USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 949 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 18 ASN : amide:sc=-0.000256 X(o=4.3e-05,f=0) USER MOD Set 1.2: A 124 THR OG1 : rot 180:sc=0.000299 USER MOD Single : A 6 SER OG : rot 30:sc= 0.0216 USER MOD Single : A 8 MET CE :methyl -159:sc= -0.264 (180deg=-0.848) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 33:sc= -0.253 USER MOD Single : A 21 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00108) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0598) USER MOD Single : A 42 THR OG1 : rot 121:sc= 1.43 USER MOD Single : A 43 LYS NZ :NH3+ 153:sc=-0.00382 (180deg=-0.632) USER MOD Single : A 44 LYS NZ :NH3+ -114:sc= 0.259 (180deg=0) USER MOD Single : A 47 ASN :FLIP amide:sc= 0.757 F(o=-0.71,f=0.76) USER MOD Single : A 50 ASN : amide:sc= -1.14 K(o=-1.1,f=-1.9) USER MOD Single : A 54 ASN : amide:sc= -0.458 X(o=-0.46,f=-0.0061) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -166:sc= 0.507 USER MOD Single : A 71 SER OG : rot 68:sc= 0.686 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -62:sc= 1.25 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot -64:sc= 1.05 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 129:sc= 0.587 USER MOD Single : A 105 SER OG : rot 43:sc= 0.358 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 168:sc= 0.465 (180deg=0.376) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN :FLIP amide:sc= -10.2! C(o=-13!,f=-10!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 THR OG1 : rot 170:sc= -0.26 USER MOD Single : A 131 TYR OH : rot 180:sc= 0.237 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.218 -22.469 2.691 1.00 0.00 N ATOM 49 CA SER A 6 -7.857 -22.650 1.290 1.00 0.00 C ATOM 50 C SER A 6 -6.926 -21.536 0.821 1.00 0.00 C ATOM 51 O SER A 6 -7.038 -21.051 -0.304 1.00 0.00 O ATOM 52 CB SER A 6 -9.114 -22.681 0.418 1.00 0.00 C ATOM 53 OG SER A 6 -9.938 -23.784 0.750 1.00 0.00 O ATOM 0 HA SER A 6 -7.334 -23.601 1.195 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.673 -21.754 0.547 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.830 -22.739 -0.633 1.00 0.00 H new ATOM 0 HG SER A 6 -9.823 -24.005 1.698 1.00 0.00 H new ATOM 59 N GLY A 7 -6.007 -21.135 1.693 1.00 0.00 N ATOM 60 CA GLY A 7 -5.069 -20.081 1.351 1.00 0.00 C ATOM 61 C GLY A 7 -5.721 -18.713 1.320 1.00 0.00 C ATOM 62 O GLY A 7 -6.845 -18.565 0.843 1.00 0.00 O ATOM 0 H GLY A 7 -5.895 -21.521 2.631 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.254 -20.075 2.075 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.629 -20.293 0.377 1.00 0.00 H new ATOM 66 N MET A 8 -5.013 -17.711 1.831 1.00 0.00 N ATOM 67 CA MET A 8 -5.531 -16.347 1.860 1.00 0.00 C ATOM 68 C MET A 8 -4.400 -15.340 2.042 1.00 0.00 C ATOM 69 O MET A 8 -3.624 -15.428 2.994 1.00 0.00 O ATOM 70 CB MET A 8 -6.554 -16.191 2.986 1.00 0.00 C ATOM 71 CG MET A 8 -6.977 -14.751 3.228 1.00 0.00 C ATOM 72 SD MET A 8 -8.650 -14.620 3.887 1.00 0.00 S ATOM 73 CE MET A 8 -9.578 -14.289 2.391 1.00 0.00 C ATOM 0 H MET A 8 -4.080 -17.817 2.230 1.00 0.00 H new ATOM 0 HA MET A 8 -6.019 -16.150 0.906 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.436 -16.785 2.749 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.134 -16.597 3.906 1.00 0.00 H new ATOM 0 HG2 MET A 8 -6.279 -14.283 3.923 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.915 -14.196 2.292 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.529 -13.823 2.648 1.00 0.00 H new ATOM 0 HE2 MET A 8 -9.007 -13.618 1.750 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.763 -15.225 1.863 1.00 0.00 H new ATOM 83 N LEU A 9 -4.311 -14.385 1.123 1.00 0.00 N ATOM 84 CA LEU A 9 -3.274 -13.360 1.182 1.00 0.00 C ATOM 85 C LEU A 9 -3.848 -12.031 1.662 1.00 0.00 C ATOM 86 O LEU A 9 -4.666 -11.415 0.979 1.00 0.00 O ATOM 87 CB LEU A 9 -2.626 -13.183 -0.192 1.00 0.00 C ATOM 88 CG LEU A 9 -1.423 -12.241 -0.251 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.159 -12.962 0.192 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.254 -11.678 -1.654 1.00 0.00 C ATOM 0 H LEU A 9 -4.944 -14.299 0.328 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.516 -13.685 1.895 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.313 -14.163 -0.553 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.384 -12.816 -0.884 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.602 -11.411 0.432 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.687 -12.276 0.144 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.282 -13.315 1.216 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.025 -13.812 -0.466 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.393 -11.010 -1.677 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.097 -12.496 -2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.150 -11.125 -1.934 1.00 0.00 H new ATOM 102 N ARG A 10 -3.412 -11.594 2.839 1.00 0.00 N ATOM 103 CA ARG A 10 -3.882 -10.338 3.409 1.00 0.00 C ATOM 104 C ARG A 10 -2.891 -9.211 3.132 1.00 0.00 C ATOM 105 O ARG A 10 -1.687 -9.366 3.334 1.00 0.00 O ATOM 106 CB ARG A 10 -4.095 -10.485 4.917 1.00 0.00 C ATOM 107 CG ARG A 10 -5.496 -10.938 5.293 1.00 0.00 C ATOM 108 CD ARG A 10 -5.855 -10.519 6.710 1.00 0.00 C ATOM 109 NE ARG A 10 -6.964 -11.302 7.248 1.00 0.00 N ATOM 110 CZ ARG A 10 -6.830 -12.535 7.724 1.00 0.00 C ATOM 111 NH1 ARG A 10 -5.641 -13.122 7.729 1.00 0.00 N ATOM 112 NH2 ARG A 10 -7.887 -13.184 8.196 1.00 0.00 N ATOM 0 H ARG A 10 -2.734 -12.092 3.416 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.832 -10.087 2.938 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.373 -11.201 5.309 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.890 -9.529 5.399 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.217 -10.514 4.593 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.565 -12.022 5.204 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.983 -10.635 7.354 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -6.120 -9.462 6.719 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.892 -10.879 7.259 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.826 -12.627 7.367 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -5.541 -14.069 8.095 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.803 -12.736 8.194 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.783 -14.131 8.561 1.00 0.00 H new ATOM 126 N VAL A 11 -3.407 -8.077 2.668 1.00 0.00 N ATOM 127 CA VAL A 11 -2.568 -6.924 2.364 1.00 0.00 C ATOM 128 C VAL A 11 -2.948 -5.725 3.226 1.00 0.00 C ATOM 129 O VAL A 11 -3.851 -4.962 2.882 1.00 0.00 O ATOM 130 CB VAL A 11 -2.675 -6.529 0.879 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.784 -5.332 0.579 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.315 -7.707 -0.013 1.00 0.00 C ATOM 0 H VAL A 11 -4.402 -7.932 2.495 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.540 -7.214 2.583 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.707 -6.246 0.670 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.873 -5.067 -0.475 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -2.093 -4.486 1.193 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.748 -5.584 0.804 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.396 -7.410 -1.059 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.293 -8.023 0.196 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.998 -8.534 0.183 1.00 0.00 H new ATOM 142 N ILE A 12 -2.252 -5.566 4.347 1.00 0.00 N ATOM 143 CA ILE A 12 -2.516 -4.459 5.258 1.00 0.00 C ATOM 144 C ILE A 12 -1.923 -3.158 4.727 1.00 0.00 C ATOM 145 O ILE A 12 -0.791 -3.130 4.246 1.00 0.00 O ATOM 146 CB ILE A 12 -1.944 -4.736 6.661 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.443 -6.085 7.181 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.327 -3.618 7.619 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.476 -6.763 8.127 1.00 0.00 C ATOM 0 H ILE A 12 -1.502 -6.189 4.646 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.599 -4.360 5.330 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.857 -4.773 6.594 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.395 -5.939 7.691 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.633 -6.744 6.334 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.916 -3.828 8.606 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.927 -2.672 7.253 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.413 -3.552 7.685 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -1.895 -7.714 8.456 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.530 -6.941 7.615 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.305 -6.123 8.993 1.00 0.00 H new ATOM 161 N VAL A 13 -2.696 -2.080 4.821 1.00 0.00 N ATOM 162 CA VAL A 13 -2.247 -0.774 4.353 1.00 0.00 C ATOM 163 C VAL A 13 -2.172 0.225 5.502 1.00 0.00 C ATOM 164 O VAL A 13 -3.171 0.847 5.863 1.00 0.00 O ATOM 165 CB VAL A 13 -3.181 -0.217 3.263 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.728 1.168 2.828 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.239 -1.165 2.075 1.00 0.00 C ATOM 0 H VAL A 13 -3.636 -2.086 5.217 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.252 -0.914 3.931 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.185 -0.131 3.679 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.400 1.545 2.057 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.744 1.842 3.685 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.715 1.111 2.430 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.904 -0.755 1.315 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.240 -1.286 1.657 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.615 -2.135 2.401 1.00 0.00 H new ATOM 177 N GLU A 14 -0.980 0.374 6.073 1.00 0.00 N ATOM 178 CA GLU A 14 -0.775 1.298 7.182 1.00 0.00 C ATOM 179 C GLU A 14 -1.028 2.738 6.744 1.00 0.00 C ATOM 180 O GLU A 14 -2.058 3.326 7.073 1.00 0.00 O ATOM 181 CB GLU A 14 0.646 1.162 7.732 1.00 0.00 C ATOM 182 CG GLU A 14 0.844 -0.061 8.611 1.00 0.00 C ATOM 183 CD GLU A 14 0.559 0.219 10.074 1.00 0.00 C ATOM 184 OE1 GLU A 14 1.483 0.670 10.782 1.00 0.00 O ATOM 185 OE2 GLU A 14 -0.588 -0.012 10.510 1.00 0.00 O ATOM 0 H GLU A 14 -0.143 -0.133 5.786 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.486 1.046 7.968 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.346 1.117 6.898 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.891 2.055 8.306 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.191 -0.862 8.265 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.869 -0.417 8.506 1.00 0.00 H new ATOM 192 N SER A 15 -0.080 3.299 6.002 1.00 0.00 N ATOM 193 CA SER A 15 -0.196 4.671 5.522 1.00 0.00 C ATOM 194 C SER A 15 0.914 4.995 4.527 1.00 0.00 C ATOM 195 O SER A 15 1.806 4.182 4.289 1.00 0.00 O ATOM 196 CB SER A 15 -0.146 5.650 6.697 1.00 0.00 C ATOM 197 OG SER A 15 1.119 5.617 7.335 1.00 0.00 O ATOM 0 H SER A 15 0.778 2.825 5.720 1.00 0.00 H new ATOM 0 HA SER A 15 -1.155 4.772 5.014 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.351 6.660 6.342 1.00 0.00 H new ATOM 0 HB3 SER A 15 -0.926 5.400 7.416 1.00 0.00 H new ATOM 0 HG SER A 15 1.126 6.252 8.081 1.00 0.00 H new ATOM 203 N ALA A 16 0.852 6.191 3.950 1.00 0.00 N ATOM 204 CA ALA A 16 1.852 6.624 2.982 1.00 0.00 C ATOM 205 C ALA A 16 2.369 8.020 3.315 1.00 0.00 C ATOM 206 O ALA A 16 1.773 8.738 4.118 1.00 0.00 O ATOM 207 CB ALA A 16 1.274 6.595 1.575 1.00 0.00 C ATOM 0 H ALA A 16 0.120 6.877 4.136 1.00 0.00 H new ATOM 0 HA ALA A 16 2.692 5.932 3.031 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.032 6.921 0.863 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.960 5.580 1.331 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.415 7.263 1.521 1.00 0.00 H new ATOM 213 N SER A 17 3.480 8.399 2.692 1.00 0.00 N ATOM 214 CA SER A 17 4.079 9.708 2.926 1.00 0.00 C ATOM 215 C SER A 17 4.995 10.100 1.770 1.00 0.00 C ATOM 216 O SER A 17 5.321 9.277 0.916 1.00 0.00 O ATOM 217 CB SER A 17 4.866 9.705 4.238 1.00 0.00 C ATOM 218 OG SER A 17 4.011 9.923 5.346 1.00 0.00 O ATOM 0 H SER A 17 3.984 7.818 2.021 1.00 0.00 H new ATOM 0 HA SER A 17 3.276 10.441 2.995 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.381 8.752 4.354 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.632 10.480 4.208 1.00 0.00 H new ATOM 0 HG SER A 17 3.131 9.532 5.162 1.00 0.00 H new ATOM 224 N ASN A 18 5.407 11.363 1.753 1.00 0.00 N ATOM 225 CA ASN A 18 6.285 11.866 0.703 1.00 0.00 C ATOM 226 C ASN A 18 5.593 11.816 -0.656 1.00 0.00 C ATOM 227 O ASN A 18 6.215 11.494 -1.669 1.00 0.00 O ATOM 228 CB ASN A 18 7.580 11.053 0.659 1.00 0.00 C ATOM 229 CG ASN A 18 8.386 11.179 1.937 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.770 12.279 2.336 1.00 0.00 O ATOM 231 ND2 ASN A 18 8.647 10.050 2.585 1.00 0.00 N ATOM 0 H ASN A 18 5.147 12.057 2.454 1.00 0.00 H new ATOM 0 HA ASN A 18 6.524 12.905 0.931 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.341 10.004 0.485 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.186 11.386 -0.184 1.00 0.00 H new ATOM 0 HD21 ASN A 18 9.186 10.072 3.451 1.00 0.00 H new ATOM 0 HD22 ASN A 18 8.309 9.161 2.217 1.00 0.00 H new ATOM 238 N ILE A 19 4.304 12.137 -0.669 1.00 0.00 N ATOM 239 CA ILE A 19 3.528 12.130 -1.903 1.00 0.00 C ATOM 240 C ILE A 19 3.664 13.455 -2.645 1.00 0.00 C ATOM 241 O ILE A 19 3.654 14.533 -2.050 1.00 0.00 O ATOM 242 CB ILE A 19 2.037 11.858 -1.629 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.856 10.479 -0.992 1.00 0.00 C ATOM 244 CG2 ILE A 19 1.234 11.962 -2.917 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.421 10.002 -0.981 1.00 0.00 C ATOM 0 H ILE A 19 3.775 12.405 0.161 1.00 0.00 H new ATOM 0 HA ILE A 19 3.927 11.327 -2.522 1.00 0.00 H new ATOM 0 HB ILE A 19 1.668 12.610 -0.932 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.467 9.755 -1.532 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.228 10.509 0.032 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.182 11.767 -2.707 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.341 12.964 -3.333 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.602 11.230 -3.635 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.368 9.018 -0.515 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.192 10.705 -0.416 1.00 0.00 H new ATOM 0 HD13 ILE A 19 0.051 9.939 -2.004 1.00 0.00 H new ATOM 257 N PRO A 20 3.792 13.376 -3.978 1.00 0.00 N ATOM 258 CA PRO A 20 3.929 14.560 -4.832 1.00 0.00 C ATOM 259 C PRO A 20 2.642 15.375 -4.905 1.00 0.00 C ATOM 260 O PRO A 20 1.678 14.973 -5.557 1.00 0.00 O ATOM 261 CB PRO A 20 4.269 13.971 -6.203 1.00 0.00 C ATOM 262 CG PRO A 20 3.695 12.597 -6.178 1.00 0.00 C ATOM 263 CD PRO A 20 3.812 12.125 -4.755 1.00 0.00 C ATOM 0 HA PRO A 20 4.681 15.252 -4.452 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.837 14.566 -7.008 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.346 13.947 -6.367 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.655 12.603 -6.503 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.236 11.936 -6.854 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.987 11.468 -4.480 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.733 11.565 -4.592 1.00 0.00 H new ATOM 271 N LYS A 21 2.634 16.521 -4.234 1.00 0.00 N ATOM 272 CA LYS A 21 1.466 17.394 -4.224 1.00 0.00 C ATOM 273 C LYS A 21 1.085 17.809 -5.641 1.00 0.00 C ATOM 274 O LYS A 21 1.759 17.450 -6.607 1.00 0.00 O ATOM 275 CB LYS A 21 1.739 18.636 -3.373 1.00 0.00 C ATOM 276 CG LYS A 21 2.708 19.613 -4.016 1.00 0.00 C ATOM 277 CD LYS A 21 3.504 20.378 -2.972 1.00 0.00 C ATOM 278 CE LYS A 21 2.631 21.378 -2.229 1.00 0.00 C ATOM 279 NZ LYS A 21 2.363 22.595 -3.045 1.00 0.00 N ATOM 0 H LYS A 21 3.424 16.868 -3.689 1.00 0.00 H new ATOM 0 HA LYS A 21 0.633 16.840 -3.790 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.796 19.147 -3.179 1.00 0.00 H new ATOM 0 HB3 LYS A 21 2.138 18.324 -2.408 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.391 19.072 -4.671 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.157 20.315 -4.641 1.00 0.00 H new ATOM 0 HD2 LYS A 21 3.942 19.677 -2.261 1.00 0.00 H new ATOM 0 HD3 LYS A 21 4.330 20.902 -3.454 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.686 20.906 -1.960 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.120 21.665 -1.