USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1019 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 80 MET CE :methyl -140:sc= -0.211 (180deg=-2.34!) USER MOD Set 1.2: A 154 MET CE :methyl -128:sc= -0.488 (180deg=-3.31!) USER MOD Set 2.1: A 143 GLN : amide:sc= 0.0813 X(o=0.21,f=0.049) USER MOD Set 2.2: A 144 ASN : amide:sc= 0.132 X(o=0.21,f=-0.17) USER MOD Set 3.1: A 40 THR OG1 : rot -162:sc= 0.322 USER MOD Set 3.2: A 98 TYR OH : rot 30:sc= 0.241 USER MOD Set 4.1: A 37 HIS : no HD1:sc= -0.313 X(o=0.12,f=0.081) USER MOD Set 4.2: A 53 SER OG : rot 4:sc= 0.428 USER MOD Single : A 14 GLN : amide:sc= -0.394 X(o=-0.39,f=-0.0095) USER MOD Single : A 15 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0566) USER MOD Single : A 19 GLN : amide:sc= -0.175 X(o=-0.18,f=0) USER MOD Single : A 29 GLN : amide:sc= 0.0362 X(o=0.036,f=0) USER MOD Single : A 32 THR OG1 : rot 38:sc= 0.935 USER MOD Single : A 33 LYS NZ :NH3+ 153:sc= -0.197 (180deg=-1.5!) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0175 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 43 SER OG : rot 119:sc= 0.872 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -167:sc= -0.989 (180deg=-1.7) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 76:sc=0.000871 USER MOD Single : A 78 CYS SG : rot -58:sc= 1 USER MOD Single : A 79 THR OG1 : rot -76:sc= -0.166 USER MOD Single : A 87 GLN : amide:sc= -0.475 X(o=-0.48,f=-0.12) USER MOD Single : A 90 CYS SG : rot -150:sc= -1.38 USER MOD Single : A 93 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.332) USER MOD Single : A 94 HIS : no HD1:sc= -0.546 X(o=-0.55,f=-0.59) USER MOD Single : A 103 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00183) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 146 GLN : amide:sc= -0.0166 K(o=-0.017,f=-1.2) USER MOD Single : A 151 HIS : no HD1:sc= -0.37 X(o=-0.37,f=-0.032) USER MOD Single : A 152 MET CE :methyl 167:sc= 0 (180deg=-0.00235) USER MOD Single : A 156 LYS NZ :NH3+ 161:sc= 0.00344 (180deg=0) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 162 THR OG1 : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 42 N ILE A 5 21.812 -4.712 -10.692 1.00 0.00 N ATOM 43 CA ILE A 5 22.245 -3.492 -9.934 1.00 0.00 C ATOM 44 C ILE A 5 23.105 -2.493 -10.784 1.00 0.00 C ATOM 45 O ILE A 5 22.830 -1.292 -10.743 1.00 0.00 O ATOM 46 CB ILE A 5 22.960 -3.910 -8.591 1.00 0.00 C ATOM 47 CG1 ILE A 5 22.117 -4.827 -7.648 1.00 0.00 C ATOM 48 CG2 ILE A 5 23.524 -2.720 -7.765 1.00 0.00 C ATOM 49 CD1 ILE A 5 20.826 -4.213 -7.088 1.00 0.00 C ATOM 0 HA ILE A 5 21.343 -2.933 -9.686 1.00 0.00 H new ATOM 0 HB ILE A 5 23.796 -4.499 -8.968 1.00 0.00 H new ATOM 0 HG12 ILE A 5 21.857 -5.734 -8.194 1.00 0.00 H new ATOM 0 HG13 ILE A 5 22.746 -5.128 -6.810 1.00 0.00 H new ATOM 0 HG21 ILE A 5 23.998 -3.098 -6.859 1.00 0.00 H new ATOM 0 HG22 ILE A 5 24.259 -2.180 -8.361 1.00 0.00 H new ATOM 0 HG23 ILE A 5 22.711 -2.047 -7.495 1.00 0.00 H new ATOM 0 HD11 ILE