE A 22 16.561 -1.674 -2.068 1.00 0.00 H new ATOM 0 HE2 PHE A 22 17.841 -4.531 -4.952 1.00 0.00 H new ATOM 0 HZ PHE A 22 16.923 -2.316 -4.415 1.00 0.00 H new ATOM 342 N LEU A 23 15.022 -5.163 0.952 1.00 0.00 N ATOM 343 CA LEU A 23 14.140 -4.356 1.826 1.00 0.00 C ATOM 344 C LEU A 23 13.996 -5.036 3.173 1.00 0.00 C ATOM 345 O LEU A 23 13.903 -4.393 4.199 1.00 0.00 O ATOM 346 CB LEU A 23 12.751 -4.269 1.180 1.00 0.00 C ATOM 347 CG LEU A 23 12.401 -3.009 0.385 1.00 0.00 C ATOM 348 CD1 LEU A 23 13.581 -2.497 -0.422 1.00 0.00 C ATOM 349 CD2 LEU A 23 11.235 -3.317 -0.540 1.00 0.00 C ATOM 0 H LEU A 23 14.579 -5.462 0.083 1.00 0.00 H new ATOM 0 HA LEU A 23 14.569 -3.363 1.956 1.00 0.00 H new ATOM 0 HB2 LEU A 23 12.639 -5.125 0.514 1.00 0.00 H new ATOM 0 HB3 LEU A 23 12.009 -4.381 1.970 1.00 0.00 H new ATOM 0 HG LEU A 23 12.129 -2.225 1.092 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.286 -1.602 -0.970 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.404 -2.256 0.250 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.901 -3.265 -1.127 1.00 0.00 H new ATOM 0 HD21 LEU A 23 10.978 -2.425 -1.111 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.515 -4.118 -1.224 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.374 -3.630 0.051 1.00 0.00 H new ATOM 361 N LEU A 24 13.994 -6.338 3.151 1.00 0.00 N ATOM 362 CA LEU A 24 13.973 -7.117 4.369 1.00 0.00 C ATOM 363 C LEU A 24 15.289 -6.930 5.137 1.00 0.00 C ATOM 364 O LEU A 24 15.290 -6.700 6.340 1.00 0.00 O ATOM 365 CB LEU A 24 13.734 -8.555 4.002 1.00 0.00 C ATOM 366 CG LEU A 24 12.380 -8.854 3.432 1.00 0.00 C ATOM 367 CD1 LEU A 24 12.379 -10.244 2.868 1.00 0.00 C ATOM 368 CD2 LEU A 24 11.307 -8.694 4.502 1.00 0.00 C ATOM 0 H LEU A 24 14.007 -6.893 2.296 1.00 0.00 H new ATOM 0 HA LEU A 24 13.171 -6.784 5.028 1.00 0.00 H new ATOM 0 HB2 LEU A 24 14.490 -8.859 3.278 1.00 0.00 H new ATOM 0 HB3 LEU A 24 13.879 -9.169 4.891 1.00 0.00 H new ATOM 0 HG LEU A 24 12.155 -8.149 2.632 1.00 0.00 H new ATOM 0 HD11 LEU A 24 11.397 -10.467 2.452 1.00 0.00 H new ATOM 0 HD12 LEU A 24 13.131 -10.319 2.083 1.00 0.00 H new ATOM 0 HD13 LEU A 24 12.609 -10.958 3.659 1.00 0.00 H new ATOM 0 HD21 LEU A 24 10.330 -8.914 4.073 1.00 0.00 H new ATOM 0 HD22 LEU A 24 11.506 -9.383 5.323 1.00 0.00 H new ATOM 0 HD23 LEU A 24 11.316 -7.670 4.876 1.00 0.00 H new ATOM 380 N TYR A 25 16.396 -6.974 4.399 1.00 0.00 N ATOM 381 CA TYR A 25 17.732 -6.722 4.949 1.00 0.00 C ATOM 382 C TYR A 25 17.810 -5.312 5.542 1.00 0.00 C ATOM 383 O TYR A 25 18.363 -5.101 6.614 1.00 0.00 O ATOM 384 CB TYR A 25 18.803 -6.913 3.847 1.00 0.00 C ATOM 385 CG TYR A 25 20.174 -6.368 4.201 1.00 0.00 C ATOM 386 CD1 TYR A 25 20.889 -6.880 5.258 1.00 0.00 C ATOM 387 CD2 TYR A 25 20.733 -5.316 3.485 1.00 0.00 C ATOM 388 CE1 TYR A 25 22.120 -6.378 5.602 1.00 0.00 C ATOM 389 CE2 TYR A 25 21.967 -4.800 3.823 1.00 0.00 C ATOM 390 CZ TYR A 25 22.656 -5.339 4.883 1.00 0.00 C ATOM 391 OH TYR A 25 23.883 -4.826 5.242 1.00 0.00 O ATOM 0 H TYR A 25 16.395 -7.185 3.401 1.00 0.00 H new ATOM 0 HA TYR A 25 17.925 -7.437 5.749 1.00 0.00 H new ATOM 0 HB2 TYR A 25 18.894 -7.977 3.627 1.00 0.00 H new ATOM 0 HB3 TYR A 25 18.458 -6.428 2.934 1.00 0.00 H new ATOM 0 HD1 TYR A 25 20.473 -7.696 5.831 1.00 0.00 H new ATOM 0 HD2 TYR A 25 20.192 -4.895 2.650 1.00 0.00 H new ATOM 0 HE1 TYR A 25 22.664 -6.799 6.435 1.00 0.00 H new ATOM 0 HE2 TYR A 25 22.388 -3.980 3.260 1.00 0.00 H new ATOM 0 HH TYR A 25 24.123 -4.096 4.634 1.00 0.00 H new ATOM 401 N LEU A 26 17.248 -4.369 4.836 1.00 0.00 N ATOM 402 CA LEU A 26 17.194 -2.996 5.252 1.00 0.00 C ATOM 403 C LEU A 26 16.356 -2.813 6.489 1.00 0.00 C ATOM 404 O LEU A 26 16.631 -1.944 7.267 1.00 0.00 O ATOM 405 CB LEU A 26 16.780 -2.043 4.120 1.00 0.00 C ATOM 406 CG LEU A 26 17.911 -1.377 3.318 1.00 0.00 C ATOM 407 CD1 LEU A 26 18.726 -0.451 4.209 1.00 0.00 C ATOM 408 CD2 LEU A 26 18.810 -2.410 2.665 1.00 0.00 C ATOM 0 H LEU A 26 16.804 -4.539 3.933 1.00 0.00 H new ATOM 0 HA LEU A 26 18.214 -2.718 5.517 1.00 0.00 H new ATOM 0 HB2 LEU A 26 16.152 -2.598 3.423 1.00 0.00 H new ATOM 0 HB3 LEU A 26 16.161 -1.256 4.550 1.00 0.00 H new ATOM 0 HG LEU A 26 17.451 -0.786 2.526 1.00 0.00 H new ATOM 0 HD11 LEU A 26 19.521 0.011 3.623 1.00 0.00 H new ATOM 0 HD12 LEU A 26 18.078 0.325 4.616 1.00 0.00 H new ATOM 0 HD13 LEU A 26 19.163 -1.024 5.026 1.00 0.00 H new ATOM 0 HD21 LEU A 26 19.598 -1.905 2.106 1.00 0.00 H new ATOM 0 HD22 LEU A 26 19.257 -3.041 3.433 1.00 0.00 H new ATOM 0 HD23 LEU A 26 18.222 -3.027 1.986 1.00 0.00 H new ATOM 420 N ASP A 27 15.324 -3.611 6.651 1.00 0.00 N ATOM 421 CA ASP A 27 14.531 -3.571 7.882 1.00 0.00 C ATOM 422 C ASP A 27 15.369 -4.043 9.070 1.00 0.00 C ATOM 423 O ASP A 27 15.319 -3.451 10.155 1.00 0.00 O ATOM 424 CB ASP A 27 13.253 -4.412 7.761 1.00 0.00 C ATOM 425 CG ASP A 27 12.462 -4.483 9.063 1.00 0.00 C ATOM 426 OD1 ASP A 27 11.972 -3.436 9.550 1.00 0.00 O ATOM 427 OD2 ASP A 27 12.343 -5.584 9.641 1.00 0.00 O ATOM 0 H ASP A 27 15.008 -4.292 5.960 1.00 0.00 H new ATOM 0 HA ASP A 27 14.230 -2.537 8.048 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.620 -3.991 6.980 1.00 0.00 H new ATOM 0 HB3 ASP A 27 13.517 -5.422 7.447 1.00 0.00 H new ATOM 432 N GLU A 28 16.167 -5.084 8.845 1.00 0.00 N ATOM 433 CA GLU A 28 17.039 -5.642 9.881 1.00 0.00 C ATOM 434 C GLU A 28 18.216 -4.700 10.180 1.00 0.00 C ATOM 435 O GLU A 28 18.594 -4.499 11.333 1.00 0.00 O ATOM 436 CB GLU A 28 17.616 -6.991 9.438 1.00 0.00 C ATOM 437 CG GLU A 28 16.599 -8.026 9.005 1.00 0.00 C ATOM 438 CD GLU A 28 17.248 -9.355 8.712 1.00 0.00 C ATOM 439 OE1 GLU A 28 17.881 -9.514 7.637 1.00 0.00 O ATOM 440 OE2 GLU A 28 17.163 -10.260 9.560 1.00 0.00 O ATOM 0 H GLU A 28 16.229 -5.563 7.947 1.00 0.00 H new ATOM 0 HA GLU A 28 16.429 -5.769 10.775 1.00 0.00 H new ATOM 0 HB2 GLU A 28 18.306 -6.817 8.612 1.00 0.00 H new ATOM 0 HB3 GLU A 28 18.201 -7.404 10.260 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.851 -8.151 9.788 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.075 -7.673 8.117 1.00 0.00 H new ATOM 447 N SER A 29 18.796 -4.163 9.136 1.00 0.00 N ATOM 448 CA SER A 29 19.953 -3.294 9.226 1.00 0.00 C ATOM 449 C SER A 29 19.538 -1.883 9.672 1.00 0.00 C ATOM 450 O SER A 29 20.067 -1.348 10.640 1.00 0.00 O ATOM 451 CB SER A 29 20.635 -3.269 7.837 1.00 0.00 C ATOM 452 OG SER A 29 21.777 -2.442 7.783 1.00 0.00 O ATOM 0 H SER A 29 18.475 -4.318 8.180 1.00 0.00 H new ATOM 0 HA SER A 29 20.653 -3.668 9.973 1.00 0.00 H new ATOM 0 HB2 SER A 29 20.919 -4.285 7.563 1.00 0.00 H new ATOM 0 HB3 SER A 29 19.914 -2.928 7.094 1.00 0.00 H new ATOM 0 HG SER A 29 22.160 -2.472 6.882 1.00 0.00 H new ATOM 458 N ASN A 30 18.566 -1.339 8.965 1.00 0.00 N ATOM 459 CA ASN A 30 17.995 -0.006 9.145 1.00 0.00 C ATOM 460 C ASN A 30 19.014 1.086 9.418 1.00 0.00 C ATOM 461 O ASN A 30 19.200 1.544 10.554 1.00 0.00 O ATOM 462 CB ASN A 30 16.811 0.010 10.110 1.00 0.00 C ATOM 463 CG ASN A 30 16.139 1.369 10.203 1.00 0.00 C ATOM 464 OD1 ASN A 30 16.204 2.185 9.269 1.00 0.00 O ATOM 465 ND2 ASN A 30 15.469 1.610 11.292 1.00 0.00 N ATOM 0 H ASN A 30 18.121 -1.844 8.199 1.00 0.00 H new ATOM 0 HA ASN A 30 17.588 0.253 8.168 1.00 0.00 H new ATOM 0 HB2 ASN A 30 16.078 -0.730 9.789 1.00 0.00 H new ATOM 0 HB3 ASN A 30 17.153 -0.289 11.101 1.00 0.00 H new ATOM 0 HD21 ASN A 30 14.973 2.495 11.401 1.00 0.00 H new ATOM 0 HD22 ASN A 30 15.439 0.914 12.037 1.00 0.00 H new ATOM 472 N ALA A 31 19.748 1.407 8.379 1.00 0.00 N ATOM 473 CA ALA A 31 20.719 2.480 8.393 1.00 0.00 C ATOM 474 C ALA A 31 20.051 3.855 8.445 1.00 0.00 C ATOM 475 O ALA A 31 20.638 4.829 8.924 1.00 0.00 O ATOM 476 CB ALA A 31 21.645 2.365 7.196 1.00 0.00 C ATOM 0 H ALA A 31 19.688 0.922 7.484 1.00 0.00 H new ATOM 0 HA ALA A 31 21.311 2.383 9.303 1.00 0.00 H new ATOM 0 HB1 ALA A 31 22.371 3.178 7.218 1.00 0.00 H new ATOM 0 HB2 ALA A 31 22.169 1.410 7.232 1.00 0.00 H new ATOM 0 HB3 ALA A 31 21.061 2.425 6.277 1.00 0.00 H new ATOM 482 N LEU A 32 18.817 3.916 7.983 1.00 0.00 N ATOM 483 CA LEU A 32 18.111 5.181 7.836 1.00 0.00 C ATOM 484 C LEU A 32 17.491 5.627 9.143 1.00 0.00 C ATOM 485 O LEU A 32 17.199 6.797 9.322 1.00 0.00 O ATOM 486 CB LEU A 32 17.001 4.999 6.813 1.00 0.00 C ATOM 487 CG LEU A 32 17.438 4.648 5.394 1.00 0.00 C ATOM 488 CD1 LEU A 32 16.269 4.088 4.634 1.00 0.00 C ATOM 489 CD2 LEU A 32 17.964 5.885 4.681 1.00 0.00 C ATOM 0 H LEU A 32 18.276 3.099 7.700 1.00 0.00 H new ATOM 0 HA LEU A 32 18.826 5.939 7.517 1.00 0.00 H new ATOM 0 HB2 LEU A 32 16.333 4.214 7.169 1.00 0.00 H new ATOM 0 HB3 LEU A 32 16.418 5.919 6.773 1.00 0.00 H new ATOM 0 HG LEU A 32 18.234 3.905 5.443 1.00 0.00 H new ATOM 0 HD11 LEU A 32 16.581 3.837 3.620 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.906 3.190 5.135 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.471 4.830 4.595 1.00 0.00 H new ATOM 0 HD21 LEU A 32 18.272 5.619 3.670 1.00 0.00 H new ATOM 0 HD22 LEU A 32 17.179 6.640 4.634 1.00 0.00 H new ATOM 0 HD23 LEU A 32 18.819 6.284 5.227 1.00 0.00 H new ATOM 501 N GLY A 33 17.321 4.704 10.055 1.00 0.00 N ATOM 502 CA GLY A 33 16.746 5.029 11.334 1.00 0.00 C ATOM 503 C GLY A 33 15.229 5.127 11.283 1.00 0.00 C ATOM 504 O GLY A 33 14.611 5.681 12.189 1.00 0.00 O ATOM 0 H GLY A 33 17.572 3.723 9.935 1.00 0.00 H new ATOM 0 HA2 GLY A 33 17.033 4.270 12.061 1.00 0.00 H new ATOM 0 HA3 GLY A 33 17.156 5.977 11.683 1.00 0.00 H new ATOM 508 N LYS A 34 14.626 4.586 10.231 1.00 0.00 N ATOM 509 CA LYS A 34 13.173 4.619 10.077 1.00 0.00 C ATOM 510 C LYS A 34 12.669 3.275 9.603 1.00 0.00 C ATOM 511 O LYS A 34 13.351 2.577 8.853 1.00 0.00 O ATOM 512 CB LYS A 34 12.667 5.662 9.046 1.00 0.00 C ATOM 513 CG LYS A 34 12.892 7.148 9.327 1.00 0.00 C ATOM 514 CD LYS A 34 14.274 7.611 8.924 1.00 0.00 C ATOM 515 CE LYS A 34 14.401 9.125 9.002 1.00 0.00 C ATOM 516 NZ LYS A 34 14.279 9.644 10.381 1.00 0.00 N ATOM 0 H LYS A 34 15.119 4.118 9.470 1.00 0.00 H new ATOM 0 HA LYS A 34 12.795 4.889 11.063 1.00 0.00 H new ATOM 0 HB2 LYS A 34 13.135 5.433 8.089 1.00 0.00 H new ATOM 0 HB3 LYS A 34 11.595 5.509 8.921 1.00 0.00 H new ATOM 0 HG2 LYS A 34 12.145 7.733 8.790 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.744 7.340 10.390 1.00 0.00 H new ATOM 0 HD2 LYS A 34 15.017 7.149 9.574 1.00 0.00 H new ATOM 0 HD3 LYS A 34 14.488 7.279 7.908 1.00 0.00 H new ATOM 0 HE2 LYS A 34 15.365 9.425 8.591 1.00 0.00 H new ATOM 0 HE3 LYS A 34 13.632 9.581 8.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 14.374 10.680 10.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 13.349 9.385 10.