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.779 23.259 -2.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.264 23.051 -3.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 1.859 22.326 -3.914 1.00 0.00 H new ATOM 293 N THR A 22 0.001 18.570 -5.760 1.00 0.00 N ATOM 294 CA THR A 22 -0.469 19.035 -7.058 1.00 0.00 C ATOM 295 C THR A 22 -0.860 20.507 -7.007 1.00 0.00 C ATOM 296 O THR A 22 -1.250 21.020 -5.958 1.00 0.00 O ATOM 297 CB THR A 22 -1.675 18.211 -7.547 1.00 0.00 C ATOM 298 OG1 THR A 22 -1.988 18.556 -8.901 1.00 0.00 O ATOM 299 CG2 THR A 22 -2.889 18.454 -6.663 1.00 0.00 C ATOM 0 H THR A 22 -0.568 18.877 -4.971 1.00 0.00 H new ATOM 0 HA THR A 22 0.357 18.906 -7.757 1.00 0.00 H new ATOM 0 HB THR A 22 -1.411 17.155 -7.494 1.00 0.00 H new ATOM 0 HG1 THR A 22 -2.755 18.026 -9.205 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.729 17.862 -7.027 1.00 0.00 H new ATOM 0 HG22 THR A 22 -2.657 18.163 -5.638 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.152 19.511 -6.689 1.00 0.00 H new ATOM 356 N LYS A 26 -3.147 19.483 -2.526 1.00 0.00 N ATOM 357 CA LYS A 26 -2.817 18.071 -2.375 1.00 0.00 C ATOM 358 C LYS A 26 -3.902 17.191 -2.988 1.00 0.00 C ATOM 359 O LYS A 26 -5.088 17.327 -2.689 1.00 0.00 O ATOM 360 CB LYS A 26 -2.640 17.722 -0.895 1.00 0.00 C ATOM 361 CG LYS A 26 -1.808 18.735 -0.128 1.00 0.00 C ATOM 362 CD LYS A 26 -1.769 18.415 1.357 1.00 0.00 C ATOM 363 CE LYS A 26 -0.471 18.883 1.995 1.00 0.00 C ATOM 364 NZ LYS A 26 -0.564 20.290 2.475 1.00 0.00 N ATOM 0 HA LYS A 26 -1.881 17.884 -2.901 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.622 17.643 -0.429 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.169 16.742 -0.815 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.793 18.749 -0.525 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.221 19.733 -0.275 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -2.613 18.892 1.855 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -1.880 17.340 1.501 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.221 18.230 2.831 1.00 0.00 H new ATOM 0 HE3 LYS A 26 0.340 18.799 1.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.341 20.571 2.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -0.777 20.917 1.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.321 20.366 3.184 1.00 0.00 H new ATOM 378 N PRO A 27 -3.488 16.265 -3.867 1.00 0.00 N ATOM 379 CA PRO A 27 -4.408 15.344 -4.539 1.00 0.00 C ATOM 380 C PRO A 27 -4.998 14.313 -3.582 1.00 0.00 C ATOM 381 O PRO A 27 -4.674 14.298 -2.394 1.00 0.00 O ATOM 382 CB PRO A 27 -3.525 14.659 -5.584 1.00 0.00 C ATOM 383 CG PRO A 27 -2.144 14.751 -5.032 1.00 0.00 C ATOM 384 CD PRO A 27 -2.089 16.047 -4.271 1.00 0.00 C ATOM 0 HA PRO A 27 -5.267 15.864 -4.962 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.823 13.621 -5.735 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.599 15.156 -6.551 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.927 13.905 -4.379 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.402 14.735 -5.831 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.427 15.978 -3.407 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -1.718 16.862 -4.892 1.00 0.00 H new ATOM 392 N ASP A 28 -5.865 13.454 -4.106 1.00 0.00 N ATOM 393 CA ASP A 28 -6.499 12.419 -3.298 1.00 0.00 C ATOM 394 C ASP A 28 -5.839 11.064 -3.536 1.00 0.00 C ATOM 395 O ASP A 28 -6.145 10.357 -4.496 1.00 0.00 O ATOM 396 CB ASP A 28 -7.993 12.336 -3.618 1.00 0.00 C ATOM 397 CG ASP A 28 -8.696 13.668 -3.450 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.305 14.635 -4.136 1.00 0.00 O ATOM 399 OD2 ASP A 28 -9.637 13.744 -2.632 1.00 0.00 O ATOM 0 H ASP A 28 -6.145 13.454 -5.087 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.374 12.684 -2.248 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.123 11.986 -4.642 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.460 11.597 -2.967 1.00 0.00 H new ATOM 404 N PRO A 29 -4.912 10.692 -2.641 1.00 0.00 N ATOM 405 CA PRO A 29 -4.189 9.420 -2.732 1.00 0.00 C ATOM 406 C PRO A 29 -5.086 8.222 -2.446 1.00 0.00 C ATOM 407 O PRO A 29 -5.958 8.281 -1.578 1.00 0.00 O ATOM 408 CB PRO A 29 -3.108 9.549 -1.656 1.00 0.00 C ATOM 409 CG PRO A 29 -3.665 10.520 -0.674 1.00 0.00 C ATOM 410 CD PRO A 29 -4.497 11.485 -1.472 1.00 0.00 C ATOM 0 HA PRO A 29 -3.794 9.246 -3.733 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.899 8.587 -1.187 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.170 9.908 -2.079 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -4.270 10.012 0.077 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.867 11.039 -0.143 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.356 11.841 -0.903 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.922 12.363 -1.766 1.00 0.00 H new ATOM 418 N ILE A 30 -4.867 7.135 -3.179 1.00 0.00 N ATOM 419 CA ILE A 30 -5.656 5.923 -3.001 1.00 0.00 C ATOM 420 C ILE A 30 -4.866 4.687 -3.420 1.00 0.00 C ATOM 421 O ILE A 30 -4.399 4.590 -4.555 1.00 0.00 O ATOM 422 CB ILE A 30 -6.965 5.979 -3.809 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.890 4.829 -3.405 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.670 5.929 -5.301 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.358 5.133 -3.610 1.00 0.00 C ATOM 0 H ILE A 30 -4.150 7.069 -3.901 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.897 5.856 -1.940 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.469 6.920 -3.589 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.627 3.942 -3.982 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.720 4.589 -2.355 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.606 5.969 -5.858 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.046 6.779 -5.577 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.147 5.003 -5.538 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.954 4.274 -3.303 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.637 6.001 -3.012 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.542 5.344 -4.663 1.00 0.00 H new ATOM 437 N VAL A 31 -4.721 3.743 -2.496 1.00 0.00 N ATOM 438 CA VAL A 31 -3.990 2.511 -2.770 1.00 0.00 C ATOM 439 C VAL A 31 -4.848 1.526 -3.556 1.00 0.00 C ATOM 440 O VAL A 31 -6.024 1.330 -3.251 1.00 0.00 O ATOM 441 CB VAL A 31 -3.518 1.837 -1.467 1.00 0.00 C ATOM 442 CG1 VAL A 31 -2.765 0.552 -1.774 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.653 2.791 -0.658 1.00 0.00 C ATOM 0 H VAL A 31 -5.100 3.807 -1.551 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.119 2.785 -3.365 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.394 1.583 -0.871 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.439 0.090 -0.842 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.420 -0.135 -2.310 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.895 0.779 -2.390 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.328 2.299 0.259 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.780 3.077 -1.245 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.230 3.681 -0.407 1.00 0.00 H new ATOM 453 N SER A 32 -4.251 0.909 -4.571 1.00 0.00 N ATOM 454 CA SER A 32 -4.962 -0.054 -5.404 1.00 0.00 C ATOM 455 C SER A 32 -4.152 -1.337 -5.563 1.00 0.00 C ATOM 456 O SER A 32 -3.082 -1.338 -6.170 1.00 0.00 O ATOM 457 CB SER A 32 -5.256 0.550 -6.779 1.00 0.00 C ATOM 458 OG SER A 32 -5.974 1.766 -6.659 1.00 0.00 O ATOM 0 H SER A 32 -3.277 1.059 -4.836 1.00 0.00 H new ATOM 0 HA SER A 32 -5.904 -0.298 -4.912 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.320 0.727 -7.309 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.831 -0.158 -7.375 1.00 0.00 H new ATOM 0 HG SER A 32 -6.148 2.133 -7.551 1.00 0.00 H new ATOM 464 N VAL A 33 -4.672 -2.429 -5.010 1.00 0.00 N ATOM 465 CA VAL A 33 -3.999 -3.720 -5.090 1.00 0.00 C ATOM 466 C VAL A 33 -4.666 -4.624 -6.121 1.00 0.00 C ATOM 467 O VAL A 33 -5.891 -4.649 -6.239 1.00 0.00 O ATOM 468 CB VAL A 33 -3.991 -4.434 -3.725 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.205 -5.734 -3.807 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.419 -3.522 -2.651 1.00 0.00 C ATOM 0 H VAL A 33 -5.557 -2.445 -4.502 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.971 -3.523 -5.395 1.00 0.00 H new ATOM 0 HB VAL A 33 -5.019 -4.676 -3.454 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.210 -6.224 -2.834 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.664 -6.390 -4.547 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.177 -5.520 -4.100 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.421 -4.042 -1.693 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.397 -3.248 -2.913 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -4.029 -2.621 -2.576 1.00 0.00 H new ATOM 480 N ILE A 34 -3.851 -5.366 -6.863 1.00 0.00 N ATOM 481 CA ILE A 34 -4.363 -6.274 -7.883 1.00 0.00 C ATOM 482 C ILE A 34 -3.626 -7.608 -7.851 1.00 0.00 C ATOM 483 O ILE A 34 -2.416 -7.667 -8.070 1.00 0.00 O ATOM 484 CB ILE A 34 -4.237 -5.665 -9.292 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.117 -4.419 -9.413 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.616 -6.693 -10.349 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.427 -3.147 -8.974 1.00 0.00 C ATOM 0 H ILE A 34 -2.835 -5.357 -6.777 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.417 -6.438 -7.659 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.200 -5.371 -9.454 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.438 -4.310 -10.449 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.017 -4.560 -8.814 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.522 -6.248 -11.340 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -3.952 -7.554 -10.274 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.646 -7.014 -10.192 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.110 -2.305 -9.087 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.130 -3.236 -7.929 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.543 -2.982 -9.589 1.00 0.00 H new ATOM 499 N PHE A 35 -4.364 -8.679 -7.578 1.00 0.00 N ATOM 500 CA PHE A 35 -3.781 -10.015 -7.518 1.00 0.00 C ATOM 501 C PHE A 35 -4.840 -11.082 -7.779 1.00 0.00 C ATOM 502 O PHE A 35 -5.911 -11.072 -7.173 1.00 0.00 O ATOM 503 CB PHE A 35 -3.130 -10.249 -6.153 1.00 0.00 C ATOM 504 CG PHE A 35 -2.343 -11.526 -6.076 1.00 0.00 C ATOM 505 CD1 PHE A 35 -2.957 -12.712 -5.705 1.00 0.00 C ATOM 506 CD2 PHE A 35 -0.990 -11.540 -6.372 1.00 0.00 C ATOM 507 CE1 PHE A 35 -2.236 -13.889 -5.634 1.00 0.00 C ATOM 508 CE2 PHE A 35 -0.264 -12.714 -6.303 1.00 0.00 C ATOM 509 CZ PHE A 35 -0.887 -13.890 -5.932 1.00 0.00 C ATOM 0 H PHE A 35 -5.367 -8.648 -7.395 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.019 -10.087 -8.294 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.471 -9.411 -5.925 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -3.905 -10.262 -5.387 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -4.011 -12.716 -5.469 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.497 -10.623 -6.660 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.727 -14.807 -5.346 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.790 -12.712 -6.539 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.321 -14.808 -5.875 1.00 0.00 H new ATOM 519 N LYS A 36 -4.531 -12.003 -8.686 1.00 0.00 N ATOM 520 CA LYS A 36 -5.454 -13.079 -9.029 1.00 0.00 C ATOM 521 C LYS A 36 -6.741 -12.522 -9.628 1.00 0.00 C ATOM 522 O LYS A 36 -7.840 -12.900 -9.222 1.00 0.00 O ATOM 523 CB LYS A 36 -5.776 -13.916 -7.789 1.00 0.00 C ATOM 524 CG LYS A 36 -4.598 -14.729 -7.281 1.00 0.00 C ATOM 525 CD LYS A 36 -4.541 -16.099 -7.936 1.00 0.00 C ATOM 526 CE LYS A 36 -3.313 -16.878 -7.493 1.00 0.00 C ATOM 527 NZ LYS A 36 -3.490 -17.470 -6.138 1.00 0.00 N ATOM 0 H LYS A 36 -3.648 -12.026 -9.197 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.973 -13.713 -9.774 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.120 -13.255 -6.994 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.600 -14.591 -8.021 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.671 -14.191 -7.480 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.674 -14.845 -6.200 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.440 -16.661 -7.684 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -4.529 -15.985 -9.020 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -3.108 -17.671 -8.212 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.446 -16.218 -7.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.631 -17.993 -5.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.661 -16.711 -5.