USER MOD reduce.3.24.130724 H: found=0, std=0, add=810, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 813 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 61 GLN : amide:sc= -1.06! K(o=-1.6!,f=-2.1) USER MOD Set 1.2: A 68 HIS : no HD1:sc= -0.491 K(o=-1.6,f=-6.3!) USER MOD Set 2.1: A 2 GLN : amide:sc= 0 X(o=-0.09,f=-0.45) USER MOD Set 2.2: A 34 GLN : amide:sc= -0.0895 X(o=-0.09,f=-0.021) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -171:sc= 1.02 (180deg=0.958) USER MOD Single : A 3 THR OG1 : rot 144:sc= 1.25 USER MOD Single : A 9 SER OG : rot 37:sc= 0.473 USER MOD Single : A 13 TYR OH : rot -105:sc= 1.21 USER MOD Single : A 14 SER OG : rot -153:sc= 1.27 USER MOD Single : A 18 LYS NZ :NH3+ -141:sc= 0.804! (180deg=0.495) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 24:sc= 0.0585 USER MOD Single : A 26 ASN : amide:sc= 0.907 K(o=0.91,f=0) USER MOD Single : A 32 GLN : amide:sc= 0.596 K(o=0.6,f=-0.016) USER MOD Single : A 33 TYR OH : rot -132:sc= 1.26 USER MOD Single : A 35 TYR OH : rot -165:sc= 0.912 USER MOD Single : A 44 THR OG1 : rot -164:sc= 0.807 USER MOD Single : A 45 LYS NZ :NH3+ -144:sc= 1.27 (180deg=0.557) USER MOD Single : A 49 GLN : amide:sc= -0.0421 X(o=-0.042,f=-0.018) USER MOD Single : A 50 GLN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A 51 LYS NZ :NH3+ -155:sc= 1.22 (180deg=0.464) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 144:sc= 1.27 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 GLN : amide:sc= -0.0725 K(o=-0.073,f=-2.1) USER MOD Single : A 72 TYR OH : rot 180:sc= -0.354 USER MOD Single : A 73 THR OG1 : rot 102:sc= 1.27 USER MOD Single : A 80 LYS NZ :NH3+ -116:sc= 0.528 (180deg=-1.55!) USER MOD Single : A 82 ASN : amide:sc= 0.953 K(o=0.95,f=0) USER MOD Single : B 131 GLN : amide:sc= 0.739 K(o=0.74,f=-0.09) USER MOD Single : B 137 SER OG : rot 180:sc= 0 USER MOD Single : B 139 GLN : amide:sc= 0.885 K(o=0.89,f=-0.67) USER MOD Single : B 143 SER OG : rot 180:sc= 0 USER MOD Single : B 145 SER OG : rot 180:sc= 0 USER MOD Single : B 149 LYS NZ :NH3+ -118:sc= 0.846 (180deg=0.0718) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.016 -16.380 -1.280 1.00 1.00 N ATOM 2 CA MET A 1 14.160 -15.185 -1.129 1.00 1.00 C ATOM 3 C MET A 1 14.906 -14.045 -0.445 1.00 1.00 C ATOM 4 O MET A 1 15.296 -14.180 0.711 1.00 1.00 O ATOM 5 CB MET A 1 12.852 -15.524 -0.381 1.00 1.00 C ATOM 6 CG MET A 1 11.975 -14.310 -0.062 1.00 1.00 C ATOM 7 SD MET A 1 11.734 -13.204 -1.469 1.00 1.00 S ATOM 8 CE MET A 1 10.593 -14.187 -2.470 1.00 1.00 C ATOM 0 H1 MET A 1 14.534 -17.079 -1.880 1.00 1.00 H new ATOM 0 H2 MET A 1 15.917 -16.108 -1.722 1.00 1.00 H new ATOM 0 H3 MET A 1 15.200 -16.795 -0.345 1.00 1.00 H new ATOM 0 HA MET A 1 13.893 -14.847 -2.130 1.00 1.00 H new ATOM 0 HB2 MET A 1 12.275 -16.226 -0.983 1.00 1.00 H new ATOM 0 HB3 MET A 1 13.101 -16.032 0.551 1.00 1.00 H new ATOM 0 HG2 MET A 1 11.003 -14.656 0.288 1.00 1.00 H new ATOM 0 HG3 MET A 1 12.428 -13.750 0.756 1.00 1.00 H new ATOM 0 HE1 MET A 1 10.344 -13.641 -3.380 1.00 1.00 H new ATOM 0 HE2 MET A 1 11.063 -15.135 -2.732 1.00 1.00 H new ATOM 0 HE3 MET A 1 9.683 -14.379 -1.902 1.00 1.00 H new ATOM 20 N GLN A 2 15.059 -12.909 -1.129 1.00 1.00 N ATOM 21 CA GLN A 2 15.593 -11.641 -0.613 1.00 1.00 C ATOM 22 C GLN A 2 14.594 -10.475 -0.675 1.00 1.00 C ATOM 23 O GLN A 2 14.074 -10.166 -1.739 1.00 1.00 O ATOM 24 CB GLN A 2 16.923 -11.225 -1.246 1.00 1.00 C ATOM 25 CG GLN A 2 17.764 -10.496 -0.170 1.00 1.00 C ATOM 26 CD GLN A 2 18.818 -9.533 -0.688 1.00 1.00 C ATOM 27 OE1 GLN A 2 18.724 -8.915 -1.737 1.00 1.00 O ATOM 28 NE2 GLN A 2 19.841 -9.284 0.082 1.00 1.00 N ATOM 0 H GLN A 2 14.800 -12.843 -2.113 1.00 1.00 H new ATOM 0 HA GLN A 2 15.782 -11.860 0.438 1.00 1.00 H new ATOM 0 HB2 GLN A 2 17.457 -12.100 -1.618 1.00 1.00 H new ATOM 0 HB3 GLN A 2 16.749 -10.571 -2.100 1.00 1.00 H new ATOM 0 HG2 GLN A 2 17.085 -9.945 0.481 1.00 1.00 H new ATOM 0 HG3 GLN A 2 18.258 -11.247 0.447 1.00 1.00 H new ATOM 0 HE21 GLN A 2 19.948 -9.783 0.965 1.00 1.00 H new ATOM 0 HE22 GLN A 2 20.534 -8.590 -0.199 1.00 1.00 H new ATOM 37 N THR A 3 14.291 -9.841 0.454 1.00 1.00 N ATOM 38 CA THR A 3 13.379 -8.666 0.530 1.00 1.00 C ATOM 39 C THR A 3 14.129 -7.395 0.952 1.00 1.00 C ATOM 40 O THR A 3 14.645 -7.322 2.068 1.00 1.00 O ATOM 41 CB THR A 3 12.158 -8.910 1.437 1.00 1.00 C ATOM 42 OG1 THR A 3 11.484 -10.090 1.054 1.00 1.00 O ATOM 43 CG2 THR A 3 11.139 -7.778 1.294 1.00 1.00 C ATOM 0 H THR A 3 14.667 -10.119 1.360 1.00 1.00 H new ATOM 0 HA THR A 3 12.996 -8.518 -0.480 1.00 1.00 H new ATOM 0 HB THR A 3 12.534 -8.977 2.458 1.00 1.00 H new ATOM 0 HG1 THR A 3 11.145 -10.547 1.852 1.00 1.00 H new ATOM 0 HG21 THR A 3 10.286 -7.972 1.944 1.00 1.00 H new ATOM 0 HG22 THR A 3 11.603 -6.833 1.577 1.00 1.00 H new ATOM 0 HG23 THR A 3 10.801 -7.721 0.259 1.00 1.00 H new ATOM 51 N VAL A 4 14.188 -6.387 0.073 1.00 1.00 N ATOM 52 CA VAL A 4 14.972 -5.131 0.199 1.00 1.00 C ATOM 53 C VAL A 4 14.004 -3.952 0.400 1.00 1.00 C ATOM 54 O VAL A 4 13.070 -3.745 -0.371 1.00 1.00 O ATOM 55 CB VAL A 4 15.969 -4.931 -0.969 1.00 1.00 C ATOM 56 CG1 VAL A 4 16.897 -3.722 -0.727 1.00 1.00 C ATOM 57 CG2 VAL A 4 16.842 -6.181 -1.196 1.00 1.00 C ATOM 0 H VAL A 4 13.662 -6.419 -0.800 1.00 1.00 H new ATOM 0 HA VAL A 4 15.610 -5.193 1.080 1.00 1.00 H new ATOM 0 HB VAL A 4 15.361 -4.749 -1.855 1.00 1.00 H new ATOM 0 HG11 VAL A 4 17.582 -3.615 -1.568 1.00 1.00 H new ATOM 0 HG12 VAL A 4 16.297 -2.817 -0.629 1.00 1.00 H new ATOM 0 HG13 VAL A 4 17.468 -3.879 0.188 1.00 1.00 H new ATOM 0 HG21 VAL A 4 17.528 -6.000 -2.024 1.00 1.00 H new ATOM 0 HG22 VAL A 4 17.412 -6.395 -0.292 1.00 1.00 H new ATOM 0 HG23 VAL A 4 16.204 -7.032 -1.433 1.00 1.00 H new ATOM 67 N ILE A 5 14.201 -3.208 1.487 1.00 1.00 N ATOM 68 CA ILE A 5 13.343 -2.144 2.044 1.00 1.00 C ATOM 69 C ILE A 5 13.922 -0.722 1.913 1.00 1.00 C ATOM 70 O ILE A 5 15.030 -0.461 2.386 1.00 1.00 O ATOM 71 CB ILE A 5 13.137 -2.496 3.544 1.00 1.00 C ATOM 72 CG1 ILE A 5 12.621 -3.941 3.841 1.00 1.00 C ATOM 73 CG2 ILE A 5 12.220 -1.476 4.235 1.00 1.00 C ATOM 74 CD1 ILE A 5 13.120 -4.464 5.193 1.00 1.00 C ATOM 0 H ILE A 5 15.037 -3.340 2.056 1.00 1.00 H new ATOM 0 HA ILE A 5 12.413 -2.116 1.477 1.00 1.00 H new ATOM 0 HB ILE A 5 14.145 -2.453 3.956 1.00 1.00 H new ATOM 0 HG12 ILE A 5 11.531 -3.946 3.831 1.00 1.00 H new ATOM 0 HG13 ILE A 5 12.950 -4.613 3.049 1.00 1.00 H new ATOM 0 HG21 ILE A 5 12.096 -1.750 5.283 1.00 1.00 H new ATOM 0 HG22 ILE A 5 12.666 -0.483 4.170 1.00 1.00 H new ATOM 0 HG23 ILE A 5 11.247 -1.470 3.744 1.00 1.00 H new ATOM 0 HD11 ILE A 5 12.737 -5.471 5.357 1.00 1.00 H new ATOM 0 HD12 ILE A 5 14.210 -4.486 5.195 1.00 1.00 H new ATOM 0 HD13 ILE A 5 12.769 -3.808 5.989 1.00 1.00 H new ATOM 86 N PHE A 6 13.164 0.224 1.344 1.00 1.00 N ATOM 87 CA PHE A 6 13.513 1.654 1.196 1.00 1.00 C ATOM 88 C PHE A 6 12.734 2.572 2.167 1.00 1.00 C ATOM 89 O PHE A 6 11.510 2.698 2.083 1.00 1.00 O ATOM 90 CB PHE A 6 13.353 2.120 -0.271 1.00 1.00 C ATOM 91 CG PHE A 6 14.399 1.582 -1.238 1.00 1.00 C ATOM 92 CD1 PHE A 6 15.730 2.064 -1.193 1.00 1.00 C ATOM 93 CD2 PHE A 6 14.062 0.574 -2.170 1.00 1.00 C ATOM 94 CE1 PHE A 6 16.706 1.551 -2.073 1.00 1.00 C ATOM 95 CE2 PHE A 6 15.045 0.051 -3.042 1.00 1.00 C ATOM 96 CZ PHE A 6 16.367 0.536 -2.989 1.00 1.00 C ATOM 0 H PHE A 6 12.246 0.009 0.954 1.00 1.00 H new ATOM 0 HA PHE A 6 14.564 1.744 1.471 1.00 1.00 H new ATOM 0 HB2 PHE A 6 12.366 1.822 -0.625 1.00 1.00 H new ATOM 0 HB3 PHE A 6 13.385 3.209 -0.295 1.00 1.00 H new ATOM 0 HD1 PHE A 6 16.000 2.829 -0.480 1.00 1.00 H new ATOM 0 HD2 PHE A 6 13.049 0.202 -2.216 1.00 1.00 H new ATOM 0 HE1 PHE A 6 17.714 1.937 -2.044 1.00 1.00 H new ATOM 0 HE2 PHE A 6 14.782 -0.721 -3.750 1.00 1.00 H new ATOM 0 HZ PHE A 6 17.119 0.130 -3.650 1.00 1.00 H new ATOM 106 N GLY A 7 13.455 3.219 3.095 1.00 1.00 N ATOM 107 CA GLY A 7 12.960 4.270 4.004 1.00 1.00 C ATOM 108 C GLY A 7 12.033 3.913 5.176 1.00 1.00 C ATOM 109 O GLY A 7 10.874 4.331 5.189 1.00 1.00 O ATOM 0 H GLY A 7 14.444 3.016 3.241 1.00 1.00 H new ATOM 0 HA2 GLY A 7 13.833 4.769 4.425 1.00 1.00 H new ATOM 0 HA3 GLY A 7 12.437 5.005 3.392 1.00 1.00 H new ATOM 113 N ARG A 8 12.561 3.271 6.229 1.00 1.00 N ATOM 114 CA ARG A 8 11.916 2.979 7.548 1.00 1.00 C ATOM 115 C ARG A 8 11.871 4.248 8.455 1.00 1.00 C ATOM 116 O ARG A 8 11.951 4.198 9.679 1.00 1.00 O ATOM 117 CB ARG A 8 12.726 1.824 8.177 1.00 1.00 C ATOM 118 CG ARG A 8 12.109 1.175 9.437 1.00 1.00 C ATOM 119 CD ARG A 8 13.106 0.936 10.582 1.00 1.00 C ATOM 120 NE ARG A 8 13.676 2.207 11.074 1.00 1.00 N ATOM 121 CZ ARG A 8 14.913 2.635 11.016 1.00 1.00 C ATOM 122 NH1 ARG A 8 15.932 1.922 10.691 1.00 1.00 N ATOM 123 NH2 ARG A 8 15.195 3.864 11.243 1.00 1.00 N ATOM 0 H ARG A 8 13.515 2.911 6.194 1.00 1.00 H new ATOM 0 HA ARG A 8 10.873 2.686 7.427 1.00 1.00 H new ATOM 0 HB2 ARG A 8 12.863 1.049 7.423 1.00 1.00 H new ATOM 0 HB3 ARG A 8 13.717 2.198 8.433 1.00 1.00 H new ATOM 0 HG2 ARG A 8 11.303 1.812 9.801 1.00 1.00 H new ATOM 0 HG3 ARG A 8 11.661 0.222 9.157 1.00 1.00 H new ATOM 0 HD2 ARG A 8 12.605 0.419 11.401 1.00 1.00 H new ATOM 0 HD3 ARG A 8 13.909 0.285 10.237 1.00 1.00 H new ATOM 0 HE ARG A 8 13.014 2.840 11.522 1.00 1.00 H new ATOM 0 HH11 ARG A 8 15.810 0.938 10.452 1.00 1.00 H new ATOM 0 HH12 ARG A 8 16.862 2.340 10.672 1.00 1.00 H new ATOM 0 HH21 ARG A 8 14.452 4.524 11.473 1.00 1.00 H new ATOM 0 HH22 ARG A 8 16.163 4.183 11.194 1.00 1.00 H new ATOM 137 N SER A 9 11.744 5.401 7.805 1.00 1.00 N ATOM 138 CA SER A 9 11.835 6.798 8.262 1.00 1.00 C ATOM 139 C SER A 9 10.551 7.646 8.193 1.00 1.00 C ATOM 140 O SER A 9 10.018 7.852 7.104 1.00 1.00 O ATOM 141 CB SER A 9 12.909 7.484 7.393 1.00 1.00 C ATOM 142 OG SER A 9 12.566 7.419 6.010 1.00 1.00 O ATOM 0 H SER A 9 11.547 5.381 6.804 1.00 1.00 H new ATOM 0 HA SER A 9 12.066 6.744 9.326 1.00 1.00 H new ATOM 0 HB2 SER A 9 13.016 8.525 7.696 1.00 1.00 H new ATOM 0 HB3 SER A 9 13.874 7.004 7.555 1.00 1.00 H new ATOM 0 HG SER A 9 11.597 7.524 5.908 1.00 1.00 H new ATOM 148 N GLY A 10 10.092 8.196 9.324 1.00 1.00 N ATOM 149 CA GLY A 10 8.987 9.173 9.446 1.00 1.00 C ATOM 150 C GLY A 10 7.568 8.607 9.291 1.00 1.00 C ATOM 151 O GLY A 10 6.760 8.670 10.221 1.00 1.00 O ATOM 0 H GLY A 10 10.498 7.964 10.230 1.00 1.00 H new ATOM 0 HA2 GLY A 10 9.060 9.654 10.421 1.00 1.00 H new ATOM 0 HA3 GLY A 10 9.131 9.950 8.695 1.00 1.00 H new ATOM 155 N CYS A 11 7.241 8.056 8.118 1.00 1.00 N ATOM 156 CA CYS A 11 6.001 7.338 7.830 1.00 1.00 C ATOM 157 C CYS A 11 5.847 5.962 8.530 1.00 1.00 C ATOM 158 O CYS A 11 6.600 5.020 8.241 1.00 1.00 O ATOM 159 CB CYS A 11 5.748 7.303 6.328 1.00 1.00 C ATOM 160 SG CYS A 11 7.164 6.687 5.371 1.00 1.00 S ATOM 0 H CYS A 11 7.862 8.102 7.310 1.00 1.00 H new ATOM 0 HA CYS A 11 5.200 7.913 8.294 1.00 1.00 H new ATOM 0 HB2 CYS A 11 4.882 6.672 6.128 1.00 1.00 H new ATOM 0 HB3 CYS A 11 5.497 8.307 5.986 1.00 1.00 H new ATOM 165 N PRO A 12 4.827 5.805 9.406 1.00 1.00 N ATOM 166 CA PRO A 12 4.661 4.623 10.255 1.00 1.00 C ATOM 167 C PRO A 12 4.314 3.328 9.491 1.00 1.00 C ATOM 168 O PRO A 12 4.808 2.273 9.899 1.00 1.00 O ATOM 169 CB PRO A 12 3.596 5.028 11.280 1.00 1.00 C ATOM 170 CG PRO A 12 2.713 6.022 10.527 1.00 1.00 C ATOM 171 CD PRO A 12 3.720 6.736 9.625 1.00 1.00 C ATOM 0 HA PRO A 12 5.604 4.352 10.730 1.00 1.00 H new ATOM 0 HB2 PRO A 12 3.024 4.166 11.622 1.00 1.00 H new ATOM 0 HB3 PRO A 12 4.045 5.483 12.163 1.00 1.00 H new ATOM 0 HG2 PRO A 12 1.936 5.520 9.951 1.00 1.00 H new ATOM 0 HG3 PRO A 12 2.211 6.714 11.204 1.00 1.00 H new ATOM 0 HD2 PRO A 12 3.259 7.018 8.678 1.00 1.00 H new ATOM 0 HD3 PRO A 12 4.074 7.655 10.093 1.00 1.00 H new ATOM 179 N TYR A 13 3.600 3.394 8.345 1.00 1.00 N ATOM 180 CA TYR A 13 3.324 2.202 7.493 1.00 