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 15.028 9.233 10.974 1.00 0.00 H new ATOM 530 N LYS A 35 11.490 2.918 10.018 1.00 0.00 N ATOM 531 CA LYS A 35 10.869 1.722 9.526 1.00 0.00 C ATOM 532 C LYS A 35 10.076 2.048 8.289 1.00 0.00 C ATOM 533 O LYS A 35 8.963 2.569 8.360 1.00 0.00 O ATOM 534 CB LYS A 35 9.997 1.027 10.576 1.00 0.00 C ATOM 535 CG LYS A 35 10.761 0.391 11.729 1.00 0.00 C ATOM 536 CD LYS A 35 11.740 -0.652 11.218 1.00 0.00 C ATOM 537 CE LYS A 35 12.283 -1.516 12.335 1.00 0.00 C ATOM 538 NZ LYS A 35 13.197 -2.552 11.816 1.00 0.00 N ATOM 0 H LYS A 35 10.937 3.439 10.698 1.00 0.00 H new ATOM 0 HA LYS A 35 11.659 1.012 9.280 1.00 0.00 H new ATOM 0 HB2 LYS A 35 9.295 1.755 10.983 1.00 0.00 H new ATOM 0 HB3 LYS A 35 9.406 0.256 10.082 1.00 0.00 H new ATOM 0 HG2 LYS A 35 11.299 1.160 12.283 1.00 0.00 H new ATOM 0 HG3 LYS A 35 10.060 -0.071 12.424 1.00 0.00 H new ATOM 0 HD2 LYS A 35 11.245 -1.283 10.480 1.00 0.00 H new ATOM 0 HD3 LYS A 35 12.566 -0.155 10.710 1.00 0.00 H new ATOM 0 HE2 LYS A 35 12.810 -0.892 13.057 1.00 0.00 H new ATOM 0 HE3 LYS A 35 11.457 -1.990 12.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 13.513 -3.160 12.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.701 -3.129 11.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 14.022 -2.098 11.376 1.00 0.00 H new ATOM 552 N PHE A 36 10.681 1.790 7.164 1.00 0.00 N ATOM 553 CA PHE A 36 10.070 2.047 5.886 1.00 0.00 C ATOM 554 C PHE A 36 9.021 0.989 5.578 1.00 0.00 C ATOM 555 O PHE A 36 7.902 1.316 5.237 1.00 0.00 O ATOM 556 CB PHE A 36 11.151 2.130 4.764 1.00 0.00 C ATOM 557 CG PHE A 36 12.019 0.903 4.651 1.00 0.00 C ATOM 558 CD1 PHE A 36 13.114 0.744 5.479 1.00 0.00 C ATOM 559 CD2 PHE A 36 11.721 -0.103 3.737 1.00 0.00 C ATOM 560 CE1 PHE A 36 13.884 -0.382 5.408 1.00 0.00 C ATOM 561 CE2 PHE A 36 12.498 -1.232 3.666 1.00 0.00 C ATOM 562 CZ PHE A 36 13.573 -1.368 4.501 1.00 0.00 C ATOM 0 H PHE A 36 11.619 1.393 7.105 1.00 0.00 H new ATOM 0 HA PHE A 36 9.567 3.013 5.926 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.655 2.300 3.809 1.00 0.00 H new ATOM 0 HB3 PHE A 36 11.787 2.995 4.951 1.00 0.00 H new ATOM 0 HD1 PHE A 36 13.364 1.518 6.190 1.00 0.00 H new ATOM 0 HD2 PHE A 36 10.872 0.005 3.079 1.00 0.00 H new ATOM 0 HE1 PHE A 36 14.735 -0.498 6.063 1.00 0.00 H new ATOM 0 HE2 PHE A 36 12.262 -2.009 2.954 1.00 0.00 H new ATOM 0 HZ PHE A 36 14.183 -2.258 4.448 1.00 0.00 H new ATOM 572 N ILE A 37 9.378 -0.269 5.763 1.00 0.00 N ATOM 573 CA ILE A 37 8.486 -1.359 5.478 1.00 0.00 C ATOM 574 C ILE A 37 7.536 -1.529 6.657 1.00 0.00 C ATOM 575 O ILE A 37 7.927 -1.957 7.748 1.00 0.00 O ATOM 576 CB ILE A 37 9.300 -2.691 5.068 1.00 0.00 C ATOM 577 CG1 ILE A 37 8.439 -3.937 4.678 1.00 0.00 C ATOM 578 CG2 ILE A 37 10.333 -3.089 6.085 1.00 0.00 C ATOM 579 CD1 ILE A 37 7.668 -4.605 5.806 1.00 0.00 C ATOM 0 H ILE A 37 10.292 -0.555 6.114 1.00 0.00 H new ATOM 0 HA ILE A 37 7.874 -1.142 4.602 1.00 0.00 H new ATOM 0 HB ILE A 37 9.795 -2.373 4.151 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.727 -3.634 3.910 1.00 0.00 H new ATOM 0 HG13 ILE A 37 9.097 -4.680 4.227 1.00 0.00 H new ATOM 0 HG21 ILE A 37 10.845 -3.991 5.750 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.058 -2.283 6.202 1.00 0.00 H new ATOM 0 HG23 ILE A 37 9.847 -3.282 7.041 1.00 0.00 H new ATOM 0 HD11 ILE A 37 7.110 -5.455 5.412 1.00 0.00 H new ATOM 0 HD12 ILE A 37 8.366 -4.951 6.569 1.00 0.00 H new ATOM 0 HD13 ILE A 37 6.975 -3.889 6.247 1.00 0.00 H new ATOM 591 N ILE A 38 6.323 -1.092 6.446 1.00 0.00 N ATOM 592 CA ILE A 38 5.277 -1.202 7.434 1.00 0.00 C ATOM 593 C ILE A 38 4.681 -2.589 7.373 1.00 0.00 C ATOM 594 O ILE A 38 4.616 -3.308 8.369 1.00 0.00 O ATOM 595 CB ILE A 38 4.188 -0.131 7.193 1.00 0.00 C ATOM 596 CG1 ILE A 38 4.736 1.270 7.529 1.00 0.00 C ATOM 597 CG2 ILE A 38 2.909 -0.453 7.957 1.00 0.00 C ATOM 598 CD1 ILE A 38 3.768 2.407 7.267 1.00 0.00 C ATOM 0 H ILE A 38 6.028 -0.646 5.577 1.00 0.00 H new ATOM 0 HA ILE A 38 5.698 -1.034 8.425 1.00 0.00 H new ATOM 0 HB ILE A 38 3.921 -0.137 6.136 1.00 0.00 H new ATOM 0 HG12 ILE A 38 5.024 1.290 8.580 1.00 0.00 H new ATOM 0 HG13 ILE A 38 5.642 1.440 6.947 1.00 0.00 H new ATOM 0 HG21 ILE A 38 2.166 0.321 7.764 1.00 0.00 H new ATOM 0 HG22 ILE A 38 2.522 -1.418 7.629 1.00 0.00 H new ATOM 0 HG23 ILE A 38 3.123 -0.492 9.025 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.239 3.354 7.532 1.00 0.00 H new ATOM 0 HD12 ILE A 38 3.498 2.419 6.211 1.00 0.00 H new ATOM 0 HD13 ILE A 38 2.870 2.267 7.869 1.00 0.00 H new ATOM 610 N GLN A 39 4.266 -2.966 6.209 1.00 0.00 N ATOM 611 CA GLN A 39 3.812 -4.289 5.990 1.00 0.00 C ATOM 612 C GLN A 39 4.307 -4.725 4.674 1.00 0.00 C ATOM 613 O GLN A 39 4.420 -3.902 3.746 1.00 0.00 O ATOM 614 CB GLN A 39 2.271 -4.479 6.065 1.00 0.00 C ATOM 615 CG GLN A 39 1.454 -3.649 5.072 1.00 0.00 C ATOM 616 CD GLN A 39 0.032 -4.198 4.810 1.00 0.00 C ATOM 617 OE1 GLN A 39 -0.879 -3.441 4.557 1.00 0.00 O ATOM 618 NE2 GLN A 39 -0.142 -5.523 4.818 1.00 0.00 N ATOM 0 H GLN A 39 4.234 -2.363 5.387 1.00 0.00 H new ATOM 0 HA GLN A 39 4.206 -4.897 6.804 1.00 0.00 H new ATOM 0 HB2 GLN A 39 2.044 -5.533 5.903 1.00 0.00 H new ATOM 0 HB3 GLN A 39 1.941 -4.233 7.074 1.00 0.00 H new ATOM 0 HG2 GLN A 39 1.375 -2.629 5.447 1.00 0.00 H new ATOM 0 HG3 GLN A 39 1.993 -3.600 4.126 1.00 0.00 H new ATOM 0 HE21 GLN A 39 0.642 -6.139 5.034 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -1.058 -5.918 4.608 1.00 0.00 H new ATOM 627 N ASP A 40 4.694 -5.949 4.568 1.00 0.00 N ATOM 628 CA ASP A 40 4.989 -6.424 3.283 1.00 0.00 C ATOM 629 C ASP A 40 3.811 -7.168 2.749 1.00 0.00 C ATOM 630 O ASP A 40 3.337 -8.143 3.330 1.00 0.00 O ATOM 631 CB ASP A 40 6.346 -7.142 3.092 1.00 0.00 C ATOM 632 CG ASP A 40 6.566 -8.412 3.861 1.00 0.00 C ATOM 633 OD1 ASP A 40 6.020 -9.449 3.475 1.00 0.00 O ATOM 634 OD2 ASP A 40 7.410 -8.415 4.770 1.00 0.00 O ATOM 0 H ASP A 40 4.808 -6.612 5.334 1.00 0.00 H new ATOM 0 HA ASP A 40 5.163 -5.542 2.667 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.464 -7.365 2.032 1.00 0.00 H new ATOM 0 HB3 ASP A 40 7.138 -6.443 3.361 1.00 0.00 H new ATOM 639 N ILE A 41 3.287 -6.639 1.705 1.00 0.00 N ATOM 640 CA ILE A 41 2.118 -7.143 1.082 1.00 0.00 C ATOM 641 C ILE A 41 2.444 -8.212 0.038 1.00 0.00 C ATOM 642 O ILE A 41 3.617 -8.530 -0.215 1.00 0.00 O ATOM 643 CB ILE A 41 1.170 -6.021 0.494 1.00 0.00 C ATOM 644 CG1 ILE A 41 1.932 -4.821 -0.048 1.00 0.00 C ATOM 645 CG2 ILE A 41 0.154 -5.557 1.502 1.00 0.00 C ATOM 646 CD1 ILE A 41 2.328 -3.788 0.956 1.00 0.00 C ATOM 0 H ILE A 41 3.673 -5.815 1.244 1.00 0.00 H new ATOM 0 HA ILE A 41 1.548 -7.618 1.880 1.00 0.00 H new ATOM 0 HB ILE A 41 0.653 -6.494 -0.341 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.833 -5.182 -0.543 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.319 -4.341 -0.811 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -0.475 -4.787 1.056 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -0.466 -6.400 1.808 1.00 0.00 H new ATOM 0 HG23 ILE A 41 0.666 -5.148 2.373 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.864 -2.981 0.456 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.436 -3.387 1.437 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.973 -4.241 1.709 1.00 0.00 H new ATOM 658 N ASP A 42 1.409 -8.653 -0.605 1.00 0.00 N ATOM 659 CA ASP A 42 1.333 -9.821 -1.468 1.00 0.00 C ATOM 660 C ASP A 42 2.535 -10.153 -2.332 1.00 0.00 C ATOM 661 O ASP A 42 2.744 -9.578 -3.412 1.00 0.00 O ATOM 662 CB ASP A 42 0.073 -9.784 -2.311 1.00 0.00 C ATOM 663 CG ASP A 42 -0.121 -8.476 -3.061 1.00 0.00 C ATOM 664 OD1 ASP A 42 -0.402 -7.452 -2.397 1.00 0.00 O ATOM 665 OD2 ASP A 42 -0.038 -8.462 -4.317 1.00 0.00 O ATOM 0 H ASP A 42 0.511 -8.173 -0.543 1.00 0.00 H new ATOM 0 HA ASP A 42 1.315 -10.642 -0.751 1.00 0.00 H new ATOM 0 HB2 ASP A 42 0.102 -10.604 -3.029 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.790 -9.955 -1.667 1.00 0.00 H new ATOM 670 N ASP A 43 3.371 -11.023 -1.777 1.00 0.00 N ATOM 671 CA ASP A 43 4.419 -11.769 -2.487 1.00 0.00 C ATOM 672 C ASP A 43 5.643 -10.952 -2.899 1.00 0.00 C ATOM 673 O ASP A 43 6.779 -11.384 -2.716 1.00 0.00 O ATOM 674 CB ASP A 43 3.780 -12.549 -3.656 1.00 0.00 C ATOM 675 CG ASP A 43 4.725 -12.943 -4.741 1.00 0.00 C ATOM 676 OD1 ASP A 43 5.377 -14.007 -4.652 1.00 0.00 O ATOM 677 OD2 ASP A 43 4.811 -12.186 -5.731 1.00 0.00 O ATOM 0 H ASP A 43 3.341 -11.241 -0.781 1.00 0.00 H new ATOM 0 HA ASP A 43 4.847 -12.474 -1.774 1.00 0.00 H new ATOM 0 HB2 ASP A 43 3.310 -13.449 -3.259 1.00 0.00 H new ATOM 0 HB3 ASP A 43 2.987 -11.940 -4.089 1.00 0.00 H new ATOM 682 N THR A 44 5.414 -9.786 -3.380 1.00 0.00 N ATOM 683 CA THR A 44 6.493 -8.927 -3.908 1.00 0.00 C ATOM 684 C THR A 44 6.161 -7.452 -3.616 1.00 0.00 C ATOM 685 O THR A 44 6.759 -6.528 -4.156 1.00 0.00 O ATOM 686 CB THR A 44 6.697 -9.166 -5.474 1.00 0.00 C ATOM 687 OG1 THR A 44 6.858 -10.571 -5.735 1.00 0.00 O ATOM 688 CG2 THR A 44 7.957 -8.467 -6.031 1.00 0.00 C ATOM 0 H THR A 44 4.485 -9.369 -3.434 1.00 0.00 H new ATOM 0 HA THR A 44 7.429 -9.186 -3.413 1.00 0.00 H new ATOM 0 HB THR A 44 5.813 -8.752 -5.959 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.985 -11.014 -5.690 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.041 -8.666 -7.099 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.879 -7.392 -5.867 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.841 -8.849 -5.520 1.00 0.00 H new ATOM 696 N HIS A 45 5.235 -7.216 -2.715 1.00 0.00 N ATOM 697 CA HIS A 45 4.856 -5.857 -2.455 1.00 0.00 C ATOM 698 C HIS A 45 5.298 -5.418 -1.077 1.00 0.00 C ATOM 699 O HIS A 45 5.302 -6.193 -0.149 1.00 0.00 O ATOM 700 CB HIS A 45 3.355 -5.637 -2.695 1.00 0.00 C ATOM 701 CG HIS A 45 2.939 -5.734 -4.117 1.00 0.00 C ATOM 702 ND1 HIS A 45 2.835 -4.643 -4.933 1.00 0.00 N ATOM 703 CD2 HIS A 45 2.659 -6.803 -4.887 1.00 0.00 C ATOM 704 CE1 HIS A 45 2.527 -5.040 -6.142 1.00 0.00 C ATOM 705 NE2 HIS A 45 2.410 -6.343 -6.144 1.00 0.00 N ATOM 0 H HIS A 45 4.747 -7.925 -2.168 1.00 0.00 H new ATOM 0 HA HIS A 45 5.379 -5.219 -3.168 1.00 0.00 H new ATOM 0 HB2 HIS A 45 2.796 -6.371 -2.115 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.079 -4.653 -2.315 1.00 0.00 H new ATOM 0 HD2 HIS A 45 2.636 -7.834 -4.567 1.00 0.00 H new ATOM 0 HE1 HIS A 45 2.392 -4.396 -6.999 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.172 -6.918 -6.952 1.00 0.00 H new ATOM 714 N VAL A 46 5.741 -4.205 -0.975 1.00 0.00 N ATOM 715 CA VAL A 46 6.154 -3.611 0.279 1.00 0.00 C ATOM 716 C VAL A 46 5.479 -2.283 0.460 1.00 0.00 C ATOM 717 O VAL A 46 5.197 -1.601 -0.513 1.00 0.00 O ATOM 718 CB VAL A 46 7.718 -3.518 0.396 1.00 0.00 C ATOM 719 CG1 VAL A 46 8.179 -2.413 1.357 1.00 0.00 C ATOM 720 CG2 VAL A 46 8.240 -4.850 0.889 1.00 0.00 C ATOM 0 H VAL A 46 5.832 -3.577 -1.774 1.00 0.00 H new ATOM 0 HA VAL A 46 5.837 -4.260 1.095 1.00 0.00 H new ATOM 0 HB VAL A 46 8.112 -3.271 -0.590 1.00 0.00 H new ATOM 0 HG11 VAL A 46 9.268 -2.397 1.397 1.00 0.00 H new ATOM 0 HG12 VAL A 46 7.814 -1.448 1.004 1.00 0.00 H new ATOM 0 HG13 VAL A 46 7.782 -2.608 2.353 1.00 0.00 H new ATOM 0 HG21 VAL A 46 9.326 -4.805 0.977 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.806 -5.073 1.864 1.00 0.00 H new ATOM 0 HG23 VAL A 46 7.965 -5.633 0.182 1.00 0.00 