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -4.302 -18.120 -6.146 1.00 0.00 H new ATOM 541 N ASP A 37 -6.597 -11.623 -10.595 1.00 0.00 N ATOM 542 CA ASP A 37 -7.749 -11.016 -11.252 1.00 0.00 C ATOM 543 C ASP A 37 -8.663 -10.341 -10.233 1.00 0.00 C ATOM 544 O ASP A 37 -9.876 -10.272 -10.425 1.00 0.00 O ATOM 545 CB ASP A 37 -8.531 -12.071 -12.036 1.00 0.00 C ATOM 546 CG ASP A 37 -9.390 -11.463 -13.128 1.00 0.00 C ATOM 547 OD1 ASP A 37 -8.832 -11.084 -14.179 1.00 0.00 O ATOM 548 OD2 ASP A 37 -10.619 -11.365 -12.930 1.00 0.00 O ATOM 0 H ASP A 37 -5.694 -11.298 -10.941 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.383 -10.258 -11.944 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.833 -12.781 -12.480 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.165 -12.633 -11.350 1.00 0.00 H new ATOM 553 N GLU A 38 -8.070 -9.847 -9.150 1.00 0.00 N ATOM 554 CA GLU A 38 -8.832 -9.180 -8.101 1.00 0.00 C ATOM 555 C GLU A 38 -8.219 -7.825 -7.762 1.00 0.00 C ATOM 556 O GLU A 38 -7.126 -7.748 -7.200 1.00 0.00 O ATOM 557 CB GLU A 38 -8.889 -10.055 -6.847 1.00 0.00 C ATOM 558 CG GLU A 38 -10.155 -9.865 -6.029 1.00 0.00 C ATOM 559 CD GLU A 38 -11.404 -10.276 -6.783 1.00 0.00 C ATOM 560 OE1 GLU A 38 -11.392 -11.357 -7.408 1.00 0.00 O ATOM 561 OE2 GLU A 38 -12.395 -9.517 -6.748 1.00 0.00 O ATOM 0 H GLU A 38 -7.066 -9.896 -8.977 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.845 -9.019 -8.469 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -8.810 -11.102 -7.141 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.025 -9.834 -6.220 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.081 -10.448 -5.111 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.240 -8.819 -5.736 1.00 0.00 H new ATOM 568 N LYS A 39 -8.931 -6.757 -8.107 1.00 0.00 N ATOM 569 CA LYS A 39 -8.460 -5.404 -7.840 1.00 0.00 C ATOM 570 C LYS A 39 -9.171 -4.809 -6.629 1.00 0.00 C ATOM 571 O LYS A 39 -10.351 -4.465 -6.696 1.00 0.00 O ATOM 572 CB LYS A 39 -8.683 -4.513 -9.064 1.00 0.00 C ATOM 573 CG LYS A 39 -8.140 -3.104 -8.898 1.00 0.00 C ATOM 574 CD LYS A 39 -7.699 -2.516 -10.228 1.00 0.00 C ATOM 575 CE LYS A 39 -8.890 -2.092 -11.072 1.00 0.00 C ATOM 576 NZ LYS A 39 -8.472 -1.314 -12.271 1.00 0.00 N ATOM 0 H LYS A 39 -9.837 -6.803 -8.573 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.393 -5.454 -7.624 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.211 -4.976 -9.931 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -9.751 -4.459 -9.274 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.906 -2.468 -8.454 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.297 -3.117 -8.207 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -7.053 -1.656 -10.051 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.108 -3.251 -10.774 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.444 -2.976 -11.388 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.568 -1.490 -10.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.313 -1.044 -12.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -7.965 -0.457 -11.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.845 -1.897 -12.862 1.00 0.00 H new ATOM 590 N LYS A 40 -8.446 -4.690 -5.522 1.00 0.00 N ATOM 591 CA LYS A 40 -9.006 -4.134 -4.296 1.00 0.00 C ATOM 592 C LYS A 40 -8.262 -2.868 -3.882 1.00 0.00 C ATOM 593 O LYS A 40 -7.043 -2.881 -3.708 1.00 0.00 O ATOM 594 CB LYS A 40 -8.942 -5.167 -3.168 1.00 0.00 C ATOM 595 CG LYS A 40 -9.620 -6.482 -3.509 1.00 0.00 C ATOM 596 CD LYS A 40 -9.550 -7.463 -2.351 1.00 0.00 C ATOM 597 CE LYS A 40 -10.025 -8.848 -2.763 1.00 0.00 C ATOM 598 NZ LYS A 40 -11.495 -9.006 -2.584 1.00 0.00 N ATOM 0 H LYS A 40 -7.468 -4.971 -5.449 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.048 -3.876 -4.487 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.898 -5.359 -2.922 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.408 -4.748 -2.276 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -10.663 -6.298 -3.769 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.145 -6.920 -4.387 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.525 -7.523 -1.985 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.162 -7.098 -1.526 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.765 -9.026 -3.807 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -9.504 -9.601 -2.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.779 -9.963 -2.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.740 -8.862 -1.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.993 -8.304 -3.167 1.00 0.00 H new ATOM 612 N LYS A 41 -9.003 -1.776 -3.726 1.00 0.00 N ATOM 613 CA LYS A 41 -8.415 -0.502 -3.330 1.00 0.00 C ATOM 614 C LYS A 41 -8.928 -0.068 -1.961 1.00 0.00 C ATOM 615 O LYS A 41 -9.931 -0.587 -1.469 1.00 0.00 O ATOM 616 CB LYS A 41 -8.732 0.574 -4.371 1.00 0.00 C ATOM 617 CG LYS A 41 -10.174 0.555 -4.846 1.00 0.00 C ATOM 618 CD LYS A 41 -10.468 1.715 -5.783 1.00 0.00 C ATOM 619 CE LYS A 41 -11.958 1.842 -6.062 1.00 0.00 C ATOM 620 NZ LYS A 41 -12.696 2.394 -4.893 1.00 0.00 N ATOM 0 H LYS A 41 -10.013 -1.748 -3.868 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.335 -0.632 -3.268 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.511 1.554 -3.947 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.074 0.442 -5.230 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.378 -0.387 -5.356 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.842 0.603 -3.986 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.099 2.642 -5.344 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -9.932 1.571 -6.721 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.112 2.488 -6.926 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.364 0.864 -6.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.670 2.624 -5.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -12.713 1.689 -4.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.220 3.256 -4.558 1.00 0.00 H new ATOM 634 N THR A 42 -8.236 0.889 -1.351 1.00 0.00 N ATOM 635 CA THR A 42 -8.623 1.394 -0.039 1.00 0.00 C ATOM 636 C THR A 42 -9.381 2.711 -0.158 1.00 0.00 C ATOM 637 O THR A 42 -9.377 3.349 -1.212 1.00 0.00 O ATOM 638 CB THR A 42 -7.394 1.602 0.867 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.522 2.581 0.292 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.639 0.296 1.063 1.00 0.00 C ATOM 0 H THR A 42 -7.405 1.330 -1.744 1.00 0.00 H new ATOM 0 HA THR A 42 -9.274 0.643 0.409 1.00 0.00 H new ATOM 0 HB THR A 42 -7.742 1.952 1.839 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.416 3.331 0.914 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.776 0.468 1.706 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.297 -0.438 1.528 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.303 -0.078 0.096 1.00 0.00 H new ATOM 648 N LYS A 43 -10.031 3.114 0.928 1.00 0.00 N ATOM 649 CA LYS A 43 -10.793 4.357 0.947 1.00 0.00 C ATOM 650 C LYS A 43 -9.918 5.538 0.536 1.00 0.00 C ATOM 651 O LYS A 43 -8.827 5.732 1.071 1.00 0.00 O ATOM 652 CB LYS A 43 -11.375 4.602 2.341 1.00 0.00 C ATOM 653 CG LYS A 43 -10.320 4.833 3.409 1.00 0.00 C ATOM 654 CD LYS A 43 -10.948 5.066 4.773 1.00 0.00 C ATOM 655 CE LYS A 43 -11.243 6.540 5.006 1.00 0.00 C ATOM 656 NZ LYS A 43 -12.614 6.909 4.556 1.00 0.00 N ATOM 0 H LYS A 43 -10.045 2.597 1.807 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.609 4.264 0.230 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.036 5.468 2.302 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.987 3.746 2.626 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.654 3.971 3.456 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.708 5.693 3.137 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -11.871 4.492 4.853 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -10.277 4.701 5.551 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -11.135 6.769 6.066 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -10.510 7.146 4.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.952 7.724 5.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -12.593 7.157 3.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -13.256 6.104 4.701 1.00 0.00 H new ATOM 670 N LYS A 44 -10.406 6.325 -0.417 1.00 0.00 N ATOM 671 CA LYS A 44 -9.671 7.489 -0.899 1.00 0.00 C ATOM 672 C LYS A 44 -9.588 8.565 0.179 1.00 0.00 C ATOM 673 O LYS A 44 -10.585 8.889 0.824 1.00 0.00 O ATOM 674 CB LYS A 44 -10.340 8.058 -2.152 1.00 0.00 C ATOM 675 CG LYS A 44 -11.605 8.847 -1.861 1.00 0.00 C ATOM 676 CD LYS A 44 -12.252 9.356 -3.138 1.00 0.00 C ATOM 677 CE LYS A 44 -13.343 10.373 -2.844 1.00 0.00 C ATOM 678 NZ LYS A 44 -14.128 10.714 -4.063 1.00 0.00 N ATOM 0 H LYS A 44 -11.307 6.178 -0.871 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.659 7.170 -1.148 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.631 8.703 -2.671 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.581 7.238 -2.829 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.311 8.217 -1.321 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.368 9.690 -1.212 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.493 9.809 -3.776 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.675 8.518 -3.692 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.012 9.977 -2.080 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -12.894 11.279 -2.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -13.964 11.710 -4.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -13.829 10.104 -4.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.140 10.567 -3.876 1.00 0.00 H new ATOM 692 N VAL A 45 -8.394 9.116 0.368 1.00 0.00 N ATOM 693 CA VAL A 45 -8.182 10.158 1.366 1.00 0.00 C ATOM 694 C VAL A 45 -8.235 11.544 0.734 1.00 0.00 C ATOM 695 O VAL A 45 -7.777 11.742 -0.392 1.00 0.00 O ATOM 696 CB VAL A 45 -6.829 9.983 2.081 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.586 11.129 3.052 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.776 8.644 2.801 1.00 0.00 C ATOM 0 H VAL A 45 -7.558 8.858 -0.157 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.986 10.065 2.097 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.037 9.999 1.332 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.626 10.988 3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.578 12.073 2.506 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.380 11.148 3.798 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.813 8.537 3.301 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.576 8.597 3.540 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.901 7.837 2.079 1.00 0.00 H new ATOM 708 N ASP A 46 -8.795 12.501 1.465 1.00 0.00 N ATOM 709 CA ASP A 46 -8.907 13.870 0.976 1.00 0.00 C ATOM 710 C ASP A 46 -7.527 14.481 0.752 1.00 0.00 C ATOM 711 O ASP A 46 -6.506 13.840 0.998 1.00 0.00 O ATOM 712 CB ASP A 46 -9.702 14.724 1.966 1.00 0.00 C ATOM 713 CG ASP A 46 -8.915 15.036 3.224 1.00 0.00 C ATOM 714 OD1 ASP A 46 -8.003 15.885 3.157 1.00 0.00 O ATOM 715 OD2 ASP A 46 -9.212 14.430 4.275 1.00 0.00 O ATOM 0 H ASP A 46 -9.179 12.354 2.399 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.434 13.848 0.022 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.995 15.657 1.484 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.620 14.202 2.235 1.00 0.00 H new ATOM 720 N ASN A 47 -7.505 15.725 0.283 1.00 0.00 N ATOM 721 CA ASN A 47 -6.251 16.422 0.024 1.00 0.00 C ATOM 722 C ASN A 47 -5.264 16.210 1.169 1.00 0.00 C ATOM 723 O ASN A 47 -5.349 16.871 2.203 1.00 0.00 O ATOM 724 CB ASN A 47 -6.506 17.918 -0.174 1.00 0.00 C ATOM 725 CG ASN A 47 -7.530 18.464 0.802 1.00 0.00 C ATOM 726 OD1 ASN A 47 -8.685 18.865 0.284 1.00 0.00 O flip ATOM 727 ND2 ASN A 47 -7.285 18.524 2.007 1.00 0.00 N flip ATOM 0 H ASN A 47 -8.341 16.270 0.075 1.00 0.00 H new ATOM 0 HA ASN A 47 -5.817 16.010 -0.887 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -5.569 18.462 -0.056 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.850 18.093 -1.193 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -6.383 18.204 2.361 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.984 18.893 2.652 1.00 0.00 H new ATOM 734 N GLU A 48 -4.330 15.285 0.974 1.00 0.00 N ATOM 735 CA GLU A 48 -3.328 14.987 1.990 1.00 0.00 C ATOM 736 C GLU A 48 -2.167 14.195 1.394 1.00 0.00 C ATOM 737 O GLU A 48 -2.373 13.200 0.698 1.00 0.00 O ATOM 738 CB GLU A 48 -3.956 14.201 3.143 1.00 0.00 C ATOM 739 CG GLU A 48 -2.949 13.726 4.176 1.00 0.00 C ATOM 740 CD GLU A 48 -2.192 14.869 4.823 1.00 0.00 C ATOM 741 OE1 GLU A 48 -2.838 15.866 5.208 1.00 0.00 O ATOM 742 OE2 GLU A 48 -0.953 14.767 4.944 1.00 0.00 O ATOM 0 H GLU A 48 -4.246 14.730 0.123 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.943 15.933 2.371 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.701 14.827 3.635 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.483 13.337 2.738 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.467 13.156 4.947 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.240 13.048 3.701 1.00 0.00 H new ATOM 749 N LEU A 49 -0.948 14.644 1.671 1.00 0.00 N ATOM 750 CA LEU A 49 0.246 13.978 1.163 1.00 0.00 C ATOM 751 C LEU A 49 0.476 12.651 1.878 1.00 0.00 C ATOM 752 O LEU A 49 0.763 11.636 1.246 1.00 0.00 O ATOM 753 CB LEU A 49 1.469 14.882 1.334 1.00 0.00 C ATOM 754 CG LEU A 49 1.800 15.793 0.152 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.607 16.667 -0.200 1.00 0.00 C ATOM 756 CD2 LEU A 49 3.018 16.651 0.465 1.00 0.00 C ATOM 0 H LEU A 49 -0.760 15.466 2.245 1.00 0.00 H new ATOM 0 HA LEU A 49 0.096 13.776 0.102 1.00 0.00 H new ATOM 0 HB2 LEU A 49 1.315 15.505 2.215 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.336 14.253 1.536 1.00 0.00 H new ATOM 0 HG LEU A 49 2.032 15.167 -0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.862 17.308 -1.044 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.240 16.036 -0.467 1.00 0.00 H new ATOM 0 HD13 LEU A 49 0.343 17.285 0.658 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.239 17.293 -0.387 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.814 17.267 1.340 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.874 16.007 0.666 1.00 0.00 H new ATOM 768 N ASN A 50 0.347 12.667 3.201 1.00 0.00 N ATOM 769 CA ASN A 50 0.539 11.464 4.002 1.00 0.00 C ATOM 770 C ASN A 50 -0.794 10.944 4.530 1.00 0.00 C ATOM 771 O ASN A 50 -1.156 11.153 5.688 1.00 0.00 O ATOM 772 CB ASN A 50 1.486 11.750 5.169 1.00 0.00 C ATOM 773 CG ASN A 50 1.436 13.199 5.613 1.00 0.00 C ATOM 774 OD1 ASN A 50 0.668 13.561 6.505 1.00 0.00 O ATOM 775 ND2 ASN A 50 2.257 14.037 4.991 1.00 0.00 N ATOM 0 H ASN A 50 0.110 13.500 3.741 