A 5 20.325 -4.940 -6.448 1.00 0.00 H new ATOM 0 HD12 ILE A 5 21.069 -3.324 -6.506 1.00 0.00 H new ATOM 0 HD13 ILE A 5 20.166 -3.939 -7.911 1.00 0.00 H new ATOM 61 N ALA A 6 24.095 -2.994 -11.554 1.00 0.00 N ATOM 62 CA ALA A 6 24.861 -2.186 -12.538 1.00 0.00 C ATOM 63 C ALA A 6 24.024 -1.492 -13.658 1.00 0.00 C ATOM 64 O ALA A 6 24.264 -0.308 -13.912 1.00 0.00 O ATOM 65 CB ALA A 6 25.969 -3.074 -13.135 1.00 0.00 C ATOM 0 H ALA A 6 24.389 -3.970 -11.514 1.00 0.00 H new ATOM 0 HA ALA A 6 25.276 -1.343 -11.985 1.00 0.00 H new ATOM 0 HB1 ALA A 6 26.544 -2.499 -13.861 1.00 0.00 H new ATOM 0 HB2 ALA A 6 26.629 -3.417 -12.338 1.00 0.00 H new ATOM 0 HB3 ALA A 6 25.519 -3.935 -13.629 1.00 0.00 H new ATOM 71 N ARG A 7 23.040 -2.183 -14.284 1.00 0.00 N ATOM 72 CA ARG A 7 22.077 -1.540 -15.229 1.00 0.00 C ATOM 73 C ARG A 7 21.048 -0.535 -14.598 1.00 0.00 C ATOM 74 O ARG A 7 20.631 0.393 -15.294 1.00 0.00 O ATOM 75 CB ARG A 7 21.462 -2.586 -16.206 1.00 0.00 C ATOM 76 CG ARG A 7 20.147 -3.298 -15.800 1.00 0.00 C ATOM 77 CD ARG A 7 19.764 -4.532 -16.641 1.00 0.00 C ATOM 78 NE ARG A 7 19.537 -4.232 -18.077 1.00 0.00 N ATOM 79 CZ ARG A 7 19.351 -5.168 -19.030 1.00 0.00 C ATOM 80 NH1 ARG A 7 19.361 -6.480 -18.798 1.00 0.00 N ATOM 81 NH2 ARG A 7 19.146 -4.760 -20.268 1.00 0.00 N ATOM 0 H ARG A 7 22.888 -3.183 -14.156 1.00 0.00 H new ATOM 0 HA ARG A 7 22.677 -0.857 -15.831 1.00 0.00 H new ATOM 0 HB2 ARG A 7 21.287 -2.086 -17.159 1.00 0.00 H new ATOM 0 HB3 ARG A 7 22.214 -3.355 -16.383 1.00 0.00 H new ATOM 0 HG2 ARG A 7 20.229 -3.604 -14.757 1.00 0.00 H new ATOM 0 HG3 ARG A 7 19.333 -2.576 -15.857 1.00 0.00 H new ATOM 0 HD2 ARG A 7 20.555 -5.278 -16.556 1.00 0.00 H new ATOM 0 HD3 ARG A 7 18.860 -4.977 -16.225 1.00 0.00 H new ATOM 0 HE ARG A 7 19.521 -3.253 -18.362 1.00 0.00 H new ATOM 0 HH11 ARG A 7 19.516 -6.830 -17.852 1.00 0.00 H new ATOM 0 HH12 ARG A 7 19.213 -7.135 -19.566 1.00 0.00 H new ATOM 0 HH21 ARG A 7 19.132 -3.762 -20.480 1.00 0.00 H new ATOM 0 HH22 ARG A 7 19.002 -5.442 -21.013 1.00 0.00 H new ATOM 95 N LEU A 8 20.667 -0.687 -13.306 1.00 0.00 N ATOM 96 CA LEU A 8 19.887 0.333 -12.547 1.00 0.00 C ATOM 97 C LEU A 8 20.636 1.682 -12.302 1.00 0.00 C ATOM 98 O LEU A 8 20.001 2.728 -12.437 1.00 0.00 O ATOM 99 CB LEU A 8 19.358 -0.203 -11.183 1.00 0.00 C ATOM 100 CG LEU A 8 18.448 -1.463 -11.147 1.00 0.00 C ATOM 101 CD1 LEU A 8 18.031 -1.754 -9.695 1.00 0.00 C ATOM 102 CD2 LEU A 8 17.190 -1.398 -12.032 1.00 0.00 C ATOM 0 H LEU A 8 20.889 -1.518 -12.757 1.00 0.00 H new ATOM 0 HA LEU A 8 19.047 0.541 -13.210 1.00 0.00 H new ATOM 0 HB2 LEU A 8 20.226 -0.411 -10.557 1.00 0.00 H new ATOM 0 HB3 LEU A 8 18.808 0.609 -10.706 1.00 0.00 H new ATOM 0 HG LEU A 8 19.056 -2.265 -11.565 1.00 0.00 H new ATOM 0 HD11 LEU A 8 17.393 -2.637 -9.670 1.00 0.00 H new ATOM 0 HD12 LEU A 8 18.920 -1.931 -9.090 1.00 0.00 H new ATOM 0 HD13 LEU A 8 17.484 -0.900 -9.295 1.00 0.00 H new ATOM 0 HD21 LEU A 8 16.627 -2.326 -11.933 1.00 0.00 