H new ATOM 730 N PHE A 47 5.133 -1.962 1.672 1.00 0.00 N ATOM 731 CA PHE A 47 4.504 -0.724 1.923 1.00 0.00 C ATOM 732 C PHE A 47 5.416 0.165 2.713 1.00 0.00 C ATOM 733 O PHE A 47 5.946 -0.253 3.751 1.00 0.00 O ATOM 734 CB PHE A 47 3.218 -0.918 2.689 1.00 0.00 C ATOM 735 CG PHE A 47 2.352 0.250 2.569 1.00 0.00 C ATOM 736 CD1 PHE A 47 1.767 0.536 1.353 1.00 0.00 C ATOM 737 CD2 PHE A 47 2.154 1.086 3.623 1.00 0.00 C ATOM 738 CE1 PHE A 47 0.984 1.635 1.198 1.00 0.00 C ATOM 739 CE2 PHE A 47 1.381 2.196 3.472 1.00 0.00 C ATOM 740 CZ PHE A 47 0.789 2.466 2.256 1.00 0.00 C ATOM 0 H PHE A 47 5.281 -2.548 2.494 1.00 0.00 H new ATOM 0 HA PHE A 47 4.277 -0.261 0.962 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.698 -1.800 2.315 1.00 0.00 H new ATOM 0 HB3 PHE A 47 3.442 -1.102 3.740 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.934 -0.122 0.513 1.00 0.00 H new ATOM 0 HD2 PHE A 47 2.609 0.870 4.578 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.522 1.846 0.245 1.00 0.00 H new ATOM 0 HE2 PHE A 47 1.231 2.866 4.305 1.00 0.00 H new ATOM 0 HZ PHE A 47 0.167 3.342 2.144 1.00 0.00 H new ATOM 750 N VAL A 48 5.591 1.360 2.232 1.00 0.00 N ATOM 751 CA VAL A 48 6.370 2.368 2.893 1.00 0.00 C ATOM 752 C VAL A 48 5.513 3.614 3.004 1.00 0.00 C ATOM 753 O VAL A 48 4.690 3.870 2.149 1.00 0.00 O ATOM 754 CB VAL A 48 7.719 2.648 2.140 1.00 0.00 C ATOM 755 CG1 VAL A 48 7.497 3.010 0.680 1.00 0.00 C ATOM 756 CG2 VAL A 48 8.540 3.730 2.830 1.00 0.00 C ATOM 0 H VAL A 48 5.187 1.670 1.348 1.00 0.00 H new ATOM 0 HA VAL A 48 6.655 2.026 3.888 1.00 0.00 H new ATOM 0 HB VAL A 48 8.283 1.716 2.174 1.00 0.00 H new ATOM 0 HG11 VAL A 48 8.458 3.195 0.201 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.991 2.188 0.174 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.882 3.908 0.617 1.00 0.00 H new ATOM 0 HG21 VAL A 48 9.465 3.893 2.277 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.968 4.657 2.861 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.776 3.415 3.847 1.00 0.00 H new ATOM 766 N ILE A 49 5.656 4.360 4.055 1.00 0.00 N ATOM 767 CA ILE A 49 4.818 5.534 4.218 1.00 0.00 C ATOM 768 C ILE A 49 5.390 6.711 3.433 1.00 0.00 C ATOM 769 O ILE A 49 6.617 6.899 3.353 1.00 0.00 O ATOM 770 CB ILE A 49 4.576 5.905 5.702 1.00 0.00 C ATOM 771 CG1 ILE A 49 3.456 6.959 5.818 1.00 0.00 C ATOM 772 CG2 ILE A 49 5.862 6.363 6.394 1.00 0.00 C ATOM 773 CD1 ILE A 49 3.156 7.394 7.233 1.00 0.00 C ATOM 0 H ILE A 49 6.327 4.193 4.805 1.00 0.00 H new ATOM 0 HA ILE A 49 3.838 5.285 3.810 1.00 0.00 H new ATOM 0 HB ILE A 49 4.249 5.006 6.224 1.00 0.00 H new ATOM 0 HG12 ILE A 49 3.735 7.835 5.233 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.546 6.556 5.374 1.00 0.00 H new ATOM 0 HG21 ILE A 49 5.647 6.613 7.433 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.599 5.561 6.359 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.257 7.241 5.883 1.00 0.00 H new ATOM 0 HD11 ILE A 49 2.357 8.136 7.224 1.00 0.00 H new ATOM 0 HD12 ILE A 49 2.843 6.531 7.820 1.00 0.00 H new ATOM 0 HD13 ILE A 49 4.051 7.830 7.677 1.00 0.00 H new ATOM 785 N ALA A 50 4.501 7.505 2.879 1.00 0.00 N ATOM 786 CA ALA A 50 4.859 8.596 1.998 1.00 0.00 C ATOM 787 C ALA A 50 5.662 9.696 2.697 1.00 0.00 C ATOM 788 O ALA A 50 6.396 10.446 2.047 1.00 0.00 O ATOM 789 CB ALA A 50 3.624 9.164 1.332 1.00 0.00 C ATOM 0 H ALA A 50 3.497 7.411 3.029 1.00 0.00 H new ATOM 0 HA ALA A 50 5.517 8.181 1.234 1.00 0.00 H new ATOM 0 HB1 ALA A 50 3.910 9.983 0.673 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.134 8.384 0.749 1.00 0.00 H new ATOM 0 HB3 ALA A 50 2.937 9.534 2.094 1.00 0.00 H new ATOM 795 N GLU A 51 5.542 9.775 4.008 1.00 0.00 N ATOM 796 CA GLU A 51 6.250 10.783 4.770 1.00 0.00 C ATOM 797 C GLU A 51 7.760 10.567 4.755 1.00 0.00 C ATOM 798 O GLU A 51 8.521 11.525 4.659 1.00 0.00 O ATOM 799 CB GLU A 51 5.716 10.879 6.197 1.00 0.00 C ATOM 800 CG GLU A 51 4.284 11.378 6.264 1.00 0.00 C ATOM 801 CD GLU A 51 3.771 11.529 7.673 1.00 0.00 C ATOM 802 OE1 GLU A 51 4.277 12.398 8.417 1.00 0.00 O ATOM 803 OE2 GLU A 51 2.839 10.804 8.055 1.00 0.00 O ATOM 0 H GLU A 51 4.960 9.152 4.568 1.00 0.00 H new ATOM 0 HA GLU A 51 6.064 11.738 4.278 1.00 0.00 H new ATOM 0 HB2 GLU A 51 5.775 9.898 6.668 1.00 0.00 H new ATOM 0 HB3 GLU A 51 6.355 11.548 6.774 1.00 0.00 H new ATOM 0 HG2 GLU A 51 4.217 12.340 5.755 1.00 0.00 H new ATOM 0 HG3 GLU A 51 3.640 10.686 5.722 1.00 0.00 H new ATOM 810 N LEU A 52 8.206 9.322 4.797 1.00 0.00 N ATOM 811 CA LEU A 52 9.639 9.087 4.822 1.00 0.00 C ATOM 812 C LEU A 52 10.138 8.484 3.516 1.00 0.00 C ATOM 813 O LEU A 52 11.317 8.189 3.378 1.00 0.00 O ATOM 814 CB LEU A 52 10.073 8.285 6.074 1.00 0.00 C ATOM 815 CG LEU A 52 9.646 6.819 6.171 1.00 0.00 C ATOM 816 CD1 LEU A 52 10.664 5.879 5.532 1.00 0.00 C ATOM 817 CD2 LEU A 52 9.337 6.427 7.603 1.00 0.00 C ATOM 0 H LEU A 52 7.621 8.487 4.814 1.00 0.00 H new ATOM 0 HA LEU A 52 10.128 10.057 4.908 1.00 0.00 H new ATOM 0 HB2 LEU A 52 11.161 8.321 6.133 1.00 0.00 H new ATOM 0 HB3 LEU A 52 9.689 8.804 6.953 1.00 0.00 H new ATOM 0 HG LEU A 52 8.725 6.715 5.598 1.00 0.00 H new ATOM 0 HD11 LEU A 52 10.318 4.850 5.625 1.00 0.00 H new ATOM 0 HD12 LEU A 52 10.778 6.129 4.477 1.00 0.00 H new ATOM 0 HD13 LEU A 52 11.624 5.986 6.036 1.00 0.00 H new ATOM 0 HD21 LEU A 52 9.037 5.380 7.637 1.00 0.00 H new ATOM 0 HD22 LEU A 52 10.225 6.570 8.219 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.527 7.049 7.984 1.00 0.00 H new ATOM 829 N VAL A 53 9.244 8.339 2.530 1.00 0.00 N ATOM 830 CA VAL A 53 9.660 7.863 1.203 1.00 0.00 C ATOM 831 C VAL A 53 10.610 8.884 0.601 1.00 0.00 C ATOM 832 O VAL A 53 11.457 8.556 -0.188 1.00 0.00 O ATOM 833 CB VAL A 53 8.491 7.530 0.210 1.00 0.00 C ATOM 834 CG1 VAL A 53 7.775 8.773 -0.280 1.00 0.00 C ATOM 835 CG2 VAL A 53 8.990 6.699 -0.968 1.00 0.00 C ATOM 0 H VAL A 53 8.248 8.539 2.621 1.00 0.00 H new ATOM 0 HA VAL A 53 10.153 6.903 1.358 1.00 0.00 H new ATOM 0 HB VAL A 53 7.765 6.940 0.770 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.976 8.487 -0.964 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.351 9.308 0.570 1.00 0.00 H new ATOM 0 HG13 VAL A 53 8.482 9.420 -0.799 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.159 6.483 -1.639 1.00 0.00 H new ATOM 0 HG22 VAL A 53 9.757 7.256 -1.507 1.00 0.00 H new ATOM 0 HG23 VAL A 53 9.412 5.763 -0.601 1.00 0.00 H new ATOM 845 N ASN A 54 10.423 10.137 0.996 1.00 0.00 N ATOM 846 CA ASN A 54 11.283 11.248 0.598 1.00 0.00 C ATOM 847 C ASN A 54 12.753 10.914 0.914 1.00 0.00 C ATOM 848 O ASN A 54 13.648 11.204 0.127 1.00 0.00 O ATOM 849 CB ASN A 54 10.861 12.537 1.332 1.00 0.00 C ATOM 850 CG ASN A 54 9.392 12.906 1.122 1.00 0.00 C ATOM 851 OD1 ASN A 54 8.789 12.592 0.098 1.00 0.00 O ATOM 852 ND2 ASN A 54 8.811 13.567 2.082 1.00 0.00 N ATOM 0 H ASN A 54 9.659 10.416 1.611 1.00 0.00 H new ATOM 0 HA ASN A 54 11.180 11.408 -0.475 1.00 0.00 H new ATOM 0 HB2 ASN A 54 11.048 12.416 2.399 1.00 0.00 H new ATOM 0 HB3 ASN A 54 11.487 13.362 0.990 1.00 0.00 H new ATOM 0 HD21 ASN A 54 7.831 13.837 1.995 1.00 0.00 H new ATOM 0 HD22 ASN A 54 9.336 13.814 2.921 1.00 0.00 H new ATOM 859 N VAL A 55 12.965 10.211 2.039 1.00 0.00 N ATOM 860 CA VAL A 55 14.295 9.773 2.477 1.00 0.00 C ATOM 861 C VAL A 55 14.826 8.763 1.463 1.00 0.00 C ATOM 862 O VAL A 55 15.979 8.802 1.034 1.00 0.00 O ATOM 863 CB VAL A 55 14.209 9.098 3.887 1.00 0.00 C ATOM 864 CG1 VAL A 55 15.543 8.573 4.347 1.00 0.00 C ATOM 865 CG2 VAL A 55 13.649 10.056 4.920 1.00 0.00 C ATOM 0 H VAL A 55 12.214 9.931 2.670 1.00 0.00 H new ATOM 0 HA VAL A 55 14.960 10.634 2.544 1.00 0.00 H new ATOM 0 HB VAL A 55 13.531 8.251 3.785 1.00 0.00 H new ATOM 0 HG11 VAL A 55 15.434 8.114 5.329 1.00 0.00 H new ATOM 0 HG12 VAL A 55 15.906 7.830 3.637 1.00 0.00 H new ATOM 0 HG13 VAL A 55 16.256 9.395 4.408 1.00 0.00 H new ATOM 0 HG21 VAL A 55 13.601 9.559 5.889 1.00 0.00 H new ATOM 0 HG22 VAL A 55 14.295 10.931 4.992 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.648 10.368 4.622 1.00 0.00 H new ATOM 875 N LEU A 56 13.938 7.904 1.058 1.00 0.00 N ATOM 876 CA LEU A 56 14.189 6.885 0.070 1.00 0.00 C ATOM 877 C LEU A 56 14.484 7.476 -1.288 1.00 0.00 C ATOM 878 O LEU A 56 15.277 6.942 -2.013 1.00 0.00 O ATOM 879 CB LEU A 56 13.026 5.895 0.011 1.00 0.00 C ATOM 880 CG LEU A 56 13.187 4.601 0.807 1.00 0.00 C ATOM 881 CD1 LEU A 56 14.109 3.671 0.056 1.00 0.00 C ATOM 882 CD2 LEU A 56 13.759 4.867 2.196 1.00 0.00 C ATOM 0 H LEU A 56 12.983 7.889 1.417 1.00 0.00 H new ATOM 0 HA LEU A 56 15.083 6.341 0.375 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.128 6.403 0.364 1.00 0.00 H new ATOM 0 HB3 LEU A 56 12.854 5.633 -1.033 1.00 0.00 H new ATOM 0 HG LEU A 56 12.203 4.148 0.928 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.229 2.745 0.618 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.684 3.449 -0.923 1.00 0.00 H new ATOM 0 HD13 LEU A 56 15.081 4.147 -0.071 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.860 3.925 2.734 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.737 5.338 2.102 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.089 5.528 2.745 1.00 0.00 H new ATOM 894 N GLN A 57 13.840 8.574 -1.625 1.00 0.00 N ATOM 895 CA GLN A 57 14.068 9.231 -2.909 1.00 0.00 C ATOM 896 C GLN A 57 15.494 9.710 -2.998 1.00 0.00 C ATOM 897 O GLN A 57 16.157 9.559 -4.048 1.00 0.00 O ATOM 898 CB GLN A 57 13.112 10.397 -3.127 1.00 0.00 C ATOM 899 CG GLN A 57 11.630 10.121 -2.849 1.00 0.00 C ATOM 900 CD GLN A 57 10.959 8.975 -3.619 1.00 0.00 C ATOM 901 OE1 GLN A 57 11.629 7.879 -3.787 1.00 0.00 O flip ATOM 902 NE2 GLN A 57 9.780 9.066 -3.961 1.00 0.00 N flip ATOM 0 H GLN A 57 13.152 9.036 -1.031 1.00 0.00 H new ATOM 0 HA GLN A 57 13.880 8.498 -3.693 1.00 0.00 H new ATOM 0 HB2 GLN A 57 13.431 11.224 -2.493 1.00 0.00 H new ATOM 0 HB3 GLN A 57 13.210 10.731 -4.160 1.00 0.00 H new ATOM 0 HG2 GLN A 57 11.521 9.918 -1.784 1.00 0.00 H new ATOM 0 HG3 GLN A 57 11.074 11.035 -3.057 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.274 9.940 -3.818 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.310 8.268 -4.387 1.00 0.00 H new ATOM 1237 N VAL B 5 6.941 -4.553 -11.631 1.00 0.00 N ATOM 1238 CA VAL B 5 7.257 -3.318 -10.929 1.00 0.00 C ATOM 1239 C VAL B 5 6.002 -2.482 -10.868 1.00 0.00 C ATOM 1240 O VAL B 5 5.582 -1.903 -11.880 1.00 0.00 O ATOM 1241 CB VAL B 5 8.371 -2.409 -11.578 1.00 0.00 C ATOM 1242 CG1 VAL B 5 8.546 -1.148 -10.736 1.00 0.00 C ATOM 1243 CG2 VAL B 5 9.713 -3.106 -11.716 1.00 0.00 C ATOM 0 HA VAL B 5 7.645 -3.637 -9.962 1.00 0.00 H new ATOM 0 HB VAL B 5 8.033 -2.167 -12.586 1.00 0.00 H new ATOM 0 HG11 VAL B 5 9.315 -0.517 -11.181 1.00 0.00 H new ATOM 0 HG12 VAL B 5 7.604 -0.601 -10.700 1.00 0.00 H new ATOM 0 HG13 VAL B 5 8.844 -1.424 -9.725 1.00 0.00 H new ATOM 0 HG21 VAL B 5 10.432 -2.424 -12.169 1.00 0.00 H new ATOM 0 HG22 VAL B 5 10.069 -3.407 -10.731 1.00 0.00 H new ATOM 0 HG23 VAL B 5 