1.00 0.00 H new ATOM 0 HA ASN A 50 0.980 10.698 3.364 1.00 0.00 H new ATOM 0 HB2 ASN A 50 1.227 11.106 6.010 1.00 0.00 H new ATOM 0 HB3 ASN A 50 2.505 11.498 4.876 1.00 0.00 H new ATOM 0 HD21 ASN A 50 2.268 15.024 5.247 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.877 13.693 4.257 1.00 0.00 H new ATOM 782 N PRO A 51 -1.543 10.247 3.663 1.00 0.00 N ATOM 783 CA PRO A 51 -2.847 9.681 4.019 1.00 0.00 C ATOM 784 C PRO A 51 -2.727 8.518 4.998 1.00 0.00 C ATOM 785 O PRO A 51 -1.654 7.936 5.157 1.00 0.00 O ATOM 786 CB PRO A 51 -3.401 9.194 2.677 1.00 0.00 C ATOM 787 CG PRO A 51 -2.196 8.942 1.839 1.00 0.00 C ATOM 788 CD PRO A 51 -1.174 9.958 2.267 1.00 0.00 C ATOM 0 HA PRO A 51 -3.484 10.410 4.520 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.995 8.288 2.799 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.050 9.942 2.222 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.824 7.928 1.986 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.429 9.046 0.779 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.160 9.564 2.193 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.214 10.854 1.647 1.00 0.00 H new ATOM 796 N VAL A 52 -3.834 8.185 5.654 1.00 0.00 N ATOM 797 CA VAL A 52 -3.852 7.090 6.617 1.00 0.00 C ATOM 798 C VAL A 52 -5.047 6.172 6.383 1.00 0.00 C ATOM 799 O VAL A 52 -6.197 6.608 6.438 1.00 0.00 O ATOM 800 CB VAL A 52 -3.899 7.617 8.063 1.00 0.00 C ATOM 801 CG1 VAL A 52 -4.098 6.470 9.043 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.631 8.392 8.389 1.00 0.00 C ATOM 0 H VAL A 52 -4.730 8.658 5.536 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.931 6.526 6.473 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.747 8.295 8.156 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -4.129 6.861 10.060 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -5.036 5.961 8.822 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -3.272 5.765 8.950 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.681 8.757 9.415 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.766 7.738 8.279 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.536 9.237 7.707 1.00 0.00 H new ATOM 812 N TRP A 53 -4.766 4.901 6.122 1.00 0.00 N ATOM 813 CA TRP A 53 -5.819 3.920 5.880 1.00 0.00 C ATOM 814 C TRP A 53 -5.919 2.933 7.037 1.00 0.00 C ATOM 815 O TRP A 53 -6.978 2.782 7.646 1.00 0.00 O ATOM 816 CB TRP A 53 -5.553 3.169 4.574 1.00 0.00 C ATOM 817 CG TRP A 53 -5.429 4.072 3.384 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.450 4.605 2.650 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.215 4.545 2.791 1.00 0.00 C ATOM 820 NE1 TRP A 53 -5.943 5.381 1.635 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.575 5.362 1.701 1.00 0.00 C ATOM 822 CE3 TRP A 53 -2.860 4.361 3.076 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.627 5.990 0.897 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -1.920 4.985 2.277 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.307 5.792 1.198 1.00 0.00 C ATOM 0 H TRP A 53 -3.819 4.525 6.072 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.767 4.452 5.799 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.636 2.588 4.677 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.362 2.460 4.400 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.501 4.441 2.839 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.496 5.889 0.944 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.552 3.742 3.906 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -3.923 6.612 0.065 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -0.870 4.848 2.488 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.549 6.266 0.593 1.00 0.00 H new ATOM 836 N ASN A 54 -4.811 2.263 7.336 1.00 0.00 N ATOM 837 CA ASN A 54 -4.775 1.289 8.422 1.00 0.00 C ATOM 838 C ASN A 54 -5.842 0.217 8.225 1.00 0.00 C ATOM 839 O ASN A 54 -6.386 -0.315 9.192 1.00 0.00 O ATOM 840 CB ASN A 54 -4.980 1.987 9.768 1.00 0.00 C ATOM 841 CG ASN A 54 -3.671 2.425 10.397 1.00 0.00 C ATOM 842 OD1 ASN A 54 -3.276 1.920 11.448 1.00 0.00 O ATOM 843 ND2 ASN A 54 -2.992 3.368 9.754 1.00 0.00 N ATOM 0 H ASN A 54 -3.926 2.376 6.842 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.796 0.809 8.415 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -5.622 2.857 9.629 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -5.499 1.313 10.449 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -2.104 3.702 10.129 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -3.358 3.758 8.886 1.00 0.00 H new ATOM 850 N GLU A 55 -6.135 -0.095 6.967 1.00 0.00 N ATOM 851 CA GLU A 55 -7.137 -1.104 6.644 1.00 0.00 C ATOM 852 C GLU A 55 -6.494 -2.479 6.486 1.00 0.00 C ATOM 853 O GLU A 55 -5.278 -2.626 6.619 1.00 0.00 O ATOM 854 CB GLU A 55 -7.879 -0.726 5.360 1.00 0.00 C ATOM 855 CG GLU A 55 -7.081 -0.992 4.095 1.00 0.00 C ATOM 856 CD GLU A 55 -6.899 -2.472 3.819 1.00 0.00 C ATOM 857 OE1 GLU A 55 -7.890 -3.130 3.440 1.00 0.00 O ATOM 858 OE2 GLU A 55 -5.767 -2.972 3.984 1.00 0.00 O ATOM 0 H GLU A 55 -5.693 0.336 6.155 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.849 -1.147 7.468 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.814 -1.284 5.313 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.140 0.332 5.399 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -7.585 -0.528 3.248 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -6.103 -0.520 4.181 1.00 0.00 H new ATOM 865 N ILE A 56 -7.318 -3.482 6.203 1.00 0.00 N ATOM 866 CA ILE A 56 -6.829 -4.844 6.027 1.00 0.00 C ATOM 867 C ILE A 56 -7.528 -5.532 4.858 1.00 0.00 C ATOM 868 O ILE A 56 -8.730 -5.795 4.907 1.00 0.00 O ATOM 869 CB ILE A 56 -7.036 -5.686 7.300 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.401 -4.989 8.506 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.449 -7.077 7.116 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.740 -5.641 9.828 1.00 0.00 C ATOM 0 H ILE A 56 -8.326 -3.377 6.091 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.762 -4.771 5.819 1.00 0.00 H new ATOM 0 HB ILE A 56 -8.106 -5.786 7.483 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.318 -4.980 8.382 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.728 -3.949 8.528 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.603 -7.660 8.024 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.942 -7.572 6.279 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.381 -6.997 6.913 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.256 -5.095 10.638 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.820 -5.626 9.975 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.388 -6.673 9.826 1.00 0.00 H new ATOM 884 N LEU A 57 -6.766 -5.822 3.809 1.00 0.00 N ATOM 885 CA LEU A 57 -7.311 -6.482 2.628 1.00 0.00 C ATOM 886 C LEU A 57 -7.197 -7.998 2.749 1.00 0.00 C ATOM 887 O LEU A 57 -6.407 -8.509 3.542 1.00 0.00 O ATOM 888 CB LEU A 57 -6.582 -6.003 1.371 1.00 0.00 C ATOM 889 CG LEU A 57 -6.507 -4.489 1.174 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.380 -4.130 0.218 1.00 0.00 C ATOM 891 CD2 LEU A 57 -7.836 -3.951 0.661 1.00 0.00 C ATOM 0 H LEU A 57 -5.770 -5.611 3.752 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.367 -6.221 2.551 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.566 -6.397 1.392 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.075 -6.438 0.502 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.299 -4.026 2.139 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.342 -3.048 0.090 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.432 -4.481 0.625 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.557 -4.604 -0.748 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -7.764 -2.872 0.527 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.075 -4.420 -0.293 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.622 -4.175 1.382 1.00 0.00 H new ATOM 903 N GLU A 58 -7.991 -8.711 1.956 1.00 0.00 N ATOM 904 CA GLU A 58 -7.977 -10.169 1.975 1.00 0.00 C ATOM 905 C GLU A 58 -8.167 -10.733 0.569 1.00 0.00 C ATOM 906 O GLU A 58 -9.098 -10.357 -0.142 1.00 0.00 O ATOM 907 CB GLU A 58 -9.073 -10.700 2.901 1.00 0.00 C ATOM 908 CG GLU A 58 -9.172 -9.950 4.219 1.00 0.00 C ATOM 909 CD GLU A 58 -10.471 -10.226 4.951 1.00 0.00 C ATOM 910 OE1 GLU A 58 -10.521 -11.204 5.726 1.00 0.00 O ATOM 911 OE2 GLU A 58 -11.439 -9.462 4.749 1.00 0.00 O ATOM 0 H GLU A 58 -8.651 -8.303 1.294 1.00 0.00 H new ATOM 0 HA GLU A 58 -7.006 -10.493 2.350 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -10.032 -10.641 2.386 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.885 -11.754 3.106 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.333 -10.231 4.856 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.085 -8.880 4.031 1.00 0.00 H new ATOM 918 N PHE A 59 -7.276 -11.638 0.176 1.00 0.00 N ATOM 919 CA PHE A 59 -7.344 -12.253 -1.144 1.00 0.00 C ATOM 920 C PHE A 59 -7.525 -13.764 -1.032 1.00 0.00 C ATOM 921 O PHE A 59 -7.029 -14.391 -0.095 1.00 0.00 O ATOM 922 CB PHE A 59 -6.077 -11.938 -1.942 1.00 0.00 C ATOM 923 CG PHE A 59 -5.989 -10.506 -2.388 1.00 0.00 C ATOM 924 CD1 PHE A 59 -5.657 -9.506 -1.488 1.00 0.00 C ATOM 925 CD2 PHE A 59 -6.240 -10.160 -3.706 1.00 0.00 C ATOM 926 CE1 PHE A 59 -5.576 -8.188 -1.895 1.00 0.00 C ATOM 927 CE2 PHE A 59 -6.160 -8.844 -4.118 1.00 0.00 C ATOM 928 CZ PHE A 59 -5.828 -7.856 -3.211 1.00 0.00 C ATOM 0 H PHE A 59 -6.499 -11.961 0.753 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.207 -11.839 -1.666 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.205 -12.174 -1.332 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.038 -12.586 -2.818 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.459 -9.760 -0.457 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -6.501 -10.928 -4.419 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.316 -7.418 -1.184 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -6.357 -8.587 -5.148 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.766 -6.826 -3.531 1.00 0.00 H new ATOM 938 N ASP A 60 -8.238 -14.341 -1.992 1.00 0.00 N ATOM 939 CA ASP A 60 -8.485 -15.779 -2.002 1.00 0.00 C ATOM 940 C ASP A 60 -7.441 -16.503 -2.846 1.00 0.00 C ATOM 941 O ASP A 60 -7.068 -16.040 -3.925 1.00 0.00 O ATOM 942 CB ASP A 60 -9.886 -16.073 -2.539 1.00 0.00 C ATOM 943 CG ASP A 60 -10.923 -16.156 -1.436 1.00 0.00 C ATOM 944 OD1 ASP A 60 -11.081 -17.248 -0.852 1.00 0.00 O ATOM 945 OD2 ASP A 60 -11.578 -15.129 -1.158 1.00 0.00 O ATOM 0 H ASP A 60 -8.655 -13.836 -2.774 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.414 -16.143 -0.977 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.172 -15.293 -3.245 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -9.871 -17.013 -3.091 1.00 0.00 H new ATOM 950 N LEU A 61 -6.971 -17.642 -2.347 1.00 0.00 N ATOM 951 CA LEU A 61 -5.969 -18.431 -3.055 1.00 0.00 C ATOM 952 C LEU A 61 -6.583 -19.704 -3.628 1.00 0.00 C ATOM 953 O LEU A 61 -6.009 -20.337 -4.514 1.00 0.00 O ATOM 954 CB LEU A 61 -4.815 -18.786 -2.115 1.00 0.00 C ATOM 955 CG LEU A 61 -4.100 -17.607 -1.454 1.00 0.00 C ATOM 956 CD1 LEU A 61 -2.941 -18.096 -0.600 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.612 -16.622 -2.505 1.00 0.00 C ATOM 0 H LEU A 61 -7.268 -18.039 -1.456 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.586 -17.831 -3.881 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.199 -19.438 -1.331 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.080 -19.362 -2.677 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.810 -17.094 -0.806 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.444 -17.243 -0.138 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.317 -18.762 0.177 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.230 -18.635 -1.226 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.106 -15.790 -2.016 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -2.918 -17.124 -3.179 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.462 -16.246 -3.074 1.00 0.00 H new ATOM 969 N ARG A 62 -7.754 -20.072 -3.118 1.00 0.00 N ATOM 970 CA ARG A 62 -8.446 -21.268 -3.580 1.00 0.00 C ATOM 971 C ARG A 62 -7.501 -22.465 -3.613 1.00 0.00 C ATOM 972 O ARG A 62 -7.519 -23.258 -4.553 1.00 0.00 O ATOM 973 CB ARG A 62 -9.039 -21.035 -4.971 1.00 0.00 C ATOM 974 CG ARG A 62 -10.021 -19.876 -5.028 1.00 0.00 C ATOM 975 CD ARG A 62 -10.015 -19.207 -6.394 1.00 0.00 C ATOM 976 NE ARG A 62 -8.662 -18.884 -6.838 1.00 0.00 N ATOM 977 CZ ARG A 62 -8.381 -18.395 -8.041 1.00 0.00 C ATOM 978 NH1 ARG A 62 -9.353 -18.174 -8.914 1.00 0.00 N ATOM 979 NH2 ARG A 62 -7.124 -18.126 -8.372 1.00 0.00 N ATOM 0 H ARG A 62 -8.243 -19.559 -2.385 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.253 -21.483 -2.879 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.229 -20.848 -5.676 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.543 -21.944 -5.299 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.025 -20.237 -4.803 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.766 -19.144 -4.262 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -10.488 -19.865 -7.122 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -10.611 -18.295 -6.354 1.00 0.00 H new ATOM 0 HE ARG A 62 -7.891 -19.042 -6.189 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -10.320 -18.379 -8.663 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -9.134 -17.799 -9.837 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -6.373 -18.295 -7.703 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -6.909 -17.751 -9.296 1.00 0.00 H new ATOM 993 N GLY A 63 -6.674 -22.589 -2.579 1.00 0.00 N ATOM 994 CA GLY A 63 -5.733 -23.691 -2.509 1.00 0.00 C ATOM 995 C GLY A 63 -4.495 -23.450 -3.351 1.00 0.00 C ATOM 996 O GLY A 63 -3.467 -24.098 -3.153 1.00 0.00 O ATOM 0 H GLY A 63 -6.639 -21.945 -1.788 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.438 -23.848 -1.471 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.223 -24.605 -2.843 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.595 -22.519 -4.293 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.475 -22.195 -5.168 1.00 0.00 C ATOM 1002 C ILE A 64 -2.411 -21.393 -4.426 1.00 0.00 C ATOM 1003 O ILE A 64 -2.619 -20.240 -4.048 1.00 0.00 O ATOM 1004 CB ILE A 64 -3.936 -21.397 -6.402 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -4.942 -22.213 -7.217 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.741 -21.010 -7.260 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.332 -23.417 -7.899 1.00 0.00 C ATOM 0 H ILE A 64 -5.440 -21.976 -4.470 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.048 -23.142 -5.497 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.426 -20.484 -6.064 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.745 -22.546 -6.559 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.394 -21.569 -7.971 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.084 -20.447 -8.128 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.057 -20.395 -6.675 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.225 -21.911 -7.593 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.103 -23.948 -8.458 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.548 -23.090 -8.582 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.905 -24.082 -7.149 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.242 -22.015 -4.213 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.121 -21.376 -3.517 1.00 0.00 C ATOM 1021 C PRO A 65 0.511 -20.259 -4.339 1.00 0.00 C ATOM 1022 O PRO A 65 0.060 -19.956 -5.444 1.00 0.00 O ATOM 1023 CB PRO A 65 0.873 -22.523 -3.319 1.00 0.00 C ATOM 1024 CG PRO A 65 0.559 -23.489 -4.409 1.00 0.00 C ATOM 1025 CD PRO A 65 -0.924 -23.389 -4.636 1.00 0.00 C ATOM 0 HA PRO A 65 -0.436 -20.901 -2.588 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.902 -22.171 -3.387 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.757 -22.982 -2.337 1.00 0.00 H new ATOM 0 HG2 PRO A 65 1.110 -23.245 -5.317 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.843 -24.503 -4.126 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.183 -23.558 -5.681 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.471 -24.127 -4.049 1.00 0.00 H new ATOM 1033 N LEU A 66 1.559 -19.650 -3.794 1.00 0.00 N ATOM 1034 CA LEU A 66 2.254 -18.565 -4.478 1.00 0.00 C ATOM 1035 C LEU A 66 3.494 -19.083 -5.201 1.00 0.00 C ATOM 1036 O LEU A 66 4.026 -20.140 -4.861 1.00 0.00 O ATOM 1037 CB LEU A 66 2.650 -17.476 -3.479 1.00 0.00 C ATOM 1038 CG LEU A 66 1.505 -16.630 -2.921 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.023 -15.659 -1.871 1.00 0.00 C ATOM 1040 CD2 LEU A 66 0.800 -15.881 -4.042 1.00 0.00 C ATOM 0 H LEU A 66 1.946 -19.889 -2.881 1.00 0.00 H new ATOM 0 HA LEU A 66 1.575 -18.141 -5.218 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.167 -17.948 -2.644 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.365 -16.810 -3.962 1.00 0.00 H new ATOM 0 HG LEU A 66 0.784 -17.295 -2.447 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.195 -15.065 -1.485 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.482 -16.217 -1.054 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.764 -14.999 -2.321 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.012 -15.284 -3.626 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.511 -15.226 -4.545 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.395 -16.596 -4.759 1.00 0.00 H new ATOM 1052 N ASP A 67 3.949 -18.331 -6.196 1.00 0.00 N ATOM 1053 CA ASP A 67 5.129 -18.713 -6.965 1.00 0.00 C ATOM 1054 C ASP A 67 6.095 -17.539 -7.096 1.00 0.00 C ATOM 1055 O ASP A 67 5.699 -16.380 -6.977 1.00 0.00 O ATOM 1056 CB ASP A 67 4.721 -19.211 -8.352 1.00 0.00 C ATOM 1057 CG ASP A 67 3.619 -20.250 -8.293 1.00 0.00 C ATOM 1058 OD1 ASP A 67 3.942 -21.453 -8.202 1.00 0.00 O ATOM 1059 OD2 ASP A 67 2.432 -19.861 -8.338 1.00 0.00 O ATOM 0 H ASP A 67 3.520 -17.454 -6.490 1.00 0.00 H new ATOM 0 HA ASP A 67 5.634 -19.519 -6.433 1.00 0.00 H new ATOM 0 HB2 ASP A 67 4.388 -18.366 -8.955 1.00 0.00 H new ATOM 0 HB3 ASP A 67 5.591 -19.636 -8.853 1.00 0.00 H new ATOM 1064 N PHE A 68 7.364 -17.849 -7.340 1.00 0.00 N ATOM 1065 CA PHE A 68 8.387 -16.820 -7.486 1.00 0.00 C ATOM 1066 C PHE A 68 7.901 -15.694 -8.393 1.00 0.00 C ATOM 1067 O PHE A 68 8.312 -14.543 -8.246 1.00 0.00 O ATOM 1068 CB PHE A 68 9.673 -17.426 -8.051 1.00 0.00 C ATOM 1069 CG PHE A 68 10.157 -18.625 -7.285 1.00 0.00 C ATOM 1070 CD1 PHE A 68 10.384 -18.547 -5.921 1.00 0.00 C ATOM 1071 CD2 PHE A 68 10.387 -19.829 -7.931 1.00 0.00 C ATOM 1072 CE1 PHE A 68 10.829 -19.648 -5.214 1.00 0.00 C ATOM 1073 CE2 PHE A 68 10.832 -20.933 -7.229 1.00 0.00 C ATOM 1074 CZ PHE A 68 11.054 -20.842 -5.869 1.00 0.00 C ATOM 0 H PHE A 68 7.708 -18.804 -7.441 1.00 0.00 H new ATOM 0 HA PHE A 68 8.592 -16.405 -6.499 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.505 -17.712 -9.089 1.00 0.00 H new ATOM 0 HB3 PHE A 68 10.454 -16.666 -8.052 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.211 -17.615 -5.404 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.217 -19.905 -8.995 1.00 0.00 H new ATOM 0 HE1 PHE A 68 11.000 -19.574 -4.150 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.006 -21.866 -7.744 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.403 -21.703 -5.319 1.00 0.00 H new ATOM 1084 N SER A 69 7.024 -16.035 -9.332 1.00 0.00 N ATOM 1085 CA SER A 69 6.485 -15.054 -10.267 1.00 0.00 C ATOM 1086 C SER A 69 5.362 -14.248 -9.621 1.00 0.00 C ATOM 1087 O SER A 69 5.186 -13.065 -9.910 1.00 0.00 O ATOM 1088 CB SER A 69 5.969 -15.750 -11.527 1.00 0.00 C ATOM 1089 OG SER A 69 6.970 -16.571 -12.103 1.00 0.00 O ATOM 0 H SER A 69 6.672 -16.983 -9.465 1.00 0.00 H new ATOM 0 HA SER A 69 7.288 -14.370 -10.541 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.096 -16.354 -11.281 1.00 0.00 H new ATOM 0 HB3 SER A 69 5.645 -15.003 -12.252 1.00 0.00 H new ATOM 0 HG SER A 69 6.614 -17.006 -12.906 1.00 0.00 H new ATOM 1095 N SER A 70 4.603 -14.899 -8.745 1.00 0.00 N ATOM 1096 CA SER A 70 3.494 -14.246 -8.060 1.00 0.00 C ATOM 1097 C SER A 70 3.966 -12.985 -7.341 1.00 0.00 C ATOM 1098 O SER A 70 4.815 -13.045 -6.452 1.00 0.00 O ATOM 1099 CB SER A 70 2.849 -15.206 -7.058 1.00 0.00 C ATOM 1100 OG SER A 70 2.398 -16.386 -7.701 1.00 0.00 O ATOM 0 H SER A 70 4.736 -15.878 -8.493 1.00 0.00 H new ATOM 0 HA SER A 70 2.754 -13.962 -8.808 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.569 -15.464 -6.281 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.011 -14.713 -6.565 1.00 0.00 H new ATOM 0 HG SER A 70 1.802 -16.879 -7.099 1.00 0.00 H new ATOM 1106 N SER A 71 3.409 -11.844 -7.735 1.00 0.00 N ATOM 1107 CA SER A 71 3.775 -10.568 -7.132 1.00 0.00 C ATOM 1108 C SER A 71 2.545 -9.686 -6.939 1.00 0.00 C ATOM 1109 O SER A 71 1.478 -9.958 -7.492 1.00 0.00 O ATOM 1110 CB SER A 71 4.803 -9.844 -8.004 1.00 0.00 C ATOM 1111 OG SER A 71 5.861 -10.712 -8.371 1.00 0.00 O ATOM 0 H SER A 71 2.703 -11.777 -8.468 1.00 0.00 H new ATOM 0 HA SER A 71 4.214 -10.769 -6.155 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.317 -9.458 -8.900 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.203 -8.986 -7.464 1.00 0.00 H new ATOM 0 HG SER A 71 5.521 -11.404 -8.976 1.00 0.00 H new ATOM 1117 N LEU A 72 2.701 -8.629 -6.150 1.00 0.00 N ATOM 1118 CA LEU A 72 1.604 -7.705 -5.882 1.00 0.00 C ATOM 1119 C LEU A 72 1.788 -6.402 -6.654 1.00 0.00 C ATOM 1120 O LEU A 72 2.902 -5.894 -6.778 1.00 0.00 O ATOM 1121 CB LEU A 72 1.510 -7.415 -4.383 1.00 0.00 C ATOM 1122 CG LEU A 72 0.126 -7.027 -3.860 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -0.814 -8.223 -3.900 1.00 0.00 C ATOM 1124 CD2 LEU A 72 0.226 -6.472 -2.447 1.00 0.00 C ATOM 0 H LEU A 72 3.577 -8.390 -5.684 1.00 0.00 H new ATOM 0 HA LEU A 72 0.678 -8.174 -6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.847 -8.298 -3.841 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.205 -6.610 -4.145 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.281 -6.249 -4.506 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.794 -7.928 -3.524 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.910 -8.576 -4.927 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.412 -9.023 -3.278 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.768 -6.201 -2.091 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.654 -7.228 -1.789 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.864 -5.588 -2.447 1.00 0.00 H new ATOM 1136 N GLY A 73 0.686 -5.865 -7.169 1.00 0.00 N ATOM 1137 CA GLY A 73 0.748 -4.624 -7.920 1.00 0.00 C ATOM 1138 C GLY A 73 0.087 -3.472 -7.191 1.00 0.00 C ATOM 1139 O GLY A 73 -1.140 -3.388 -7.132 1.00 0.00 O ATOM 0 H GLY A 73 -0.247 -6.266 -7.080 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.790 -4.374 -8.118 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.264 -4.763 -8.887 1.00 0.00 H new ATOM 1143 N ILE A 74 0.901 -2.582 -6.633 1.00 0.00 N ATOM 1144 CA ILE A 74 0.387 -1.429 -5.903 1.00 0.00 C ATOM 1145 C ILE A 74 0.384 -0.181 -6.779 1.00 0.00 C ATOM 1146 O ILE A 74 1.438 0.378 -7.084 1.00 0.00 O ATOM 1147 CB ILE A 74 1.215 -1.151 -4.635 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.233 -2.385 -3.731 1.00 0.00 C ATOM 1149 CG2 ILE A 74 0.654 0.051 -3.890 1.00 0.00 C ATOM 1150 CD1 ILE A 74 -0.134 -2.778 -3.217 1.00 0.00 C ATOM 0 H ILE A 74 1.919 -2.637 -6.672 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.636 -1.669 -5.613 1.00 0.00 H new ATOM 0 HB ILE A 74 2.240 -0.925 -4.929 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.660 -3.223 -4.282 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.890 -2.194 -2.883 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.250 0.235 -2.996 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.688 0.928 -4.536 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.379 -0.148 -3.603 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.045 -3.660 -2.583 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.555 -1.956 -2.638 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.789 -3.001 -4.059 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.807 0.251 -7.179 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.947 1.435 -8.018 1.00 0.00 C ATOM 1164 C ILE A 75 -1.658 2.558 -7.269 1.00 0.00 C ATOM 1165 O ILE A 75 -2.849 2.463 -6.971 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.725 1.122 -9.310 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -1.103 -0.078 -10.027 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.747 2.338 -10.223 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -2.072 -0.816 -10.923 1.00 0.00 C ATOM 0 H ILE A 75 -1.689 -0.201 -6.936 1.00 0.00 H new ATOM 0 HA ILE A 75 0.061 1.757 -8.280 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.753 0.872 -9.046 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.258 0.264 -10.624 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.709 -0.771 -9.283 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.300 2.101 -11.132 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.231 3.169 -9.710 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.726 2.617 -10.483 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.562 -1.654 -11.398 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.906 -1.189 -10.328 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.448 -0.138 -11.689 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.921 3.622 -6.970 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.481 4.765 -6.259 1.00 0.00 C ATOM 1183 C VAL A 76 -1.642 5.964 -7.187 1.00 0.00 C ATOM 1184 O VAL A 76 -0.677 6.427 -7.796 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.599 5.170 -5.063 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.171 6.396 -4.368 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.458 4.011 -4.089 1.00 0.00 C ATOM 0 H VAL A 76 0.066 3.717 -7.209 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.460 4.460 -5.891 1.00 0.00 H new ATOM 0 HB VAL A 76 0.393 5.424 -5.435 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.534 6.667 -3.526 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.214 7.227 -5.072 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.175 6.174 -4.007 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.168 4.315 -3.250 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.443 3.723 -3.721 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.002 3.163 -4.597 1.00 0.00 H new ATOM 1197 N LYS A 77 -2.869 6.465 -7.290 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.158 7.612 -8.142 1.00 0.00 C ATOM 1199 C LYS A 77 -4.110 8.580 -7.446 1.00 0.00 C ATOM 1200 O LYS A 77 -4.522 8.351 -6.309 1.00 0.00 O ATOM 1201 CB LYS A 77 -3.765 7.148 -9.468 1.00 0.00 C ATOM 1202 CG LYS A 77 -2.879 6.184 -10.238 1.00 0.00 C ATOM 1203 CD LYS A 77 -3.665 5.427 -11.295 1.00 0.00 C ATOM 1204 CE LYS A 77 -2.743 4.763 -12.306 1.00 0.00 C ATOM 1205 NZ LYS A 77 -3.456 3.738 -13.117 1.00 0.00 N ATOM 0 H LYS A 77 -3.679 6.094 -6.794 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.220 8.131 -8.341 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.724 6.669 -9.271 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.966 8.020 -10.091 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.067 6.735 -10.712 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.423 5.476 -9.546 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.286 4.670 -10.816 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.338 6.113 -11.810 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.323 5.521 -12.967 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -1.908 4.296 -11.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.794 3.309 -13.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -3.836 3.001 -12.