1.00 C ATOM 181 C TYR A 13 4.623 1.657 6.860 1.00 1.00 C ATOM 182 O TYR A 13 4.802 0.448 6.754 1.00 1.00 O ATOM 183 CB TYR A 13 2.234 2.428 6.422 1.00 1.00 C ATOM 184 CG TYR A 13 0.794 2.555 6.913 1.00 1.00 C ATOM 185 CD1 TYR A 13 0.399 3.646 7.722 1.00 1.00 C ATOM 186 CD2 TYR A 13 -0.176 1.601 6.517 1.00 1.00 C ATOM 187 CE1 TYR A 13 -0.948 3.784 8.130 1.00 1.00 C ATOM 188 CE2 TYR A 13 -1.524 1.730 6.925 1.00 1.00 C ATOM 189 CZ TYR A 13 -1.911 2.827 7.730 1.00 1.00 C ATOM 190 OH TYR A 13 -3.196 2.936 8.148 1.00 1.00 O ATOM 0 H TYR A 13 3.201 4.260 7.983 1.00 1.00 H new ATOM 0 HA TYR A 13 2.917 1.449 8.168 1.00 1.00 H new ATOM 0 HB2 TYR A 13 2.485 3.334 5.870 1.00 1.00 H new ATOM 0 HB3 TYR A 13 2.278 1.601 5.714 1.00 1.00 H new ATOM 0 HD1 TYR A 13 1.131 4.378 8.030 1.00 1.00 H new ATOM 0 HD2 TYR A 13 0.117 0.767 5.897 1.00 1.00 H new ATOM 0 HE1 TYR A 13 -1.242 4.620 8.747 1.00 1.00 H new ATOM 0 HE2 TYR A 13 -2.255 0.994 6.623 1.00 1.00 H new ATOM 0 HH TYR A 13 -3.371 2.270 8.845 1.00 1.00 H new ATOM 200 N SER A 14 5.550 2.540 6.448 1.00 1.00 N ATOM 201 CA SER A 14 6.912 2.198 5.979 1.00 1.00 C ATOM 202 C SER A 14 7.714 1.395 7.020 1.00 1.00 C ATOM 203 O SER A 14 8.312 0.370 6.684 1.00 1.00 O ATOM 204 CB SER A 14 7.692 3.463 5.611 1.00 1.00 C ATOM 205 OG SER A 14 8.607 3.169 4.583 1.00 1.00 O ATOM 0 H SER A 14 5.370 3.544 6.430 1.00 1.00 H new ATOM 0 HA SER A 14 6.783 1.570 5.097 1.00 1.00 H new ATOM 0 HB2 SER A 14 7.005 4.245 5.288 1.00 1.00 H new ATOM 0 HB3 SER A 14 8.221 3.844 6.485 1.00 1.00 H new ATOM 0 HG SER A 14 9.362 3.793 4.629 1.00 1.00 H new ATOM 211 N VAL A 15 7.700 1.831 8.295 1.00 1.00 N ATOM 212 CA VAL A 15 8.272 1.077 9.441 1.00 1.00 C ATOM 213 C VAL A 15 7.580 -0.284 9.591 1.00 1.00 C ATOM 214 O VAL A 15 8.274 -1.295 9.639 1.00 1.00 O ATOM 215 CB VAL A 15 8.214 1.828 10.798 1.00 1.00 C ATOM 216 CG1 VAL A 15 8.834 0.942 11.904 1.00 1.00 C ATOM 217 CG2 VAL A 15 8.896 3.211 10.774 1.00 1.00 C ATOM 0 H VAL A 15 7.289 2.724 8.567 1.00 1.00 H new ATOM 0 HA VAL A 15 9.327 0.951 9.198 1.00 1.00 H new ATOM 0 HB VAL A 15 7.161 2.019 11.007 1.00 1.00 H new ATOM 0 HG11 VAL A 15 8.794 1.469 12.857 1.00 1.00 H new ATOM 0 HG12 VAL A 15 8.274 0.010 11.980 1.00 1.00 H new ATOM 0 HG13 VAL A 15 9.872 0.722 11.655 1.00 1.00 H new ATOM 0 HG21 VAL A 15 8.814 3.674 11.757 1.00 1.00 H new ATOM 0 HG22 VAL A 15 9.948 3.093 10.515 1.00 1.00 H new ATOM 0 HG23 VAL A 15 8.408 3.844 10.033 1.00 1.00 H new ATOM 227 N ARG A 16 6.237 -0.338 9.627 1.00 1.00 N ATOM 228 CA ARG A 16 5.459 -1.597 9.666 1.00 1.00 C ATOM 229 C ARG A 16 5.771 -2.539 8.488 1.00 1.00 C ATOM 230 O ARG A 16 5.985 -3.716 8.726 1.00 1.00 O ATOM 231 CB ARG A 16 3.952 -1.292 9.785 1.00 1.00 C ATOM 232 CG ARG A 16 3.518 -0.623 11.106 1.00 1.00 C ATOM 233 CD ARG A 16 3.706 -1.493 12.359 1.00 1.00 C ATOM 234 NE ARG A 16 2.890 -2.719 12.295 1.00 1.00 N ATOM 235 CZ ARG A 16 3.161 -3.934 12.694 1.00 1.00 C ATOM 236 NH1 ARG A 16 4.226 -4.274 13.325 1.00 1.00 N ATOM 237 NH2 ARG A 16 2.315 -4.864 12.469 1.00 1.00 N ATOM 0 H ARG A 16 5.652 0.497 9.630 1.00 1.00 H new ATOM 0 HA ARG A 16 5.770 -2.142 10.557 1.00 1.00 H new ATOM 0 HB2 ARG A 16 3.662 -0.645 8.957 1.00 1.00 H new ATOM 0 HB3 ARG A 16 3.399 -2.224 9.670 1.00 1.00 H new ATOM 0 HG2 ARG A 16 4.084 0.300 11.233 1.00 1.00 H new ATOM 0 HG3 ARG A 16 2.467 -0.344 11.028 1.00 1.00 H new ATOM 0 HD2 ARG A 16 4.758 -1.760 12.463 1.00 1.00 H new ATOM 0 HD3 ARG A 16 3.434 -0.920 13.245 1.00 1.00 H new ATOM 0 HE ARG A 16 1.969 -2.601 11.873 1.00 1.00 H new ATOM 0 HH11 ARG A 16 4.933 -3.573 13.548 1.00 1.00 H new ATOM 0 HH12 ARG A 16 4.366 -5.245 13.604 1.00 1.00 H new ATOM 0 HH21 ARG A 16 1.443 -4.654 11.984 1.00 1.00 H new ATOM 0 HH22 ARG A 16 2.512 -5.817 12.774 1.00 1.00 H new ATOM 251 N ALA A 17 5.921 -2.045 7.254 1.00 1.00 N ATOM 252 CA ALA A 17 6.369 -2.799 6.066 1.00 1.00 C ATOM 253 C ALA A 17 7.738 -3.497 6.288 1.00 1.00 C ATOM 254 O ALA A 17 7.886 -4.688 6.002 1.00 1.00 O ATOM 255 CB ALA A 17 6.415 -1.838 4.863 1.00 1.00 C ATOM 0 H ALA A 17 5.726 -1.067 7.041 1.00 1.00 H new ATOM 0 HA ALA A 17 5.657 -3.601 5.871 1.00 1.00 H new ATOM 0 HB1 ALA A 17 6.744 -2.380 3.977 1.00 1.00 H new ATOM 0 HB2 ALA A 17 5.421 -1.426 4.688 1.00 1.00 H new ATOM 0 HB3 ALA A 17 7.112 -1.027 5.072 1.00 1.00 H new ATOM 261 N LYS A 18 8.725 -2.757 6.831 1.00 1.00 N ATOM 262 CA LYS A 18 10.038 -3.269 7.288 1.00 1.00 C ATOM 263 C LYS A 18 9.864 -4.337 8.374 1.00 1.00 C ATOM 264 O LYS A 18 10.442 -5.417 8.273 1.00 1.00 O ATOM 265 CB LYS A 18 10.911 -2.103 7.798 1.00 1.00 C ATOM 266 CG LYS A 18 12.297 -2.511 8.362 1.00 1.00 C ATOM 267 CD LYS A 18 12.404 -2.474 9.914 1.00 1.00 C ATOM 268 CE LYS A 18 12.305 -3.861 10.581 1.00 1.00 C ATOM 269 NZ LYS A 18 11.901 -3.786 12.006 1.00 1.00 N ATOM 0 H LYS A 18 8.629 -1.751 6.969 1.00 1.00 H new ATOM 0 HA LYS A 18 10.541 -3.738 6.442 1.00 1.00 H new ATOM 0 HB2 LYS A 18 11.063 -1.399 6.980 1.00 1.00 H new ATOM 0 HB3 LYS A 18 10.362 -1.573 8.576 1.00 1.00 H new ATOM 0 HG2 LYS A 18 12.531 -3.519 8.019 1.00 1.00 H new ATOM 0 HG3 LYS A 18 13.054 -1.848 7.943 1.00 1.00 H new ATOM 0 HD2 LYS A 18 13.353 -2.015 10.192 1.00 1.00 H new ATOM 0 HD3 LYS A 18 11.613 -1.835 10.308 1.00 1.00 H new ATOM 0 HE2 LYS A 18 11.585 -4.471 10.036 1.00 1.00 H new ATOM 0 HE3 LYS A 18 13.269 -4.364 10.507 1.00 1.00 H new ATOM 0 HZ1 LYS A 18 12.434 -4.490 12.555 1.00 1.00 H new ATOM 0 HZ2 LYS A 18 12.103 -2.835 12.374 1.00 1.00 H new ATOM 0 HZ3 LYS A 18 10.883 -3.980 12.089 1.00 1.00 H new ATOM 283 N ASP A 19 9.092 -4.020 9.417 1.00 1.00 N ATOM 284 CA ASP A 19 8.677 -4.929 10.496 1.00 1.00 C ATOM 285 C ASP A 19 8.047 -6.257 10.002 1.00 1.00 C ATOM 286 O ASP A 19 8.446 -7.311 10.478 1.00 1.00 O ATOM 287 CB ASP A 19 7.780 -4.166 11.503 1.00 1.00 C ATOM 288 CG ASP A 19 8.263 -4.362 12.937 1.00 1.00 C ATOM 289 OD1 ASP A 19 9.441 -4.040 13.200 1.00 1.00 O ATOM 290 OD2 ASP A 19 7.457 -4.753 13.814 1.00 1.00 O ATOM 0 H ASP A 19 8.720 -3.078 9.541 1.00 1.00 H new ATOM 0 HA ASP A 19 9.580 -5.255 11.013 1.00 1.00 H new ATOM 0 HB2 ASP A 19 7.779 -3.104 11.260 1.00 1.00 H new ATOM 0 HB3 ASP A 19 6.751 -4.514 11.413 1.00 1.00 H new ATOM 295 N LEU A 20 7.144 -6.233 9.012 1.00 1.00 N ATOM 296 CA LEU A 20 6.557 -7.391 8.304 1.00 1.00 C ATOM 297 C LEU A 20 7.613 -8.290 7.616 1.00 1.00 C ATOM 298 O LEU A 20 7.579 -9.513 7.784 1.00 1.00 O ATOM 299 CB LEU A 20 5.486 -6.888 7.304 1.00 1.00 C ATOM 300 CG LEU A 20 4.036 -6.827 7.837 1.00 1.00 C ATOM 301 CD1 LEU A 20 3.835 -6.067 9.153 1.00 1.00 C ATOM 302 CD2 LEU A 20 3.160 -6.176 6.761 1.00 1.00 C ATOM 0 H LEU A 20 6.777 -5.350 8.658 1.00 1.00 H new ATOM 0 HA LEU A 20 6.085 -8.033 9.048 1.00 1.00 H new ATOM 0 HB2 LEU A 20 5.771 -5.891 6.968 1.00 1.00 H new ATOM 0 HB3 LEU A 20 5.503 -7.536 6.428 1.00 1.00 H new ATOM 0 HG LEU A 20 3.761 -7.858 8.057 1.00 1.00 H new ATOM 0 HD11 LEU A 20 2.781 -6.090 9.429 1.00 1.00 H new ATOM 0 HD12 LEU A 20 4.426 -6.537 9.939 1.00 1.00 H new ATOM 0 HD13 LEU A 20 4.155 -5.032 9.028 1.00 1.00 H new ATOM 0 HD21 LEU A 20 2.130 -6.122 7.114 1.00 1.00 H new ATOM 0 HD22 LEU A 20 3.526 -5.171 6.553 1.00 1.00 H new ATOM 0 HD23 LEU A 20 3.200 -6.772 5.849 1.00 1.00 H new ATOM 314 N ALA A 21 8.550 -7.705 6.853 1.00 1.00 N ATOM 315 CA ALA A 21 9.709 -8.416 6.286 1.00 1.00 C ATOM 316 C ALA A 21 10.611 -9.032 7.388 1.00 1.00 C ATOM 317 O ALA A 21 10.986 -10.199 7.300 1.00 1.00 O ATOM 318 CB ALA A 21 10.458 -7.469 5.335 1.00 1.00 C ATOM 0 H ALA A 21 8.525 -6.715 6.609 1.00 1.00 H new ATOM 0 HA ALA A 21 9.365 -9.272 5.705 1.00 1.00 H new ATOM 0 HB1 ALA A 21 11.318 -7.986 4.910 1.00 1.00 H new ATOM 0 HB2 ALA A 21 9.790 -7.156 4.533 1.00 1.00 H new ATOM 0 HB3 ALA A 21 10.798 -6.593 5.887 1.00 1.00 H new ATOM 324 N GLU A 22 10.907 -8.285 8.459 1.00 1.00 N ATOM 325 CA GLU A 22 11.604 -8.771 9.667 1.00 1.00 C ATOM 326 C GLU A 22 10.872 -9.951 10.356 1.00 1.00 C ATOM 327 O GLU A 22 11.527 -10.946 10.668 1.00 1.00 O ATOM 328 CB GLU A 22 11.847 -7.591 10.623 1.00 1.00 C ATOM 329 CG GLU A 22 12.760 -7.933 11.809 1.00 1.00 C ATOM 330 CD GLU A 22 13.157 -6.642 12.525 1.00 1.00 C ATOM 331 OE1 GLU A 22 12.372 -6.136 13.352 1.00 1.00 O ATOM 332 OE2 GLU A 22 14.159 -5.994 12.139 1.00 1.00 O ATOM 0 H GLU A 22 10.663 -7.296 8.515 1.00 1.00 H new ATOM 0 HA GLU A 22 12.567 -9.181 9.363 1.00 1.00 H new ATOM 0 HB2 GLU A 22 12.288 -6.766 10.063 1.00 1.00 H new ATOM 0 HB3 GLU A 22 10.888 -7.241 11.004 1.00 1.00 H new ATOM 0 HG2 GLU A 22 12.245 -8.602 12.499 1.00 1.00 H new ATOM 0 HG3 GLU A 22 13.649 -8.458 11.460 1.00 1.00 H new ATOM 339 N LYS A 23 9.534 -9.890 10.506 1.00 1.00 N ATOM 340 CA LYS A 23 8.590 -10.917 11.035 1.00 1.00 C ATOM 341 C LYS A 23 8.746 -12.268 10.302 1.00 1.00 C ATOM 342 O LYS A 23 8.854 -13.309 10.949 1.00 1.00 O ATOM 343 CB LYS A 23 7.132 -10.357 10.902 1.00 1.00 C ATOM 344 CG LYS A 23 6.110 -10.755 11.983 1.00 1.00 C ATOM 345 CD LYS A 23 4.623 -10.514 11.603 1.00 1.00 C ATOM 346 CE LYS A 23 4.210 -9.048 11.324 1.00 1.00 C ATOM 347 NZ LYS A 23 2.727 -8.884 11.222 1.00 1.00 N ATOM 0 H LYS A 23 9.031 -9.044 10.237 1.00 1.00 H new ATOM 0 HA LYS A 23 8.815 -11.113 12.083 1.00 1.00 H new ATOM 0 HB2 LYS A 23 7.191 -9.269 10.881 1.00 1.00 H new ATOM 0 HB3 LYS A 23 6.738 -10.673 9.936 1.00 1.00 H new ATOM 0 HG2 LYS A 23 6.243 -11.812 12.216 1.00 1.00 H new ATOM 0 HG3 LYS A 23 6.331 -10.198 12.893 1.00 1.00 H new ATOM 0 HD2 LYS A 23 4.397 -11.107 10.717 1.00 1.00 H new ATOM 0 HD3 LYS A 23 3.998 -10.897 12.410 1.00 1.00 H new ATOM 0 HE2 LYS A 23 4.590 -8.408 12.121 1.00 1.00 H new ATOM 0 HE3 LYS A 23 4.675 -8.712 10.397 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 2.500 -7.886 11.035 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 2.365 -9.473 10.445 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 2.283 -9.178 12.115 1.00 1.00 H new ATOM 361 N LEU A 24 8.804 -12.238 8.965 1.00 1.00 N ATOM 362 CA LEU A 24 9.111 -13.346 8.034 1.00 1.00 C ATOM 363 C LEU A 24 10.563 -13.872 8.153 1.00 1.00 C ATOM 364 O LEU A 24 10.777 -15.075 8.313 1.00 1.00 O ATOM 365 CB LEU A 24 8.800 -12.861 6.594 1.00 1.00 C ATOM 366 CG LEU A 24 7.355 -13.179 6.143 1.00 1.00 C ATOM 367 CD1 LEU A 24 6.829 -12.135 5.153 1.00 1.00 C ATOM 368 CD2 LEU A 24 7.295 -14.568 5.491 1.00 1.00 C ATOM 0 H LEU A 24 8.624 -11.371 8.459 1.00 1.00 H new ATOM 0 HA LEU A 24 8.485 -14.199 8.297 1.00 1.00 H new ATOM 0 HB2 LEU A 24 8.963 -11.785 6.537 1.00 1.00 H new ATOM 0 HB3 LEU A 24 9.501 -13.327 5.901 1.00 1.00 H new ATOM 0 HG LEU A 24 6.725 -13.159 7.032 1.00 1.00 H new ATOM 0 HD11 LEU A 24 5.811 -12.392 4.859 1.00 1.00 H new ATOM 0 HD12 LEU A 24 6.833 -11.152 5.624 1.00 1.00 H new ATOM 0 HD13 LEU A 24 7.468 -12.117 4.270 1.00 1.00 H new ATOM 0 HD21 LEU A 24 6.272 -14.779 5.178 1.00 1.00 H new ATOM 0 HD22 LEU A 24 7.952 -14.591 4.622 1.00 1.00 H new ATOM 0 HD23 LEU A 24 7.618 -15.321 6.210 1.00 1.00 H new ATOM 380 N SER A 25 11.560 -12.977 8.098 1.00 1.00 N ATOM 381 CA SER A 25 13.005 -13.280 8.195 1.00 1.00 C ATOM 382 C SER A 25 13.409 -13.953 9.527 1.00 1.00 C ATOM 383 O SER A 25 14.304 -14.796 9.548 1.00 1.00 O ATOM 384 CB SER A 25 13.805 -11.977 7.971 1.00 1.00 C ATOM 385 OG SER A 25 14.979 -12.169 7.206 1.00 1.00 O ATOM 0 H SER A 25 11.380 -11.980 7.980 1.00 1.00 H new ATOM 0 HA SER A 25 13.240 -14.009 7.420 1.00 1.00 H new ATOM 0 HB2 SER A 25 13.168 -11.248 7.470 1.00 1.00 H new ATOM 0 HB3 SER A 25 14.075 -11.553 8.938 1.00 1.00 H new ATOM 0 HG SER A 25 14.879 -12.969 6.649 1.00 1.00 H new ATOM 391 N ASN A 26 12.803 -13.564 10.658 1.00 1.00 N ATOM 392 CA ASN A 26 12.885 -14.162 11.983 1.00 1.00 C ATOM 393 C ASN A 26 12.247 -15.575 12.052 1.00 1.00 C ATOM 394 O ASN A 26 12.789 -16.497 12.660 1.00 1.00 O ATOM 395 CB ASN A 26 12.181 -13.136 