9.602 -3.988 -12.347 1.00 0.00 H new ATOM 1253 N ASN B 6 5.388 -2.435 -9.732 1.00 0.00 N ATOM 1254 CA ASN B 6 4.241 -1.581 -9.541 1.00 0.00 C ATOM 1255 C ASN B 6 4.368 -0.891 -8.258 1.00 0.00 C ATOM 1256 O ASN B 6 4.115 -1.446 -7.185 1.00 0.00 O ATOM 1257 CB ASN B 6 2.900 -2.318 -9.600 1.00 0.00 C ATOM 1258 CG ASN B 6 2.589 -2.842 -10.970 1.00 0.00 C ATOM 1259 OD1 ASN B 6 1.929 -2.181 -11.768 1.00 0.00 O ATOM 1260 ND2 ASN B 6 3.073 -4.000 -11.272 1.00 0.00 N ATOM 0 H ASN B 6 5.656 -2.978 -8.911 1.00 0.00 H new ATOM 0 HA ASN B 6 4.234 -0.874 -10.371 1.00 0.00 H new ATOM 0 HB2 ASN B 6 2.914 -3.147 -8.893 1.00 0.00 H new ATOM 0 HB3 ASN B 6 2.105 -1.643 -9.284 1.00 0.00 H new ATOM 0 HD21 ASN B 6 2.912 -4.394 -12.199 1.00 0.00 H new ATOM 0 HD22 ASN B 6 3.617 -4.521 -10.584 1.00 0.00 H new ATOM 1267 N VAL B 7 4.804 0.281 -8.355 1.00 0.00 N ATOM 1268 CA VAL B 7 4.925 1.134 -7.236 1.00 0.00 C ATOM 1269 C VAL B 7 4.002 2.317 -7.437 1.00 0.00 C ATOM 1270 O VAL B 7 4.028 2.977 -8.493 1.00 0.00 O ATOM 1271 CB VAL B 7 6.409 1.532 -6.926 1.00 0.00 C ATOM 1272 CG1 VAL B 7 7.134 2.009 -8.173 1.00 0.00 C ATOM 1273 CG2 VAL B 7 6.494 2.599 -5.846 1.00 0.00 C ATOM 0 H VAL B 7 5.100 0.703 -9.235 1.00 0.00 H new ATOM 0 HA VAL B 7 4.614 0.601 -6.337 1.00 0.00 H new ATOM 0 HB VAL B 7 6.899 0.630 -6.561 1.00 0.00 H new ATOM 0 HG11 VAL B 7 8.160 2.276 -7.918 1.00 0.00 H new ATOM 0 HG12 VAL B 7 7.141 1.213 -8.917 1.00 0.00 H new ATOM 0 HG13 VAL B 7 6.623 2.881 -8.580 1.00 0.00 H new ATOM 0 HG21 VAL B 7 7.539 2.847 -5.661 1.00 0.00 H new ATOM 0 HG22 VAL B 7 5.962 3.492 -6.174 1.00 0.00 H new ATOM 0 HG23 VAL B 7 6.042 2.224 -4.928 1.00 0.00 H new ATOM 1283 N LEU B 8 3.226 2.589 -6.443 1.00 0.00 N ATOM 1284 CA LEU B 8 2.120 3.447 -6.581 1.00 0.00 C ATOM 1285 C LEU B 8 1.884 4.234 -5.275 1.00 0.00 C ATOM 1286 O LEU B 8 2.397 3.858 -4.237 1.00 0.00 O ATOM 1287 CB LEU B 8 0.987 2.500 -6.864 1.00 0.00 C ATOM 1288 CG LEU B 8 -0.265 3.057 -7.408 1.00 0.00 C ATOM 1289 CD1 LEU B 8 0.020 3.743 -8.718 1.00 0.00 C ATOM 1290 CD2 LEU B 8 -1.211 1.936 -7.632 1.00 0.00 C ATOM 0 H LEU B 8 3.352 2.212 -5.504 1.00 0.00 H new ATOM 0 HA LEU B 8 2.244 4.199 -7.360 1.00 0.00 H new ATOM 0 HB2 LEU B 8 1.349 1.747 -7.564 1.00 0.00 H new ATOM 0 HB3 LEU B 8 0.746 1.982 -5.936 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.692 3.780 -6.713 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -0.905 4.155 -9.122 1.00 0.00 H new ATOM 0 HD12 LEU B 8 0.737 4.548 -8.559 1.00 0.00 H new ATOM 0 HD13 LEU B 8 0.434 3.023 -9.423 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -2.146 2.324 -8.035 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -0.777 1.229 -8.339 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -1.406 1.430 -6.687 1.00 0.00 H new ATOM 1302 N LYS B 9 1.131 5.322 -5.343 1.00 0.00 N ATOM 1303 CA LYS B 9 0.860 6.163 -4.168 1.00 0.00 C ATOM 1304 C LYS B 9 -0.642 6.185 -3.881 1.00 0.00 C ATOM 1305 O LYS B 9 -1.446 6.304 -4.809 1.00 0.00 O ATOM 1306 CB LYS B 9 1.421 7.604 -4.414 1.00 0.00 C ATOM 1307 CG LYS B 9 1.279 8.621 -3.246 1.00 0.00 C ATOM 1308 CD LYS B 9 -0.156 9.132 -3.059 1.00 0.00 C ATOM 1309 CE LYS B 9 -0.317 9.985 -1.812 1.00 0.00 C ATOM 1310 NZ LYS B 9 0.450 11.236 -1.882 1.00 0.00 N ATOM 0 H LYS B 9 0.691 5.651 -6.202 1.00 0.00 H new ATOM 0 HA LYS B 9 1.361 5.750 -3.292 1.00 0.00 H new ATOM 0 HB2 LYS B 9 2.479 7.519 -4.663 1.00 0.00 H new ATOM 0 HB3 LYS B 9 0.920 8.019 -5.288 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.614 8.151 -2.321 1.00 0.00 H new ATOM 0 HG3 LYS B 9 1.939 9.469 -3.429 1.00 0.00 H new ATOM 0 HD2 LYS B 9 -0.446 9.715 -3.933 1.00 0.00 H new ATOM 0 HD3 LYS B 9 -0.836 8.282 -3.003 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -1.372 10.217 -1.669 1.00 0.00 H new ATOM 0 HE3 LYS B 9 0.005 9.414 -0.941 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 0.306 11.781 -1.008 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 1.461 11.018 -1.992 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 0.127 11.796 -2.696 1.00 0.00 H new ATOM 1324 N GLY B 10 -1.017 6.073 -2.605 1.00 0.00 N ATOM 1325 CA GLY B 10 -2.416 6.151 -2.239 1.00 0.00 C ATOM 1326 C GLY B 10 -2.733 5.382 -0.975 1.00 0.00 C ATOM 1327 O GLY B 10 -1.945 5.390 -0.016 1.00 0.00 O ATOM 0 H GLY B 10 -0.376 5.930 -1.825 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -2.694 7.196 -2.103 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -3.023 5.764 -3.057 1.00 0.00 H new ATOM 1331 N VAL B 11 -3.869 4.715 -0.982 1.00 0.00 N ATOM 1332 CA VAL B 11 -4.348 3.936 0.132 1.00 0.00 C ATOM 1333 C VAL B 11 -4.374 2.460 -0.228 1.00 0.00 C ATOM 1334 O VAL B 11 -4.940 2.041 -1.248 1.00 0.00 O ATOM 1335 CB VAL B 11 -5.753 4.414 0.635 1.00 0.00 C ATOM 1336 CG1 VAL B 11 -6.340 3.458 1.672 1.00 0.00 C ATOM 1337 CG2 VAL B 11 -5.631 5.784 1.258 1.00 0.00 C ATOM 0 H VAL B 11 -4.498 4.702 -1.785 1.00 0.00 H new ATOM 0 HA VAL B 11 -3.652 4.087 0.957 1.00 0.00 H new ATOM 0 HB VAL B 11 -6.418 4.440 -0.228 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -7.314 3.825 1.995 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -6.454 2.468 1.231 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -5.672 3.398 2.531 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -6.610 6.114 1.607 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -4.941 5.740 2.101 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -5.254 6.489 0.517 1.00 0.00 H new ATOM 1347 N LEU B 12 -3.763 1.711 0.607 1.00 0.00 N ATOM 1348 CA LEU B 12 -3.623 0.296 0.467 1.00 0.00 C ATOM 1349 C LEU B 12 -4.687 -0.399 1.279 1.00 0.00 C ATOM 1350 O LEU B 12 -4.951 -0.013 2.426 1.00 0.00 O ATOM 1351 CB LEU B 12 -2.247 -0.118 0.971 1.00 0.00 C ATOM 1352 CG LEU B 12 -1.982 -1.615 1.084 1.00 0.00 C ATOM 1353 CD1 LEU B 12 -1.987 -2.282 -0.275 1.00 0.00 C ATOM 1354 CD2 LEU B 12 -0.685 -1.849 1.793 1.00 0.00 C ATOM 0 H LEU B 12 -3.322 2.076 1.451 1.00 0.00 H new ATOM 0 HA LEU B 12 -3.731 0.017 -0.581 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.498 0.311 0.306 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.095 0.330 1.953 1.00 0.00 H new ATOM 0 HG LEU B 12 -2.787 -2.064 1.665 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.795 -3.349 -0.158 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.959 -2.138 -0.747 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.211 -1.840 -0.900 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -0.501 -2.921 1.871 1.00 0.00 H new ATOM 0 HD22 LEU B 12 0.125 -1.381 1.233 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -0.733 -1.416 2.792 1.00 0.00 H new ATOM 1366 N ILE B 13 -5.304 -1.397 0.695 1.00 0.00 N ATOM 1367 CA ILE B 13 -6.313 -2.154 1.373 1.00 0.00 C ATOM 1368 C ILE B 13 -5.874 -3.585 1.563 1.00 0.00 C ATOM 1369 O ILE B 13 -5.350 -4.239 0.626 1.00 0.00 O ATOM 1370 CB ILE B 13 -7.654 -2.223 0.583 1.00 0.00 C ATOM 1371 CG1 ILE B 13 -8.236 -0.872 0.249 1.00 0.00 C ATOM 1372 CG2 ILE B 13 -8.707 -3.054 1.310 1.00 0.00 C ATOM 1373 CD1 ILE B 13 -8.413 0.075 1.413 1.00 0.00 C ATOM 0 H ILE B 13 -5.118 -1.702 -0.260 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.463 -1.639 2.322 1.00 0.00 H new ATOM 0 HB ILE B 13 -7.389 -2.710 -0.356 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -7.593 -0.393 -0.490 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -9.207 -1.023 -0.223 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -9.625 -3.074 0.722 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -8.339 -4.071 1.443 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -8.910 -2.611 2.285 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -8.838 1.014 1.057 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -9.084 -0.372 2.147 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -7.445 0.267 1.876 1.00 0.00 H new ATOM 1385 N GLU B 14 -6.045 -4.048 2.744 1.00 0.00 N ATOM 1386 CA GLU B 14 -6.018 -5.421 3.028 1.00 0.00 C ATOM 1387 C GLU B 14 -7.205 -5.665 3.926 1.00 0.00 C ATOM 1388 O GLU B 14 -7.298 -5.061 4.988 1.00 0.00 O ATOM 1389 CB GLU B 14 -4.744 -5.782 3.788 1.00 0.00 C ATOM 1390 CG GLU B 14 -4.658 -7.234 4.229 1.00 0.00 C ATOM 1391 CD GLU B 14 -3.466 -7.489 5.115 1.00 0.00 C ATOM 1392 OE1 GLU B 14 -2.317 -7.406 4.630 1.00 0.00 O ATOM 1393 OE2 GLU B 14 -3.655 -7.786 6.302 1.00 0.00 O ATOM 0 H GLU B 14 -6.212 -3.459 3.560 1.00 0.00 H new ATOM 0 HA GLU B 14 -6.047 -6.016 2.115 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -3.884 -5.557 3.157 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -4.669 -5.144 4.669 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -5.569 -7.505 4.762 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -4.600 -7.876 3.350 1.00 0.00 H new ATOM 1400 N CYS B 15 -8.107 -6.463 3.478 1.00 0.00 N ATOM 1401 CA CYS B 15 -9.208 -6.951 4.286 1.00 0.00 C ATOM 1402 C CYS B 15 -9.753 -8.157 3.616 1.00 0.00 C ATOM 1403 O CYS B 15 -9.317 -8.451 2.494 1.00 0.00 O ATOM 1404 CB CYS B 15 -10.307 -5.909 4.455 1.00 0.00 C ATOM 1405 SG CYS B 15 -10.967 -5.243 2.921 1.00 0.00 S ATOM 0 H CYS B 15 -8.116 -6.813 2.520 1.00 0.00 H new ATOM 0 HA CYS B 15 -8.841 -7.182 5.286 1.00 0.00 H new ATOM 0 HB2 CYS B 15 -11.125 -6.354 5.021 1.00 0.00 H new ATOM 0 HB3 CYS B 15 -9.917 -5.085 5.053 1.00 0.00 H new ATOM 0 HG CYS B 15 -11.044 -6.190 2.034 1.00 0.00 H new ATOM 1411 N ASP B 16 -10.692 -8.866 4.261 1.00 0.00 N ATOM 1412 CA ASP B 16 -11.307 -10.021 3.623 1.00 0.00 C ATOM 1413 C ASP B 16 -11.933 -9.551 2.303 1.00 0.00 C ATOM 1414 O ASP B 16 -12.584 -8.489 2.270 1.00 0.00 O ATOM 1415 CB ASP B 16 -12.339 -10.744 4.533 1.00 0.00 C ATOM 1416 CG ASP B 16 -13.646 -10.011 4.736 1.00 0.00 C ATOM 1417 OD1 ASP B 16 -13.693 -9.041 5.522 1.00 0.00 O ATOM 1418 OD2 ASP B 16 -14.667 -10.434 4.156 1.00 0.00 O ATOM 0 H ASP B 16 -11.030 -8.661 5.201 1.00 0.00 H new ATOM 0 HA ASP B 16 -10.540 -10.771 3.430 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -12.553 -11.723 4.105 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -11.882 -10.915 5.508 1.00 0.00 H new ATOM 1423 N PRO B 17 -11.718 -10.307 1.197 1.00 0.00 N ATOM 1424 CA PRO B 17 -12.019 -9.881 -0.209 1.00 0.00 C ATOM 1425 C PRO B 17 -13.487 -9.639 -0.579 1.00 0.00 C ATOM 1426 O PRO B 17 -13.863 -9.698 -1.754 1.00 0.00 O ATOM 1427 CB PRO B 17 -11.421 -11.006 -1.036 1.00 0.00 C ATOM 1428 CG PRO B 17 -10.437 -11.611 -0.119 1.00 0.00 C ATOM 1429 CD PRO B 17 -11.132 -11.647 1.181 1.00 0.00 C ATOM 0 HA PRO B 17 -11.603 -8.888 -0.383 1.00 0.00 H new ATOM 0 HB2 PRO B 17 -12.179 -11.726 -1.345 1.00 0.00 H new ATOM 0 HB3 PRO B 17 -10.948 -10.631 -1.944 1.00 0.00 H new ATOM 0 HG2 PRO B 17 -10.150 -12.611 -0.445 1.00 0.00 H new ATOM 0 HG3 PRO B 17 -9.524 -11.018 -0.067 1.00 0.00 H new ATOM 0 HD2 PRO B 17 -11.887 -12.432 1.228 1.00 0.00 H new ATOM 0 HD3 PRO B 17 -10.448 -11.812 2.014 1.00 0.00 H new ATOM 1437 N ALA B 18 -14.267 -9.297 0.390 1.00 0.00 N ATOM 1438 CA ALA B 18 -15.633 -8.893 0.208 1.00 0.00 C ATOM 1439 C ALA B 18 -15.624 -7.550 -0.513 1.00 0.00 C ATOM 1440 O ALA B 18 -16.407 -7.293 -1.469 1.00 0.00 O ATOM 1441 CB ALA B 18 -16.243 -8.728 1.572 1.00 0.00 C ATOM 0 H ALA B 18 -13.968 -9.288 1.365 1.00 0.00 H new ATOM 0 HA ALA B 18 -16.200 -9.623 -0.369 1.00 0.00 H new ATOM 0 HB1 ALA B 18 -17.284 -8.421 1.470 1.00 0.00 H new ATOM 0 HB2 ALA B 18 -16.195 -9.675 2.109 1.00 0.00 H new ATOM 0 HB3 ALA B 18 -15.693 -7.968 2.127 1.00 0.00 H new ATOM 1447 N MET B 19 -14.649 -6.720 -0.105 1.00 0.00 N ATOM 1448 CA MET B 19 -14.481 -5.399 -0.664 1.00 0.00 C ATOM 1449 C MET B 19 -14.169 -5.530 -2.122 1.00 0.00 C ATOM 1450 O MET B 19 -14.670 -4.786 -2.933 1.00 0.00 O ATOM 1451 CB MET B 19 -13.365 -4.575 0.049 1.00 0.00 C ATOM 1452 CG MET B 19 -11.906 -4.888 -0.355 1.00 0.00 C ATOM 1453 SD MET B 19 -11.414 -6.597 -0.045 1.00 0.00 S ATOM 1454 CE MET B 19 -9.695 -6.548 -0.551 1.00 0.00 C ATOM 0 H MET B 19 -13.968 -6.958 0.616 1.00 0.00 H new ATOM 0 HA MET B 19 -15.412 -4.853 -0.514 1.00 0.00 H new ATOM 0 HB2 MET B 19 -13.551 -3.517 -0.138 1.00 0.00 H new ATOM 0 HB3 MET B 19 -13.461 -4.730 1.124 1.00 0.00 H new ATOM 0 HG2 MET B 19 -11.778 -4.670 -1.415 1.00 0.00 H new ATOM 0 HG3 MET B 19 -11.237 -4.223 0.191 1.00 0.00 H new ATOM 0 HE1 MET B 19 -9.429 -7.492 -1.027 1.00 0.00 H new ATOM 0 HE2 MET B 19 -9.547 -5.731 -1.257 1.00 0.00 H new ATOM 0 HE3 MET B 19 -9.063 -6.391 0.323 1.00 0.00 H new ATOM 1464 N LYS B 20 -13.405 -6.561 -2.441 1.00 0.00 N ATOM 1465 CA LYS B 20 -12.953 -6.820 -3.770 1.00 0.00 C ATOM 1466 C LYS B 20 -14.097 -6.936 -4.711 1.00 0.00 C ATOM 1467 O LYS B 20 -14.108 -6.316 -5.769 1.00 0.00 O ATOM 1468 CB LYS B 20 -12.164 -8.127 -3.835 1.00 0.00 C ATOM 1469 CG LYS B 20 -10.684 -7.979 -4.111 1.00 0.00 C ATOM 1470 CD LYS B 20 -10.424 -7.084 -5.311 1.00 0.00 C ATOM 1471 CE LYS B 20 -11.268 -7.419 -6.523 1.00 0.00 C ATOM 1472 NZ LYS B 20 -11.028 -6.475 -7.614 1.00 0.00 N ATOM 0 H LYS B 20 -13.083 -7.247 -1.759 1.00 0.00 H new ATOM 0 HA LYS B 20 -12.317 -5.982 -4.055 1.00 0.00 H new ATOM 0 HB2 LYS B 20 -12.289 -8.654 -2.889 1.00 0.00 H new ATOM 0 HB3 LYS B 20 -12.600 -8.756 -4.611 1.00 0.00 H new ATOM 0 HG2 LYS B 20 -10.190 -7.563 -3.233 1.00 0.00 H new ATOM 0 HG3 LYS B 20 -10.247 -8.962 -4.288 1.00 0.00 H new ATOM 0 HD2 LYS B 20 -10.610 -6.048 -5.026 1.00 0.00 H new ATOM 0 HD3 LYS B 20 -9.371 -7.155 -5.583 1.00 0.00 H new ATOM 0 HE2 LYS B 20 -11.041 -8.431 -6.858 1.00 0.00 H new ATOM 0 HE3 LYS B 20 -12.323 -7.402 -6.250 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 -11.024 -6.985 -8.520 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 -11.781 -5.757 -7.624 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 -10.108 -6.010 -7.475 1.00 0.00 H new ATOM 1486 N GLN B 21 -15.046 -7.685 -4.304 1.00 0.00 N ATOM 1487 CA GLN B 21 -16.154 -8.019 -5.128 1.00 0.00 C ATOM 1488 C GLN B 21 -17.038 -6.820 -5.407 1.00 0.00 C ATOM 1489 O GLN B 21 -17.487 -6.631 -6.547 1.00 0.00 O ATOM 1490 CB GLN B 21 -16.877 -9.205 -4.543 1.00 0.00 C ATOM 1491 CG GLN B 21 -15.905 -10.351 -4.265 1.00 0.00 C ATOM 1492 CD GLN B 21 -15.120 -10.782 -5.488 1.00 0.00 C ATOM 1493 OE1 GLN B 21 -15.599 -10.702 -6.613 1.00 0.00 O ATOM 1494 NE2 GLN B 21 -13.904 -11.207 -5.282 1.00 0.00 N ATOM 0 H GLN B 21 -15.082 -8.095 -3.371 1.00 0.00 H new ATOM 0 HA GLN B 21 -15.798 -8.320 -6.113 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -17.375 -8.913 -3.619 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -17.653 -9.539 -5.232 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -15.209 -10.046 -3.484 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -16.462 -11.205 -3.880 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -13.537 -11.261 -4.332 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -13.320 -11.485 -6.071 1.00 0.00 H new ATOM 1503 N PHE B 22 -17.279 -5.977 -4.411 1.00 0.00 N ATOM 1504 CA PHE B 22 -17.992 -4.744 -4.731 1.00 0.00 C ATOM 1505 C PHE B 22 -17.138 -3.790 -5.593 1.00 0.00 C ATOM 1506 O PHE B 22 -17.655 -3.125 -6.495 1.00 0.00 O ATOM 1507 CB PHE B 22 -18.721 -4.047 -3.545 1.00 0.00 C ATOM 1508 CG PHE B 22 -17.903 -3.639 -2.346 1.00 0.00 C ATOM 1509 CD1 PHE B 22 -16.969 -2.617 -2.423 1.00 0.00 C ATOM 1510 CD2 PHE B 22 -18.121 -4.247 -1.121 1.00 0.00 C ATOM 1511 CE1 PHE B 22 -16.264 -2.219 -1.306 1.00 0.00 C ATOM 1512 CE2 PHE B 22 -17.420 -3.859 -0.001 1.00 0.00 C ATOM 1513 CZ PHE B 22 -16.490 -2.841 -0.092 1.00 0.00 C ATOM 0 H PHE B 22 -17.013 -6.107 -3.435 1.00 0.00 H new ATOM 0 HA PHE B 22 -18.830 -5.067 -5.349 1.00 0.00 H new ATOM 0 HB2 PHE B 22 -19.210 -3.154 -3.934 1.00 0.00 H new ATOM 0 HB3 PHE B 22 -19.508 -4.716 -3.199 1.00 0.00 H new ATOM 0 HD1 PHE B 22 -16.791 -2.127 -3.369 1.00 0.00 H new ATOM 0 HD2 PHE B 22 -18.852 -5.038 -1.043 1.00 0.00 H new ATOM 0 HE1 PHE B 22 -15.537 -1.423 -1.380 1.00 0.00 H new ATOM 0 HE2 PHE B 22 -17.596 -4.349 0.945 1.00 0.00 H new ATOM 0 HZ PHE B 22 -15.940 -2.531 0.784 1.00 0.00 H new ATOM 1523 N LEU B 23 -15.825 -3.770 -5.339 1.00 0.00 N ATOM 1524 CA LEU B 23 -14.889 -2.932 -6.095 1.00 0.00 C ATOM 1525 C LEU B 23 -14.860 -3.284 -7.536 1.00 0.00 C ATOM 1526 O LEU B 23 -14.927 -2.422 -8.358 1.00 0.00 O ATOM 1527 CB LEU B 23 -13.484 -3.017 -5.551 1.00 0.00 C ATOM 1528 CG LEU B 23 -13.303 -2.558 -4.136 1.00 0.00 C ATOM 1529 CD1 LEU B 23 -11.960 -2.951 -3.657 1.00 0.00 C ATOM 1530 CD2 LEU B 23 -13.520 -1.066 -3.972 1.00 0.00 C ATOM 0 H LEU B 23 -15.384 -4.330 -4.609 1.00 0.00 H new ATOM 0 HA LEU B 23 -15.257 -1.912 -5.983 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -13.149 -4.052 -5.623 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -12.830 -2.425 -6.191 1.00 0.00 H new ATOM 0 HG LEU B 23 -14.066 -3.046 -3.529 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -11.829 -2.617 -2.628 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -11.861 -4.036 -3.702 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -11.200 -2.490 -4.288 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -13.376 -0.790 -2.927 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -12.806 -0.524 -4.592 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -14.534 -0.810 -4.278 1.00 0.00 H new ATOM 1542 N LEU B 24 -14.752 -4.551 -7.845 1.00 0.00 N ATOM 1543 CA LEU B 24 -14.705 -4.961 -9.230 1.00 0.00 C ATOM 1544 C LEU B 24 -16.026 -4.708 -9.946 1.00 0.00 C ATOM 1545 O LEU B 24 -16.035 -4.374 -11.135 1.00 0.00 O ATOM 1546 CB LEU B 24 -14.151 -6.383 -9.385 1.00 0.00 C ATOM 1547 CG LEU B 24 -14.792 -7.476 -8.544 1.00 0.00 C ATOM 1548 CD1 LEU B 24 -16.038 -7.994 -9.145 1.00 0.00 C ATOM 1549 CD2 LEU B 24 -13.840 -8.581 -8.295 1.00 0.00 C ATOM 0 H LEU B 24 -14.695 -5.311 -7.167 1.00 0.00 H new ATOM 0 HA LEU B 24 -13.987 -4.324 -9.747 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -14.241 -6.668 -10.433 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -13.087 -6.358 -9.151 1.00 0.00 H new ATOM 0 HG LEU B 24 -15.059 -7.020 -7.591 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -16.455 -8.772 -8.505 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -16.758 -7.182 -9.246 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -15.822 -8.411 -10.129 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -14.324 -9.349 -7.691 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -13.525 -9.011 -9.246 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -12.969 -8.198 -7.764 1.00 0.00 H new ATOM 1561 N TYR B 25 -17.139 -4.812 -9.204 1.00 0.00 N ATOM 1562 CA TYR B 25 -18.442 -4.460 -9.743 1.00 0.00 C ATOM 1563 C TYR B 25 -18.470 -2.970 -10.081 1.00 0.00 C ATOM 1564 O TYR B 25 -18.842 -2.572 -11.187 1.00 0.00 O ATOM 1565 CB TYR B 25 -19.580 -4.808 -8.754 1.00 0.00 C ATOM 1566 CG TYR B 25 -20.927 -4.235 -9.167 1.00 0.00 C ATOM 1567 CD1 TYR B 25 -21.631 -4.761 -10.230 1.00 0.00 C ATOM 1568 CD2 TYR B 25 -21.467 -3.138 -8.509 1.00 0.00 C ATOM 1569 CE1 TYR B 25 -22.828 -4.211 -10.638 1.00 0.00 C ATOM 1570 CE2 TYR B 25 -22.669 -2.587 -8.902 1.00 0.00 C ATOM 1571 CZ TYR B 25 -23.345 -3.125 -9.971 1.00 0.00 C ATOM 1572 OH TYR B 25 -24.536 -2.555 -10.396 1.00 0.00 O ATOM 0 H TYR B 25 -17.154 -5.136 -8.237 1.00 0.00 H new ATOM 0 HA TYR B 25 -18.606 -5.043 -10.649 1.00 0.00 H new ATOM 0 HB2 TYR B 25 -19.663 -5.892 -8.672 1.00 0.00 H new ATOM 0 HB3 TYR B 25 -19.320 -4.432 -7.764 1.00 0.00 H new ATOM 0 HD1 TYR B 25 -21.237 -5.620 -10.753 1.00 0.00 H new ATOM 0 HD2 TYR B 25 -20.936 -2.708 -7.673 1.00 0.00 H new ATOM 0 HE1 TYR B 25 -23.358 -4.632 -11.479 1.00 0.00 H new ATOM 0 HE2 TYR B 25 -23.076 -1.738 -8.373 1.00 0.00 H new ATOM 0 HH TYR B 25 -24.762 -1.798 -9.816 1.00 0.00 H new ATOM 1582 N LEU B 26 -18.053 -2.160 -9.136 1.00 0.00 N ATOM 1583 CA LEU B 26 -18.009 -0.731 -9.319 1.00 0.00 C ATOM 1584 C LEU B 26 -17.001 -0.316 -10.369 1.00 0.00 C ATOM 1585 O LEU B 26 -17.191 0.670 -11.026 1.00 0.00 O ATOM 1586 CB LEU B 26 -17.784 0.021 -8.010 1.00 0.00 C ATOM 1587 CG LEU B 26 -18.983 0.782 -7.451 1.00 0.00 C ATOM 1588 CD1 LEU B 26 -19.441 1.844 -8.440 1.00 0.00 C ATOM 1589 CD2 LEU B 26 -20.114 -0.164 -7.105 1.00 0.00 C ATOM 0 H LEU B 26 -17.735 -2.475 -8.219 1.00 0.00 H new ATOM 0 HA LEU B 26 -18.996 -0.448 -9.686 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -17.452 -0.694 -7.258 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -16.969 0.729 -8.158 1.00 0.00 H new ATOM 0 HG LEU B 26 -18.677 1.279 -6.531 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -20.297 2.379 -8.029 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -18.627 2.546 -8.623 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -19.727 1.368 -9.378 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -20.955 0.404 -6.709 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -20.427 -0.699 -8.001 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -19.774 -0.879 -6.356 1.00 0.00 H new ATOM 1601 N ASP B 27 -15.927 -1.047 -10.477 1.00 0.00 N ATOM 1602 CA ASP B 27 -14.887 -0.791 -11.470 1.00 0.00 C ATOM 1603 C ASP B 27 -15.442 -0.915 -12.882 1.00 0.00 C ATOM 1604 O ASP B 27 -15.224 -0.032 -13.722 1.00 0.00 O ATOM 1605 CB ASP B 27 -13.692 -1.747 -11.246 1.00 0.00 C ATOM 1606 CG ASP B 27 -12.630 -1.676 -12.324 1.00 0.00 C ATOM 1607 OD1 ASP B 27 -11.979 -0.621 -12.479 1.00 0.00 O ATOM 1608 OD2 ASP B 27 -12.428 -2.694 -13.044 1.00 0.00 O ATOM 0 H ASP B 27 -15.734 -1.849 -9.878 1.00 0.00 H new ATOM 0 HA ASP B 27 -14.531 0.232 -11.350 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -13.233 -1.518 -10.284 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -14.065 -2.769 -11.186 1.00 0.00 H new ATOM 1613 N GLU B 28 -16.197 -1.975 -13.127 1.00 0.00 N ATOM 1614 CA GLU B 28 -16.806 -2.190 -14.433 1.00 0.00 C ATOM 1615 C GLU B 28 -18.038 -1.302 -14.663 1.00 0.00 C ATOM 1616 O GLU B 28 -18.259 -0.814 -15.776 1.00 0.00 O ATOM 1617 CB GLU B 28 -17.121 -3.663 -14.685 1.00 0.00 C ATOM 1618 CG GLU B 28 -17.970 -4.337 -13.631 1.00 0.00 C ATOM 1619 CD GLU B 28 -18.301 -5.753 -13.992 1.00 0.00 C ATOM 1620 OE1 GLU B 28 -17.421 -6.621 -13.939 1.00 0.00 O ATOM 1621 OE2 GLU B 28 -19.459 -6.026 -14.368 1.00 0.00 O ATOM 0 H GLU B 28 -16.403 -2.700 -12.440 1.00 0.00 H new ATOM 0 HA GLU B 28 -16.060 -1.888 -15.168 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -17.629 -3.749 -15.645 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -16.181 -4.208 -14.772 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -17.443 -4.321 -12.677 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -18.893 -3.773 -13.495 1.00 0.00 H new ATOM 1628 N SER B 29 -18.835 -1.104 -13.618 1.00 0.00 N ATOM 1629 CA SER B 29 -20.014 -0.247 -13.683 1.00 0.00 C ATOM 1630 C SER B 29 -19.567 1.210 -13.852 1.00 0.00 C ATOM 1631 O SER B 29 -20.147 1.982 -14.619 1.00 0.00 O ATOM 1632 CB SER B 29 -20.843 -0.426 -12.392 1.00 0.00 C ATOM 1633 OG SER B 29 -22.030 0.346 -12.398 1.00 0.00 O ATOM 0 H SER B 29 -18.683 -1.532 -12.705 1.00 0.00 H new ATOM 0 HA SER B 29 -20.637 -0.520 -14.535 1.00 0.00 H new ATOM 0 HB2 SER B 29 -21.099 -1.479 -12.271 1.00 0.00 H new ATOM 0 HB3 SER B 29 -20.235 -0.145 -11.532 1.00 0.00 H new ATOM 0 HG SER B 29 -22.520 0.198 -11.563 1.00 0.00 H new ATOM 1639 N ASN B 30 -18.523 1.532 -13.122 1.00 0.00 N ATOM 1640 CA ASN B 30 -17.844 2.814 -13.097 1.00 0.00 C ATOM 1641 C ASN B 30 -18.800 3.983 -12.863 1.00 0.00 C ATOM 1642 O ASN B 30 -18.821 4.969 -13.600 1.00 0.00 O ATOM 1643 CB ASN B 30 -16.937 2.999 -14.327 1.00 0.00 C ATOM 1644 CG ASN B 30 -15.973 4.156 -14.164 1.00 0.00 C ATOM 1645 OD1 ASN B 30 -15.615 4.519 -13.043 1.00 0.00 O ATOM 1646 ND2 ASN B 30 -15.498 4.700 -15.258 1.00 0.00 N ATOM 0 H ASN B 30 -18.094 0.861 -12.485 1.00 0.00 H new ATOM 0 HA ASN B 30 -17.184 2.812 -12.229 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -16.374 2.082 -14.501 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -17.555 3.166 -15.209 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -14.809 5.449 -15.197 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -15.818 4.374 -16.170 1.00 0.00 H new ATOM 1653 N ALA B 31 -19.575 3.867 -11.793 1.00 0.00 N ATOM 1654 CA ALA B 31 -20.528 4.904 -11.390 1.00 0.00 C ATOM 1655 C ALA B 31 -19.806 6.154 -10.909 1.00 0.00 C ATOM 1656 O ALA B 31 -20.344 7.262 -10.923 1.00 0.00 O ATOM 1657 CB ALA B 31 -21.473 4.380 -10.321 1.00 0.00 C ATOM 0 H ALA B 31 -19.564 3.054 -11.177 1.00 0.00 H new ATOM 0 HA ALA B 31 -21.119 5.176 -12.264 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -22.172 5.166 -10.036 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -22.027 3.526 -10.712 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -20.899 4.071 -9.447 1.00 0.00 H new ATOM 1663 N LEU B 32 -18.590 5.970 -10.478 1.00 0.00 N ATOM 1664 CA LEU B 32 -17.773 7.054 -9.978 1.00 0.00 C ATOM 1665 C LEU B 32 -17.080 7.777 -11.146 1.00 0.00 C ATOM 1666 O LEU B 32 -16.621 8.909 -11.020 1.00 0.00 O ATOM 1667 CB LEU B 32 -16.791 6.484 -8.970 1.00 0.00 C ATOM 1668 CG LEU B 32 -17.451 5.769 -7.786 1.00 0.00 C ATOM 1669 CD1 LEU B 32 -16.436 4.999 -7.008 1.00 0.00 C ATOM 1670 CD2 LEU B 32 -18.166 6.763 -6.875 1.00 0.00 C ATOM 0 H LEU B 32 -18.129 5.060 -10.461 1.00 0.00 H new ATOM 0 HA LEU B 32 -18.382 7.804 -9.473 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -16.129 5.784 -9.480 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -16.167 7.293 -8.590 1.00 0.00 H new ATOM 0 HG LEU B 32 -18.191 5.075 -8.184 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -16.922 4.498 -6.171 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -15.969 4.256 -7.654 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -15.674 5.680 -6.630 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -18.625 6.229 -6.043 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -17.447 7.486 -6.489 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -18.937 7.286 -7.441 1.00 0.00 H new ATOM 1682 N GLY B 33 -17.037 7.102 -12.274 1.00 0.00 N ATOM 1683 CA GLY B 33 -16.540 7.649 -13.531 1.00 0.00 C ATOM 1684 C GLY B 33 -15.027 7.682 -13.665 1.00 0.00 C ATOM 1685 O GLY B 33 -14.510 8.093 -14.702 1.00 0.00 O ATOM 0 H GLY B 33 -17.352 6.135 -12.351 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -16.949 7.061 -14.352 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.922 8.664 -13.644 1.00 0.00 H new ATOM 1689 N LYS B 34 -14.316 7.233 -12.660 1.00 0.00 N ATOM 1690 CA LYS B 34 -12.881 7.133 -12.749 1.00 0.00 C ATOM 1691 C LYS B 34 -12.405 5.882 -12.018 1.00 0.00 C ATOM 1692 O LYS B 34 -13.151 5.321 -11.202 1.00 0.00 O ATOM 1693 CB LYS B 34 -12.179 8.450 -12.303 1.00 0.00 C ATOM 1694 CG LYS B 34 -12.285 8.822 -10.832 1.00 0.00 C ATOM 1695 CD LYS B 34 -11.107 8.299 -10.003 1.00 0.00 C ATOM 1696 CE LYS B 34 -9.807 9.142 -10.152 1.00 0.00 C ATOM 1697 NZ LYS B 34 -9.169 9.091 -11.494 1.00 0.00 N ATOM 0 H LYS B 34 -14.709 6.930 -11.769 1.00 0.00 H new ATOM 0 HA LYS B 34 -12.587 7.014 -13.792 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -11.122 8.374 -12.559 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -12.591 9.270 -12.891 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -12.336 9.907 -10.739 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -13.215 8.423 -10.427 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -11.396 8.278 -8.952 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -10.897 7.271 -10.297 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -10.038 10.181 -9.917 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -9.085 8.800 -9.411 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -8.173 9.381 -11.416 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -9.219 8.121 -11.865 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -9.668 9.735 -12.140 1.00 0.00 H new ATOM 1711 N LYS B 35 -11.199 5.447 -12.301 1.00 0.00 N ATOM 1712 CA LYS B 35 -10.626 4.262 -11.672 1.00 0.00 C ATOM 1713 C LYS B 35 -10.244 4.556 -10.248 1.00 0.00 C ATOM 1714 O LYS B 35 -9.250 5.228 -9.977 1.00 0.00 O ATOM 1715 CB LYS B 35 -9.402 3.746 -12.443 1.00 0.00 C ATOM 1716 CG LYS B 35 -9.594 3.413 -13.939 1.00 0.00 C ATOM 1717 CD LYS B 35 -10.417 2.139 -14.225 1.00 0.00 C ATOM 1718 CE LYS B 35 -11.925 2.323 -14.087 1.00 0.00 C ATOM 1719 NZ LYS B 35 -12.642 1.081 -14.423 1.00 0.00 N ATOM 0 H LYS B 35 -10.580 5.900 -12.974 1.00 0.00 H new ATOM 0 HA LYS B 35 -11.389 3.483 -11.688 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -8.613 4.494 -12.363 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -9.042 2.848 -11.941 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -10.082 4.259 -14.424 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -8.612 3.304 -14.400 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -10.195 1.796 -15.236 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -10.095 1.352 -13.544 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -12.167 2.622 -13.067 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -12.258 3.128 -14.742 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -13.636 1.164 -14.130 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -12.595 0.920 -15.449 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -12.201 0.280 -13.927 1.00 0.00 H new ATOM 1733 N PHE B 36 -11.084 4.119 -9.365 1.00 0.00 N ATOM 1734 CA PHE B 36 -10.830 4.199 -7.959 1.00 0.00 C ATOM 1735 C PHE B 36 -9.830 3.111 -7.573 1.00 0.00 C ATOM 1736 O PHE B 36 -8.729 3.410 -7.126 1.00 0.00 O ATOM 1737 CB PHE B 36 -12.153 4.143 -7.146 1.00 0.00 C ATOM 1738 CG PHE B 36 -13.031 2.959 -7.462 1.00 0.00 C ATOM 1739 CD1 PHE B 36 -13.828 2.949 -8.595 1.00 0.00 C ATOM 1740 CD2 PHE B 36 -13.038 1.850 -6.639 1.00 0.00 C ATOM 1741 CE1 PHE B 36 -14.603 1.863 -8.889 1.00 0.00 C ATOM 1742 CE2 PHE B 36 -13.813 0.764 -6.938 1.00 0.00 C ATOM 1743 CZ PHE B 36 -14.588 0.770 -8.057 1.00 0.00 C ATOM 0 H PHE B 36 -11.979 3.690 -9.602 1.00 0.00 H new ATOM 0 HA PHE B 36 -10.382 5.162 -7.712 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -11.911 4.127 -6.083 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -12.717 5.057 -7.331 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -13.837 3.807 -9.251 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -12.425 1.840 -5.750 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -15.225 1.864 -9.772 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -13.810 -0.098 -6.287 1.00 0.00 H new ATOM 0 HZ PHE B 36 -15.196 -0.091 -8.293 1.00 0.00 H new ATOM 1753 N ILE B 37 -10.194 1.858 -7.796 1.00 0.00 N ATOM 1754 CA ILE B 37 -9.284 0.780 -7.581 1.00 0.00 C ATOM 1755 C ILE B 37 -8.337 0.753 -8.760 1.00 0.00 C ATOM 1756 O ILE B 37 -8.735 0.517 -9.912 1.00 0.00 O ATOM 1757 CB ILE B 37 -10.007 -0.618 -7.240 1.00 0.00 C ATOM 1758 CG1 ILE B 37 -9.035 -1.825 -7.086 1.00 0.00 C ATOM 1759 CG2 ILE B 37 -11.163 -0.972 -8.158 1.00 0.00 C ATOM 1760 CD1 ILE B 37 -8.439 -2.387 -8.368 1.00 0.00 C ATOM 0 H ILE B 37 -11.118 1.578 -8.126 1.00 0.00 H new ATOM 0 HA ILE B 37 -8.703 0.945 -6.674 1.00 0.00 H new ATOM 0 HB ILE B 37 -10.434 -0.426 -6.256 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -8.216 -1.522 -6.434 1.00 0.00 H new ATOM 0 HG13 ILE B 37 -9.567 -2.628 -6.577 1.00 0.00 H new ATOM 0 HG21 ILE B 37 -11.589 -1.928 -7.854 1.00 0.00 H new ATOM 0 HG22 ILE B 37 -11.928 -0.198 -8.095 1.00 0.00 H new ATOM 0 HG23 ILE B 37 -10.803 -1.045 -9.184 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -7.781 -3.222 -8.128 1.00 0.00 H new ATOM 0 HD12 ILE B 37 -9.240 -2.733 -9.021 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -7.868 -1.609 -8.875 1.00 0.00 H new ATOM 1772 N ILE B 38 -7.114 1.092 -8.469 1.00 0.00 N ATOM 1773 CA ILE B 38 -6.088 1.242 -9.455 1.00 0.00 C ATOM 1774 C ILE B 38 -5.473 -0.094 -9.804 1.00 0.00 C ATOM 1775 O ILE B 38 -5.426 -0.473 -10.976 1.00 0.00 O ATOM 1776 CB ILE B 38 -4.999 2.219 -8.948 1.00 0.00 C ATOM 1777 CG1 ILE B 38 -5.582 3.636 -8.765 1.00 0.00 C ATOM 1778 CG2 ILE B 38 -3.794 2.221 -9.871 1.00 0.00 C ATOM 1779 CD1 ILE B 38 -4.609 4.640 -8.174 1.00 0.00 C ATOM 0 H ILE B 38 -6.797 1.276 -7.517 1.00 0.00 H new ATOM 0 HA ILE B 38 -6.540 1.653 -10.358 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.656 1.874 -7.972 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.922 4.004 -9.733 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -6.459 3.575 -8.121 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -3.045 2.916 -9.491 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -3.369 1.218 -9.916 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -4.101 2.530 -10.870 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -5.099 5.609 -8.079 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -4.287 4.299 -7.190 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -3.742 4.734 -8.828 1.00 0.00 H new ATOM 1791 N GLN B 39 -5.023 -0.812 -8.806 1.00 0.00 N ATOM 1792 CA GLN B 39 -4.429 -2.095 -9.043 1.00 0.00 C ATOM 1793 C GLN B 39 -4.917 -3.133 -8.092 1.00 0.00 C ATOM 1794 O GLN B 39 -5.125 -2.869 -6.897 1.00 0.00 O ATOM 1795 CB GLN B 39 -2.889 -2.074 -9.099 1.00 0.00 C ATOM 1796 CG GLN B 39 -2.200 -1.461 -7.892 1.00 0.00 C ATOM 1797 CD GLN B 39 -0.702 -1.799 -7.801 1.00 0.00 C ATOM 1798 OE1 GLN B 39 0.086 -1.022 -7.302 1.00 0.00 O ATOM 1799 NE2 GLN B 39 -0.306 -2.964 -8.259 1.00 0.00 N ATOM 0 H GLN B 39 -5.058 -0.528 -7.827 1.00 0.00 H new ATOM 0 HA GLN B 39 -4.764 -2.371 -10.043 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -2.533 -3.097 -9.218 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -2.582 -1.524 -9.989 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -2.318 -0.378 -7.928 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -2.698 -1.806 -6.986 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -0.982 -3.605 -8.675 1.00 0.00 H new ATOM 0 HE22 GLN B 39 0.677 -3.228 -8.199 1.00 0.00 H new ATOM 1808 N ASP B 40 -5.157 -4.287 -8.638 1.00 0.00 N ATOM 1809 CA ASP B 40 -5.525 -5.448 -7.883 1.00 0.00 C ATOM 1810 C ASP B 40 -4.299 -6.171 -7.490 1.00 0.00 C ATOM 1811 O ASP B 40 -3.570 -6.717 -8.336 1.00 0.00 O ATOM 1812 CB ASP B 40 -6.405 -6.388 -8.686 1.00 0.00 C ATOM 1813 CG ASP B 40 -7.840 -6.037 -8.603 1.00 0.00 C ATOM 1814 OD1 ASP B 40 -8.442 -6.281 -7.555 1.00 0.00 O ATOM 1815 OD2 ASP B 40 -8.406 -5.518 -9.587 1.00 0.00 O ATOM 0 H ASP B 40 -5.101 -4.452 -9.643 1.00 0.00 H new ATOM 0 HA ASP B 40 -6.086 -5.117 -7.009 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -6.091 -6.371 -9.730 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -6.263 -7.407 -8.327 1.00 0.00 H new ATOM 1820 N ILE B 41 -4.037 -6.158 -6.256 1.00 0.00 N ATOM 1821 CA ILE B 41 -2.921 -6.834 -5.723 1.00 0.00 C ATOM 1822 C ILE B 41 -3.436 -8.163 -5.113 1.00 0.00 C ATOM 1823 O ILE B 41 -4.591 -8.241 -4.708 1.00 0.00 O ATOM 1824 CB ILE B 41 -2.068 -5.884 -4.797 1.00 0.00 C ATOM 1825 CG1 ILE B 41 -2.964 -4.784 -4.227 1.00 0.00 C ATOM 1826 CG2 ILE B 41 -0.892 -5.237 -5.584 1.00 0.00 C ATOM 1827 CD1 ILE B 41 -2.247 -3.771 -3.393 1.00 0.00 C ATOM 0 H ILE B 41 -4.601 -5.667 -5.562 1.00 0.00 H new ATOM 0 HA ILE B 41 -2.189 -7.116 -6.479 1.00 0.00 H new ATOM 0 HB ILE B 41 -1.651 -6.483 -3.988 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -3.459 -4.272 -5.052 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -3.745 -5.246 -3.623 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -0.323 -4.588 -4.919 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -0.240 -6.019 -5.973 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -1.288 -4.650 -6.413 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -2.958 -3.029 -3.030 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -1.775 -4.267 -2.545 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -1.484 -3.278 -3.995 1.00 0.00 H new ATOM 1839 N ASP B 42 -2.589 -9.155 -5.031 1.00 0.00 N ATOM 1840 CA ASP B 42 -2.991 -10.587 -4.926 1.00 0.00 C ATOM 1841 C ASP B 42 -4.112 -10.955 -3.998 1.00 0.00 C ATOM 1842 O ASP B 42 -3.961 -11.031 -2.770 1.00 0.00 O ATOM 1843 CB ASP B 42 -1.829 -11.541 -4.796 1.00 0.00 C ATOM 1844 CG ASP B 42 -2.255 -12.999 -4.624 1.00 0.00 C ATOM 1845 OD1 ASP B 42 -2.913 -13.575 -5.556 1.00 0.00 O ATOM 1846 OD2 ASP B 42 -1.957 -13.592 -3.555 1.00 0.00 O ATOM 0 H ASP B 42 -1.578 -9.019 -5.033 1.00 0.00 H new ATOM 0 HA ASP B 42 -3.445 -10.716 -5.909 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -1.199 -11.457 -5.681 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -1.220 -11.245 -3.942 1.00 0.00 H new ATOM 1851 N ASP B 43 -5.255 -11.073 -4.654 1.00 0.00 N ATOM 1852 CA ASP B 43 -6.559 -11.622 -4.202 1.00 0.00 C ATOM 1853 C ASP B 43 -7.224 -10.834 -3.115 1.00 0.00 C ATOM 1854 O ASP B 43 -8.416 -10.517 -3.179 1.00 0.00 O ATOM 1855 CB ASP B 43 -6.426 -13.091 -3.765 1.00 0.00 C ATOM 1856 CG ASP B 43 -7.747 -13.699 -3.321 1.00 0.00 C ATOM 1857 OD1 ASP B 43 -8.119 -13.571 -2.129 1.00 0.00 O ATOM 1858 OD2 ASP B 43 -8.448 -14.318 -4.162 1.00 0.00 O ATOM 0 H ASP B 43 -5.317 -10.757 -5.622 1.00 0.00 H new ATOM 0 HA ASP B 43 -7.205 -11.548 -5.077 1.00 0.00 H new ATOM 0 HB2 ASP B 43 -6.023 -13.676 -4.592 1.00 0.00 H new ATOM 0 HB3 ASP B 43 -5.708 -13.158 -2.947 1.00 0.00 H new ATOM 1863 N THR B 44 -6.462 -10.503 -2.167 1.00 0.00 N ATOM 1864 CA THR B 44 -6.961 -9.944 -0.947 1.00 0.00 C ATOM 1865 C THR B 44 -6.465 -8.505 -0.788 1.00 0.00 C ATOM 1866 O THR B 44 -6.694 -7.854 0.235 1.00 0.00 O ATOM 1867 CB THR B 44 -6.459 -10.813 0.239 1.00 0.00 C ATOM 1868 OG1 THR B 44 -6.487 -12.214 -0.165 1.00 0.00 O ATOM 1869 CG2 THR B 44 -7.362 -10.665 1.470 1.00 0.00 C ATOM 0 H THR B 44 -5.448 -10.606 -2.195 1.00 0.00 H new ATOM 0 HA THR B 44 -8.051 -9.934 -0.964 1.00 0.00 H new ATOM 0 HB THR B 44 -5.452 -10.483 0.496 1.00 0.00 H new ATOM 0 HG1 THR B 44 -7.256 -12.370 -0.752 1.00 0.00 H new ATOM 0 HG21 THR B 44 -6.979 -11.287 2.279 1.00 0.00 H new ATOM 0 HG22 THR B 44 -7.374 -9.623 1.789 1.00 0.00 H new ATOM 0 HG23 THR B 44 -8.375 -10.980 1.218 1.00 0.00 H new ATOM 1877 N HIS B 45 -5.764 -7.997 -1.780 1.00 0.00 N ATOM 1878 CA HIS B 45 -5.287 -6.657 -1.679 1.00 0.00 C ATOM 1879 C HIS B 45 -5.855 -5.797 -2.780 1.00 0.00 C ATOM 1880 O HIS B 45 -6.116 -6.255 -3.888 1.00 0.00 O ATOM 1881 CB HIS B 45 -3.761 -6.601 -1.642 1.00 0.00 C ATOM 1882 CG HIS B 45 -3.172 -7.238 -0.437 1.00 0.00 C ATOM 1883 ND1 HIS B 45 -2.712 -8.491 -0.234 1.00 0.00 N flip ATOM 1884 CD2 HIS B 45 -3.041 -6.585 0.762 1.00 0.00 C flip ATOM 1885 CE1 HIS B 45 -2.318 -8.567 1.070 1.00 0.00 C flip ATOM 1886 NE2 HIS B 45 -2.527 -7.406 1.650 1.00 0.00 N flip ATOM 0 H HIS B 45 -5.522 -8.487 -2.641 1.00 0.00 H new ATOM 0 HA HIS B 45 -5.639 -6.251 -0.731 1.00 0.00 H new ATOM 0 HB2 HIS B 45 -3.366 -7.091 -2.532 1.00 0.00 H new ATOM 0 HB3 HIS B 45 -3.443 -5.559 -1.684 1.00 0.00 H new ATOM 0 HD2 HIS B 45 -3.317 -5.557 0.947 1.00 0.00 H new ATOM 0 HE1 HIS B 45 -1.901 -9.441 1.549 1.00 0.00 H new ATOM 0 HE2 HIS B 45 -2.325 -7.181 2.624 1.00 0.00 H new ATOM 1895 N VAL B 46 -6.061 -4.576 -2.468 1.00 0.00 N ATOM 1896 CA VAL B 46 -6.621 -3.611 -3.370 1.00 0.00 C ATOM 1897 C VAL B 46 -5.909 -2.317 -3.142 1.00 0.00 C ATOM 1898 O VAL B 46 -5.478 -2.042 -2.017 1.00 0.00 O ATOM 1899 CB VAL B 46 -8.152 -3.444 -3.086 1.00 0.00 C ATOM 1900 CG1 VAL B 46 -8.684 -2.087 -3.538 1.00 0.00 C ATOM 1901 CG2 VAL B 46 -8.917 -4.538 -3.797 1.00 0.00 C ATOM 0 H VAL B 46 -5.841 -4.194 -1.548 1.00 0.00 H new ATOM 0 HA VAL B 46 -6.502 -3.933 -4.404 1.00 0.00 H new ATOM 0 HB VAL B 46 -8.292 -3.511 -2.007 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -9.750 -2.022 -3.318 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -8.156 -1.294 -3.008 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -8.527 -1.974 -4.611 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -9.983 -4.423 -3.600 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -8.736 -4.470 -4.870 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -8.584 -5.510 -3.434 1.00 0.00 H new ATOM 1911 N PHE B 47 -5.734 -1.553 -4.171 1.00 0.00 N ATOM 1912 CA PHE B 47 -5.150 -0.288 -4.012 1.00 0.00 C ATOM 1913 C PHE B 47 -6.026 0.763 -4.671 1.00 0.00 C ATOM 1914 O PHE B 47 -6.472 0.590 -5.815 1.00 0.00 O ATOM 1915 CB PHE B 47 -3.769 -0.278 -4.600 1.00 0.00 C ATOM 1916 CG PHE B 47 -2.994 0.901 -4.193 1.00 0.00 C ATOM 1917 CD1 PHE B 47 -2.257 0.881 -3.029 1.00 0.00 C ATOM 1918 CD2 PHE B 47 -3.002 2.026 -4.958 1.00 0.00 C ATOM 1919 CE1 PHE B 47 -1.534 1.972 -2.647 1.00 0.00 C ATOM 1920 CE2 PHE B 47 -2.290 3.117 -4.592 1.00 0.00 C ATOM 1921 CZ PHE B 47 -1.548 3.089 -3.430 1.00 0.00 C ATOM 0 H PHE B 47 -5.992 -1.796 -5.127 1.00 0.00 H new ATOM 0 HA PHE B 47 -5.067 -0.058 -2.950 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -3.240 -1.180 -4.293 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -3.840 -0.305 -5.687 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -2.252 -0.007 -2.414 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -3.583 2.049 -5.868 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -0.957 1.952 -1.735 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -2.303 4.005 -5.207 1.00 0.00 H new ATOM 0 HZ PHE B 47 -0.975 3.956 -3.138 1.00 0.00 H new ATOM 1931 N VAL B 48 -6.256 1.822 -3.960 1.00 0.00 N ATOM 1932 CA VAL B 48 -7.061 2.936 -4.404 1.00 0.00 C ATOM 1933 C VAL B 48 -6.325 4.205 -3.989 1.00 0.00 C ATOM 1934 O VAL B 48 -5.469 4.137 -3.135 1.00 0.00 O ATOM 1935 CB VAL B 48 -8.499 2.863 -3.763 1.00 0.00 C ATOM 1936 CG1 VAL B 48 -8.441 2.741 -2.245 1.00 0.00 C ATOM 1937 CG2 VAL B 48 -9.354 4.051 -4.152 1.00 0.00 C ATOM 0 H VAL B 48 -5.879 1.947 -3.021 1.00 0.00 H new ATOM 0 HA VAL B 48 -7.201 2.920 -5.485 1.00 0.00 H new ATOM 0 HB VAL B 48 -8.963 1.961 -4.163 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -9.454 2.694 -1.845 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -7.901 1.834 -1.973 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -7.927 3.608 -1.830 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -10.336 3.960 -3.688 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -8.876 4.970 -3.812 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -9.466 4.080 -5.236 1.00 0.00 H new ATOM 1947 N ILE B 49 -6.589 5.330 -4.600 1.00 0.00 N ATOM 1948 CA ILE B 49 -5.894 6.523 -4.177 1.00 0.00 C ATOM 1949 C ILE B 49 -6.662 7.169 -3.006 1.00 0.00 C ATOM 1950 O ILE B 49 -7.885 6.971 -2.868 1.00 0.00 O ATOM 1951 CB ILE B 49 -5.577 7.502 -5.348 1.00 0.00 C ATOM 1952 CG1 ILE B 49 -4.426 8.455 -4.983 1.00 0.00 C ATOM 1953 CG2 ILE B 49 -6.802 8.282 -5.780 1.00 0.00 C ATOM 1954 CD1 ILE B 49 -3.979 9.358 -6.122 1.00 0.00 C ATOM 0 H ILE B 49 -7.254 5.449 -5.364 1.00 0.00 H new ATOM 0 HA ILE B 49 -4.905 6.242 -3.814 1.00 0.00 H new ATOM 0 HB ILE B 49 -5.260 6.893 -6.194 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -4.736 9.076 -4.142 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -3.574 7.865 -4.646 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.537 8.952 -6.598 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -7.575 7.590 -6.114 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.177 8.866 -4.939 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -3.165 9.998 -5.781 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -3.635 8.747 -6.957 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -4.816 9.977 -6.445 1.00 0.00 H new ATOM 1966 N ALA B 50 -5.962 7.947 -2.213 1.00 0.00 N ATOM 1967 CA ALA B 50 -6.425 8.393 -0.901 1.00 0.00 C ATOM 1968 C ALA B 50 -7.765 9.122 -0.858 1.00 0.00 C ATOM 1969 O ALA B 50 -8.597 8.833 -0.001 1.00 0.00 O ATOM 1970 CB ALA B 50 -5.352 9.198 -0.203 1.00 0.00 C ATOM 0 H ALA B 50 -5.037 8.299 -2.458 1.00 0.00 H new ATOM 0 HA ALA B 50 -6.620 7.465 -0.364 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -5.716 9.521 0.772 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -4.462 