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.238 4.187 -13.635 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.458 9.660 -8.137 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.364 10.661 -7.586 1.00 0.00 C ATOM 1221 C ASP A 78 -6.805 10.374 -7.996 1.00 0.00 C ATOM 1222 O ASP A 78 -7.263 10.818 -9.049 1.00 0.00 O ATOM 1223 CB ASP A 78 -4.957 12.060 -8.054 1.00 0.00 C ATOM 1224 CG ASP A 78 -4.444 12.067 -9.480 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -4.942 11.262 -10.295 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -3.544 12.879 -9.782 1.00 0.00 O ATOM 0 H ASP A 78 -4.126 9.865 -9.080 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.298 10.616 -6.499 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.814 12.730 -7.976 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.185 12.451 -7.391 1.00 0.00 H new ATOM 1231 N PHE A 79 -7.515 9.627 -7.157 1.00 0.00 N ATOM 1232 CA PHE A 79 -8.904 9.278 -7.432 1.00 0.00 C ATOM 1233 C PHE A 79 -9.684 10.495 -7.919 1.00 0.00 C ATOM 1234 O PHE A 79 -10.430 10.416 -8.895 1.00 0.00 O ATOM 1235 CB PHE A 79 -9.565 8.702 -6.178 1.00 0.00 C ATOM 1236 CG PHE A 79 -10.981 8.251 -6.400 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -11.982 9.173 -6.662 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -11.310 6.907 -6.346 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -13.286 8.761 -6.867 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -12.612 6.489 -6.551 1.00 0.00 C ATOM 1241 CZ PHE A 79 -13.601 7.418 -6.811 1.00 0.00 C ATOM 0 H PHE A 79 -7.151 9.252 -6.281 1.00 0.00 H new ATOM 0 HA PHE A 79 -8.914 8.524 -8.219 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -8.975 7.858 -5.821 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.551 9.456 -5.391 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -11.741 10.225 -6.707 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.541 6.177 -6.141 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -14.057 9.489 -7.071 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -12.856 5.438 -6.508 1.00 0.00 H new ATOM 0 HZ PHE A 79 -14.619 7.094 -6.970 1.00 0.00 H new ATOM 1378 N ILE A 88 0.223 9.021 -9.569 1.00 0.00 N ATOM 1379 CA ILE A 88 1.067 9.432 -8.454 1.00 0.00 C ATOM 1380 C ILE A 88 2.284 8.522 -8.321 1.00 0.00 C ATOM 1381 O ILE A 88 3.424 8.983 -8.361 1.00 0.00 O ATOM 1382 CB ILE A 88 0.288 9.425 -7.126 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.829 10.471 -7.159 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.228 9.685 -5.959 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.800 10.355 -6.005 1.00 0.00 C ATOM 0 HA ILE A 88 1.398 10.449 -8.667 1.00 0.00 H new ATOM 0 HB ILE A 88 -0.163 8.442 -6.992 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.384 11.466 -7.150 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.378 10.375 -8.096 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.662 9.677 -5.027 1.00 0.00 H new ATOM 0 HG22 ILE A 88 1.991 8.908 -5.927 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.705 10.657 -6.085 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.564 11.127 -6.093 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -2.273 9.373 -6.025 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.264 10.481 -5.064 1.00 0.00 H new ATOM 1397 N GLY A 89 2.033 7.226 -8.165 1.00 0.00 N ATOM 1398 CA GLY A 89 3.117 6.271 -8.031 1.00 0.00 C ATOM 1399 C GLY A 89 2.637 4.835 -8.103 1.00 0.00 C ATOM 1400 O GLY A 89 1.486 4.540 -7.781 1.00 0.00 O ATOM 0 H GLY A 89 1.098 6.820 -8.129 1.00 0.00 H new ATOM 0 HA2 GLY A 89 3.850 6.446 -8.818 1.00 0.00 H new ATOM 0 HA3 GLY A 89 3.625 6.434 -7.080 1.00 0.00 H new ATOM 1404 N THR A 90 3.522 3.938 -8.528 1.00 0.00 N ATOM 1405 CA THR A 90 3.182 2.525 -8.644 1.00 0.00 C ATOM 1406 C THR A 90 4.358 1.642 -8.242 1.00 0.00 C ATOM 1407 O THR A 90 5.448 1.751 -8.803 1.00 0.00 O ATOM 1408 CB THR A 90 2.752 2.167 -10.079 1.00 0.00 C ATOM 1409 OG1 THR A 90 3.838 2.388 -10.985 1.00 0.00 O ATOM 1410 CG2 THR A 90 1.550 2.996 -10.507 1.00 0.00 C ATOM 0 H THR A 90 4.479 4.165 -8.797 1.00 0.00 H new ATOM 0 HA THR A 90 2.347 2.344 -7.967 1.00 0.00 H new ATOM 0 HB THR A 90 2.472 1.114 -10.099 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.085 3.336 -10.974 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.265 2.725 -11.524 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.716 2.803 -9.832 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.807 4.055 -10.472 1.00 0.00 H new ATOM 1418 N ALA A 91 4.129 0.767 -7.269 1.00 0.00 N ATOM 1419 CA ALA A 91 5.169 -0.137 -6.795 1.00 0.00 C ATOM 1420 C ALA A 91 4.685 -1.583 -6.801 1.00 0.00 C ATOM 1421 O ALA A 91 3.504 -1.855 -6.581 1.00 0.00 O ATOM 1422 CB ALA A 91 5.621 0.264 -5.398 1.00 0.00 C ATOM 0 H ALA A 91 3.232 0.665 -6.794 1.00 0.00 H new ATOM 0 HA ALA A 91 6.017 -0.062 -7.475 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.398 -0.420 -5.057 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.016 1.280 -5.421 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.773 0.220 -4.715 1.00 0.00 H new ATOM 1428 N THR A 92 5.604 -2.510 -7.055 1.00 0.00 N ATOM 1429 CA THR A 92 5.270 -3.928 -7.091 1.00 0.00 C ATOM 1430 C THR A 92 6.034 -4.700 -6.023 1.00 0.00 C ATOM 1431 O THR A 92 7.253 -4.575 -5.904 1.00 0.00 O ATOM 1432 CB THR A 92 5.576 -4.542 -8.471 1.00 0.00 C ATOM 1433 OG1 THR A 92 4.806 -3.882 -9.482 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.267 -6.031 -8.481 1.00 0.00 C ATOM 0 H THR A 92 6.586 -2.303 -7.239 1.00 0.00 H new ATOM 0 HA THR A 92 4.200 -4.006 -6.896 1.00 0.00 H new ATOM 0 HB THR A 92 6.638 -4.407 -8.678 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.007 -4.277 -10.356 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.491 -6.442 -9.465 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.876 -6.534 -7.730 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.212 -6.185 -8.255 1.00 0.00 H new ATOM 1442 N VAL A 93 5.311 -5.502 -5.247 1.00 0.00 N ATOM 1443 CA VAL A 93 5.922 -6.297 -4.188 1.00 0.00 C ATOM 1444 C VAL A 93 6.095 -7.748 -4.622 1.00 0.00 C ATOM 1445 O VAL A 93 5.117 -8.470 -4.813 1.00 0.00 O ATOM 1446 CB VAL A 93 5.081 -6.255 -2.898 1.00 0.00 C ATOM 1447 CG1 VAL A 93 5.792 -6.991 -1.773 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.786 -4.816 -2.502 1.00 0.00 C ATOM 0 H VAL A 93 4.301 -5.618 -5.332 1.00 0.00 H new ATOM 0 HA VAL A 93 6.901 -5.861 -3.989 1.00 0.00 H new ATOM 0 HB VAL A 93 4.133 -6.758 -3.086 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.183 -6.951 -0.870 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.947 -8.031 -2.060 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.756 -6.519 -1.582 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.191 -4.805 -1.589 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.723 -4.286 -2.331 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.232 -4.325 -3.302 1.00 0.00 H new ATOM 1458 N ALA A 94 7.346 -8.169 -4.774 1.00 0.00 N ATOM 1459 CA ALA A 94 7.648 -9.535 -5.183 1.00 0.00 C ATOM 1460 C ALA A 94 7.393 -10.518 -4.045 1.00 0.00 C ATOM 1461 O ALA A 94 8.121 -10.536 -3.052 1.00 0.00 O ATOM 1462 CB ALA A 94 9.090 -9.638 -5.657 1.00 0.00 C ATOM 0 H ALA A 94 8.167 -7.584 -4.620 1.00 0.00 H new ATOM 0 HA ALA A 94 6.986 -9.795 -6.009 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.301 -10.664 -5.959 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.243 -8.971 -6.505 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.761 -9.353 -4.846 1.00 0.00 H new ATOM 1468 N LEU A 95 6.354 -11.332 -4.195 1.00 0.00 N ATOM 1469 CA LEU A 95 6.001 -12.318 -3.179 1.00 0.00 C ATOM 1470 C LEU A 95 6.915 -13.536 -3.262 1.00 0.00 C ATOM 1471 O LEU A 95 6.672 -14.553 -2.613 1.00 0.00 O ATOM 1472 CB LEU A 95 4.543 -12.748 -3.342 1.00 0.00 C ATOM 1473 CG LEU A 95 3.519 -11.619 -3.465 1.00 0.00 C ATOM 1474 CD1 LEU A 95 2.177 -12.163 -3.929 1.00 0.00 C ATOM 1475 CD2 LEU A 95 3.371 -10.887 -2.140 1.00 0.00 C ATOM 0 H LEU A 95 5.741 -11.329 -5.010 1.00 0.00 H new ATOM 0 HA LEU A 95 6.129 -11.856 -2.200 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.468 -13.378 -4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.270 -13.367 -2.487 1.00 0.00 H new ATOM 0 HG LEU A 95 3.877 -10.910 -4.211 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.461 -11.345 -4.011 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.295 -12.641 -4.902 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.812 -12.894 -3.208 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.638 -10.087 -2.246 1.00 0.00 H new ATOM 0 HD22 LEU A 95 3.036 -11.586 -1.374 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.332 -10.463 -1.849 1.00 0.00 H new ATOM 1487 N LYS A 96 7.970 -13.425 -4.062 1.00 0.00 N ATOM 1488 CA LYS A 96 8.924 -14.515 -4.228 1.00 0.00 C ATOM 1489 C LYS A 96 9.623 -14.831 -2.910 1.00 0.00 C ATOM 1490 O LYS A 96 10.093 -15.949 -2.698 1.00 0.00 O ATOM 1491 CB LYS A 96 9.961 -14.155 -5.294 1.00 0.00 C ATOM 1492 CG LYS A 96 10.999 -13.153 -4.819 1.00 0.00 C ATOM 1493 CD LYS A 96 12.150 -13.840 -4.105 1.00 0.00 C ATOM 1494 CE LYS A 96 13.407 -12.983 -4.121 1.00 0.00 C ATOM 1495 NZ LYS A 96 14.207 -13.195 -5.359 1.00 0.00 N ATOM 0 H LYS A 96 8.186 -12.590 -4.606 1.00 0.00 H new ATOM 0 HA LYS A 96 8.374 -15.400 -4.549 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.467 -15.064 -5.618 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.448 -13.748 -6.165 1.00 0.00 H new ATOM 0 HG2 LYS A 96 11.381 -12.592 -5.672 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.531 -12.433 -4.148 1.00 0.00 H new ATOM 0 HD2 LYS A 96 11.866 -14.052 -3.074 1.00 0.00 H new ATOM 0 HD3 LYS A 96 12.356 -14.798 -4.582 1.00 0.00 H new ATOM 0 HE2 LYS A 96 13.131 -11.932 -4.043 1.00 0.00 H new ATOM 0 HE3 LYS A 96 14.018 -13.218 -3.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 15.055 -12.593 -5.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 14.492 -14.193 -5.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.633 -12.947 -6.190 1.00 0.00 H new ATOM 1509 N ASP A 97 9.687 -13.840 -2.027 1.00 0.00 N ATOM 1510 CA ASP A 97 10.327 -14.014 -0.728 1.00 0.00 C ATOM 1511 C ASP A 97 9.399 -14.738 0.242 1.00 0.00 C ATOM 1512 O ASP A 97 9.848 -15.522 1.079 1.00 0.00 O ATOM 1513 CB ASP A 97 10.732 -12.657 -0.150 1.00 0.00 C ATOM 1514 CG ASP A 97 12.006 -12.120 -0.771 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.936 -12.919 -1.002 1.00 0.00 O ATOM 1516 OD2 ASP A 97 12.072 -10.899 -1.027 1.00 0.00 O ATOM 0 H ASP A 97 9.304 -12.908 -2.187 1.00 0.00 H new ATOM 0 HA ASP A 97 11.221 -14.622 -0.869 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.925 -11.942 -0.309 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.868 -12.750 0.927 1.00 0.00 H new ATOM 1521 N LEU A 98 8.103 -14.470 0.125 1.00 0.00 N ATOM 1522 CA LEU A 98 7.111 -15.096 0.992 1.00 0.00 C ATOM 1523 C LEU A 98 6.926 -16.567 0.636 1.00 0.00 C ATOM 1524 O LEU A 98 6.800 -17.420 1.515 1.00 0.00 O ATOM 1525 CB LEU A 98 5.774 -14.361 0.883 1.00 0.00 C ATOM 1526 CG LEU A 98 5.817 -12.850 1.114 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.506 -12.207 0.690 1.00 0.00 C ATOM 1528 CD2 LEU A 98 6.117 -12.542 2.574 1.00 0.00 C ATOM 0 H LEU A 98 7.715 -13.823 -0.562 1.00 0.00 H new ATOM 0 HA LEU A 98 7.471 -15.033 2.019 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.361 -14.545 -0.109 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.082 -14.799 1.603 1.00 0.00 H new ATOM 0 HG LEU A 98 6.617 -12.431 0.503 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.556 -11.132 0.862 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.333 -12.398 -0.369 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.688 -12.630 1.273 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.144 -11.462 2.720 1.00 0.00 H new ATOM 0 HD22 LEU A 98 5.340 -12.974 3.204 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.083 -12.969 2.845 1.00 0.00 H new ATOM 1540 N THR A 99 6.913 -16.860 -0.661 1.00 0.00 N ATOM 1541 CA THR A 99 6.745 -18.228 -1.135 1.00 0.00 C ATOM 1542 C THR A 99 7.447 -19.218 -0.213 1.00 0.00 C ATOM 1543 O THR A 99 8.646 -19.106 0.037 1.00 0.00 O ATOM 1544 CB THR A 99 7.291 -18.398 -2.565 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.679 -18.048 -2.604 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.516 -17.533 -3.547 1.00 0.00 C ATOM 0 H THR A 99 7.017 -16.167 -1.402 1.00 0.00 H new ATOM 0 HA THR A 99 5.675 -18.434 -1.137 1.00 0.00 H new ATOM 0 HB THR A 99 7.172 -19.442 -2.854 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.783 -17.099 -2.382 1.00 0.00 H new ATOM 0 HG21 THR A 99 6.920 -17.670 -4.550 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.465 -17.823 -3.536 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.607 -16.486 -3.259 1.00 0.00 H new ATOM 1554 N GLY A 100 6.691 -20.190 0.289 1.00 0.00 N ATOM 1555 CA GLY A 100 7.259 -21.188 1.178 1.00 0.00 C ATOM 1556 C GLY A 100 6.264 -22.271 1.544 1.00 0.00 C ATOM 1557 O GLY A 100 5.201 -22.379 0.933 1.00 0.00 O ATOM 0 H GLY A 100 5.696 -20.304 0.096 1.00 0.00 H new ATOM 0 HA2 GLY A 100 8.127 -21.643 0.701 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.613 -20.701 2.087 1.00 0.00 H new ATOM 1561 N ASP A 101 6.611 -23.077 2.542 1.00 0.00 N ATOM 1562 CA ASP A 101 5.741 -24.159 2.988 1.00 0.00 C ATOM 1563 C ASP A 101 5.061 -23.801 4.306 1.00 0.00 C ATOM 1564 O ASP A 101 4.359 -24.622 4.895 1.00 0.00 O ATOM 1565 CB ASP A 101 6.541 -25.453 3.147 1.00 0.00 C ATOM 1566 CG ASP A 101 6.643 -26.233 1.852 1.00 0.00 C ATOM 1567 OD1 ASP A 101 5.589 -26.520 1.247 1.00 0.00 O ATOM 1568 OD2 ASP A 101 7.778 -26.559 1.443 1.00 0.00 O ATOM 0 H ASP A 101 7.488 -23.001 3.057 1.00 0.00 H new ATOM 0 HA ASP A 101 4.971 -24.308 2.231 1.00 0.00 H new ATOM 0 HB2 ASP A 101 7.543 -25.216 3.505 1.00 0.00 H new ATOM 0 HB3 ASP A 101 6.071 -26.077 3.907 1.00 0.00 H new ATOM 1573 N GLN A 102 5.275 -22.571 4.761 1.00 0.00 N ATOM 1574 CA GLN A 102 4.684 -22.106 6.010 1.00 0.00 C ATOM 1575 C GLN A 102 4.337 -20.622 5.929 1.00 0.00 C ATOM 1576 O GLN A 102 4.970 -19.867 5.192 1.00 0.00 O ATOM 1577 CB GLN A 102 5.642 -22.355 7.176 1.00 0.00 C ATOM 1578 CG GLN A 102 5.604 -23.781 7.701 1.00 0.00 C ATOM 1579 CD GLN A 102 6.735 -24.078 8.666 1.00 0.00 C ATOM 1580 OE1 GLN A 102 7.879 -24.277 8.258 1.00 0.00 O ATOM 1581 NE2 GLN A 102 6.419 -24.110 9.956 1.00 0.00 N ATOM 0 H GLN A 102 5.853 -21.879 4.284 1.00 0.00 H new ATOM 0 HA GLN A 102 3.765 -22.667 6.179 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.658 -22.121 6.857 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.398 -21.671 7.989 1.00 0.00 H new ATOM 0 HG2 GLN A 102 4.651 -23.955 8.200 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.656 -24.475 6.862 1.00 0.00 H new ATOM 0 HE21 GLN A 102 5.457 -23.939 10.250 1.00 0.00 H new ATOM 0 HE22 GLN A 102 7.138 -24.305 10.653 1.00 0.00 H new ATOM 1590 N SER A 103 3.329 -20.213 6.692 1.00 0.00 N ATOM 1591 CA SER A 103 2.896 -18.821 6.704 1.00 0.00 C ATOM 1592 C SER A 103 4.081 -17.885 6.921 1.00 0.00 C ATOM 1593 O SER A 103 4.935 -18.134 7.772 1.00 0.00 O ATOM 1594 CB SER A 103 1.849 -18.599 7.798 1.00 0.00 C ATOM 1595 OG SER A 103 1.381 -17.262 7.793 1.00 0.00 O ATOM 0 H SER A 103 2.797 -20.826 7.310 1.00 0.00 H new ATOM 0 HA SER A 103 2.451 -18.597 5.735 1.00 0.00 H new ATOM 0 HB2 SER A 103 1.012 -19.281 7.648 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.280 -18.833 8.771 1.00 0.00 H new ATOM 0 HG SER A 103 0.401 -17.258 7.784 1.00 0.00 H new ATOM 1601 N ARG A 104 4.125 -16.807 6.145 1.00 0.00 N ATOM 1602 CA ARG A 104 5.205 -15.833 6.251 1.00 0.00 C ATOM 1603 C ARG A 104 4.699 -14.425 5.950 1.00 0.00 C ATOM 1604 O ARG A 104 4.243 -14.142 4.842 1.00 0.00 O ATOM 1605 CB ARG A 