12.893 1.00 1.00 C ATOM 396 CG ASN A 26 13.149 -12.138 13.494 1.00 1.00 C ATOM 397 OD1 ASN A 26 13.723 -12.337 14.557 1.00 1.00 O ATOM 398 ND2 ASN A 26 13.372 -11.041 12.830 1.00 1.00 N ATOM 0 H ASN A 26 12.190 -12.749 10.660 1.00 1.00 H new ATOM 0 HA ASN A 26 13.915 -14.347 12.290 1.00 1.00 H new ATOM 0 HB2 ASN A 26 11.424 -12.603 12.317 1.00 1.00 H new ATOM 0 HB3 ASN A 26 11.661 -13.661 13.694 1.00 1.00 H new ATOM 0 HD21 ASN A 26 14.025 -10.348 13.195 1.00 1.00 H new ATOM 0 HD22 ASN A 26 12.894 -10.875 11.944 1.00 1.00 H new ATOM 405 N GLU A 27 11.062 -15.727 11.452 1.00 1.00 N ATOM 406 CA GLU A 27 10.235 -16.944 11.403 1.00 1.00 C ATOM 407 C GLU A 27 10.911 -18.071 10.576 1.00 1.00 C ATOM 408 O GLU A 27 11.054 -19.188 11.082 1.00 1.00 O ATOM 409 CB GLU A 27 8.847 -16.503 10.873 1.00 1.00 C ATOM 410 CG GLU A 27 7.842 -17.569 10.428 1.00 1.00 C ATOM 411 CD GLU A 27 6.650 -16.943 9.677 1.00 1.00 C ATOM 412 OE1 GLU A 27 5.793 -16.293 10.332 1.00 1.00 O ATOM 413 OE2 GLU A 27 6.562 -17.086 8.438 1.00 1.00 O ATOM 0 H GLU A 27 10.623 -14.953 10.953 1.00 1.00 H new ATOM 0 HA GLU A 27 10.116 -17.395 12.388 1.00 1.00 H new ATOM 0 HB2 GLU A 27 8.371 -15.910 11.654 1.00 1.00 H new ATOM 0 HB3 GLU A 27 9.016 -15.838 10.026 1.00 1.00 H new ATOM 0 HG2 GLU A 27 8.340 -18.293 9.783 1.00 1.00 H new ATOM 0 HG3 GLU A 27 7.479 -18.114 11.299 1.00 1.00 H new ATOM 420 N ARG A 28 11.449 -17.779 9.373 1.00 1.00 N ATOM 421 CA ARG A 28 11.982 -18.757 8.374 1.00 1.00 C ATOM 422 C ARG A 28 13.504 -18.678 8.062 1.00 1.00 C ATOM 423 O ARG A 28 14.232 -17.899 8.673 1.00 1.00 O ATOM 424 CB ARG A 28 11.087 -18.671 7.108 1.00 1.00 C ATOM 425 CG ARG A 28 9.566 -18.756 7.422 1.00 1.00 C ATOM 426 CD ARG A 28 8.625 -19.346 6.357 1.00 1.00 C ATOM 427 NE ARG A 28 8.456 -18.474 5.178 1.00 1.00 N ATOM 428 CZ ARG A 28 9.264 -18.355 4.154 1.00 1.00 C ATOM 429 NH1 ARG A 28 10.347 -19.030 4.030 1.00 1.00 N ATOM 430 NH2 ARG A 28 9.056 -17.562 3.168 1.00 1.00 N ATOM 0 H ARG A 28 11.532 -16.816 9.048 1.00 1.00 H new ATOM 0 HA ARG A 28 11.922 -19.746 8.827 1.00 1.00 H new ATOM 0 HB2 ARG A 28 11.292 -17.734 6.590 1.00 1.00 H new ATOM 0 HB3 ARG A 28 11.356 -19.478 6.426 1.00 1.00 H new ATOM 0 HG2 ARG A 28 9.448 -19.346 8.331 1.00 1.00 H new ATOM 0 HG3 ARG A 28 9.218 -17.748 7.649 1.00 1.00 H new ATOM 0 HD2 ARG A 28 9.014 -20.311 6.033 1.00 1.00 H new ATOM 0 HD3 ARG A 28 7.649 -19.530 6.807 1.00 1.00 H new ATOM 0 HE ARG A 28 7.614 -17.899 5.159 1.00 1.00 H new ATOM 0 HH11 ARG A 28 10.616 -19.700 4.751 1.00 1.00 H new ATOM 0 HH12 ARG A 28 10.940 -18.897 3.211 1.00 1.00 H new ATOM 0 HH21 ARG A 28 8.221 -16.977 3.152 1.00 1.00 H new ATOM 0 HH22 ARG A 28 9.726 -17.517 2.400 1.00 1.00 H new ATOM 444 N ASP A 29 13.998 -19.525 7.144 1.00 1.00 N ATOM 445 CA ASP A 29 15.375 -19.545 6.573 1.00 1.00 C ATOM 446 C ASP A 29 15.486 -19.033 5.111 1.00 1.00 C ATOM 447 O ASP A 29 16.493 -18.425 4.735 1.00 1.00 O ATOM 448 CB ASP A 29 15.954 -20.979 6.561 1.00 1.00 C ATOM 449 CG ASP A 29 16.150 -21.660 7.915 1.00 1.00 C ATOM 450 OD1 ASP A 29 16.985 -21.186 8.721 1.00 1.00 O ATOM 451 OD2 ASP A 29 15.588 -22.766 8.097 1.00 1.00 O ATOM 0 H ASP A 29 13.418 -20.265 6.749 1.00 1.00 H new ATOM 0 HA ASP A 29 15.927 -18.870 7.227 1.00 1.00 H new ATOM 0 HB2 ASP A 29 15.295 -21.605 5.959 1.00 1.00 H new ATOM 0 HB3 ASP A 29 16.918 -20.951 6.053 1.00 1.00 H new ATOM 456 N ASP A 30 14.483 -19.309 4.264 1.00 1.00 N ATOM 457 CA ASP A 30 14.499 -19.048 2.794 1.00 1.00 C ATOM 458 C ASP A 30 14.614 -17.556 2.440 1.00 1.00 C ATOM 459 O ASP A 30 15.238 -17.147 1.461 1.00 1.00 O ATOM 460 CB ASP A 30 13.219 -19.626 2.142 1.00 1.00 C ATOM 461 CG ASP A 30 12.362 -18.708 1.250 1.00 1.00 C ATOM 462 OD1 ASP A 30 12.655 -18.635 0.034 1.00 1.00 O ATOM 463 OD2 ASP A 30 11.443 -18.044 1.774 1.00 1.00 O ATOM 0 H ASP A 30 13.610 -19.731 4.579 1.00 1.00 H new ATOM 0 HA ASP A 30 15.390 -19.541 2.405 1.00 1.00 H new ATOM 0 HB2 ASP A 30 13.514 -20.487 1.543 1.00 1.00 H new ATOM 0 HB3 ASP A 30 12.580 -19.999 2.943 1.00 1.00 H new ATOM 468 N PHE A 31 14.016 -16.801 3.337 1.00 1.00 N ATOM 469 CA PHE A 31 13.705 -15.379 3.374 1.00 1.00 C ATOM 470 C PHE A 31 14.761 -14.604 4.189 1.00 1.00 C ATOM 471 O PHE A 31 14.978 -14.839 5.377 1.00 1.00 O ATOM 472 CB PHE A 31 12.310 -15.242 4.022 1.00 1.00 C ATOM 473 CG PHE A 31 11.703 -13.851 3.948 1.00 1.00 C ATOM 474 CD1 PHE A 31 12.280 -12.767 4.654 1.00 1.00 C ATOM 475 CD2 PHE A 31 10.536 -13.636 3.182 1.00 1.00 C ATOM 476 CE1 PHE A 31 11.717 -11.480 4.568 1.00 1.00 C ATOM 477 CE2 PHE A 31 9.955 -12.355 3.125 1.00 1.00 C ATOM 478 CZ PHE A 31 10.549 -11.275 3.812 1.00 1.00 C ATOM 0 H PHE A 31 13.683 -17.240 4.195 1.00 1.00 H new ATOM 0 HA PHE A 31 13.711 -14.959 2.368 1.00 1.00 H new ATOM 0 HB2 PHE A 31 11.631 -15.945 3.539 1.00 1.00 H new ATOM 0 HB3 PHE A 31 12.382 -15.536 5.069 1.00 1.00 H new ATOM 0 HD1 PHE A 31 13.158 -12.929 5.262 1.00 1.00 H new ATOM 0 HD2 PHE A 31 10.089 -14.456 2.639 1.00 1.00 H new ATOM 0 HE1 PHE A 31 12.181 -10.651 5.082 1.00 1.00 H new ATOM 0 HE2 PHE A 31 9.052 -12.198 2.554 1.00 1.00 H new ATOM 0 HZ PHE A 31 10.107 -10.291 3.757 1.00 1.00 H new ATOM 488 N GLN A 32 15.419 -13.662 3.509 1.00 1.00 N ATOM 489 CA GLN A 32 16.515 -12.792 3.960 1.00 1.00 C ATOM 490 C GLN A 32 16.165 -11.307 3.693 1.00 1.00 C ATOM 491 O GLN A 32 15.833 -10.931 2.569 1.00 1.00 O ATOM 492 CB GLN A 32 17.818 -13.222 3.240 1.00 1.00 C ATOM 493 CG GLN A 32 18.240 -14.695 3.472 1.00 1.00 C ATOM 494 CD GLN A 32 18.501 -15.023 4.943 1.00 1.00 C ATOM 495 OE1 GLN A 32 19.265 -14.352 5.618 1.00 1.00 O ATOM 496 NE2 GLN A 32 17.921 -16.052 5.509 1.00 1.00 N ATOM 0 H GLN A 32 15.177 -13.469 2.537 1.00 1.00 H new ATOM 0 HA GLN A 32 16.664 -12.894 5.035 1.00 1.00 H new ATOM 0 HB2 GLN A 32 17.694 -13.060 2.169 1.00 1.00 H new ATOM 0 HB3 GLN A 32 18.628 -12.572 3.569 1.00 1.00 H new ATOM 0 HG2 GLN A 32 17.459 -15.354 3.093 1.00 1.00 H new ATOM 0 HG3 GLN A 32 19.141 -14.903 2.895 1.00 1.00 H new ATOM 0 HE21 GLN A 32 17.277 -16.633 4.973 1.00 1.00 H new ATOM 0 HE22 GLN A 32 18.113 -16.272 6.486 1.00 1.00 H new ATOM 505 N TYR A 33 16.236 -10.445 4.713 1.00 1.00 N ATOM 506 CA TYR A 33 15.786 -9.033 4.700 1.00 1.00 C ATOM 507 C TYR A 33 16.926 -7.983 4.724 1.00 1.00 C ATOM 508 O TYR A 33 17.883 -8.119 5.493 1.00 1.00 O ATOM 509 CB TYR A 33 14.667 -8.776 5.741 1.00 1.00 C ATOM 510 CG TYR A 33 15.074 -8.361 7.151 1.00 1.00 C ATOM 511 CD1 TYR A 33 16.019 -9.119 7.881 1.00 1.00 C ATOM 512 CD2 TYR A 33 14.499 -7.210 7.747 1.00 1.00 C ATOM 513 CE1 TYR A 33 16.393 -8.730 9.186 1.00 1.00 C ATOM 514 CE2 TYR A 33 14.880 -6.815 9.051 1.00 1.00 C ATOM 515 CZ TYR A 33 15.820 -7.581 9.781 1.00 1.00 C ATOM 516 OH TYR A 33 16.188 -7.196 11.030 1.00 1.00 O ATOM 0 H TYR A 33 16.625 -10.717 5.616 1.00 1.00 H new ATOM 0 HA TYR A 33 15.339 -8.878 3.718 1.00 1.00 H new ATOM 0 HB2 TYR A 33 14.013 -8.001 5.342 1.00 1.00 H new ATOM 0 HB3 TYR A 33 14.072 -9.685 5.821 1.00 1.00 H new ATOM 0 HD1 TYR A 33 16.457 -10.001 7.438 1.00 1.00 H new ATOM 0 HD2 TYR A 33 13.767 -6.632 7.203 1.00 1.00 H new ATOM 0 HE1 TYR A 33 17.120 -9.312 9.733 1.00 1.00 H new ATOM 0 HE2 TYR A 33 14.452 -5.926 9.491 1.00 1.00 H new ATOM 0 HH TYR A 33 15.388 -7.007 11.563 1.00 1.00 H new ATOM 526 N GLN A 34 16.823 -6.919 3.910 1.00 1.00 N ATOM 527 CA GLN A 34 17.816 -5.829 3.752 1.00 1.00 C ATOM 528 C GLN A 34 17.112 -4.464 3.885 1.00 1.00 C ATOM 529 O GLN A 34 16.063 -4.230 3.290 1.00 1.00 O ATOM 530 CB GLN A 34 18.465 -5.845 2.342 1.00 1.00 C ATOM 531 CG GLN A 34 19.752 -4.991 2.250 1.00 1.00 C ATOM 532 CD GLN A 34 20.238 -4.861 0.806 1.00 1.00 C ATOM 533 OE1 GLN A 34 20.502 -5.841 0.130 1.00 1.00 O ATOM 534 NE2 GLN A 34 20.357 -3.683 0.246 1.00 1.00 N ATOM 0 H GLN A 34 16.007 -6.784 3.313 1.00 1.00 H new ATOM 0 HA GLN A 34 18.575 -5.979 4.519 1.00 1.00 H new ATOM 0 HB2 GLN A 34 18.700 -6.874 2.070 1.00 1.00 H new ATOM 0 HB3 GLN A 34 17.742 -5.479 1.613 1.00 1.00 H new ATOM 0 HG2 GLN A 34 19.562 -4.000 2.661 1.00 1.00 H new ATOM 0 HG3 GLN A 34 20.535 -5.444 2.859 1.00 1.00 H new ATOM 0 HE21 GLN A 34 20.145 -2.840 0.780 1.00 1.00 H new ATOM 0 HE22 GLN A 34 20.662 -3.608 -0.725 1.00 1.00 H new ATOM 543 N TYR A 35 17.711 -3.545 4.645 1.00 1.00 N ATOM 544 CA TYR A 35 17.189 -2.202 4.931 1.00 1.00 C ATOM 545 C TYR A 35 18.107 -1.060 4.436 1.00 1.00 C ATOM 546 O TYR A 35 19.288 -1.008 4.773 1.00 1.00 O ATOM 547 CB TYR A 35 16.814 -2.067 6.418 1.00 1.00 C ATOM 548 CG TYR A 35 16.436 -0.636 6.754 1.00 1.00 C ATOM 549 CD1 TYR A 35 15.424 0.007 6.002 1.00 1.00 C ATOM 550 CD2 TYR A 35 17.258 0.119 7.619 1.00 1.00 C ATOM 551 CE1 TYR A 35 15.279 1.406 6.068 1.00 1.00 C ATOM 552 CE2 TYR A 35 17.067 1.510 7.735 1.00 1.00 C ATOM 553 CZ TYR A 35 16.083 2.161 6.953 1.00 1.00 C ATOM 554 OH TYR A 35 15.931 3.507 7.033 1.00 1.00 O ATOM 0 H TYR A 35 18.608 -3.720 5.097 1.00 1.00 H new ATOM 0 HA TYR A 35 16.276 -2.088 4.347 1.00 1.00 H new ATOM 0 HB2 TYR A 35 15.981 -2.731 6.649 1.00 1.00 H new ATOM 0 HB3 TYR A 35 17.653 -2.381 7.039 1.00 1.00 H new ATOM 0 HD1 TYR A 35 14.763 -0.575 5.377 1.00 1.00 H new ATOM 0 HD2 TYR A 35 18.033 -0.370 8.191 1.00 1.00 H new ATOM 0 HE1 TYR A 35 14.553 1.903 5.442 1.00 1.00 H new ATOM 0 HE2 TYR A 35 17.673 2.081 8.423 1.00 1.00 H new ATOM 0 HH TYR A 35 16.705 3.897 7.491 1.00 1.00 H new ATOM 564 N VAL A 36 17.551 -0.167 3.604 1.00 1.00 N ATOM 565 CA VAL A 36 18.180 1.015 2.967 1.00 1.00 C ATOM 566 C VAL A 36 17.434 2.336 3.310 1.00 1.00 C ATOM 567 O VAL A 36 16.272 2.531 2.936 1.00 1.00 O ATOM 568 CB VAL A 36 18.295 0.796 1.432 1.00 1.00 C ATOM 569 CG1 VAL A 36 19.167 1.887 0.791 1.00 1.00 C ATOM 570 CG2 VAL A 36 18.865 -0.590 1.038 1.00 1.00 C ATOM 0 H VAL A 36 16.571 -0.254 3.333 1.00 1.00 H new ATOM 0 HA VAL A 36 19.185 1.122 3.375 1.00 1.00 H new ATOM 0 HB VAL A 36 17.273 0.848 1.057 1.00 1.00 H new ATOM 0 HG11 VAL A 36 19.234 1.715 -0.283 1.00 1.00 H new ATOM 0 HG12 VAL A 36 18.720 2.864 0.974 1.00 1.00 H new ATOM 0 HG13 VAL A 36 20.166 1.857 1.226 1.00 1.00 H new ATOM 0 HG21 VAL A 36 18.915 -0.668 -0.048 1.00 1.00 H new ATOM 0 HG22 VAL A 36 19.865 -0.704 1.456 1.00 1.00 H new ATOM 0 HG23 VAL A 36 18.217 -1.374 1.428 1.00 1.00 H new ATOM 580 N ASP A 37 18.082 3.270 4.024 1.00 1.00 N ATOM 581 CA ASP A 37 17.575 4.632 4.332 1.00 1.00 C ATOM 582 C ASP A 37 17.560 5.645 3.168 1.00 1.00 C ATOM 583 O ASP A 37 18.537 6.328 2.896 1.00 1.00 O ATOM 584 CB ASP A 37 18.123 5.299 5.620 1.00 1.00 C ATOM 585 CG ASP A 37 18.983 4.473 6.577 1.00 1.00 C ATOM 586 OD1 ASP A 37 20.115 4.082 6.224 1.00 1.00 O ATOM 587 OD2 ASP A 37 18.526 4.246 7.718 1.00 1.00 O ATOM 0 H ASP A 37 19.006 3.099 4.420 1.00 1.00 H new ATOM 0 HA ASP A 37 16.535 4.374 4.531 1.00 1.00 H new ATOM 0 HB2 ASP A 37 18.709 6.166 5.317 1.00 1.00 H new ATOM 0 HB3 ASP A 37 17.269 5.673 6.185 1.00 1.00 H new ATOM 592 N ILE A 38 16.397 5.878 2.567 1.00 1.00 N ATOM 593 CA ILE A 38 16.160 6.927 1.545 1.00 1.00 C ATOM 594 C ILE A 38 16.195 8.347 2.151 1.00 1.00 C ATOM 595 O ILE A 38 16.724 9.267 1.535 1.00 1.00 O ATOM 596 CB ILE A 38 14.877 6.628 0.717 1.00 1.00 C ATOM 597 CG1 ILE A 38 13.570 6.681 1.551 1.00 1.00 C ATOM 598 CG2 ILE A 38 15.039 5.269 0.017 1.00 1.00 C ATOM 599 CD1 ILE A 38 12.885 8.047 1.499 1.00 1.00 C ATOM 0 H ILE A 38 15.560 5.333 2.774 1.00 1.00 H new ATOM 0 HA ILE A 38 16.988 6.901 0.837 1.00 1.00 H new ATOM 0 HB ILE A 38 14.772 7.421 -0.024 1.00 1.00 H new ATOM 0 HG12 ILE A 38 12.880 5.920 1.185 1.00 1.00 H new ATOM 0 HG13 ILE A 38 13.797 6.433 2.588 1.00 1.00 H new ATOM 0 HG21 ILE A 38 14.144 5.051 -0.566 1.00 1.00 H new ATOM 0 HG22 ILE A 38 15.904 5.302 -0.645 1.00 1.00 H new ATOM 0 HG23 ILE A 38 15.184 4.489 0.765 1.00 1.00 H new ATOM 0 HD11 ILE A 38 11.977 8.022 2.101 1.00 1.00 H new ATOM 