8.582 -0.072 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -5.103 10.072 -0.805 1.00 0.00 H new ATOM 1976 N GLU B 51 -7.990 10.022 -1.751 1.00 0.00 N ATOM 1977 CA GLU B 51 -9.195 10.826 -1.706 1.00 0.00 C ATOM 1978 C GLU B 51 -10.448 10.077 -2.153 1.00 0.00 C ATOM 1979 O GLU B 51 -11.557 10.427 -1.753 1.00 0.00 O ATOM 1980 CB GLU B 51 -8.996 12.122 -2.463 1.00 0.00 C ATOM 1981 CG GLU B 51 -7.961 13.012 -1.794 1.00 0.00 C ATOM 1982 CD GLU B 51 -7.585 14.198 -2.617 1.00 0.00 C ATOM 1983 OE1 GLU B 51 -8.337 15.182 -2.641 1.00 0.00 O ATOM 1984 OE2 GLU B 51 -6.498 14.180 -3.232 1.00 0.00 O ATOM 0 H GLU B 51 -7.364 10.232 -2.529 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.376 11.067 -0.658 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -8.682 11.903 -3.483 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -9.945 12.654 -2.529 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -8.350 13.352 -0.834 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.067 12.425 -1.585 1.00 0.00 H new ATOM 1991 N LEU B 52 -10.282 8.998 -2.893 1.00 0.00 N ATOM 1992 CA LEU B 52 -11.444 8.310 -3.463 1.00 0.00 C ATOM 1993 C LEU B 52 -12.041 7.343 -2.493 1.00 0.00 C ATOM 1994 O LEU B 52 -13.122 6.822 -2.717 1.00 0.00 O ATOM 1995 CB LEU B 52 -11.049 7.532 -4.686 1.00 0.00 C ATOM 1996 CG LEU B 52 -10.288 8.288 -5.728 1.00 0.00 C ATOM 1997 CD1 LEU B 52 -9.950 7.363 -6.861 1.00 0.00 C ATOM 1998 CD2 LEU B 52 -11.069 9.499 -6.224 1.00 0.00 C ATOM 0 H LEU B 52 -9.379 8.579 -3.115 1.00 0.00 H new ATOM 0 HA LEU B 52 -12.172 9.082 -3.712 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -10.446 6.680 -4.371 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -11.953 7.131 -5.144 1.00 0.00 H new ATOM 0 HG LEU B 52 -9.367 8.666 -5.284 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -9.395 7.909 -7.624 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -9.341 6.539 -6.489 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -10.869 6.968 -7.294 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -10.485 10.024 -6.980 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -12.013 9.170 -6.658 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -11.268 10.170 -5.389 1.00 0.00 H new ATOM 2010 N VAL B 53 -11.372 7.107 -1.413 1.00 0.00 N ATOM 2011 CA VAL B 53 -11.886 6.177 -0.450 1.00 0.00 C ATOM 2012 C VAL B 53 -13.120 6.758 0.229 1.00 0.00 C ATOM 2013 O VAL B 53 -14.036 6.028 0.605 1.00 0.00 O ATOM 2014 CB VAL B 53 -10.810 5.670 0.540 1.00 0.00 C ATOM 2015 CG1 VAL B 53 -10.409 6.733 1.546 1.00 0.00 C ATOM 2016 CG2 VAL B 53 -11.229 4.374 1.222 1.00 0.00 C ATOM 0 H VAL B 53 -10.479 7.537 -1.172 1.00 0.00 H new ATOM 0 HA VAL B 53 -12.198 5.277 -0.980 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.922 5.447 -0.052 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -9.652 6.330 2.219 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -10.004 7.597 1.020 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -11.283 7.036 2.123 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -10.445 4.054 1.908 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -12.153 4.537 1.777 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -11.390 3.602 0.469 1.00 0.00 H new ATOM 2026 N ASN B 54 -13.145 8.080 0.335 1.00 0.00 N ATOM 2027 CA ASN B 54 -14.288 8.792 0.877 1.00 0.00 C ATOM 2028 C ASN B 54 -15.530 8.454 0.073 1.00 0.00 C ATOM 2029 O ASN B 54 -16.570 8.115 0.646 1.00 0.00 O ATOM 2030 CB ASN B 54 -14.073 10.319 0.871 1.00 0.00 C ATOM 2031 CG ASN B 54 -12.877 10.763 1.688 1.00 0.00 C ATOM 2032 OD1 ASN B 54 -12.974 10.964 2.896 1.00 0.00 O ATOM 2033 ND2 ASN B 54 -11.764 10.984 1.035 1.00 0.00 N ATOM 0 H ASN B 54 -12.375 8.684 0.048 1.00 0.00 H new ATOM 0 HA ASN B 54 -14.412 8.476 1.913 1.00 0.00 H new ATOM 0 HB2 ASN B 54 -13.946 10.656 -0.158 1.00 0.00 H new ATOM 0 HB3 ASN B 54 -14.968 10.806 1.258 1.00 0.00 H new ATOM 0 HD21 ASN B 54 -10.943 11.334 1.530 1.00 0.00 H new ATOM 0 HD22 ASN B 54 -11.718 10.806 0.032 1.00 0.00 H new ATOM 2040 N VAL B 55 -15.404 8.465 -1.266 1.00 0.00 N ATOM 2041 CA VAL B 55 -16.549 8.184 -2.115 1.00 0.00 C ATOM 2042 C VAL B 55 -16.940 6.733 -2.037 1.00 0.00 C ATOM 2043 O VAL B 55 -18.117 6.398 -2.035 1.00 0.00 O ATOM 2044 CB VAL B 55 -16.410 8.647 -3.601 1.00 0.00 C ATOM 2045 CG1 VAL B 55 -16.100 10.113 -3.677 1.00 0.00 C ATOM 2046 CG2 VAL B 55 -15.385 7.849 -4.394 1.00 0.00 C ATOM 0 H VAL B 55 -14.536 8.662 -1.764 1.00 0.00 H new ATOM 0 HA VAL B 55 -17.350 8.800 -1.706 1.00 0.00 H new ATOM 0 HB VAL B 55 -17.378 8.456 -4.065 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -16.008 10.412 -4.721 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -16.904 10.680 -3.207 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -15.163 10.314 -3.158 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -15.342 8.226 -5.416 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -14.405 7.951 -3.928 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -15.673 6.798 -4.406 1.00 0.00 H new ATOM 2056 N LEU B 56 -15.951 5.881 -1.920 1.00 0.00 N ATOM 2057 CA LEU B 56 -16.182 4.461 -1.771 1.00 0.00 C ATOM 2058 C LEU B 56 -16.967 4.194 -0.521 1.00 0.00 C ATOM 2059 O LEU B 56 -17.897 3.423 -0.534 1.00 0.00 O ATOM 2060 CB LEU B 56 -14.877 3.689 -1.755 1.00 0.00 C ATOM 2061 CG LEU B 56 -14.038 3.825 -3.011 1.00 0.00 C ATOM 2062 CD1 LEU B 56 -12.807 2.978 -2.919 1.00 0.00 C ATOM 2063 CD2 LEU B 56 -14.846 3.451 -4.226 1.00 0.00 C ATOM 0 H LEU B 56 -14.967 6.148 -1.925 1.00 0.00 H new ATOM 0 HA LEU B 56 -16.759 4.119 -2.631 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -14.285 4.022 -0.903 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -15.098 2.634 -1.596 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.730 4.866 -3.107 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.219 3.090 -3.830 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.212 3.293 -2.062 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -13.093 1.933 -2.798 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -14.229 3.554 -5.119 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.183 2.418 -4.135 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -15.711 4.110 -4.305 1.00 0.00 H new ATOM 2075 N GLN B 57 -16.617 4.891 0.544 1.00 0.00 N ATOM 2076 CA GLN B 57 -17.321 4.787 1.794 1.00 0.00 C ATOM 2077 C GLN B 57 -18.762 5.170 1.668 1.00 0.00 C ATOM 2078 O GLN B 57 -19.630 4.555 2.299 1.00 0.00 O ATOM 2079 CB GLN B 57 -16.644 5.603 2.836 1.00 0.00 C ATOM 2080 CG GLN B 57 -15.945 4.733 3.866 1.00 0.00 C ATOM 2081 CD GLN B 57 -14.742 3.896 3.379 1.00 0.00 C ATOM 2082 OE1 GLN B 57 -14.771 3.414 2.170 1.00 0.00 O flip ATOM 2083 NE2 GLN B 57 -13.806 3.657 4.139 1.00 0.00 N flip ATOM 0 H GLN B 57 -15.834 5.545 0.559 1.00 0.00 H new ATOM 0 HA GLN B 57 -17.299 3.740 2.095 1.00 0.00 H new ATOM 0 HB2 GLN B 57 -15.917 6.264 2.365 1.00 0.00 H new ATOM 0 HB3 GLN B 57 -17.377 6.238 3.334 1.00 0.00 H new ATOM 0 HG2 GLN B 57 -15.603 5.377 4.677 1.00 0.00 H new ATOM 0 HG3 GLN B 57 -16.682 4.051 4.289 1.00 0.00 H new ATOM 0 HE21 GLN B 57 -13.803 4.045 5.082 1.00 0.00 H new ATOM 0 HE22 GLN B 57 -13.032 3.071 3.826 1.00 0.00 H new ATOM 2092 N GLU B 58 -19.035 6.147 0.812 1.00 0.00 N ATOM 2093 CA GLU B 58 -20.399 6.581 0.598 1.00 0.00 C ATOM 2094 C GLU B 58 -21.151 5.512 -0.166 1.00 0.00 C ATOM 2095 O GLU B 58 -22.246 5.140 0.196 1.00 0.00 O ATOM 2096 CB GLU B 58 -20.480 7.879 -0.204 1.00 0.00 C ATOM 2097 CG GLU B 58 -19.494 8.939 0.233 1.00 0.00 C ATOM 2098 CD GLU B 58 -19.613 10.255 -0.510 1.00 0.00 C ATOM 2099 OE1 GLU B 58 -19.484 10.290 -1.751 1.00 0.00 O ATOM 2100 OE2 GLU B 58 -19.802 11.301 0.147 1.00 0.00 O ATOM 0 H GLU B 58 -18.335 6.646 0.263 1.00 0.00 H new ATOM 0 HA GLU B 58 -20.837 6.755 1.581 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -20.311 7.654 -1.257 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -21.490 8.282 -0.122 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -19.629 9.125 1.299 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -18.483 8.553 0.102 1.00 0.00 H new ATOM 2107 N ARG B 59 -20.524 4.996 -1.212 1.00 0.00 N ATOM 2108 CA ARG B 59 -21.162 4.013 -2.070 1.00 0.00 C ATOM 2109 C ARG B 59 -21.407 2.710 -1.299 1.00 0.00 C ATOM 2110 O ARG B 59 -22.490 2.157 -1.332 1.00 0.00 O ATOM 2111 CB ARG B 59 -20.302 3.743 -3.323 1.00 0.00 C ATOM 2112 CG ARG B 59 -19.905 4.990 -4.100 1.00 0.00 C ATOM 2113 CD ARG B 59 -21.094 5.799 -4.640 1.00 0.00 C ATOM 2114 NE ARG B 59 -21.882 5.104 -5.682 1.00 0.00 N ATOM 2115 CZ ARG B 59 -22.999 5.620 -6.264 1.00 0.00 C ATOM 2116 NH1 ARG B 59 -23.480 6.798 -5.863 1.00 0.00 N ATOM 2117 NH2 ARG B 59 -23.642 4.932 -7.212 1.00 0.00 N ATOM 0 H ARG B 59 -19.573 5.243 -1.486 1.00 0.00 H new ATOM 0 HA ARG B 59 -22.123 4.412 -2.394 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -19.397 3.216 -3.020 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -20.851 3.076 -3.988 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -19.306 5.632 -3.454 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -19.269 4.697 -4.936 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -21.754 6.051 -3.810 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -20.723 6.739 -5.048 1.00 0.00 H new ATOM 0 HE ARG B 59 -21.569 4.181 -5.983 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -23.011 7.314 -5.119 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -24.317 7.183 -6.301 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -23.296 4.017 -7.502 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -24.479 5.322 -7.646 1.00 0.00 H new ATOM 2131 N VAL B 60 -20.426 2.281 -0.553 1.00 0.00 N ATOM 2132 CA VAL B 60 -20.545 1.049 0.225 1.00 0.00 C ATOM 2133 C VAL B 60 -21.586 1.201 1.329 1.00 0.00 C ATOM 2134 O VAL B 60 -22.434 0.334 1.511 1.00 0.00 O ATOM 2135 CB VAL B 60 -19.185 0.608 0.840 1.00 0.00 C ATOM 2136 CG1 VAL B 60 -19.335 -0.668 1.671 1.00 0.00 C ATOM 2137 CG2 VAL B 60 -18.165 0.390 -0.256 1.00 0.00 C ATOM 0 H VAL B 60 -19.529 2.757 -0.458 1.00 0.00 H new ATOM 0 HA VAL B 60 -20.867 0.271 -0.468 1.00 0.00 H new ATOM 0 HB VAL B 60 -18.844 1.405 1.501 1.00 0.00 H new ATOM 0 HG11 VAL B 60 -18.367 -0.948 2.086 1.00 0.00 H new ATOM 0 HG12 VAL B 60 -20.041 -0.492 2.483 1.00 0.00 H new ATOM 0 HG13 VAL B 60 -19.705 -1.474 1.037 1.00 0.00 H new ATOM 0 HG21 VAL B 60 -17.217 0.082 0.185 1.00 0.00 H new ATOM 0 HG22 VAL B 60 -18.519 -0.387 -0.934 1.00 0.00 H new ATOM 0 HG23 VAL B 60 -18.023 1.318 -0.810 1.00 0.00 H new ATOM 2147 N GLY B 61 -21.537 2.324 2.015 1.00 0.00 N ATOM 2148 CA GLY B 61 -22.413 2.551 3.135 1.00 0.00 C ATOM 2149 C GLY B 61 -23.845 2.854 2.747 1.00 0.00 C ATOM 2150 O GLY B 61 -24.776 2.233 3.275 1.00 0.00 O ATOM 0 H GLY B 61 -20.897 3.092 1.813 1.00 0.00 H new ATOM 0 HA2 GLY B 61 -22.400 1.670 3.777 1.00 0.00 H new ATOM 0 HA3 GLY B 61 -22.024 3.381 3.725 1.00 0.00 H new