104 6.341 -16.194 5.292 1.00 0.00 C ATOM 1606 CG ARG A 104 7.486 -15.194 5.300 1.00 0.00 C ATOM 1607 CD ARG A 104 8.812 -15.864 4.977 1.00 0.00 C ATOM 1608 NE ARG A 104 8.720 -16.721 3.797 1.00 0.00 N ATOM 1609 CZ ARG A 104 9.572 -17.705 3.536 1.00 0.00 C ATOM 1610 NH1 ARG A 104 10.575 -17.956 4.365 1.00 0.00 N ATOM 1611 NH2 ARG A 104 9.422 -18.441 2.442 1.00 0.00 N ATOM 0 H ARG A 104 3.426 -16.586 5.436 1.00 0.00 H new ATOM 0 HA ARG A 104 5.581 -15.854 7.274 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.728 -17.179 5.555 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.942 -16.268 4.281 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.288 -14.407 4.573 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.547 -14.717 6.278 1.00 0.00 H new ATOM 0 HD2 ARG A 104 9.573 -15.101 4.812 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.136 -16.458 5.832 1.00 0.00 H new ATOM 0 HE ARG A 104 7.960 -16.554 3.138 1.00 0.00 H new ATOM 0 HH11 ARG A 104 10.694 -17.392 5.207 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.228 -18.713 4.161 1.00 0.00 H new ATOM 0 HH21 ARG A 104 8.652 -18.251 1.801 1.00 0.00 H new ATOM 0 HH22 ARG A 104 10.077 -19.197 2.242 1.00 0.00 H new ATOM 1625 N SER A 105 4.783 -13.547 6.944 1.00 0.00 N ATOM 1626 CA SER A 105 4.330 -12.170 6.787 1.00 0.00 C ATOM 1627 C SER A 105 5.482 -11.192 6.994 1.00 0.00 C ATOM 1628 O SER A 105 5.930 -10.971 8.120 1.00 0.00 O ATOM 1629 CB SER A 105 3.204 -11.865 7.778 1.00 0.00 C ATOM 1630 OG SER A 105 3.576 -12.221 9.098 1.00 0.00 O ATOM 0 H SER A 105 5.160 -13.764 7.866 1.00 0.00 H new ATOM 0 HA SER A 105 3.953 -12.051 5.771 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.959 -10.804 7.740 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.305 -12.410 7.491 1.00 0.00 H new ATOM 0 HG SER A 105 4.500 -11.939 9.265 1.00 0.00 H new ATOM 1636 N LEU A 106 5.958 -10.609 5.899 1.00 0.00 N ATOM 1637 CA LEU A 106 7.059 -9.654 5.958 1.00 0.00 C ATOM 1638 C LEU A 106 6.553 -8.227 5.775 1.00 0.00 C ATOM 1639 O LEU A 106 5.915 -7.892 4.776 1.00 0.00 O ATOM 1640 CB LEU A 106 8.101 -9.979 4.886 1.00 0.00 C ATOM 1641 CG LEU A 106 8.805 -11.330 5.023 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.338 -11.792 3.675 1.00 0.00 C ATOM 1643 CD2 LEU A 106 9.931 -11.244 6.043 1.00 0.00 C ATOM 0 H LEU A 106 5.599 -10.781 4.960 1.00 0.00 H new ATOM 0 HA LEU A 106 7.522 -9.732 6.942 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.614 -9.943 3.911 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.858 -9.195 4.894 1.00 0.00 H new ATOM 0 HG LEU A 106 8.079 -12.063 5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.836 -12.755 3.791 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.511 -11.894 2.972 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.050 -11.059 3.295 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.420 -12.214 6.127 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.657 -10.498 5.721 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.523 -10.958 7.012 1.00 0.00 H new ATOM 1655 N PRO A 107 6.844 -7.364 6.760 1.00 0.00 N ATOM 1656 CA PRO A 107 6.430 -5.958 6.728 1.00 0.00 C ATOM 1657 C PRO A 107 7.180 -5.156 5.671 1.00 0.00 C ATOM 1658 O PRO A 107 8.354 -4.827 5.844 1.00 0.00 O ATOM 1659 CB PRO A 107 6.781 -5.454 8.130 1.00 0.00 C ATOM 1660 CG PRO A 107 7.878 -6.349 8.592 1.00 0.00 C ATOM 1661 CD PRO A 107 7.601 -7.694 7.979 1.00 0.00 C ATOM 0 HA PRO A 107 5.376 -5.849 6.472 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.103 -4.413 8.107 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.920 -5.507 8.796 1.00 0.00 H new ATOM 0 HG2 PRO A 107 8.850 -5.969 8.277 1.00 0.00 H new ATOM 0 HG3 PRO A 107 7.898 -6.413 9.680 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.523 -8.228 7.747 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.024 -8.330 8.650 1.00 0.00 H new ATOM 1669 N TYR A 108 6.496 -4.844 4.576 1.00 0.00 N ATOM 1670 CA TYR A 108 7.099 -4.082 3.489 1.00 0.00 C ATOM 1671 C TYR A 108 6.886 -2.584 3.690 1.00 0.00 C ATOM 1672 O TYR A 108 5.811 -2.055 3.405 1.00 0.00 O ATOM 1673 CB TYR A 108 6.511 -4.517 2.145 1.00 0.00 C ATOM 1674 CG TYR A 108 7.003 -5.868 1.678 1.00 0.00 C ATOM 1675 CD1 TYR A 108 8.173 -5.985 0.937 1.00 0.00 C ATOM 1676 CD2 TYR A 108 6.299 -7.027 1.977 1.00 0.00 C ATOM 1677 CE1 TYR A 108 8.626 -7.217 0.507 1.00 0.00 C ATOM 1678 CE2 TYR A 108 6.745 -8.264 1.552 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.909 -8.353 0.818 1.00 0.00 C ATOM 1680 OH TYR A 108 8.356 -9.583 0.392 1.00 0.00 O ATOM 0 H TYR A 108 5.523 -5.107 4.418 1.00 0.00 H new ATOM 0 HA TYR A 108 8.171 -4.281 3.490 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.424 -4.543 2.225 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.757 -3.769 1.391 1.00 0.00 H new ATOM 0 HD1 TYR A 108 8.738 -5.097 0.693 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.387 -6.961 2.552 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.536 -7.290 -0.069 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.185 -9.156 1.793 1.00 0.00 H new ATOM 0 HH TYR A 108 7.737 -10.279 0.696 1.00 0.00 H new ATOM 1690 N LYS A 109 7.918 -1.907 4.181 1.00 0.00 N ATOM 1691 CA LYS A 109 7.847 -0.470 4.419 1.00 0.00 C ATOM 1692 C LYS A 109 8.906 0.269 3.608 1.00 0.00 C ATOM 1693 O LYS A 109 9.821 -0.345 3.057 1.00 0.00 O ATOM 1694 CB LYS A 109 8.028 -0.169 5.908 1.00 0.00 C ATOM 1695 CG LYS A 109 7.197 -1.061 6.815 1.00 0.00 C ATOM 1696 CD LYS A 109 6.808 -0.346 8.097 1.00 0.00 C ATOM 1697 CE LYS A 109 6.345 -1.326 9.164 1.00 0.00 C ATOM 1698 NZ LYS A 109 5.441 -0.680 10.155 1.00 0.00 N ATOM 0 H LYS A 109 8.814 -2.330 4.422 1.00 0.00 H new ATOM 0 HA LYS A 109 6.864 -0.123 4.101 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.081 -0.281 6.167 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.763 0.872 6.094 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.298 -1.380 6.288 1.00 0.00 H new ATOM 0 HG3 LYS A 109 7.761 -1.962 7.057 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.659 0.224 8.470 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.012 0.369 7.889 1.00 0.00 H new ATOM 0 HE2 LYS A 109 5.828 -2.161 8.691 1.00 0.00 H new ATOM 0 HE3 LYS A 109 7.212 -1.739 9.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 4.988 -1.411 10.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 5.992 -0.042 10.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 4.710 -0.135 9.655 1.00 0.00 H new ATOM 1712 N LEU A 110 8.778 1.589 3.539 1.00 0.00 N ATOM 1713 CA LEU A 110 9.726 2.412 2.796 1.00 0.00 C ATOM 1714 C LEU A 110 9.800 1.974 1.337 1.00 0.00 C ATOM 1715 O LEU A 110 10.880 1.936 0.745 1.00 0.00 O ATOM 1716 CB LEU A 110 11.113 2.332 3.436 1.00 0.00 C ATOM 1717 CG LEU A 110 11.174 2.594 4.941 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.331 1.833 5.569 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.300 4.085 5.218 1.00 0.00 C ATOM 0 H LEU A 110 8.027 2.113 3.989 1.00 0.00 H new ATOM 0 HA LEU A 110 9.377 3.444 2.829 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.523 1.341 3.243 1.00 0.00 H new ATOM 0 HB3 LEU A 110 11.764 3.049 2.936 1.00 0.00 H new ATOM 0 HG LEU A 110 10.247 2.239 5.390 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.358 2.032 6.640 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.197 0.764 5.402 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.268 2.157 5.116 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.342 4.253 6.294 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.211 4.465 4.756 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.437 4.606 4.803 1.00 0.00 H new ATOM 1731 N ILE A 111 8.648 1.648 0.763 1.00 0.00 N ATOM 1732 CA ILE A 111 8.582 1.216 -0.628 1.00 0.00 C ATOM 1733 C ILE A 111 8.644 2.408 -1.577 1.00 0.00 C ATOM 1734 O ILE A 111 7.838 3.333 -1.481 1.00 0.00 O ATOM 1735 CB ILE A 111 7.297 0.416 -0.910 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.218 -0.804 0.010 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.247 -0.010 -2.369 1.00 0.00 C ATOM 1738 CD1 ILE A 111 5.860 -1.470 0.015 1.00 0.00 C ATOM 0 H ILE A 111 7.747 1.675 1.239 1.00 0.00 H new ATOM 0 HA ILE A 111 9.445 0.572 -0.799 1.00 0.00 H new ATOM 0 HB ILE A 111 6.437 1.055 -0.709 1.00 0.00 H new ATOM 0 HG12 ILE A 111 7.969 -1.531 -0.299 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.468 -0.499 1.026 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.333 -0.574 -2.552 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.262 0.874 -3.007 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.111 -0.635 -2.595 1.00 0.00 H new ATOM 0 HD11 ILE A 111 5.877 -2.327 0.689 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.107 -0.758 0.353 1.00 0.00 H new ATOM 0 HD13 ILE A 111 5.616 -1.806 -0.993 1.00 0.00 H new ATOM 1750 N SER A 112 9.605 2.378 -2.495 1.00 0.00 N ATOM 1751 CA SER A 112 9.774 3.457 -3.461 1.00 0.00 C ATOM 1752 C SER A 112 8.796 3.304 -4.622 1.00 0.00 C ATOM 1753 O SER A 112 8.872 2.346 -5.391 1.00 0.00 O ATOM 1754 CB SER A 112 11.210 3.478 -3.988 1.00 0.00 C ATOM 1755 OG SER A 112 12.045 4.270 -3.162 1.00 0.00 O ATOM 0 H SER A 112 10.279 1.618 -2.590 1.00 0.00 H new ATOM 0 HA SER A 112 9.567 4.400 -2.956 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.599 2.461 -4.034 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.222 3.870 -5.005 1.00 0.00 H new ATOM 0 HG SER A 112 12.958 4.266 -3.519 1.00 0.00 H new ATOM 1761 N LEU A 113 7.877 4.256 -4.742 1.00 0.00 N ATOM 1762 CA LEU A 113 6.882 4.229 -5.809 1.00 0.00 C ATOM 1763 C LEU A 113 7.474 4.742 -7.118 1.00 0.00 C ATOM 1764 O LEU A 113 8.386 5.570 -7.117 1.00 0.00 O ATOM 1765 CB LEU A 113 5.666 5.072 -5.420 1.00 0.00 C ATOM 1766 CG LEU A 113 4.774 4.496 -4.321 1.00 0.00 C ATOM 1767 CD1 LEU A 113 3.779 5.541 -3.838 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.047 3.256 -4.820 1.00 0.00 C ATOM 0 H LEU A 113 7.800 5.056 -4.114 1.00 0.00 H new ATOM 0 HA LEU A 113 6.568 3.195 -5.954 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.017 6.053 -5.099 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.057 5.227 -6.310 1.00 0.00 H new ATOM 0 HG LEU A 113 5.406 4.209 -3.480 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.152 5.113 -3.056 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.318 6.401 -3.441 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.152 5.859 -4.671 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.416 2.859 -4.024 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.427 3.518 -5.678 1.00 0.00 H new ATOM 0 HD23 LEU A 113 4.776 2.501 -5.116 1.00 0.00 H new ATOM 1780 N LEU A 114 6.948 4.248 -8.233 1.00 0.00 N ATOM 1781 CA LEU A 114 7.422 4.657 -9.550 1.00 0.00 C ATOM 1782 C LEU A 114 6.259 5.089 -10.437 1.00 0.00 C ATOM 1783 O LEU A 114 5.175 4.510 -10.382 1.00 0.00 O ATOM 1784 CB LEU A 114 8.190 3.514 -10.216 1.00 0.00 C ATOM 1785 CG LEU A 114 9.181 2.764 -9.326 1.00 0.00 C ATOM 1786 CD1 LEU A 114 9.461 1.379 -9.888 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.474 3.554 -9.183 1.00 0.00 C ATOM 0 H LEU A 114 6.192 3.563 -8.251 1.00 0.00 H new ATOM 0 HA LEU A 114 8.091 5.508 -9.420 1.00 0.00 H new ATOM 0 HB2 LEU A 114 7.468 2.797 -10.606 1.00 0.00 H new ATOM 0 HB3 LEU A 114 8.733 3.917 -11.071 1.00 0.00 H new ATOM 0 HG LEU A 114 8.737 2.650 -8.337 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.168 0.860 -9.241 1.00 0.00 H new ATOM 0 HD12 LEU A 114 8.532 0.812 -9.938 1.00 0.00 H new ATOM 0 HD13 LEU A 114 9.884 1.471 -10.888 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.167 3.005 -8.546 1.00 0.00 H new ATOM 0 HD22 LEU A 114 10.922 3.700 -10.166 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.260 4.524 -8.734 1.00 0.00 H new ATOM 1799 N ASN A 115 6.493 6.108 -11.257 1.00 0.00 N ATOM 1800 CA ASN A 115 5.465 6.616 -12.158 1.00 0.00 C ATOM 1801 C ASN A 115 5.185 5.621 -13.280 1.00 0.00 C ATOM 1802 O ASN A 115 5.726 4.516 -13.291 1.00 0.00 O ATOM 1803 CB ASN A 115 5.895 7.960 -12.750 1.00 0.00 C ATOM 1804 CG ASN A 115 6.902 8.682 -11.875 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.183 8.432 -12.117 1.00 0.00 O flip ATOM 1806 ND2 ASN A 115 6.531 9.455 -10.992 1.00 0.00 N flip ATOM 0 H ASN A 115 7.385 6.598 -11.316 1.00 0.00 H new ATOM 0 HA ASN A 115 4.550 6.755 -11.583 1.00 0.00 H new ATOM 0 HB2 ASN A 115 6.327 7.797 -13.738 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.017 8.592 -12.886 1.00 0.00 H new ATOM 0 HD21 ASN A 115 5.535 9.617 -10.841 1.00 0.00 H new ATOM 0 HD22 ASN A 115 7.219 9.934 -10.411 1.00 0.00 H new ATOM 1813 N GLU A 116 4.336 6.022 -14.221 1.00 0.00 N ATOM 1814 CA GLU A 116 3.984 5.164 -15.347 1.00 0.00 C ATOM 1815 C GLU A 116 5.232 4.713 -16.098 1.00 0.00 C ATOM 1816 O GLU A 116 5.239 3.663 -16.742 1.00 0.00 O ATOM 1817 CB GLU A 116 3.039 5.899 -16.300 1.00 0.00 C ATOM 1818 CG GLU A 116 3.170 5.456 -17.748 1.00 0.00 C ATOM 1819 CD GLU A 116 1.893 5.665 -18.539 1.00 0.00 C ATOM 1820 OE1 GLU A 116 0.822 5.236 -18.060 1.00 0.00 O ATOM 1821 OE2 GLU A 116 1.965 6.256 -19.636 1.00 0.00 O ATOM 0 H GLU A 116 3.880 6.934 -14.226 1.00 0.00 H new ATOM 0 HA GLU A 116 3.479 4.281 -14.955 1.00 0.00 H new ATOM 0 HB2 GLU A 116 2.011 5.742 -15.972 1.00 0.00 H new ATOM 0 HB3 GLU A 116 3.233 6.970 -16.237 1.00 0.00 H new ATOM 0 HG2 GLU A 116 3.981 6.009 -18.221 1.00 0.00 H new ATOM 0 HG3 GLU A 116 3.443 4.401 -17.778 1.00 0.00 H new ATOM 1828 N LYS A 117 6.289 5.513 -16.012 1.00 0.00 N ATOM 1829 CA LYS A 117 7.545 5.198 -16.683 1.00 0.00 C ATOM 1830 C LYS A 117 8.398 4.264 -15.830 1.00 0.00 C ATOM 1831 O LYS A 117 9.177 3.468 -16.353 1.00 0.00 O ATOM 1832 CB LYS A 117 8.322 6.482 -16.984 1.00 0.00 C ATOM 1833 CG LYS A 117 7.629 7.391 -17.984 1.00 0.00 C ATOM 1834 CD LYS A 117 8.045 7.072 -19.410 1.00 0.00 C ATOM 1835 CE LYS A 117 7.027 7.587 -20.416 1.00 0.00 C ATOM 1836 NZ LYS A 117 7.645 7.851 -21.745 1.00 0.00 N ATOM 0 H LYS A 117 6.301 6.385 -15.484 1.00 0.00 H new ATOM 0 HA LYS A 117 7.311 4.694 -17.620 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.477 7.030 -16.054 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.308 6.219 -17.367 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.549 7.284 -17.887 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.868 8.430 -17.758 1.00 0.00 H new ATOM 0 HD2 LYS A 117 9.018 7.518 -19.615 1.00 0.00 H new ATOM 0 HD3 LYS A 117 8.158 5.994 -19.525 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.225 6.857 -20.527 1.00 0.00 H new ATOM 0 HE3 LYS A 117 6.574 8.503 -20.