0 HD12 ILE A 38 13.560 8.808 1.892 1.00 1.00 H new ATOM 0 HD13 ILE A 38 12.629 8.287 0.467 1.00 1.00 H new ATOM 611 N ARG A 39 15.745 8.509 3.412 1.00 1.00 N ATOM 612 CA ARG A 39 15.830 9.743 4.232 1.00 1.00 C ATOM 613 C ARG A 39 17.212 9.966 4.907 1.00 1.00 C ATOM 614 O ARG A 39 17.379 10.936 5.643 1.00 1.00 O ATOM 615 CB ARG A 39 14.630 9.807 5.212 1.00 1.00 C ATOM 616 CG ARG A 39 14.533 11.092 6.073 1.00 1.00 C ATOM 617 CD ARG A 39 13.122 11.444 6.586 1.00 1.00 C ATOM 618 NE ARG A 39 12.503 12.529 5.797 1.00 1.00 N ATOM 619 CZ ARG A 39 11.306 13.049 5.889 1.00 1.00 C ATOM 620 NH1 ARG A 39 10.412 12.732 6.756 1.00 1.00 N ATOM 621 NH2 ARG A 39 10.938 13.959 5.070 1.00 1.00 N ATOM 0 H ARG A 39 15.289 7.747 3.914 1.00 1.00 H new ATOM 0 HA ARG A 39 15.754 10.594 3.556 1.00 1.00 H new ATOM 0 HB2 ARG A 39 13.709 9.707 4.637 1.00 1.00 H new ATOM 0 HB3 ARG A 39 14.684 8.947 5.880 1.00 1.00 H new ATOM 0 HG2 ARG A 39 15.196 10.984 6.931 1.00 1.00 H new ATOM 0 HG3 ARG A 39 14.907 11.931 5.486 1.00 1.00 H new ATOM 0 HD2 ARG A 39 12.489 10.558 6.544 1.00 1.00 H new ATOM 0 HD3 ARG A 39 13.181 11.744 7.632 1.00 1.00 H new ATOM 0 HE ARG A 39 13.097 12.933 5.073 1.00 1.00 H new ATOM 0 HH11 ARG A 39 10.610 12.015 7.454 1.00 1.00 H new ATOM 0 HH12 ARG A 39 9.504 13.197 6.746 1.00 1.00 H new ATOM 0 HH21 ARG A 39 11.578 14.281 4.344 1.00 1.00 H new ATOM 0 HH22 ARG A 39 10.004 14.364 5.143 1.00 1.00 H new ATOM 635 N ALA A 40 18.200 9.090 4.671 1.00 1.00 N ATOM 636 CA ALA A 40 19.605 9.294 5.112 1.00 1.00 C ATOM 637 C ALA A 40 20.612 9.255 3.932 1.00 1.00 C ATOM 638 O ALA A 40 21.417 10.171 3.764 1.00 1.00 O ATOM 639 CB ALA A 40 19.947 8.361 6.285 1.00 1.00 C ATOM 0 H ALA A 40 18.056 8.214 4.168 1.00 1.00 H new ATOM 0 HA ALA A 40 19.702 10.308 5.500 1.00 1.00 H new ATOM 0 HB1 ALA A 40 20.980 8.526 6.592 1.00 1.00 H new ATOM 0 HB2 ALA A 40 19.281 8.570 7.122 1.00 1.00 H new ATOM 0 HB3 ALA A 40 19.823 7.324 5.973 1.00 1.00 H new ATOM 645 N GLU A 41 20.491 8.256 3.050 1.00 1.00 N ATOM 646 CA GLU A 41 21.222 8.112 1.765 1.00 1.00 C ATOM 647 C GLU A 41 20.930 9.217 0.710 1.00 1.00 C ATOM 648 O GLU A 41 21.728 9.417 -0.209 1.00 1.00 O ATOM 649 CB GLU A 41 20.938 6.704 1.186 1.00 1.00 C ATOM 650 CG GLU A 41 21.994 6.174 0.201 1.00 1.00 C ATOM 651 CD GLU A 41 21.811 4.674 -0.092 1.00 1.00 C ATOM 652 OE1 GLU A 41 21.952 3.851 0.840 1.00 1.00 O ATOM 653 OE2 GLU A 41 21.594 4.282 -1.264 1.00 1.00 O ATOM 0 H GLU A 41 19.849 7.480 3.213 1.00 1.00 H new ATOM 0 HA GLU A 41 22.280 8.237 1.994 1.00 1.00 H new ATOM 0 HB2 GLU A 41 20.851 6.000 2.013 1.00 1.00 H new ATOM 0 HB3 GLU A 41 19.972 6.725 0.681 1.00 1.00 H new ATOM 0 HG2 GLU A 41 21.933 6.735 -0.731 1.00 1.00 H new ATOM 0 HG3 GLU A 41 22.989 6.344 0.611 1.00 1.00 H new ATOM 660 N GLY A 42 19.824 9.967 0.850 1.00 1.00 N ATOM 661 CA GLY A 42 19.423 11.124 0.023 1.00 1.00 C ATOM 662 C GLY A 42 18.610 10.766 -1.231 1.00 1.00 C ATOM 663 O GLY A 42 18.994 11.118 -2.346 1.00 1.00 O ATOM 0 H GLY A 42 19.144 9.773 1.586 1.00 1.00 H new ATOM 0 HA2 GLY A 42 18.836 11.806 0.638 1.00 1.00 H new ATOM 0 HA3 GLY A 42 20.320 11.662 -0.283 1.00 1.00 H new ATOM 667 N ILE A 43 17.485 10.067 -1.048 1.00 1.00 N ATOM 668 CA ILE A 43 16.610 9.473 -2.085 1.00 1.00 C ATOM 669 C ILE A 43 15.116 9.809 -1.831 1.00 1.00 C ATOM 670 O ILE A 43 14.670 10.098 -0.716 1.00 1.00 O ATOM 671 CB ILE A 43 16.852 7.933 -2.175 1.00 1.00 C ATOM 672 CG1 ILE A 43 18.333 7.489 -2.336 1.00 1.00 C ATOM 673 CG2 ILE A 43 16.011 7.292 -3.304 1.00 1.00 C ATOM 674 CD1 ILE A 43 18.564 6.054 -1.830 1.00 1.00 C ATOM 0 H ILE A 43 17.130 9.884 -0.109 1.00 1.00 H new ATOM 0 HA ILE A 43 16.869 9.913 -3.048 1.00 1.00 H new ATOM 0 HB ILE A 43 16.532 7.572 -1.197 1.00 1.00 H new ATOM 0 HG12 ILE A 43 18.618 7.553 -3.386 1.00 1.00 H new ATOM 0 HG13 ILE A 43 18.979 8.175 -1.788 1.00 1.00 H new ATOM 0 HG21 ILE A 43 16.204 6.220 -3.338 1.00 1.00 H new ATOM 0 HG22 ILE A 43 14.952 7.464 -3.111 1.00 1.00 H new ATOM 0 HG23 ILE A 43 16.283 7.740 -4.260 1.00 1.00 H new ATOM 0 HD11 ILE A 43 19.612 5.786 -1.962 1.00 1.00 H new ATOM 0 HD12 ILE A 43 18.305 5.995 -0.773 1.00 1.00 H new ATOM 0 HD13 ILE A 43 17.939 5.364 -2.396 1.00 1.00 H new ATOM 686 N THR A 44 14.320 9.738 -2.901 1.00 1.00 N ATOM 687 CA THR A 44 12.903 10.153 -2.997 1.00 1.00 C ATOM 688 C THR A 44 12.053 9.268 -3.932 1.00 1.00 C ATOM 689 O THR A 44 12.590 8.543 -4.774 1.00 1.00 O ATOM 690 CB THR A 44 12.868 11.623 -3.478 1.00 1.00 C ATOM 691 OG1 THR A 44 11.542 12.029 -3.714 1.00 1.00 O ATOM 692 CG2 THR A 44 13.695 11.896 -4.744 1.00 1.00 C ATOM 0 H THR A 44 14.663 9.365 -3.786 1.00 1.00 H new ATOM 0 HA THR A 44 12.457 10.042 -2.008 1.00 1.00 H new ATOM 0 HB THR A 44 13.321 12.197 -2.670 1.00 1.00 H new ATOM 0 HG1 THR A 44 11.542 12.848 -4.252 1.00 1.00 H new ATOM 0 HG21 THR A 44 13.615 12.950 -5.011 1.00 1.00 H new ATOM 0 HG22 THR A 44 14.740 11.648 -4.557 1.00 1.00 H new ATOM 0 HG23 THR A 44 13.318 11.284 -5.564 1.00 1.00 H new ATOM 700 N LYS A 45 10.712 9.365 -3.837 1.00 1.00 N ATOM 701 CA LYS A 45 9.731 8.737 -4.759 1.00 1.00 C ATOM 702 C LYS A 45 9.996 9.038 -6.245 1.00 1.00 C ATOM 703 O LYS A 45 9.742 8.180 -7.085 1.00 1.00 O ATOM 704 CB LYS A 45 8.281 9.090 -4.354 1.00 1.00 C ATOM 705 CG LYS A 45 7.849 10.571 -4.426 1.00 1.00 C ATOM 706 CD LYS A 45 7.468 11.151 -5.811 1.00 1.00 C ATOM 707 CE LYS A 45 6.818 12.513 -5.551 1.00 1.00 C ATOM 708 NZ LYS A 45 6.181 13.135 -6.734 1.00 1.00 N ATOM 0 H LYS A 45 10.262 9.899 -3.094 1.00 1.00 H new ATOM 0 HA LYS A 45 9.865 7.660 -4.654 1.00 1.00 H new ATOM 0 HB2 LYS A 45 7.607 8.514 -4.989 1.00 1.00 H new ATOM 0 HB3 LYS A 45 8.127 8.746 -3.331 1.00 1.00 H new ATOM 0 HG2 LYS A 45 6.994 10.702 -3.763 1.00 1.00 H new ATOM 0 HG3 LYS A 45 8.661 11.176 -4.023 1.00 1.00 H new ATOM 0 HD2 LYS A 45 8.350 11.257 -6.443 1.00 1.00 H new ATOM 0 HD3 LYS A 45 6.780 10.487 -6.333 1.00 1.00 H new ATOM 0 HE2 LYS A 45 6.066 12.398 -4.770 1.00 1.00 H new ATOM 0 HE3 LYS A 45 7.577 13.194 -5.165 1.00 1.00 H new ATOM 0 HZ1 LYS A 45 6.316 14.166 -6.699 1.00 1.00 H new ATOM 0 HZ2 LYS A 45 6.616 12.758 -7.601 1.00 1.00 H new ATOM 0 HZ3 LYS A 45 5.164 12.918 -6.735 1.00 1.00 H new ATOM 722 N GLU A 46 10.560 10.217 -6.551 1.00 1.00 N ATOM 723 CA GLU A 46 10.957 10.654 -7.907 1.00 1.00 C ATOM 724 C GLU A 46 12.075 9.740 -8.493 1.00 1.00 C ATOM 725 O GLU A 46 12.037 9.377 -9.669 1.00 1.00 O ATOM 726 CB GLU A 46 11.452 12.123 -7.886 1.00 1.00 C ATOM 727 CG GLU A 46 10.371 13.221 -7.702 1.00 1.00 C ATOM 728 CD GLU A 46 10.287 13.837 -6.284 1.00 1.00 C ATOM 729 OE1 GLU A 46 11.268 13.820 -5.509 1.00 1.00 O ATOM 730 OE2 GLU A 46 9.239 14.415 -5.907 1.00 1.00 O ATOM 0 H GLU A 46 10.761 10.920 -5.839 1.00 1.00 H new ATOM 0 HA GLU A 46 10.075 10.579 -8.543 1.00 1.00 H new ATOM 0 HB2 GLU A 46 12.181 12.225 -7.082 1.00 1.00 H new ATOM 0 HB3 GLU A 46 11.979 12.318 -8.820 1.00 1.00 H new ATOM 0 HG2 GLU A 46 10.564 14.021 -8.417 1.00 1.00 H new ATOM 0 HG3 GLU A 46 9.399 12.796 -7.954 1.00 1.00 H new ATOM 737 N ASP A 47 13.048 9.325 -7.660 1.00 1.00 N ATOM 738 CA ASP A 47 14.098 8.332 -7.957 1.00 1.00 C ATOM 739 C ASP A 47 13.502 6.902 -8.064 1.00 1.00 C ATOM 740 O ASP A 47 13.650 6.210 -9.079 1.00 1.00 O ATOM 741 CB ASP A 47 15.196 8.357 -6.856 1.00 1.00 C ATOM 742 CG ASP A 47 16.450 7.548 -7.240 1.00 1.00 C ATOM 743 OD1 ASP A 47 16.919 7.629 -8.399 1.00 1.00 O ATOM 744 OD2 ASP A 47 16.947 6.763 -6.404 1.00 1.00 O ATOM 0 H ASP A 47 13.127 9.693 -6.712 1.00 1.00 H new ATOM 0 HA ASP A 47 14.543 8.597 -8.916 1.00 1.00 H new ATOM 0 HB2 ASP A 47 15.483 9.390 -6.659 1.00 1.00 H new ATOM 0 HB3 ASP A 47 14.783 7.959 -5.929 1.00 1.00 H new ATOM 749 N LEU A 48 12.830 6.472 -6.985 1.00 1.00 N ATOM 750 CA LEU A 48 12.278 5.133 -6.739 1.00 1.00 C ATOM 751 C LEU A 48 11.283 4.687 -7.833 1.00 1.00 C ATOM 752 O LEU A 48 11.444 3.586 -8.354 1.00 1.00 O ATOM 753 CB LEU A 48 11.691 5.085 -5.303 1.00 1.00 C ATOM 754 CG LEU A 48 12.760 5.160 -4.174 1.00 1.00 C ATOM 755 CD1 LEU A 48 12.172 5.633 -2.836 1.00 1.00 C ATOM 756 CD2 LEU A 48 13.449 3.803 -3.964 1.00 1.00 C ATOM 0 H LEU A 48 12.645 7.100 -6.203 1.00 1.00 H new ATOM 0 HA LEU A 48 13.081 4.398 -6.800 1.00 1.00 H new ATOM 0 HB2 LEU A 48 10.991 5.912 -5.181 1.00 1.00 H new ATOM 0 HB3 LEU A 48 11.120 4.164 -5.187 1.00 1.00 H new ATOM 0 HG LEU A 48 13.492 5.895 -4.507 1.00 1.00 H new ATOM 0 HD11 LEU A 48 12.960 5.667 -2.084 1.00 1.00 H new ATOM 0 HD12 LEU A 48 11.744 6.628 -2.958 1.00 1.00 H new ATOM 0 HD13 LEU A 48 11.394 4.940 -2.515 1.00 1.00 H new ATOM 0 HD21 LEU A 48 14.190 3.890 -3.169 1.00 1.00 H new ATOM 0 HD22 LEU A 48 12.705 3.056 -3.687 1.00 1.00 H new ATOM 0 HD23 LEU A 48 13.942 3.499 -4.887 1.00 1.00 H new ATOM 768 N GLN A 49 10.327 5.533 -8.255 1.00 1.00 N ATOM 769 CA GLN A 49 9.356 5.250 -9.345 1.00 1.00 C ATOM 770 C GLN A 49 10.015 4.855 -10.693 1.00 1.00 C ATOM 771 O GLN A 49 9.498 4.000 -11.413 1.00 1.00 O ATOM 772 CB GLN A 49 8.386 6.448 -9.522 1.00 1.00 C ATOM 773 CG GLN A 49 8.960 7.701 -10.212 1.00 1.00 C ATOM 774 CD GLN A 49 7.988 8.880 -10.271 1.00 1.00 C ATOM 775 OE1 GLN A 49 7.789 9.496 -11.310 1.00 1.00 O ATOM 776 NE2 GLN A 49 7.344 9.260 -9.198 1.00 1.00 N ATOM 0 H GLN A 49 10.199 6.457 -7.842 1.00 1.00 H new ATOM 0 HA GLN A 49 8.793 4.370 -9.034 1.00 1.00 H new ATOM 0 HB2 GLN A 49 7.524 6.107 -10.096 1.00 1.00 H new ATOM 0 HB3 GLN A 49 8.019 6.738 -8.538 1.00 1.00 H new ATOM 0 HG2 GLN A 49 9.861 8.013 -9.684 1.00 1.00 H new ATOM 0 HG3 GLN A 49 9.259 7.439 -11.227 1.00 1.00 H new ATOM 0 HE21 GLN A 49 7.487 8.768 -8.316 1.00 1.00 H new ATOM 0 HE22 GLN A 49 6.698 10.048 -9.243 1.00 1.00 H new ATOM 785 N GLN A 50 11.173 5.451 -11.020 1.00 1.00 N ATOM 786 CA GLN A 50 11.974 5.195 -12.238 1.00 1.00 C ATOM 787 C GLN A 50 12.866 3.930 -12.129 1.00 1.00 C ATOM 788 O GLN A 50 13.083 3.240 -13.129 1.00 1.00 O ATOM 789 CB GLN A 50 12.798 6.453 -12.593 1.00 1.00 C ATOM 790 CG GLN A 50 11.938 7.711 -12.843 1.00 1.00 C ATOM 791 CD GLN A 50 12.765 8.945 -13.199 1.00 1.00 C ATOM 792 OE1 GLN A 50 13.157 9.164 -14.330 1.00 1.00 O ATOM 793 NE2 GLN A 50 13.077 9.825 -12.275 1.00 1.00 N ATOM 0 H GLN A 50 11.599 6.156 -10.419 1.00 1.00 H new ATOM 0 HA GLN A 50 11.279 4.984 -13.051 1.00 1.00 H new ATOM 0 HB2 GLN A 50 13.498 6.658 -11.783 1.00 1.00 H new ATOM 0 HB3 GLN A 50 13.392 6.248 -13.483 1.00 1.00 H new ATOM 0 HG2 GLN A 50 11.235 7.508 -13.651 1.00 1.00 H new ATOM 0 HG3 GLN A 50 11.347 7.922 -11.952 1.00 1.00 H new ATOM 0 HE21 GLN A 50 12.771 9.684 -11.312 1.00 1.00 H new ATOM 0 HE22 GLN A 50 13.626 10.649 -12.520 1.00 1.00 H new ATOM 802 N LYS A 51 13.345 3.582 -10.919 1.00 1.00 N ATOM 803 CA LYS A 51 14.069 2.325 -10.564 1.00 1.00 C ATOM 804 C LYS A 51 13.146 1.101 -10.355 1.00 1.00 C ATOM 805 O LYS A 51 13.576 -0.038 -10.554 1.00 1.00 O ATOM 806 CB LYS A 51 14.951 2.579 -9.318 1.00 1.00 C ATOM 807 CG LYS A 51 16.147 3.487 -9.664 1.00 1.00 C ATOM 808 CD LYS A 51 16.998 3.875 -8.446 1.00 1.00 C ATOM 809 CE LYS A 51 18.212 4.677 -8.933 1.00 1.00 C ATOM 810 NZ LYS A 51 18.896 5.391 -7.833 1.00 1.00 N ATOM 0 H LYS A 51 13.236 4.197 -10.113 1.00 1.00 H new ATOM 0 HA LYS A 51 14.692 2.064 -11.419 1.00 1.00 H new ATOM 0 HB2 LYS A 51 14.353 3.042 -8.533 1.00 1.00 H new ATOM 0 HB3 LYS A 51 15.313 1.629 -8.924 1.00 1.00 H new ATOM 0 HG2 LYS A 51 16.780 2.979 -10.391 1.00 1.00 H new ATOM 0 HG3 LYS A 51 15.777 4.394 -10.142 1.00 1.00 H new ATOM 0 HD2 LYS A 51 16.409 4.468 -7.746 1.00 1.00 H new ATOM 0 HD3 LYS A 51 17.324 2.982 -7.912 1.00 1.00 H new ATOM 0 HE2 LYS A 51 18.918 4.003 -9.419 1.00 1.00 H new ATOM 0 HE3 LYS A 51 17.890 5.397 -9.685 1.00 1.00 H new ATOM 0 HZ1 LYS A 51 19.404 6.213 -8.216 1.00 1.00 H new ATOM 0 HZ2 LYS A 51 18.193 5.712 -7.137 1.00 1.00 H new ATOM 0 HZ3 