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 6.919 8.200 -22.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 8.393 8.566 -21.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 8.055 6.971 -22.118 1.00 0.00 H new ATOM 1850 N GLY A 118 8.243 4.366 -14.513 1.00 0.00 N ATOM 1851 CA GLY A 118 9.004 3.523 -13.610 1.00 0.00 C ATOM 1852 C GLY A 118 10.123 4.277 -12.917 1.00 0.00 C ATOM 1853 O GLY A 118 11.135 3.688 -12.540 1.00 0.00 O ATOM 0 H GLY A 118 7.604 5.017 -14.056 1.00 0.00 H new ATOM 0 HA2 GLY A 118 8.335 3.102 -12.860 1.00 0.00 H new ATOM 0 HA3 GLY A 118 9.425 2.686 -14.167 1.00 0.00 H new ATOM 1857 N GLN A 119 9.940 5.583 -12.752 1.00 0.00 N ATOM 1858 CA GLN A 119 10.943 6.418 -12.102 1.00 0.00 C ATOM 1859 C GLN A 119 10.526 6.762 -10.676 1.00 0.00 C ATOM 1860 O GLN A 119 9.352 7.017 -10.408 1.00 0.00 O ATOM 1861 CB GLN A 119 11.166 7.701 -12.905 1.00 0.00 C ATOM 1862 CG GLN A 119 11.265 7.472 -14.404 1.00 0.00 C ATOM 1863 CD GLN A 119 12.129 8.507 -15.097 1.00 0.00 C ATOM 1864 OE1 GLN A 119 11.627 9.503 -15.618 1.00 0.00 O ATOM 1865 NE2 GLN A 119 13.437 8.276 -15.107 1.00 0.00 N ATOM 0 H GLN A 119 9.107 6.085 -13.059 1.00 0.00 H new ATOM 0 HA GLN A 119 11.876 5.856 -12.061 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.347 8.392 -12.705 1.00 0.00 H new ATOM 0 HB3 GLN A 119 12.081 8.182 -12.558 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.675 6.479 -14.590 1.00 0.00 H new ATOM 0 HG3 GLN A 119 10.265 7.490 -14.837 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.810 7.437 -14.663 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.068 8.938 -15.559 1.00 0.00 H new ATOM 1874 N ASP A 120 11.494 6.766 -9.767 1.00 0.00 N ATOM 1875 CA ASP A 120 11.226 7.079 -8.368 1.00 0.00 C ATOM 1876 C ASP A 120 10.359 8.328 -8.246 1.00 0.00 C ATOM 1877 O ASP A 120 10.829 9.446 -8.457 1.00 0.00 O ATOM 1878 CB ASP A 120 12.539 7.278 -7.608 1.00 0.00 C ATOM 1879 CG ASP A 120 13.437 6.058 -7.674 1.00 0.00 C ATOM 1880 OD1 ASP A 120 13.212 5.113 -6.889 1.00 0.00 O ATOM 1881 OD2 ASP A 120 14.364 6.049 -8.510 1.00 0.00 O ATOM 0 H ASP A 120 12.471 6.556 -9.973 1.00 0.00 H new ATOM 0 HA ASP A 120 10.685 6.240 -7.931 1.00 0.00 H new ATOM 0 HB2 ASP A 120 13.068 8.137 -8.021 1.00 0.00 H new ATOM 0 HB3 ASP A 120 12.321 7.509 -6.565 1.00 0.00 H new ATOM 1886 N THR A 121 9.089 8.130 -7.906 1.00 0.00 N ATOM 1887 CA THR A 121 8.156 9.239 -7.759 1.00 0.00 C ATOM 1888 C THR A 121 8.479 10.070 -6.522 1.00 0.00 C ATOM 1889 O THR A 121 8.129 11.247 -6.444 1.00 0.00 O ATOM 1890 CB THR A 121 6.701 8.741 -7.663 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.532 7.950 -6.481 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.329 7.918 -8.887 1.00 0.00 C ATOM 0 H THR A 121 8.684 7.211 -7.727 1.00 0.00 H new ATOM 0 HA THR A 121 8.262 9.860 -8.648 1.00 0.00 H new ATOM 0 HB THR A 121 6.045 9.610 -7.616 1.00 0.00 H new ATOM 0 HG1 THR A 121 5.579 7.772 -6.340 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.298 7.577 -8.797 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.432 8.531 -9.782 1.00 0.00 H new ATOM 0 HG23 THR A 121 6.991 7.055 -8.960 1.00 0.00 H new ATOM 1900 N GLY A 122 9.150 9.449 -5.557 1.00 0.00 N ATOM 1901 CA GLY A 122 9.509 10.147 -4.336 1.00 0.00 C ATOM 1902 C GLY A 122 8.493 9.942 -3.230 1.00 0.00 C ATOM 1903 O GLY A 122 8.437 10.720 -2.278 1.00 0.00 O ATOM 0 H GLY A 122 9.451 8.475 -5.599 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.485 9.801 -3.997 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.604 11.213 -4.545 1.00 0.00 H new ATOM 1907 N ALA A 123 7.687 8.893 -3.356 1.00 0.00 N ATOM 1908 CA ALA A 123 6.668 8.589 -2.360 1.00 0.00 C ATOM 1909 C ALA A 123 6.913 7.225 -1.722 1.00 0.00 C ATOM 1910 O ALA A 123 7.375 6.294 -2.382 1.00 0.00 O ATOM 1911 CB ALA A 123 5.283 8.638 -2.988 1.00 0.00 C ATOM 0 H ALA A 123 7.720 8.239 -4.138 1.00 0.00 H new ATOM 0 HA ALA A 123 6.726 9.344 -1.576 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.532 8.409 -2.232 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.101 9.635 -3.390 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.222 7.906 -3.793 1.00 0.00 H new ATOM 1917 N THR A 124 6.603 7.115 -0.434 1.00 0.00 N ATOM 1918 CA THR A 124 6.791 5.866 0.293 1.00 0.00 C ATOM 1919 C THR A 124 5.505 5.434 0.987 1.00 0.00 C ATOM 1920 O THR A 124 4.816 6.249 1.600 1.00 0.00 O ATOM 1921 CB THR A 124 7.911 5.991 1.343 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.519 6.909 2.369 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.206 6.463 0.700 1.00 0.00 C ATOM 0 H THR A 124 6.221 7.876 0.127 1.00 0.00 H new ATOM 0 HA THR A 124 7.074 5.112 -0.442 1.00 0.00 H new ATOM 0 HB THR A 124 8.080 5.007 1.781 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.235 6.982 3.034 1.00 0.00 H new ATOM 0 HG21 THR A 124 9.982 6.544 1.461 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.517 5.747 -0.060 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.049 7.437 0.238 1.00 0.00 H new ATOM 1931 N ILE A 125 5.187 4.147 0.887 1.00 0.00 N ATOM 1932 CA ILE A 125 3.983 3.608 1.507 1.00 0.00 C ATOM 1933 C ILE A 125 4.297 2.354 2.315 1.00 0.00 C ATOM 1934 O ILE A 125 5.020 1.470 1.855 1.00 0.00 O ATOM 1935 CB ILE A 125 2.910 3.272 0.455 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.662 2.701 1.132 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.460 2.290 -0.568 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.422 2.767 0.268 1.00 0.00 C ATOM 0 H ILE A 125 5.746 3.459 0.383 1.00 0.00 H new ATOM 0 HA ILE A 125 3.597 4.380 2.173 1.00 0.00 H new ATOM 0 HB ILE A 125 2.632 4.189 -0.064 1.00 0.00 H new ATOM 0 HG12 ILE A 125 1.850 1.663 1.405 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.479 3.246 2.058 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.690 2.062 -1.305 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.322 2.731 -1.069 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.763 1.372 -0.065 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.423 2.345 0.812 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.209 3.806 0.016 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.585 2.198 -0.647 1.00 0.00 H new ATOM 1950 N ASP A 126 3.747 2.282 3.523 1.00 0.00 N ATOM 1951 CA ASP A 126 3.965 1.134 4.395 1.00 0.00 C ATOM 1952 C ASP A 126 2.876 0.085 4.195 1.00 0.00 C ATOM 1953 O ASP A 126 1.685 0.395 4.234 1.00 0.00 O ATOM 1954 CB ASP A 126 4.000 1.578 5.859 1.00 0.00 C ATOM 1955 CG ASP A 126 3.905 0.410 6.820 1.00 0.00 C ATOM 1956 OD1 ASP A 126 3.951 -0.748 6.355 1.00 0.00 O ATOM 1957 OD2 ASP A 126 3.785 0.654 8.039 1.00 0.00 O ATOM 0 H ASP A 126 3.147 3.005 3.920 1.00 0.00 H new ATOM 0 HA ASP A 126 4.925 0.689 4.135 1.00 0.00 H new ATOM 0 HB2 ASP A 126 4.923 2.126 6.048 1.00 0.00 H new ATOM 0 HB3 ASP A 126 3.177 2.267 6.047 1.00 0.00 H new ATOM 1962 N LEU A 127 3.292 -1.159 3.980 1.00 0.00 N ATOM 1963 CA LEU A 127 2.353 -2.255 3.772 1.00 0.00 C ATOM 1964 C LEU A 127 2.888 -3.552 4.371 1.00 0.00 C ATOM 1965 O LEU A 127 4.092 -3.807 4.350 1.00 0.00 O ATOM 1966 CB LEU A 127 2.080 -2.443 2.279 1.00 0.00 C ATOM 1967 CG LEU A 127 1.537 -1.222 1.537 1.00 0.00 C ATOM 1968 CD1 LEU A 127 1.676 -1.406 0.033 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.084 -0.972 1.913 1.00 0.00 C ATOM 0 H LEU A 127 4.274 -1.433 3.945 1.00 0.00 H new ATOM 0 HA LEU A 127 1.420 -2.002 4.276 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.007 -2.753 1.797 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.369 -3.261 2.160 1.00 0.00 H new ATOM 0 HG LEU A 127 2.123 -0.351 1.832 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.284 -0.527 -0.479 1.00 0.00 H new ATOM 0 HD12 LEU A 127 2.728 -1.536 -0.222 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.116 -2.287 -0.279 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -0.286 -0.099 1.375 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.516 -1.843 1.647 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.011 -0.795 2.986 1.00 0.00 H new ATOM 1981 N VAL A 128 1.985 -4.369 4.903 1.00 0.00 N ATOM 1982 CA VAL A 128 2.366 -5.642 5.504 1.00 0.00 C ATOM 1983 C VAL A 128 1.599 -6.799 4.873 1.00 0.00 C ATOM 1984 O VAL A 128 0.434 -7.033 5.195 1.00 0.00 O ATOM 1985 CB VAL A 128 2.114 -5.642 7.024 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.507 -6.980 7.630 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.873 -4.503 7.689 1.00 0.00 C ATOM 0 H VAL A 128 0.985 -4.172 4.930 1.00 0.00 H new ATOM 0 HA VAL A 128 3.432 -5.773 5.319 1.00 0.00 H new ATOM 0 HB VAL A 128 1.049 -5.490 7.199 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.322 -6.961 8.704 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.916 -7.774 7.174 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.565 -7.165 7.447 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.684 -4.518 8.762 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.941 -4.622 7.507 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.538 -3.552 7.275 1.00 0.00 H new ATOM 1997 N ILE A 129 2.261 -7.520 3.975 1.00 0.00 N ATOM 1998 CA ILE A 129 1.642 -8.654 3.300 1.00 0.00 C ATOM 1999 C ILE A 129 1.912 -9.954 4.050 1.00 0.00 C ATOM 2000 O ILE A 129 3.002 -10.161 4.583 1.00 0.00 O ATOM 2001 CB ILE A 129 2.151 -8.794 1.853 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.122 -7.438 1.146 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.313 -9.812 1.093 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.154 -7.307 0.047 1.00 0.00 C ATOM 0 H ILE A 129 3.226 -7.339 3.698 1.00 0.00 H new ATOM 0 HA ILE A 129 0.569 -8.464 3.282 1.00 0.00 H new ATOM 0 HB ILE A 129 3.182 -9.147 1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.130 -7.279 0.723 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.284 -6.650 1.882 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.685 -9.900 0.072 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.380 -10.781 1.588 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.273 -9.486 1.074 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.075 -6.321 -0.410 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.152 -7.434 0.468 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.979 -8.072 -0.709 1.00 0.00 H new ATOM 2016 N GLY A 130 0.912 -10.829 4.086 1.00 0.00 N ATOM 2017 CA GLY A 130 1.062 -12.099 4.771 1.00 0.00 C ATOM 2018 C GLY A 130 0.611 -13.272 3.924 1.00 0.00 C ATOM 2019 O GLY A 130 -0.561 -13.369 3.558 1.00 0.00 O ATOM 0 H GLY A 130 0.001 -10.681 3.653 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.107 -12.237 5.050 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.485 -12.080 5.696 1.00 0.00 H new ATOM 2023 N TYR A 131 1.543 -14.165 3.608 1.00 0.00 N ATOM 2024 CA TYR A 131 1.237 -15.335 2.795 1.00 0.00 C ATOM 2025 C TYR A 131 0.975 -16.555 3.672 1.00 0.00 C ATOM 2026 O TYR A 131 1.773 -16.886 4.549 1.00 0.00 O ATOM 2027 CB TYR A 131 2.386 -15.625 1.828 1.00 0.00 C ATOM 2028 CG TYR A 131 2.430 -17.060 1.353 1.00 0.00 C ATOM 2029 CD1 TYR A 131 1.369 -17.610 0.644 1.00 0.00 C ATOM 2030 CD2 TYR A 131 3.532 -17.865 1.613 1.00 0.00 C ATOM 2031 CE1 TYR A 131 1.404 -18.921 0.209 1.00 0.00 C ATOM 2032 CE2 TYR A 131 3.577 -19.176 1.180 1.00 0.00 C ATOM 2033 CZ TYR A 131 2.510 -19.699 0.478 1.00 0.00 C ATOM 2034 OH TYR A 131 2.551 -21.005 0.047 1.00 0.00 O ATOM 0 H TYR A 131 2.517 -14.100 3.903 1.00 0.00 H new ATOM 0 HA TYR A 131 0.334 -15.122 2.222 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.297 -14.967 0.963 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.330 -15.383 2.316 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.502 -17.002 0.429 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.368 -17.459 2.163 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.570 -19.334 -0.339 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.442 -19.788 1.390 1.00 0.00 H new ATOM 0 HH TYR A 131 3.400 -21.412 0.318 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.148 -17.221 3.428 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.516 -18.407 4.193 1.00 0.00 C ATOM 2046 C ASP A 132 -0.824 -19.578 3.266 1.00 0.00 C ATOM 2047 O ASP A 132 -1.773 -19.548 2.482 1.00 0.00 O ATOM 2048 CB ASP A 132 -1.726 -18.111 5.081 1.00 0.00 C ATOM 2049 CG ASP A 132 -1.425 -17.071 6.142 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.174 -15.904 5.775 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -1.439 -17.424 7.341 1.00 0.00 O ATOM 0 H ASP A 132 -0.820 -16.960 2.706 1.00 0.00 H new ATOM 0 HA ASP A 132 0.330 -18.680 4.824 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.552 -17.764 4.460 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.054 -19.032 5.562 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.004 -20.636 3.356 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.169 -21.837 2.532 1.00 0.00 C ATOM 2058 C PRO A 133 -1.406 -22.640 2.919 1.00 0.00 C ATOM 2059 O PRO A 133 -1.677 -22.880 4.095 1.00 0.00 O ATOM 2060 CB PRO A 133 1.102 -22.641 2.819 1.00 0.00 C ATOM 2061 CG PRO A 133 1.539 -22.189 4.170 1.00 0.00 C ATOM 2062 CD PRO A 133 1.147 -20.740 4.268 1.00 0.00 C ATOM 0 HA PRO A 133 -0.307 -21.593 1.479 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.904 -23.713 2.805 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.870 -22.449 2.070 1.00 0.00 H new ATOM 0 HG2 PRO A 133 1.059 -22.777 4.952 1.00 0.00 H new ATOM 0 HG3 PRO A 133 2.615 -22.312 4.294 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.878 -20.465 5.288 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.961 -20.082 3.964 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.176 -23.067 1.906 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.397 -23.850 2.116 1.00 0.00 C ATOM 2072 C PRO A 134 -3.102 -25.261 2.615 1.00 0.00 C ATOM 2073 O PRO A 134 -2.172 -25.915 2.143 1.00 0.00 O ATOM 2074 CB PRO A 134 -4.031 -23.898 0.724 1.00 0.00 C ATOM 2075 CG PRO A 134 -2.891 -23.722 -0.218 1.00 0.00 C ATOM 2076 CD PRO A 134 -1.913 -22.817 0.479 1.00 0.00 C ATOM 0 HA PRO A 134 -4.039 -23.407 2.877 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.542 -24.846 0.554 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.773 -23.109 0.599 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.432 -24.681 -0.459 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -3.226 -23.284 -1.158 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -0.884 -23.056 0.212 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -2.076 -21.771 0.217 1.00 0.00 H new