LYS A 51 19.573 4.750 -7.371 1.00 1.00 H new ATOM 824 N ALA A 52 11.882 1.339 -10.000 1.00 1.00 N ATOM 825 CA ALA A 52 10.762 0.400 -9.845 1.00 1.00 C ATOM 826 C ALA A 52 9.873 0.173 -11.095 1.00 1.00 C ATOM 827 O ALA A 52 9.166 -0.832 -11.151 1.00 1.00 O ATOM 828 CB ALA A 52 9.864 0.983 -8.737 1.00 1.00 C ATOM 0 H ALA A 52 11.584 2.292 -9.792 1.00 1.00 H new ATOM 0 HA ALA A 52 11.203 -0.574 -9.630 1.00 1.00 H new ATOM 0 HB1 ALA A 52 9.010 0.325 -8.577 1.00 1.00 H new ATOM 0 HB2 ALA A 52 10.435 1.068 -7.813 1.00 1.00 H new ATOM 0 HB3 ALA A 52 9.510 1.969 -9.037 1.00 1.00 H new ATOM 834 N GLY A 53 9.821 1.114 -12.049 1.00 1.00 N ATOM 835 CA GLY A 53 8.893 1.123 -13.201 1.00 1.00 C ATOM 836 C GLY A 53 7.435 1.503 -12.852 1.00 1.00 C ATOM 837 O GLY A 53 6.703 2.032 -13.694 1.00 1.00 O ATOM 0 H GLY A 53 10.445 1.921 -12.044 1.00 1.00 H new ATOM 0 HA2 GLY A 53 9.268 1.823 -13.947 1.00 1.00 H new ATOM 0 HA3 GLY A 53 8.897 0.135 -13.661 1.00 1.00 H new ATOM 841 N LYS A 54 7.028 1.269 -11.593 1.00 1.00 N ATOM 842 CA LYS A 54 5.780 1.653 -10.904 1.00 1.00 C ATOM 843 C LYS A 54 5.709 3.191 -10.730 1.00 1.00 C ATOM 844 O LYS A 54 6.638 3.743 -10.136 1.00 1.00 O ATOM 845 CB LYS A 54 5.767 0.941 -9.527 1.00 1.00 C ATOM 846 CG LYS A 54 4.464 1.065 -8.708 1.00 1.00 C ATOM 847 CD LYS A 54 3.282 0.266 -9.291 1.00 1.00 C ATOM 848 CE LYS A 54 2.332 -0.364 -8.261 1.00 1.00 C ATOM 849 NZ LYS A 54 1.678 0.623 -7.371 1.00 1.00 N ATOM 0 H LYS A 54 7.634 0.747 -10.960 1.00 1.00 H new ATOM 0 HA LYS A 54 4.911 1.353 -11.490 1.00 1.00 H new ATOM 0 HB2 LYS A 54 5.972 -0.118 -9.687 1.00 1.00 H new ATOM 0 HB3 LYS A 54 6.587 1.338 -8.928 1.00 1.00 H new ATOM 0 HG2 LYS A 54 4.653 0.725 -7.690 1.00 1.00 H new ATOM 0 HG3 LYS A 54 4.184 2.117 -8.646 1.00 1.00 H new ATOM 0 HD2 LYS A 54 2.703 0.927 -9.935 1.00 1.00 H new ATOM 0 HD3 LYS A 54 3.680 -0.527 -9.924 1.00 1.00 H new ATOM 0 HE2 LYS A 54 1.564 -0.930 -8.787 1.00 1.00 H new ATOM 0 HE3 LYS A 54 2.891 -1.075 -7.652 1.00 1.00 H new ATOM 0 HZ1 LYS A 54 1.053 0.128 -6.703 1.00 1.00 H new ATOM 0 HZ2 LYS A 54 2.404 1.148 -6.842 1.00 1.00 H new ATOM 0 HZ3 LYS A 54 1.118 1.288 -7.942 1.00 1.00 H new ATOM 863 N PRO A 55 4.643 3.899 -11.167 1.00 1.00 N ATOM 864 CA PRO A 55 4.459 5.339 -10.917 1.00 1.00 C ATOM 865 C PRO A 55 4.130 5.597 -9.429 1.00 1.00 C ATOM 866 O PRO A 55 2.961 5.709 -9.041 1.00 1.00 O ATOM 867 CB PRO A 55 3.354 5.775 -11.890 1.00 1.00 C ATOM 868 CG PRO A 55 2.482 4.524 -11.994 1.00 1.00 C ATOM 869 CD PRO A 55 3.490 3.376 -11.891 1.00 1.00 C ATOM 0 HA PRO A 55 5.360 5.926 -11.095 1.00 1.00 H new ATOM 0 HB2 PRO A 55 2.793 6.629 -11.509 1.00 1.00 H new ATOM 0 HB3 PRO A 55 3.760 6.067 -12.859 1.00 1.00 H new ATOM 0 HG2 PRO A 55 1.743 4.482 -11.194 1.00 1.00 H new ATOM 0 HG3 PRO A 55 1.934 4.494 -12.936 1.00 1.00 H new ATOM 0 HD2 PRO A 55 3.056 2.525 -11.366 1.00 1.00 H new ATOM 0 HD3 PRO A 55 3.781 3.025 -12.881 1.00 1.00 H new ATOM 877 N VAL A 56 5.156 5.592 -8.566 1.00 1.00 N ATOM 878 CA VAL A 56 5.028 5.815 -7.106 1.00 1.00 C ATOM 879 C VAL A 56 5.017 7.306 -6.724 1.00 1.00 C ATOM 880 O VAL A 56 5.794 8.111 -7.227 1.00 1.00 O ATOM 881 CB VAL A 56 6.059 5.055 -6.229 1.00 1.00 C ATOM 882 CG1 VAL A 56 6.174 3.546 -6.558 1.00 1.00 C ATOM 883 CG2 VAL A 56 7.495 5.606 -6.211 1.00 1.00 C ATOM 0 H VAL A 56 6.119 5.430 -8.862 1.00 1.00 H new ATOM 0 HA VAL A 56 4.053 5.384 -6.881 1.00 1.00 H new ATOM 0 HB VAL A 56 5.618 5.218 -5.246 1.00 1.00 H new ATOM 0 HG11 VAL A 56 6.914 3.086 -5.903 1.00 1.00 H new ATOM 0 HG12 VAL A 56 5.207 3.066 -6.407 1.00 1.00 H new ATOM 0 HG13 VAL A 56 6.482 3.422 -7.596 1.00 1.00 H new ATOM 0 HG21 VAL A 56 8.114 4.987 -5.562 1.00 1.00 H new ATOM 0 HG22 VAL A 56 7.902 5.593 -7.222 1.00 1.00 H new ATOM 0 HG23 VAL A 56 7.487 6.629 -5.836 1.00 1.00 H new ATOM 893 N GLU A 57 4.188 7.642 -5.746 1.00 1.00 N ATOM 894 CA GLU A 57 4.054 8.953 -5.062 1.00 1.00 C ATOM 895 C GLU A 57 4.222 8.845 -3.532 1.00 1.00 C ATOM 896 O GLU A 57 4.685 9.773 -2.869 1.00 1.00 O ATOM 897 CB GLU A 57 2.669 9.553 -5.399 1.00 1.00 C ATOM 898 CG GLU A 57 2.372 10.923 -4.750 1.00 1.00 C ATOM 899 CD GLU A 57 3.369 12.012 -5.179 1.00 1.00 C ATOM 900 OE1 GLU A 57 3.644 12.113 -6.401 1.00 1.00 O ATOM 901 OE2 GLU A 57 3.896 12.753 -4.310 1.00 1.00 O ATOM 0 H GLU A 57 3.531 6.960 -5.368 1.00 1.00 H new ATOM 0 HA GLU A 57 4.853 9.601 -5.421 1.00 1.00 H new ATOM 0 HB2 GLU A 57 2.589 9.656 -6.481 1.00 1.00 H new ATOM 0 HB3 GLU A 57 1.899 8.847 -5.088 1.00 1.00 H new ATOM 0 HG2 GLU A 57 1.362 11.235 -5.017 1.00 1.00 H new ATOM 0 HG3 GLU A 57 2.398 10.820 -3.665 1.00 1.00 H new ATOM 908 N THR A 58 3.874 7.686 -2.979 1.00 1.00 N ATOM 909 CA THR A 58 3.762 7.312 -1.561 1.00 1.00 C ATOM 910 C THR A 58 4.564 6.049 -1.211 1.00 1.00 C ATOM 911 O THR A 58 5.262 5.454 -2.030 1.00 1.00 O ATOM 912 CB THR A 58 2.281 7.156 -1.151 1.00 1.00 C ATOM 913 OG1 THR A 58 1.645 6.180 -1.948 1.00 1.00 O ATOM 914 CG2 THR A 58 1.525 8.479 -1.274 1.00 1.00 C ATOM 0 H THR A 58 3.636 6.894 -3.576 1.00 1.00 H new ATOM 0 HA THR A 58 4.202 8.127 -0.987 1.00 1.00 H new ATOM 0 HB THR A 58 2.265 6.841 -0.108 1.00 1.00 H new ATOM 0 HG1 THR A 58 1.004 5.679 -1.402 1.00 1.00 H new ATOM 0 HG21 THR A 58 0.486 8.333 -0.978 1.00 1.00 H new ATOM 0 HG22 THR A 58 1.986 9.223 -0.625 1.00 1.00 H new ATOM 0 HG23 THR A 58 1.563 8.825 -2.307 1.00 1.00 H new ATOM 922 N VAL A 59 4.488 5.663 0.060 1.00 1.00 N ATOM 923 CA VAL A 59 5.019 4.425 0.681 1.00 1.00 C ATOM 924 C VAL A 59 3.932 3.353 0.917 1.00 1.00 C ATOM 925 O VAL A 59 2.746 3.694 0.954 1.00 1.00 O ATOM 926 CB VAL A 59 5.710 4.728 2.040 1.00 1.00 C ATOM 927 CG1 VAL A 59 7.231 4.848 1.841 1.00 1.00 C ATOM 928 CG2 VAL A 59 5.049 5.905 2.771 1.00 1.00 C ATOM 0 H VAL A 59 4.017 6.248 0.750 1.00 1.00 H new ATOM 0 HA VAL A 59 5.743 4.031 -0.033 1.00 1.00 H new ATOM 0 HB VAL A 59 5.564 3.889 2.721 1.00 1.00 H new ATOM 0 HG11 VAL A 59 7.708 5.060 2.798 1.00 1.00 H new ATOM 0 HG12 VAL A 59 7.621 3.912 1.441 1.00 1.00 H new ATOM 0 HG13 VAL A 59 7.444 5.657 1.142 1.00 1.00 H new ATOM 0 HG21 VAL A 59 5.564 6.082 3.716 1.00 1.00 H new ATOM 0 HG22 VAL A 59 5.111 6.799 2.151 1.00 1.00 H new ATOM 0 HG23 VAL A 59 4.003 5.671 2.966 1.00 1.00 H new ATOM 938 N PRO A 60 4.326 2.084 1.184 1.00 1.00 N ATOM 939 CA PRO A 60 5.714 1.569 1.260 1.00 1.00 C ATOM 940 C PRO A 60 6.481 1.473 -0.085 1.00 1.00 C ATOM 941 O PRO A 60 5.913 1.628 -1.172 1.00 1.00 O ATOM 942 CB PRO A 60 5.604 0.240 2.008 1.00 1.00 C ATOM 943 CG PRO A 60 4.180 -0.236 1.720 1.00 1.00 C ATOM 944 CD PRO A 60 3.370 1.029 1.494 1.00 1.00 C ATOM 0 HA PRO A 60 6.345 2.285 1.787 1.00 1.00 H new ATOM 0 HB2 PRO A 60 6.343 -0.479 1.654 1.00 1.00 H new ATOM 0 HB3 PRO A 60 5.772 0.370 3.077 1.00 1.00 H new ATOM 0 HG2 PRO A 60 4.152 -0.883 0.843 1.00 1.00 H new ATOM 0 HG3 PRO A 60 3.782 -0.813 2.555 1.00 1.00 H new ATOM 0 HD2 PRO A 60 2.662 0.895 0.676 1.00 1.00 H new ATOM 0 HD3 PRO A 60 2.789 1.281 2.381 1.00 1.00 H new ATOM 952 N GLN A 61 7.798 1.245 0.021 1.00 1.00 N ATOM 953 CA GLN A 61 8.800 1.101 -1.045 1.00 1.00 C ATOM 954 C GLN A 61 9.756 -0.091 -0.790 1.00 1.00 C ATOM 955 O GLN A 61 10.913 0.050 -0.405 1.00 1.00 O ATOM 956 CB GLN A 61 9.547 2.441 -1.271 1.00 1.00 C ATOM 957 CG GLN A 61 8.689 3.561 -1.893 1.00 1.00 C ATOM 958 CD GLN A 61 7.980 3.139 -3.179 1.00 1.00 C ATOM 959 OE1 GLN A 61 8.413 2.298 -3.955 1.00 1.00 O ATOM 960 NE2 GLN A 61 6.817 3.651 -3.461 1.00 1.00 N ATOM 0 H GLN A 61 8.229 1.148 0.941 1.00 1.00 H new ATOM 0 HA GLN A 61 8.280 0.861 -1.972 1.00 1.00 H new ATOM 0 HB2 GLN A 61 9.937 2.790 -0.315 1.00 1.00 H new ATOM 0 HB3 GLN A 61 10.405 2.258 -1.918 1.00 1.00 H new ATOM 0 HG2 GLN A 61 7.944 3.884 -1.166 1.00 1.00 H new ATOM 0 HG3 GLN A 61 9.324 4.421 -2.103 1.00 1.00 H new ATOM 0 HE21 GLN A 61 6.408 4.357 -2.848 1.00 1.00 H new ATOM 0 HE22 GLN A 61 6.314 3.347 -4.295 1.00 1.00 H new ATOM 969 N ILE A 62 9.249 -1.299 -1.010 1.00 1.00 N ATOM 970 CA ILE A 62 9.979 -2.597 -1.000 1.00 1.00 C ATOM 971 C ILE A 62 10.227 -3.207 -2.411 1.00 1.00 C ATOM 972 O ILE A 62 9.493 -2.989 -3.378 1.00 1.00 O ATOM 973 CB ILE A 62 9.315 -3.561 0.027 1.00 1.00 C ATOM 974 CG1 ILE A 62 9.776 -3.176 1.466 1.00 1.00 C ATOM 975 CG2 ILE A 62 9.593 -5.062 -0.218 1.00 1.00 C ATOM 976 CD1 ILE A 62 8.754 -3.486 2.563 1.00 1.00 C ATOM 0 H ILE A 62 8.258 -1.425 -1.214 1.00 1.00 H new ATOM 0 HA ILE A 62 10.997 -2.410 -0.659 1.00 1.00 H new ATOM 0 HB ILE A 62 8.239 -3.436 -0.098 1.00 1.00 H new ATOM 0 HG12 ILE A 62 10.703 -3.704 1.691 1.00 1.00 H new ATOM 0 HG13 ILE A 62 10.003 -2.110 1.489 1.00 1.00 H new ATOM 0 HG21 ILE A 62 9.090 -5.655 0.546 1.00 1.00 H new ATOM 0 HG22 ILE A 62 9.219 -5.346 -1.202 1.00 1.00 H new ATOM 0 HG23 ILE A 62 10.666 -5.246 -0.172 1.00 1.00 H new ATOM 0 HD11 ILE A 62 9.157 -3.186 3.531 1.00 1.00 H new ATOM 0 HD12 ILE A 62 7.833 -2.937 2.368 1.00 1.00 H new ATOM 0 HD13 ILE A 62 8.544 -4.556 2.573 1.00 1.00 H new ATOM 988 N PHE A 63 11.319 -3.976 -2.519 1.00 1.00 N ATOM 989 CA PHE A 63 11.836 -4.722 -3.675 1.00 1.00 C ATOM 990 C PHE A 63 12.121 -6.183 -3.268 1.00 1.00 C ATOM 991 O PHE A 63 13.029 -6.457 -2.482 1.00 1.00 O ATOM 992 CB PHE A 63 13.099 -4.040 -4.249 1.00 1.00 C ATOM 993 CG PHE A 63 12.858 -2.749 -5.037 1.00 1.00 C ATOM 994 CD1 PHE A 63 12.388 -1.585 -4.381 1.00 1.00 C ATOM 995 CD2 PHE A 63 13.168 -2.674 -6.417 1.00 1.00 C ATOM 996 CE1 PHE A 63 12.260 -0.362 -5.074 1.00 1.00 C ATOM 997 CE2 PHE A 63 13.043 -1.449 -7.114 1.00 1.00 C ATOM 998 CZ PHE A 63 12.610 -0.288 -6.436 1.00 1.00 C ATOM 0 H PHE A 63 11.928 -4.104 -1.711 1.00 1.00 H new ATOM 0 HA PHE A 63 11.082 -4.724 -4.462 1.00 1.00 H new ATOM 0 HB2 PHE A 63 13.777 -3.819 -3.424 1.00 1.00 H new ATOM 0 HB3 PHE A 63 13.609 -4.751 -4.899 1.00 1.00 H new ATOM 0 HD1 PHE A 63 12.124 -1.634 -3.335 1.00 1.00 H new ATOM 0 HD2 PHE A 63 13.502 -3.558 -6.941 1.00 1.00 H new ATOM 0 HE1 PHE A 63 11.894 0.515 -4.561 1.00 1.00 H new ATOM 0 HE2 PHE A 63 13.279 -1.402 -8.167 1.00 1.00 H new ATOM 0 HZ PHE A 63 12.548 0.654 -6.961 1.00 1.00 H new ATOM 1008 N VAL A 64 11.324 -7.127 -3.773 1.00 1.00 N ATOM 1009 CA VAL A 64 11.413 -8.579 -3.494 1.00 1.00 C ATOM 1010 C VAL A 64 12.173 -9.297 -4.628 1.00 1.00 C ATOM 1011 O VAL A 64 11.937 -9.059 -5.813 1.00 1.00 O ATOM 1012 CB VAL A 64 10.018 -9.211 -3.294 1.00 1.00 C ATOM 1013 CG1 VAL A 64 10.166 -10.680 -2.887 1.00 1.00 C ATOM 1014 CG2 VAL A 64 9.213 -8.533 -2.167 1.00 1.00 C ATOM 0 H VAL A 64 10.564 -6.901 -4.415 1.00 1.00 H new ATOM 0 HA VAL A 64 11.965 -8.703 -2.562 1.00 1.00 H new ATOM 0 HB VAL A 64 9.495 -9.090 -4.243 1.00 1.00 H new ATOM 0 HG11 VAL A 64 9.179 -11.120 -2.747 1.00 1.00 H new ATOM 0 HG12 VAL A 64 10.698 -11.222 -3.669 1.00 1.00 H new ATOM 0 HG13 VAL A 64 10.727 -10.745 -1.955 1.00 1.00 H new ATOM 0 HG21 VAL A 64 8.242 -9.018 -2.071 1.00 1.00 H new ATOM 0 HG22 VAL A 64 9.757 -8.622 -1.227 1.00 1.00 H new ATOM 0 HG23 VAL A 64 9.070 -7.479 -2.405 1.00 1.00 H new ATOM 1024 N ASP A 65 13.119 -10.164 -4.265 1.00 1.00 N ATOM 1025 CA ASP A 65 14.109 -10.888 -5.087 1.00 1.00 C ATOM 1026 C ASP A 65 14.787 -10.009 -6.193 1.00 1.00 C ATOM 1027 O ASP A 65 15.198 -10.515 -7.240 1.00 1.00 O ATOM 1028 CB ASP A 65 13.462 -12.234 -5.544 1.00 1.00 C ATOM 1029 CG ASP A 65 13.743 -13.437 -4.615 1.00 1.00 C ATOM 1030 OD1 ASP A 65 14.740 -13.430 -3.856 1.00 1.00 O ATOM 1031 OD2 ASP A 65 12.954 -14.412 -4.621 1.00 1.00 O ATOM 0 H ASP A 65 13.228 -10.408 -3.281 1.00 1.00 H new ATOM 0 HA ASP A 65 14.986 -11.143 -4.493 1.00 1.00 H new ATOM 0 HB2 ASP A 65 12.383 -12.095 -5.619 1.00 1.00 H new ATOM 0 HB3 ASP A 65 13.823 -12.473 -6.544 1.00 1.00 H new ATOM 1036 N GLN A 66 14.950 -8.699 -5.913 1.00 1.00 N ATOM 1037 CA GLN A 66 15.509 -7.533 -6.661 1.00 1.00 C ATOM 1038 C GLN A 66 14.493 -6.648 -7.456 1.00 1.00 C ATOM 1039 O GLN A 66 14.906 -5.637 -8.030 1.00 1.00 O ATOM 1040 CB GLN A 66 16.689 -7.978 -7.578 1.00 1.00 C ATOM 1041 CG GLN A 66 17.727 -6.879 -7.903 1.00 1.00 C ATOM 1042 CD GLN A 66 18.692 -7.282 -9.012 1.00 1.00 C ATOM 1043 OE1 GLN A 66 19.841 -7.637 -8.792 1.00 1.00 O ATOM 1044 NE2 GLN A 66 18.293 -7.220 -10.260 1.00 1.00 N ATOM 0 H GLN A 66 14.639 -8.373 -4.998 1.00 1.00 H new ATOM 0 HA GLN A 66 15.863 -6.870 -5.872 1.00 1.00 H new ATOM 0 HB2 GLN A 66 17.204 -8.811 -7.100 1.00 1.00 H new ATOM 0 HB3 GLN A 66 16.277 -8.354 -8.515 1.00 1.00 H new ATOM 0 HG2 GLN A 66 17.204 -5.969 -8.196 1.00 1.00 H new ATOM 0 HG3 GLN A 66 18.294 -6.645 -7.002 1.00 1.00 H new ATOM 0 HE21 GLN A 66 17.340 -6.927 -10.477 1.00 1.00 H new ATOM 0 HE22 GLN A 66 18.935 -7.464 -11.014 1.00 1.00 H new ATOM 1053 N GLN A 67 13.171 -6.885 -7.400 1.00 1.00 N ATOM 1054 CA GLN A 67 12.133 -6.163 -8.192 1.00 1.00 C ATOM 1055 C GLN A 67 11.001 -5.563 -7.316 1.00 1.00 C ATOM 1056 O GLN A 67 10.618 -6.143 -6.299 1.00 1.00 O ATOM 1057 CB GLN A 67 11.652 -7.046 -9.381 1.00 1.00 C ATOM 1058 CG GLN A 67 10.369 -7.892 -9.188 1.00 1.00 C ATOM 1059 CD GLN A 67 9.060 -7.158 -9.508 1.00 1.00 C ATOM 1060 OE1 GLN A 67 8.981 -5.947 -9.632 1.00 1.00 O ATOM 1061 NE2 GLN A 67 7.960 -7.834 -9.704 1.00 1.00 N ATOM 0 H GLN A 67 12.774 -7.600 -6.790 1.00 1.00 H new ATOM 0 HA GLN A 67 12.590 -5.277 -8.634 1.00 1.00 H new ATOM 0 HB2 GLN A 67 11.495 -6.393 -10.239 1.00 1.00 H new ATOM 0 HB3 GLN A 67 12.464 -7.725 -9.642 1.00 1.00 H new ATOM 0 HG2 GLN A 67 10.436 -8.778 -9.820 1.00 1.00 H new ATOM 0 HG3 GLN A 67 10.331 -8.239 -8.155 1.00 1.00 H new ATOM 0 HE21 GLN A 67 7.963 -8.850 -9.615 1.00 1.00 H new ATOM 0 HE22 GLN A 67 7.098 -7.346 -9.946 1.00 1.00 H new ATOM 1070 N HIS A 68 10.458 -4.392 -7.688 1.00 1.00 N ATOM 1071 CA HIS A 68 9.491 -3.607 -6.883 1.00 1.00 C ATOM 1072 C HIS A 68 8.165 -4.341 -6.564 1.00 1.00 C ATOM 1073 O HIS A 68 7.324 -4.554 -7.439 1.00 1.00 O ATOM 1074 CB HIS A 68 9.220 -2.239 -7.543 1.00 1.00 C ATOM 1075 CG HIS A 68 8.226 -1.379 -6.776 1.00 1.00 C ATOM 1076 ND1 HIS A 68 6.845 -1.505 -6.806 1.00 1.00 N ATOM 1077 CD2 HIS A 68 8.531 -0.346 -5.931 1.00 1.00 C ATOM 1078 CE1 HIS A 68 6.334 -0.578 -5.969 1.00 1.00 C ATOM 1079 NE2 HIS A 68 7.340 0.136 -5.432 1.00 1.00 N ATOM 0 H HIS A 68 10.681 -3.949 -8.579 1.00 1.00 H new ATOM 0 HA HIS A 68 9.971 -3.460 -5.916 1.00 1.00 H new ATOM 0 HB2 HIS A 68 10.161 -1.697 -7.636 1.00 1.00 H new ATOM 0 HB3 HIS A 68 8.844 -2.400 -8.553 1.00 1.00 H new ATOM 0 HD2 HIS A 68 9.519 0.022 -5.699 1.00 1.00 H new ATOM 0 HE1 HIS A 68 5.284 -0.432 -5.763 1.00 1.00 H new ATOM 0 HE2 HIS A 68 7.239 0.904 -4.768 1.00 1.00 H new ATOM 1088 N ILE A 69 7.956 -4.617 -5.275 1.00 1.00 N ATOM 1089 CA ILE A 69 6.735 -5.144 -4.628 1.00 1.00 C ATOM 1090 C ILE A 69 6.467 -4.243 -3.414 1.00 1.00 C ATOM 1091 O ILE A 69 7.088 -4.418 -2.365 1.00 1.00 O ATOM 1092 CB ILE A 69 6.851 -6.629 -4.196 1.00 1.00 C ATOM 1093 CG1 ILE A 69 7.179 -7.618 -5.344 1.00 1.00 C ATOM 1094 CG2 ILE A 69 5.573 -7.059 -3.433 1.00 1.00 C ATOM 1095 CD1 ILE A 69 6.121 -7.739 -6.451 1.00 1.00 C ATOM 0 H ILE A 69 8.697 -4.467 -4.590 1.00 1.00 H new ATOM 0 HA ILE A 69 5.913 -5.128 -5.344 1.00 1.00 H new ATOM 0 HB ILE A 69 7.716 -6.682 -3.534 1.00 1.00 H new ATOM 0 HG12 ILE A 69 8.121 -7.314 -5.801 1.00 1.00 H new ATOM 0 HG13 ILE A 69 7.338 -8.606 -4.912 1.00 1.00 H new ATOM 0 HG21 ILE A 69 5.662 -8.103 -3.133 1.00 1.00 H new ATOM 0 HG22 ILE A 69 5.451 -6.436 -2.547 1.00 1.00 H new ATOM 0 HG23 ILE A 69 4.705 -6.941 -4.082 1.00 1.00 H new ATOM 0 HD11 ILE A 69 6.457 -8.457 -7.199 1.00 1.00 H new ATOM 0 HD12 ILE A 69 5.180 -8.079 -6.019 1.00 1.00 H new ATOM 0 HD13 ILE A 69 5.974 -6.767 -6.922 1.00 1.00 H new ATOM 1107 N GLY A 70 5.573 -3.268 -3.585 1.00 1.00 N ATOM 1108 CA GLY A 70 5.176 -2.185 -2.675 1.00 1.00 C ATOM 1109 C GLY A 70 5.683 -2.218 -1.226 1.00 1.00 C ATOM 1110 O GLY A 70 6.409 -1.321 -0.802 1.00 1.00 O ATOM 0 H GLY A 70 5.051 -3.209 -4.459 1.00 1.00 H new ATOM 0 HA2 GLY A 70 5.502 -1.244 -3.118 1.00 1.00 H new ATOM 0 HA3 GLY A 70 4.087 -2.162 -2.644 1.00 1.00 H new ATOM 1114 N GLY A 71 5.304 -3.241 -0.458 1.00 1.00 N ATOM 1115 CA GLY A 71 5.535 -3.375 0.989 1.00 1.00 C ATOM 1116 C GLY A 71 4.249 -3.738 1.718 1.00 1.00 C ATOM 1117 O GLY A 71 3.426 -4.435 1.149 1.00 1.00 O ATOM 0 H GLY A 71 4.802 -4.041 -0.844 1.00 1.00 H new ATOM 0 HA2 GLY A 71 6.288 -4.141 1.171 1.00 1.00 H new ATOM 0 HA3 GLY A 71 5.930 -2.440 1.386 1.00 1.00 H new ATOM 1121 N TYR A 72 4.036 -3.226 2.938 1.00 1.00 N ATOM 1122 CA TYR A 72 2.935 -3.569 3.866 1.00 1.00 C ATOM 1123 C TYR A 72 1.617 -3.925 3.129 1.00 1.00 C ATOM 1124 O TYR A 72 1.105 -5.025 3.285 1.00 1.00 O ATOM 1125 CB TYR A 72 2.719 -2.403 4.871 1.00 1.00 C ATOM 1126 CG TYR A 72 1.734 -2.737 5.975 1.00 1.00 C ATOM 1127 CD1 TYR A 72 0.378 -3.013 5.687 1.00 1.00 C ATOM 1128 CD2 TYR A 72 2.243 -3.012 7.264 1.00 1.00 C ATOM 1129 CE1 TYR A 72 -0.377 -3.779 6.596 1.00 1.00 C ATOM 1130 CE2 TYR A 72 1.457 -3.696 8.213 1.00 1.00 C ATOM 1131 CZ TYR A 72 0.183 -4.159 7.832 1.00 1.00 C ATOM 1132 OH TYR A 72 -0.424 -5.117 8.575 1.00 1.00 O ATOM 0 H TYR A 72 4.659 -2.521 3.332 1.00 1.00 H new ATOM 0 HA TYR A 72 3.227 -4.467 4.410 1.00 1.00 H new ATOM 0 HB2 TYR A 72 3.677 -2.135 5.317 1.00 1.00 H new ATOM 0 HB3 TYR A 72 2.363 -1.527 4.329 1.00 1.00 H new ATOM 0 HD1 TYR A 72 -0.074 -2.640 4.780 1.00 1.00 H new ATOM 0 HD2 TYR A 72 3.242 -2.696 7.524 1.00 1.00 H new ATOM 0 HE1 TYR A 72 -1.385 -4.075 6.346 1.00 1.00 H new ATOM 0 HE2 TYR A 72 1.825 -3.862 9.215 1.00 1.00 H new ATOM 0 HH TYR A 72 0.087 -5.265 9.398 1.00 1.00 H new ATOM 1142 N THR A 73 1.118 -3.020 2.273 1.00 1.00 N ATOM 1143 CA THR A 73 -0.040 -3.196 1.361 1.00 1.00 C ATOM 1144 C THR A 73 0.046 -4.422 0.424 1.00 1.00 C ATOM 1145 O THR A 73 -0.768 -5.343 0.535 1.00 1.00 O ATOM 1146 CB THR A 73 -0.287 -1.893 0.558 1.00 1.00 C ATOM 1147 OG1 THR A 73 -1.271 -2.075 -0.431 1.00 1.00 O ATOM 1148 CG2 THR A 73 0.933 -1.277 -0.140 1.00 1.00 C ATOM 0 H THR A 73 1.530 -2.091 2.188 1.00 1.00 H new ATOM 0 HA THR A 73 -0.894 -3.405 2.005 1.00 1.00 H new ATOM 0 HB THR A 73 -0.598 -1.199 1.339 1.00 1.00 H new ATOM 0 HG1 THR A 73 -2.120 -1.696 -0.122 1.00 1.00 H new ATOM 0 HG21 THR A 73 0.632 -0.372 -0.667 1.00 1.00 H new ATOM 0 HG22 THR A 73 1.691 -1.029 0.603 1.00 1.00 H new ATOM 0 HG23 THR A 73 1.344 -1.992 -0.853 1.00 1.00 H new ATOM 1156 N ASP A 74 1.051 -4.468 -0.449 1.00 1.00 N ATOM 1157 CA ASP A 74 1.393 -5.521 -1.423 1.00 1.00 C ATOM 1158 C ASP A 74 1.673 -6.875 -0.714 1.00 1.00 C ATOM 1159 O ASP A 74 1.004 -7.879 -0.943 1.00 1.00 O ATOM 1160 CB ASP A 74 2.651 -5.032 -2.184 1.00 1.00 C ATOM 1161 CG ASP A 74 2.376 -4.272 -3.486 1.00 1.00 C ATOM 1162 OD1 ASP A 74 1.664 -3.241 -3.446 1.00 1.00 O ATOM 1163 OD2 ASP A 74 2.991 -4.626 -4.520 1.00 1.00 O ATOM 0 H ASP A 74 1.716 -3.696 -0.503 1.00 1.00 H new ATOM 0 HA ASP A 74 0.562 -5.694 -2.107 1.00 1.00 H new ATOM 0 HB2 ASP A 74 3.228 -4.387 -1.521 1.00 1.00 H new ATOM 0 HB3 ASP A 74 3.276 -5.896 -2.412 1.00 1.00 H new ATOM 1168 N PHE A 75 2.658 -6.882 0.187 1.00 1.00 N ATOM 1169 CA PHE A 75 3.055 -7.958 1.111 1.00 1.00 C ATOM 1170 C PHE A 75 1.905 -8.565 1.949 1.00 1.00 C ATOM 1171 O PHE A 75 1.900 -9.781 2.156 1.00 1.00 O ATOM 1172 CB PHE A 75 4.234 -7.467 1.987 1.00 1.00 C ATOM 1173 CG PHE A 75 5.495 -8.309 1.972 1.00 1.00 C ATOM 1174 CD1 PHE A 75 5.979 -8.875 0.766 1.00 1.00 C ATOM 1175 CD2 PHE A 75 6.265 -8.416 3.152 1.00 1.00 C ATOM 1176 CE1 PHE A 75 7.222 -9.532 0.742 1.00 1.00 C ATOM 1177 CE2 PHE A 75 7.507 -9.075 3.126 1.00 1.00 C ATOM 1178 CZ PHE A 75 7.990 -9.615 1.918 1.00 1.00 C ATOM 0 H PHE A 75 3.255 -6.063 0.302 1.00 1.00 H new ATOM 0 HA PHE A 75 3.378 -8.798 0.496 1.00 1.00 H new ATOM 0 HB2 PHE A 75 4.496 -6.458 1.669 1.00 1.00 H new ATOM 0 HB3 PHE A 75 3.885 -7.396 3.017 1.00 1.00 H new ATOM 0 HD1 PHE A 75 5.391 -8.801 -0.137 1.00 1.00 H new ATOM 0 HD2 PHE A 75 5.899 -7.991 4.075 1.00 1.00 H new ATOM 0 HE1 PHE A 75 7.586 -9.971 -0.175 1.00 1.00 H new ATOM 0 HE2 PHE A 75 8.090 -9.167 4.031 1.00 1.00 H new ATOM 0 HZ PHE A 75 8.957 -10.096 1.894 1.00 1.00 H new ATOM 1188 N ALA A 76 0.945 -7.765 2.442 1.00 1.00 N ATOM 1189 CA ALA A 76 -0.284 -8.252 3.093 1.00 1.00 C ATOM 1190 C ALA A 76 -1.184 -8.997 2.074 1.00 1.00 C ATOM 1191 O ALA A 76 -1.569 -10.134 2.334 1.00 1.00 O ATOM 1192 CB ALA A 76 -1.018 -7.098 3.796 1.00 1.00 C ATOM 0 H ALA A 76 1.001 -6.747 2.399 1.00 1.00 H new ATOM 0 HA ALA A 76 -0.015 -8.974 3.864 1.00 1.00 H new ATOM 0 HB1 ALA A 76 -1.923 -7.478 4.271 1.00 1.00 H new ATOM 0 HB2 ALA A 76 -0.367 -6.661 4.553 1.00 1.00 H new ATOM 0 HB3 ALA A 76 -1.285 -6.337 3.063 1.00 1.00 H new ATOM 1198 N ALA A 77 -1.460 -8.409 0.893 1.00 1.00 N ATOM 1199 CA ALA A 77 -2.162 -9.061 -0.234 1.00 1.00 C ATOM 1200 C ALA A 77 -1.500 -10.390 -0.699 1.00 1.00 C ATOM 1201 O ALA A 77 -2.212 -11.341 -1.025 1.00 1.00 O ATOM 1202 CB ALA A 77 -2.323 -8.051 -1.383 1.00 1.00 C ATOM 0 H ALA A 77 -1.195 -7.445 0.690 1.00 1.00 H new ATOM 0 HA ALA A 77 -3.148 -9.363 0.118 1.00 1.00 H new ATOM 0 HB1 ALA A 77 -2.840 -8.527 -2.216 1.00 1.00 H new ATOM 0 HB2 ALA A 77 -2.903 -7.196 -1.037 1.00 1.00 H new ATOM 0 HB3 ALA A 77 -1.340 -7.714 -1.711 1.00 1.00 H new ATOM 1208 N TRP A 78 -0.160 -10.472 -0.687 1.00 1.00 N ATOM 1209 CA TRP A 78 0.679 -11.665 -0.920 1.00 1.00 C ATOM 1210 C TRP A 78 0.507 -12.756 0.157 1.00 1.00 C ATOM 1211 O TRP A 78 0.257 -13.919 -0.171 1.00 1.00 O ATOM 1212 CB TRP A 78 2.154 -11.247 -1.003 1.00 1.00 C ATOM 1213 CG TRP A 78 3.134 -12.371 -1.173 1.00 1.00 C ATOM 1214 CD1 TRP A 78 3.087 -13.318 -2.137 1.00 1.00 C ATOM 1215 CD2 TRP A 78 4.306 -12.684 -0.360 1.00 1.00 C ATOM 1216 NE1 TRP A 78 4.189 -14.141 -2.026 1.00 1.00 N ATOM 1217 CE2 TRP A 78 4.999 -13.771 -0.980 1.00 1.00 C ATOM 1218 CE3 TRP A 78 4.868 -12.151 0.825 1.00 1.00 C ATOM 1219 CZ2 TRP A 78 6.236 -14.247 -0.512 1.00 1.00 C ATOM 1220 CZ3 TRP A 78 6.109 -12.622 1.311 1.00 1.00 C ATOM 1221 CH2 TRP A 78 6.808 -13.642 0.629 1.00 1.00 C ATOM 0 H TRP A 78 0.410 -9.647 -0.501 1.00 1.00 H new ATOM 0 HA TRP A 78 0.349 -12.103 -1.862 1.00 1.00 H new ATOM 0 HB2 TRP A 78 2.272 -10.556 -1.838 1.00 1.00 H new ATOM 0 HB3 TRP A 78 2.410 -10.699 -0.097 1.00 1.00 H new ATOM 0 HD1 TRP A 78 2.308 -13.415 -2.879 1.00 1.00 H new ATOM 0 HE1 TRP A 78 4.379 -14.929 -2.646 1.00 1.00 H new ATOM 0 HE3 TRP A 78 4.343 -11.376 1.364 1.00 1.00 H new ATOM 0 HZ2 TRP A 78 6.739 -15.059 -1.015 1.00 1.00 H new ATOM 0 HZ3 TRP A 78 6.526 -12.198 2.212 1.00 1.00 H new ATOM 0 HH2 TRP A 78 7.779 -13.959 0.980 1.00 1.00 H new ATOM 1232 N VAL A 79 0.668 -12.400 1.442 1.00 1.00 N ATOM 1233 CA VAL A 79 0.379 -13.271 2.611 1.00 1.00 C ATOM 1234 C VAL A 79 -1.063 -13.795 2.556 1.00 1.00 C ATOM 1235 O VAL A 79 -1.260 -15.005 2.641 1.00 1.00 O ATOM 1236 CB VAL A 79 0.697 -12.569 3.955 1.00 1.00 C ATOM 1237 CG1 VAL A 79 0.087 -13.272 5.180 1.00 1.00 C ATOM 1238 CG2 VAL A 79 2.222 -12.519 4.150 1.00 1.00 C ATOM 0 H VAL A 79 1.011 -11.478 1.712 1.00 1.00 H new ATOM 0 HA VAL A 79 1.045 -14.132 2.555 1.00 1.00 H new ATOM 0 HB VAL A 79 0.255 -11.574 3.892 1.00 1.00 H new ATOM 0 HG11 VAL A 79 0.352 -12.723 6.084 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -0.998 -13.303 5.079 1.00 1.00 H new ATOM 0 HG13 VAL A 79 0.474 -14.289 5.246 1.00 1.00 H new ATOM 0 HG21 VAL A 79 2.452 -12.026 5.094 1.00 1.00 H new ATOM 0 HG22 VAL A 79 2.620 -13.533 4.164 1.00 1.00 H new ATOM 0 HG23 VAL A 79 2.676 -11.962 3.330 1.00 1.00 H new ATOM 1248 N LYS A 80 -2.056 -12.918 2.328 1.00 1.00 N ATOM 1249 CA LYS A 80 -3.479 -13.245 2.081 1.00 1.00 C ATOM 1250 C LYS A 80 -3.662 -14.257 0.935 1.00 1.00 C ATOM 1251 O LYS A 80 -4.256 -15.304 1.146 1.00 1.00 O ATOM 1252 CB LYS A 80 -4.300 -11.952 1.851 1.00 1.00 C ATOM 1253 CG LYS A 80 -4.459 -11.071 3.117 1.00 1.00 C ATOM 1254 CD LYS A 80 -5.910 -11.024 3.634 1.00 1.00 C ATOM 1255 CE LYS A 80 -6.067 -10.461 5.052 1.00 1.00 C ATOM 1256 NZ LYS A 80 -5.375 -11.294 6.066 1.00 1.00 N ATOM 0 H LYS A 80 -1.884 -11.913 2.309 1.00 1.00 H new ATOM 0 HA LYS A 80 -3.863 -13.736 2.975 1.00 1.00 H new ATOM 0 HB2 LYS A 80 -3.820 -11.363 1.069 1.00 1.00 H new ATOM 0 HB3 LYS A 80 -5.290 -12.223 1.483 1.00 1.00 H new ATOM 0 HG2 LYS A 80 -3.810 -11.454 3.904 1.00 1.00 H new ATOM 0 HG3 LYS A 80 -4.125 -10.058 2.893 1.00 1.00 H new ATOM 0 HD2 LYS A 80 -6.506 -10.420 2.950 1.00 1.00 H new ATOM 0 HD3 LYS A 80 -6.323 -12.033 3.610 1.00 1.00 H new ATOM 0 HE2 LYS A 80 -5.669 -9.447 5.084 1.00 1.00 H new ATOM 0 HE3 LYS A 80 -7.126 -10.396 5.300 1.00 1.00 H new ATOM 0 HZ1 LYS A 80 -6.075 -11.697 6.721 1.00 1.00 H new ATOM 0 HZ2 LYS A 80 -4.862 -12.064 5.591 1.00 1.00 H new ATOM 0 HZ3 LYS A 80 -4.702 -10.706 6.598 1.00 1.00 H new ATOM 1270 N GLU A 81 -3.077 -14.000 -0.240 1.00 1.00 N ATOM 1271 CA GLU A 81 -2.987 -14.907 -1.415 1.00 1.00 C ATOM 1272 C GLU A 81 -2.402 -16.320 -1.125 1.00 1.00 C ATOM 1273 O GLU A 81 -2.624 -17.245 -1.912 1.00 1.00 O ATOM 1274 CB GLU A 81 -2.213 -14.166 -2.542 1.00 1.00 C ATOM 1275 CG GLU A 81 -1.677 -15.028 -3.700 1.00 1.00 C ATOM 1276 CD GLU A 81 -0.968 -14.202 -4.778 1.00 1.00 C ATOM 1277 OE1 GLU A 81 -1.612 -13.325 -5.400 1.00 1.00 O ATOM 1278 OE2 GLU A 81 0.248 -14.413 -5.017 1.00 1.00 O ATOM 0 H GLU A 81 -2.624 -13.104 -0.418 1.00 1.00 H new ATOM 0 HA GLU A 81 -4.006 -15.131 -1.731 1.00 1.00 H new ATOM 0 HB2 GLU A 81 -2.871 -13.405 -2.962 1.00 1.00 H new ATOM 0 HB3 GLU A 81 -1.370 -13.644 -2.089 1.00 1.00 H new ATOM 0 HG2 GLU A 81 -0.984 -15.770 -3.304 1.00 1.00 H new ATOM 0 HG3 GLU A 81 -2.504 -15.574 -4.153 1.00 1.00 H new ATOM 1285 N ASN A 82 -1.663 -16.507 -0.021 1.00 1.00 N ATOM 1286 CA ASN A 82 -1.144 -17.783 0.498 1.00 1.00 C ATOM 1287 C ASN A 82 -1.980 -18.384 1.663 1.00 1.00 C ATOM 1288 O ASN A 82 -2.456 -19.519 1.578 1.00 1.00 O ATOM 1289 CB ASN A 82 0.344 -17.566 0.849 1.00 1.00 C ATOM 1290 CG ASN A 82 1.217 -17.534 -0.396 1.00 1.00 C ATOM 1291 OD1 ASN A 82 1.664 -18.560 -0.887 1.00 1.00 O ATOM 1292 ND2 ASN A 82 1.493 -16.386 -0.956 1.00 1.00 N ATOM 0 H ASN A 82 -1.394 -15.721 0.571 1.00 1.00 H new ATOM 0 HA ASN A 82 -1.235 -18.549 -0.272 1.00 1.00 H new ATOM 0 HB2 ASN A 82 0.456 -16.630 1.396 1.00 1.00 H new ATOM 0 HB3 ASN A 82 0.682 -18.364 1.510 1.00 1.00 H new ATOM 0 HD21 ASN A 82 2.075 -16.354 -1.793 1.00 1.00 H new ATOM 0 HD22 ASN A 82 1.126 -15.522 -0.556 1.00 1.00 H new ATOM 1299 N LEU A 83 -2.121 -17.645 2.767 1.00 1.00 N ATOM 1300 CA LEU A 83 -2.771 -18.017 4.035 1.00 1.00 C ATOM 1301 C LEU A 83 -4.312 -17.879 4.005 1.00 1.00 C ATOM 1302 O LEU A 83 -5.006 -18.887 4.107 1.00 1.00 O ATOM 1303 CB LEU A 83 -2.106 -17.230 5.189 1.00 1.00 C ATOM 1304 CG LEU A 83 -0.557 -17.316 5.258 1.00 1.00 C ATOM 1305 CD1 LEU A 83 -0.055 -16.799 6.606 1.00 1.00 C ATOM 1306 CD2 LEU A 83 0.006 -18.728 5.059 1.00 1.00 C ATOM 0 H LEU A 83 -1.755 -16.694 2.804 1.00 1.00 H new ATOM 0 HA LEU A 83 -2.615 -19.083 4.203 1.00 1.00 H new ATOM 0 HB2 LEU A 83 -2.390 -16.181 5.100 1.00 1.00 H new ATOM 0 HB3 LEU A 83 -2.514 -17.591 6.133 1.00 1.00 H new ATOM 0 HG LEU A 83 -0.204 -16.700 4.431 1.00 1.00 H new ATOM 0 HD11 LEU A 83 1.032 -16.866 6.639 1.00 1.00 H new ATOM 0 HD12 LEU A 83 -0.359 -15.760 6.733 1.00 1.00 H new ATOM 0 HD13 LEU A 83 -0.480 -17.402 7.408 1.00 1.00 H new ATOM 0 HD21 LEU A 83 1.094 -18.698 5.122 1.00 1.00 H new ATOM 0 HD22 LEU A 83 -0.384 -19.388 5.834 1.00 1.00 H new ATOM 0 HD23 LEU A 83 -0.290 -19.103 4.080 1.00 1.00 H new ATOM 1318 N ASP A 84 -4.858 -16.671 3.838 1.00 1.00 N ATOM 1319 CA ASP A 84 -6.294 -16.349 3.624 1.00 1.00 C ATOM 1320 C ASP A 84 -6.867 -16.782 2.227 1.00 1.00 C ATOM 1321 O ASP A 84 -7.989 -16.413 1.861 1.00 1.00 O ATOM 1322 CB ASP A 84 -6.506 -14.837 3.852 1.00 1.00 C ATOM 1323 CG ASP A 84 -5.968 -14.263 5.173 1.00 1.00 C ATOM 1324 OD1 ASP A 84 -4.760 -13.948 5.265 1.00 1.00 O ATOM 1325 OD2 ASP A 84 -6.753 -13.951 6.099 1.00 1.00 O ATOM 0 H ASP A 84 -4.282 -15.830 3.847 1.00 1.00 H new ATOM 0 HA ASP A 84 -6.855 -16.939 4.348 1.00 1.00 H new ATOM 0 HB2 ASP A 84 -6.036 -14.298 3.029 1.00 1.00 H new ATOM 0 HB3 ASP A 84 -7.575 -14.630 3.800 1.00 1.00 H new ATOM 1330 N ALA A 85 -6.078 -17.510 1.422 1.00 1.00 N ATOM 1331 CA ALA A 85 -6.249 -17.921 0.018 1.00 1.00 C ATOM 1332 C ALA A 85 -7.558 -18.645 -0.351 1.00 1.00 C ATOM 1333 O ALA A 85 -7.838 -19.753 0.160 1.00 1.00 O ATOM 1334 CB ALA A 85 -5.003 -18.734 -0.368 1.00 1.00 C ATOM 1335 OXT ALA A 85 -8.278 -18.121 -1.233 1.00 1.00 O ATOM 0 H ALA A 85 -5.195 -17.869 1.785 1.00 1.00 H new ATOM 0 HA ALA A 85 -6.347 -17.008 -0.569 1.00 1.00 H new ATOM 0 HB1 ALA A 85 -5.088 -19.060 -1.405 1.00 1.00 H new ATOM 0 HB2 ALA A 85 -4.114 -18.113 -0.254 1.00 1.00 H new ATOM 0 HB3 ALA A 85 -4.922 -19.606 0.281 1.00 1.00 H new TER 1341 ALA A 85 ATOM 1342 N GLY B 126 -20.419 33.313 4.886 1.00 1.00 N ATOM 1343 CA GLY B 126 -21.125 33.970 6.000 1.00 1.00 C ATOM 1344 C GLY B 126 -20.207 33.971 7.195 1.00 1.00 C ATOM 1345 O GLY B 126 -19.364 34.855 7.277 1.00 1.00 O ATOM 0 HA2 GLY B 126 -21.400 34.989 5.729 1.00 1.00 H new ATOM 0 HA3 GLY B 126 -22.050 33.441 6.230 1.00 1.00 H new ATOM 1351 N ALA B 127 -20.404 33.018 8.101 1.00 1.00 N ATOM 1352 CA ALA B 127 -19.546 32.696 9.246 1.00 1.00 C ATOM 1353 C ALA B 127 -19.452 31.150 9.302 1.00 1.00 C ATOM 1354 O ALA B 127 -20.426 30.478 9.643 1.00 1.00 O ATOM 1355 CB ALA B 127 -20.123 33.340 10.520 1.00 1.00 C ATOM 0 H ALA B 127 -21.220 32.408 8.055 1.00 1.00 H new ATOM 0 HA ALA B 127 -18.538 33.099 9.153 1.00 1.00 H new ATOM 0 HB1 ALA B 127 -19.485 33.100 11.370 1.00 1.00 H new ATOM 0 HB2 ALA B 127 -20.167 34.422 10.393 1.00 1.00 H new ATOM 0 HB3 ALA B 127 -21.127 32.955 10.700 1.00 1.00 H new ATOM 1361 N GLU B 128 -18.292 30.595 8.938 1.00 1.00 N ATOM 1362 CA GLU B 128 -18.049 29.148 8.755 1.00 1.00 C ATOM 1363 C GLU B 128 -16.703 28.654 9.352 1.00 1.00 C ATOM 1364 O GLU B 128 -15.800 29.441 9.634 1.00 1.00 O ATOM 1365 CB GLU B 128 -18.145 28.799 7.244 1.00 1.00 C ATOM 1366 CG GLU B 128 -19.508 29.052 6.549 1.00 1.00 C ATOM 1367 CD GLU B 128 -19.802 30.518 6.158 1.00 1.00 C ATOM 1368 OE1 GLU B 128 -18.896 31.275 5.737 1.00 1.00 O ATOM 1369 OE2 GLU B 128 -20.971 30.977 6.203 1.00 1.00 O ATOM 0 H GLU B 128 -17.461 31.157 8.754 1.00 1.00 H new ATOM 0 HA GLU B 128 -18.822 28.622 9.315 1.00 1.00 H new ATOM 0 HB2 GLU B 128 -17.383 29.372 6.715 1.00 1.00 H new ATOM 0 HB3 GLU B 128 -17.893 27.745 7.123 1.00 1.00 H new ATOM 0 HG2 GLU B 128 -19.555 28.439 5.649 1.00 1.00 H new ATOM 0 HG3 GLU B 128 -20.302 28.706 7.211 1.00 1.00 H new ATOM 1376 N ASP B 129 -16.567 27.330 9.494 1.00 1.00 N ATOM 1377 CA ASP B 129 -15.376 26.567 9.921 1.00 1.00 C ATOM 1378 C ASP B 129 -15.198 25.272 9.086 1.00 1.00 C ATOM 1379 O ASP B 129 -16.173 24.600 8.733 1.00 1.00 O ATOM 1380 CB ASP B 129 -15.402 26.277 11.440 1.00 1.00 C ATOM 1381 CG ASP B 129 -14.132 25.559 11.944 1.00 1.00 C ATOM 1382 OD1 ASP B 129 -13.055 25.724 11.325 1.00 1.00 O ATOM 1383 OD2 ASP B 129 -14.243 24.780 12.916 1.00 1.00 O ATOM 0 H ASP B 129 -17.351 26.707 9.298 1.00 1.00 H new ATOM 0 HA ASP B 129 -14.503 27.191 9.730 1.00 1.00 H new ATOM 0 HB2 ASP B 129 -15.519 27.216 11.981 1.00 1.00 H new ATOM 0 HB3 ASP B 129 -16.274 25.665 11.672 1.00 1.00 H new ATOM 1388 N ALA B 130 -13.952 24.921 8.751 1.00 1.00 N ATOM 1389 CA ALA B 130 -13.596 23.822 7.847 1.00 1.00 C ATOM 1390 C ALA B 130 -13.232 22.558 8.665 1.00 1.00 C ATOM 1391 O ALA B 130 -12.074 22.290 9.004 1.00 1.00 O ATOM 1392 CB ALA B 130 -12.474 24.303 6.909 1.00 1.00 C ATOM 0 H ALA B 130 -13.135 25.411 9.115 1.00 1.00 H new ATOM 0 HA ALA B 130 -14.440 23.534 7.220 1.00 1.00 H new ATOM 0 HB1 ALA B 130 -12.197 23.497 6.230 1.00 1.00 H new ATOM 0 HB2 ALA B 130 -12.824 25.159 6.333 1.00 1.00 H new ATOM 0 HB3 ALA B 130 -11.605 24.594 7.500 1.00 1.00 H new ATOM 1398 N GLN B 131 -14.267 21.760 8.959 1.00 1.00 N ATOM 1399 CA GLN B 131 -14.241 20.580 9.839 1.00 1.00 C ATOM 1400 C GLN B 131 -14.332 19.282 9.009 1.00 1.00 C ATOM 1401 O GLN B 131 -15.416 18.809 8.665 1.00 1.00 O ATOM 1402 CB GLN B 131 -15.410 20.689 10.851 1.00 1.00 C ATOM 1403 CG GLN B 131 -15.227 21.771 11.936 1.00 1.00 C ATOM 1404 CD GLN B 131 -14.173 21.403 12.981 1.00 1.00 C ATOM 1405 OE1 GLN B 131 -14.160 20.317 13.539 1.00 1.00 O ATOM 1406 NE2 GLN B 131 -13.241 22.259 13.311 1.00 1.00 N ATOM 0 H GLN B 131 -15.195 21.927 8.570 1.00 1.00 H new ATOM 0 HA GLN B 131 -13.299 20.545 10.386 1.00 1.00 H new ATOM 0 HB2 GLN B 131 -16.329 20.896 10.302 1.00 1.00 H new ATOM 0 HB3 GLN B 131 -15.541 19.723 11.339 1.00 1.00 H new ATOM 0 HG2 GLN B 131 -14.945 22.710 11.460 1.00 1.00 H new ATOM 0 HG3 GLN B 131 -16.181 21.941 12.435 1.00 1.00 H new ATOM 0 HE21 GLN B 131 -13.214 23.178 12.870 1.00 1.00 H new ATOM 0 HE22 GLN B 131 -12.541 22.007 14.009 1.00 1.00 H new ATOM 1415 N ASP B 132 -13.179 18.659 8.750 1.00 1.00 N ATOM 1416 CA ASP B 132 -12.980 17.445 7.933 1.00 1.00 C ATOM 1417 C ASP B 132 -12.254 16.336 8.728 1.00 1.00 C ATOM 1418 O ASP B 132 -11.181 16.576 9.292 1.00 1.00 O ATOM 1419 CB ASP B 132 -12.130 17.787 6.696 1.00 1.00 C ATOM 1420 CG ASP B 132 -12.747 18.714 5.646 1.00 1.00 C ATOM 1421 OD1 ASP B 132 -13.987 18.746 5.481 1.00 1.00 O ATOM 1422 OD2 ASP B 132 -11.941 19.307 4.886 1.00 1.00 O ATOM 0 H ASP B 132 -12.298 19.007 9.128 1.00 1.00 H new ATOM 0 HA ASP B 132 -13.965 17.082 7.640 1.00 1.00 H new ATOM 0 HB2 ASP B 132 -11.202 18.242 7.042 1.00 1.00 H new ATOM 0 HB3 ASP B 132 -11.863 16.852 6.203 1.00 1.00 H new ATOM 1427 N ASP B 133 -12.804 15.119 8.781 1.00 1.00 N ATOM 1428 CA ASP B 133 -12.188 13.959 9.453 1.00 1.00 C ATOM 1429 C ASP B 133 -11.260 13.102 8.544 1.00 1.00 C ATOM 1430 O ASP B 133 -11.451 12.988 7.327 1.00 1.00 O ATOM 1431 CB ASP B 133 -13.302 13.118 10.118 1.00 1.00 C ATOM 1432 CG ASP B 133 -12.750 12.063 11.085 1.00 1.00 C ATOM 1433 OD1 ASP B 133 -11.803 12.378 11.844 1.00 1.00 O ATOM 1434 OD2 ASP B 133 -13.217 10.899 11.060 1.00 1.00 O ATOM 0 H ASP B 133 -13.704 14.903 8.353 1.00 1.00 H new ATOM 0 HA ASP B 133 -11.511 14.345 10.215 1.00 1.00 H new ATOM 0 HB2 ASP B 133 -13.979 13.781 10.657 1.00 1.00 H new ATOM 0 HB3 ASP B 133 -13.889 12.624 9.344 1.00 1.00 H new ATOM 1439 N LEU B 134 -10.263 12.456 9.164 1.00 1.00 N ATOM 1440 CA LEU B 134 -9.342 11.461 8.581 1.00 1.00 C ATOM 1441 C LEU B 134 -10.095 10.198 8.100 1.00 1.00 C ATOM 1442 O LEU B 134 -10.429 9.331 8.912 1.00 1.00 O ATOM 1443 CB LEU B 134 -8.209 11.098 9.583 1.00 1.00 C ATOM 1444 CG LEU B 134 -8.647 10.839 11.053 1.00 1.00 C ATOM 1445 CD1 LEU B 134 -7.996 9.595 11.664 1.00 1.00 C ATOM 1446 CD2 LEU B 134 -8.332 12.045 11.947 1.00 1.00 C ATOM 0 H LEU B 134 -10.062 12.623 10.150 1.00 1.00 H new ATOM 0 HA LEU B 134 -8.881 11.914 7.703 1.00 1.00 H new ATOM 0 HB2 LEU B 134 -7.700 10.207 9.216 1.00 1.00 H new ATOM 0 HB3 LEU B 134 -7.478 11.907 9.581 1.00 1.00 H new ATOM 0 HG LEU B 134 -9.723 10.673 11.009 1.00 1.00 H new ATOM 0 HD11 LEU B 134 -8.342 9.470 12.690 1.00 1.00 H new ATOM 0 HD12 LEU B 134 -8.269 8.717 11.079 1.00 1.00 H new ATOM 0 HD13 LEU B 134 -6.912 9.712 11.659 1.00 1.00 H new ATOM 0 HD21 LEU B 134 -8.650 11.834 12.968 1.00 1.00 H new ATOM 0 HD22 LEU B 134 -7.259 12.238 11.933 1.00 1.00 H new ATOM 0 HD23 LEU B 134 -8.863 12.922 11.576 1.00 1.00 H new ATOM 1458 N VAL B 135 -10.353 10.065 6.789 1.00 1.00 N ATOM 1459 CA VAL B 135 -10.930 8.827 6.200 1.00 1.00 C ATOM 1460 C VAL B 135 -10.120 7.547 6.539 1.00 1.00 C ATOM 1461 O VAL B 135 -10.770 6.572 6.938 1.00 1.00 O ATOM 1462 CB VAL B 135 -11.329 8.941 4.703 1.00 1.00 C ATOM 1463 CG1 VAL B 135 -12.355 10.069 4.492 1.00 1.00 C ATOM 1464 CG2 VAL B 135 -10.170 9.157 3.724 1.00 1.00 C ATOM 0 H VAL B 135 -10.173 10.800 6.106 1.00 1.00 H new ATOM 0 HA VAL B 135 -11.885 8.708 6.711 1.00 1.00 H new ATOM 0 HB VAL B 135 -11.753 7.963 4.474 1.00 1.00 H new ATOM 0 HG11 VAL B 135 -12.618 10.129 3.436 1.00 1.00 H new ATOM 0 HG12 VAL B 135 -13.250 9.861 5.078 1.00 1.00 H new ATOM 0 HG13 VAL B 135 -11.924 11.017 4.813 1.00 1.00 H new ATOM 0 HG21 VAL B 135 -10.559 9.223 2.708 1.00 1.00 H new ATOM 0 HG22 VAL B 135 -9.650 10.082 3.974 1.00 1.00 H new ATOM 0 HG23 VAL B 135 -9.475 8.320 3.793 1.00 1.00 H new ATOM 1474 N PRO B 136 -8.755 7.515 6.515 1.00 1.00 N ATOM 1475 CA PRO B 136 -7.972 6.370 7.001 1.00 1.00 C ATOM 1476 C PRO B 136 -7.832 6.391 8.544 1.00 1.00 C ATOM 1477 O PRO B 136 -7.265 7.320 9.125 1.00 1.00 O ATOM 1478 CB PRO B 136 -6.612 6.481 6.297 1.00 1.00 C ATOM 1479 CG PRO B 136 -6.400 7.992 6.189 1.00 1.00 C ATOM 1480 CD PRO B 136 -7.818 8.547 6.047 1.00 1.00 C ATOM 0 HA PRO B 136 -8.458 5.421 6.774 1.00 1.00 H new ATOM 0 HB2 PRO B 136 -5.820 6.003 6.873 1.00 1.00 H new ATOM 0 HB3 PRO B 136 -6.625 6.005 5.317 1.00 1.00 H new ATOM 0 HG2 PRO B 136 -5.900 8.391 7.072 1.00 1.00 H new ATOM 0 HG3 PRO B 136 -5.781 8.249 5.329 1.00 1.00 H new ATOM 0 HD2 PRO B 136 -7.931 9.459 6.633 1.00 1.00 H new ATOM 0 HD3 PRO B 136 -8.024 8.807 5.009 1.00 1.00 H new ATOM 1488 N SER B 137 -8.283 5.329 9.218 1.00 1.00 N ATOM 1489 CA SER B 137 -8.173 5.119 10.686 1.00 1.00 C ATOM 1490 C SER B 137 -6.882 4.355 11.072 1.00 1.00 C ATOM 1491 O SER B 137 -6.086 3.997 10.199 1.00 1.00 O ATOM 1492 CB SER B 137 -9.416 4.370 11.180 1.00 1.00 C ATOM 1493 OG SER B 137 -9.606 4.541 12.574 1.00 1.00 O ATOM 0 H SER B 137 -8.755 4.556 8.749 1.00 1.00 H new ATOM 0 HA SER B 137 -8.113 6.095 11.169 1.00 1.00 H new ATOM 0 HB2 SER B 137 -10.295 4.730 10.645 1.00 1.00 H new ATOM 0 HB3 SER B 137 -9.317 3.309 10.953 1.00 1.00 H new ATOM 0 HG SER B 137 -10.407 4.053 12.857 1.00 1.00 H new ATOM 1499 N ILE B 138 -6.598 4.134 12.369 1.00 1.00 N ATOM 1500 CA ILE B 138 -5.348 3.485 12.861 1.00 1.00 C ATOM 1501 C ILE B 138 -5.452 1.946 12.675 1.00 1.00 C ATOM 1502 O ILE B 138 -5.680 1.160 13.594 1.00 1.00 O ATOM 1503 CB ILE B 138 -4.991 3.927 14.311 1.00 1.00 C ATOM 1504 CG1 ILE B 138 -4.983 5.471 14.512 1.00 1.00 C ATOM 1505 CG2 ILE B 138 -3.629 3.334 14.739 1.00 1.00 C ATOM 1506 CD1 ILE B 138 -3.964 6.265 13.673 1.00 1.00 C ATOM 0 H ILE B 138 -7.232 4.401 13.122 1.00 1.00 H new ATOM 0 HA ILE B 138 -4.505 3.824 12.260 1.00 1.00 H new ATOM 0 HB ILE B 138 -5.785 3.535 14.946 1.00 1.00 H new ATOM 0 HG12 ILE B 138 -5.980 5.850 14.287 1.00 1.00 H new ATOM 0 HG13 ILE B 138 -4.793 5.678 15.565 1.00 1.00 H new ATOM 0 HG21 ILE B 138 -3.396 3.654 15.755 1.00 1.00 H new ATOM 0 HG22 ILE B 138 -3.679 2.246 14.703 1.00 1.00 H new ATOM 0 HG23 ILE B 138 -2.851 3.684 14.061 1.00 1.00 H new ATOM 0 HD11 ILE B 138 -4.054 7.327 13.900 1.00 1.00 H new ATOM 0 HD12 ILE B 138 -2.955 5.928 13.911 1.00 1.00 H new ATOM 0 HD13 ILE B 138 -4.160 6.103 12.613 1.00 1.00 H new ATOM 1518 N GLN B 139 -5.279 1.558 11.408 1.00 1.00 N ATOM 1519 CA GLN B 139 -5.447 0.252 10.754 1.00 1.00 C ATOM 1520 C GLN B 139 -4.159 -0.211 10.040 1.00 1.00 C ATOM 1521 O GLN B 139 -3.555 0.540 9.266 1.00 1.00 O ATOM 1522 CB GLN B 139 -6.605 0.359 9.734 1.00 1.00 C ATOM 1523 CG GLN B 139 -6.980 -0.961 9.013 1.00 1.00 C ATOM 1524 CD GLN B 139 -7.796 -1.944 9.856 1.00 1.00 C ATOM 1525 OE1 GLN B 139 -8.493 -1.582 10.799 1.00 1.00 O ATOM 1526 NE2 GLN B 139 -7.835 -3.210 9.520 1.00 1.00 N ATOM 0 H GLN B 139 -4.976 2.248 10.721 1.00 1.00 H new ATOM 0 HA GLN B 139 -5.673 -0.491 11.519 1.00 1.00 H new ATOM 0 HB2 GLN B 139 -7.488 0.734 10.251 1.00 1.00 H new ATOM 0 HB3 GLN B 139 -6.337 1.101 8.982 1.00 1.00 H new ATOM 0 HG2 GLN B 139 -7.546 -0.719 8.113 1.00 1.00 H new ATOM 0 HG3 GLN B 139 -6.064 -1.455 8.690 1.00 1.00 H new ATOM 0 HE21 GLN B 139 -7.270 -3.549 8.741 1.00 1.00 H new ATOM 0 HE22 GLN B 139 -8.431 -3.857 10.037 1.00 1.00 H new ATOM 1535 N ASP B 140 -3.757 -1.461 10.250 1.00 1.00 N ATOM 1536 CA ASP B 140 -2.663 -2.133 9.537 1.00 1.00 C ATOM 1537 C ASP B 140 -3.313 -2.979 8.409 1.00 1.00 C ATOM 1538 O ASP B 140 -3.806 -4.080 8.650 1.00 1.00 O ATOM 1539 CB ASP B 140 -1.879 -3.006 10.568 1.00 1.00 C ATOM 1540 CG ASP B 140 -0.472 -2.524 10.941 1.00 1.00 C ATOM 1541 OD1 ASP B 140 -0.081 -1.385 10.599 1.00 1.00 O ATOM 1542 OD2 ASP B 140 0.243 -3.284 11.639 1.00 1.00 O ATOM 0 H ASP B 140 -4.198 -2.061 10.947 1.00 1.00 H new ATOM 0 HA ASP B 140 -1.953 -1.439 9.087 1.00 1.00 H new ATOM 0 HB2 ASP B 140 -2.471 -3.070 11.481 1.00 1.00 H new ATOM 0 HB3 ASP B 140 -1.799 -4.017 10.168 1.00 1.00 H new ATOM 1547 N ASP B 141 -3.341 -2.438 7.176 1.00 1.00 N ATOM 1548 CA ASP B 141 -3.849 -3.020 5.905 1.00 1.00 C ATOM 1549 C ASP B 141 -3.371 -2.280 4.607 1.00 1.00 C ATOM 1550 O ASP B 141 -2.377 -1.547 4.606 1.00 1.00 O ATOM 1551 CB ASP B 141 -5.384 -3.265 6.002 1.00 1.00 C ATOM 1552 CG ASP B 141 -5.734 -4.634 6.611 1.00 1.00 C ATOM 1553 OD1 ASP B 141 -5.081 -5.647 6.259 1.00 1.00 O ATOM 1554 OD2 ASP B 141 -6.724 -4.713 7.373 1.00 1.00 O ATOM 0 H ASP B 141 -2.977 -1.497 7.023 1.00 1.00 H new ATOM 0 HA ASP B 141 -3.380 -3.996 5.781 1.00 1.00 H new ATOM 0 HB2 ASP B 141 -5.835 -2.478 6.606 1.00 1.00 H new ATOM 0 HB3 ASP B 141 -5.822 -3.193 5.006 1.00 1.00 H new ATOM 1559 N GLY B 142 -4.046 -2.533 3.474 1.00 1.00 N ATOM 1560 CA GLY B 142 -3.772 -2.134 2.082 1.00 1.00 C ATOM 1561 C GLY B 142 -3.529 -0.656 1.727 1.00 1.00 C ATOM 1562 O GLY B 142 -3.097 -0.405 0.600 1.00 1.00 O ATOM 0 H GLY B 142 -4.900 -3.089 3.517 1.00 1.00 H new ATOM 0 HA2 GLY B 142 -2.895 -2.692 1.754 1.00 1.00 H new ATOM 0 HA3 GLY B 142 -4.612 -2.476 1.478 1.00 1.00 H new ATOM 1566 N SER B 143 -3.765 0.316 2.617 1.00 1.00 N ATOM 1567 CA SER B 143 -3.517 1.766 2.392 1.00 1.00 C ATOM 1568 C SER B 143 -2.063 2.127 2.010 1.00 1.00 C ATOM 1569 O SER B 143 -1.169 2.158 2.862 1.00 1.00 O ATOM 1570 CB SER B 143 -3.978 2.632 3.577 1.00 1.00 C ATOM 1571 OG SER B 143 -4.215 3.952 3.114 1.00 1.00 O ATOM 0 H SER B 143 -4.145 0.121 3.543 1.00 1.00 H new ATOM 0 HA SER B 143 -4.130 1.996 1.520 1.00 1.00 H new ATOM 0 HB2 SER B 143 -4.885 2.218 4.017 1.00 1.00 H new ATOM 0 HB3 SER B 143 -3.218 2.637 4.359 1.00 1.00 H new ATOM 0 HG SER B 143 -4.511 4.513 3.861 1.00 1.00 H new ATOM 1577 N GLU B 144 -1.806 2.389 0.721 1.00 1.00 N ATOM 1578 CA GLU B 144 -0.509 2.852 0.178 1.00 1.00 C ATOM 1579 C GLU B 144 -0.315 4.383 0.348 1.00 1.00 C ATOM 1580 O GLU B 144 -0.406 5.167 -0.601 1.00 1.00 O ATOM 1581 CB GLU B 144 -0.342 2.365 -1.282 1.00 1.00 C ATOM 1582 CG GLU B 144 1.126 2.474 -1.739 1.00 1.00 C ATOM 1583 CD GLU B 144 1.437 1.816 -3.090 1.00 1.00 C ATOM 1584 OE1 GLU B 144 0.546 1.283 -3.786 1.00 1.00 O ATOM 1585 OE2 GLU B 144 2.614 1.855 -3.525 1.00 1.00 O ATOM 0 H GLU B 144 -2.517 2.282 -0.003 1.00 1.00 H new ATOM 0 HA GLU B 144 0.295 2.404 0.761 1.00 1.00 H new ATOM 0 HB2 GLU B 144 -0.676 1.331 -1.364 1.00 1.00 H new ATOM 0 HB3 GLU B 144 -0.976 2.958 -1.941 1.00 1.00 H new ATOM 0 HG2 GLU B 144 1.396 3.529 -1.795 1.00 1.00 H new ATOM 0 HG3 GLU B 144 1.762 2.023 -0.977 1.00 1.00 H new ATOM 1592 N SER B 145 -0.065 4.822 1.589 1.00 1.00 N ATOM 1593 CA SER B 145 0.117 6.236 1.984 1.00 1.00 C ATOM 1594 C SER B 145 1.214 6.450 3.050 1.00 1.00 C ATOM 1595 O SER B 145 1.466 5.597 3.907 1.00 1.00 O ATOM 1596 CB SER B 145 -1.232 6.803 2.445 1.00 1.00 C ATOM 1597 OG SER B 145 -1.143 8.173 2.791 1.00 1.00 O ATOM 0 H SER B 145 0.020 4.183 2.379 1.00 1.00 H new ATOM 0 HA SER B 145 0.471 6.778 1.107 1.00 1.00 H new ATOM 0 HB2 SER B 145 -1.968 6.677 1.651 1.00 1.00 H new ATOM 0 HB3 SER B 145 -1.589 6.235 3.304 1.00 1.00 H new ATOM 0 HG SER B 145 -2.023 8.496 3.077 1.00 1.00 H new ATOM 1603 N GLY B 146 1.859 7.621 2.994 1.00 1.00 N ATOM 1604 CA GLY B 146 2.856 8.175 3.934 1.00 1.00 C ATOM 1605 C GLY B 146 3.767 9.296 3.392 1.00 1.00 C ATOM 1606 O GLY B 146 4.513 9.890 4.169 1.00 1.00 O ATOM 0 H GLY B 146 1.685 8.267 2.224 1.00 1.00 H new ATOM 0 HA2 GLY B 146 2.326 8.558 4.806 1.00 1.00 H new ATOM 0 HA3 GLY B 146 3.490 7.358 4.279 1.00 1.00 H new ATOM 1610 N ALA B 147 3.737 9.565 2.077 1.00 1.00 N ATOM 1611 CA ALA B 147 4.379 10.678 1.344 1.00 1.00 C ATOM 1612 C ALA B 147 5.924 10.828 1.531 1.00 1.00 C ATOM 1613 O ALA B 147 6.498 11.901 1.294 1.00 1.00 O ATOM 1614 CB ALA B 147 3.600 11.965 1.691 1.00 1.00 C ATOM 0 H ALA B 147 3.219 8.959 1.441 1.00 1.00 H new ATOM 0 HA ALA B 147 4.316 10.453 0.279 1.00 1.00 H new ATOM 0 HB1 ALA B 147 4.045 12.812 1.168 1.00 1.00 H new ATOM 0 HB2 ALA B 147 2.560 11.855 1.384 1.00 1.00 H new ATOM 0 HB3 ALA B 147 3.645 12.139 2.766 1.00 1.00 H new ATOM 1620 N CYS B 148 6.612 9.736 1.882 1.00 1.00 N ATOM 1621 CA CYS B 148 8.030 9.660 2.284 1.00 1.00 C ATOM 1622 C CYS B 148 9.117 9.842 1.184 1.00 1.00 C ATOM 1623 O CYS B 148 9.049 9.306 0.079 1.00 1.00 O ATOM 1624 CB CYS B 148 8.215 8.298 2.984 1.00 1.00 C ATOM 1625 SG CYS B 148 8.127 8.382 4.785 1.00 1.00 S ATOM 0 H CYS B 148 6.168 8.818 1.895 1.00 1.00 H new ATOM 0 HA CYS B 148 8.203 10.527 2.921 1.00 1.00 H new ATOM 0 HB2 CYS B 148 7.450 7.609 2.625 1.00 1.00 H new ATOM 0 HB3 CYS B 148 9.180 7.881 2.696 1.00 1.00 H new ATOM 1630 N LYS B 149 10.198 10.531 1.585 1.00 1.00 N ATOM 1631 CA LYS B 149 11.388 11.058 0.862 1.00 1.00 C ATOM 1632 C LYS B 149 12.297 11.854 1.832 1.00 1.00 C ATOM 1633 O LYS B 149 11.815 12.282 2.882 1.00 1.00 O ATOM 1634 CB LYS B 149 10.971 11.910 -0.369 1.00 1.00 C ATOM 1635 CG LYS B 149 10.043 13.116 -0.097 1.00 1.00 C ATOM 1636 CD LYS B 149 9.588 13.851 -1.376 1.00 1.00 C ATOM 1637 CE LYS B 149 10.730 14.627 -2.042 1.00 1.00 C ATOM 1638 NZ LYS B 149 10.289 15.329 -3.270 1.00 1.00 N ATOM 0 H LYS B 149 10.276 10.771 2.573 1.00 1.00 H new ATOM 0 HA LYS B 149 11.962 10.213 0.481 1.00 1.00 H new ATOM 0 HB2 LYS B 149 11.877 12.279 -0.850 1.00 1.00 H new ATOM 0 HB3 LYS B 149 10.475 11.254 -1.085 1.00 1.00 H new ATOM 0 HG2 LYS B 149 9.163 12.771 0.445 1.00 1.00 H new ATOM 0 HG3 LYS B 149 10.561 13.822 0.552 1.00 1.00 H new ATOM 0 HD2 LYS B 149 9.183 13.127 -2.083 1.00 1.00 H new ATOM 0 HD3 LYS B 149 8.780 14.540 -1.128 1.00 1.00 H new ATOM 0 HE2 LYS B 149 11.134 15.353 -1.336 1.00 1.00 H new ATOM 0 HE3 LYS B 149 11.538 13.939 -2.289 1.00 1.00 H new ATOM 0 HZ1 LYS B 149 10.812 14.958 -4.089 1.00 1.00 H new ATOM 0 HZ2 LYS B 149 9.270 15.175 -3.411 1.00 1.00 H new ATOM 0 HZ3 LYS B 149 10.475 16.348 -3.173 1.00 1.00 H new ATOM 1652 N ILE B 150 13.588 12.050 1.508 1.00 1.00 N ATOM 1653 CA ILE B 150 14.587 12.859 2.271 1.00 1.00 C ATOM 1654 C ILE B 150 14.040 14.207 2.779 1.00 1.00 C ATOM 1655 O ILE B 150 13.667 15.100 1.986 1.00 1.00 O ATOM 1656 CB ILE B 150 15.952 12.933 1.514 1.00 1.00 C ATOM 1657 CG1 ILE B 150 17.017 13.831 2.201 1.00 1.00 C ATOM 1658 CG2 ILE B 150 15.818 13.399 0.051 1.00 1.00 C ATOM 1659 CD1 ILE B 150 17.496 13.320 3.563 1.00 1.00 C ATOM 1660 OXT ILE B 150 13.900 14.321 4.018 1.00 1.00 O ATOM 0 H ILE B 150 13.994 11.634 0.670 1.00 1.00 H new ATOM 0 HA ILE B 150 14.796 12.327 3.199 1.00 1.00 H new ATOM 0 HB ILE B 150 16.293 11.898 1.542 1.00 1.00 H new ATOM 0 HG12 ILE B 150 17.878 13.923 1.539 1.00 1.00 H new ATOM 0 HG13 ILE B 150 16.603 14.831 2.328 1.00 1.00 H new ATOM 0 HG21 ILE B 150 16.804 13.427 -0.414 1.00 1.00 H new ATOM 0 HG22 ILE B 150 15.179 12.705 -0.495 1.00 1.00 H new ATOM 0 HG23 ILE B 150 15.376 14.395 0.025 1.00 1.00 H new ATOM 0 HD11 ILE B 150 18.238 14.008 3.969 1.00 1.00 H new ATOM 0 HD12 ILE B 150 16.649 13.255 4.246 1.00 1.00 H new ATOM 0 HD13 ILE B 150 17.943 12.333 3.445 1.00 1.00 H new TER 1672 ILE B 150