H new ATOM 0 HD22 LEU A 8 16.567 -0.560 -11.718 1.00 0.00 H new ATOM 0 HD23 LEU A 8 17.484 -1.261 -13.073 1.00 0.00 H new ATOM 114 N ARG A 9 21.952 1.688 -11.974 1.00 0.00 N ATOM 115 CA ARG A 9 22.769 2.941 -11.849 1.00 0.00 C ATOM 116 C ARG A 9 22.718 3.860 -13.112 1.00 0.00 C ATOM 117 O ARG A 9 22.351 5.035 -13.020 1.00 0.00 O ATOM 118 CB ARG A 9 24.263 2.720 -11.439 1.00 0.00 C ATOM 119 CG ARG A 9 24.642 1.468 -10.620 1.00 0.00 C ATOM 120 CD ARG A 9 26.138 1.346 -10.258 1.00 0.00 C ATOM 121 NE ARG A 9 26.582 2.280 -9.189 1.00 0.00 N ATOM 122 CZ ARG A 9 27.290 3.411 -9.386 1.00 0.00 C ATOM 123 NH1 ARG A 9 27.701 3.841 -10.577 1.00 0.00 N ATOM 124 NH2 ARG A 9 27.596 4.141 -8.328 1.00 0.00 N ATOM 0 H ARG A 9 22.482 0.836 -11.788 1.00 0.00 H new ATOM 0 HA ARG A 9 22.273 3.450 -11.023 1.00 0.00 H new ATOM 0 HB2 ARG A 9 24.855 2.705 -12.354 1.00 0.00 H new ATOM 0 HB3 ARG A 9 24.579 3.593 -10.868 1.00 0.00 H new ATOM 0 HG2 ARG A 9 24.061 1.467 -9.698 1.00 0.00 H new ATOM 0 HG3 ARG A 9 24.348 0.582 -11.183 1.00 0.00 H new ATOM 0 HD2 ARG A 9 26.342 0.324 -9.940 1.00 0.00 H new ATOM 0 HD3 ARG A 9 26.733 1.526 -11.153 1.00 0.00 H new ATOM 0 HE ARG A 9 26.331 2.046 -8.229 1.00 0.00 H new ATOM 0 HH11 ARG A 9 27.483 3.304 -11.416 1.00 0.00 H new ATOM 0 HH12 ARG A 9 28.234 4.708 -10.650 1.00 0.00 H new ATOM 0 HH21 ARG A 9 27.298 3.843 -7.399 1.00 0.00 H new ATOM 0 HH22 ARG A 9 28.130 5.002 -8.440 1.00 0.00 H new ATOM 138 N GLU A 10 23.036 3.268 -14.279 1.00 0.00 N ATOM 139 CA GLU A 10 22.843 3.901 -15.614 1.00 0.00 C ATOM 140 C GLU A 10 21.382 4.049 -16.159 1.00 0.00 C ATOM 141 O GLU A 10 21.227 4.614 -17.248 1.00 0.00 O ATOM 142 CB GLU A 10 23.769 3.187 -16.644 1.00 0.00 C ATOM 143 CG GLU A 10 23.514 1.678 -16.871 1.00 0.00 C ATOM 144 CD GLU A 10 24.275 1.104 -18.066 1.00 0.00 C ATOM 145 OE1 GLU A 10 25.423 0.639 -17.887 1.00 0.00 O ATOM 146 OE2 GLU A 10 23.729 1.112 -19.191 1.00 0.00 O ATOM 0 H GLU A 10 23.437 2.332 -14.331 1.00 0.00 H new ATOM 0 HA GLU A 10 23.120 4.945 -15.464 1.00 0.00 H new ATOM 0 HB2 GLU A 10 23.671 3.698 -17.602 1.00 0.00 H new ATOM 0 HB3 GLU A 10 24.802 3.314 -16.319 1.00 0.00 H new ATOM 0 HG2 GLU A 10 23.798 1.130 -15.972 1.00 0.00 H new ATOM 0 HG3 GLU A 10 22.446 1.516 -17.019 1.00 0.00 H new ATOM 153 N ASP A 11 20.324 3.620 -15.436 1.00 0.00 N ATOM 154 CA ASP A 11 18.914 3.947 -15.807 1.00 0.00 C ATOM 155 C ASP A 11 18.417 5.374 -15.407 1.00 0.00 C ATOM 156 O ASP A 11 17.305 5.732 -15.802 1.00 0.00 O ATOM 157 CB ASP A 11 18.030 2.763 -15.319 1.00 0.00 C ATOM 158 CG ASP A 11 16.563 2.772 -15.772 1.00 0.00 C ATOM 159 OD1 ASP A 11 16.294 2.472 -16.957 1.00 0.00 O ATOM 160 OD2 ASP A 11 15.677 3.085 -14.947 1.00 0.00 O ATOM 0 H ASP A 11 20.410 3.049 -14.595 1.00 0.00 H new ATOM 0 HA ASP A 11 18.838 4.036 -16.891 1.00 0.00 H new ATOM 0 HB2 ASP A 11 18.486 1.833 -15.659 1.00 0.00 H new ATOM 0 HB3 ASP A 11 18.051 2.748 -14.229 1.00 0.00 H new ATOM 165 N GLY A 12 19.206 6.192 -14.682 1.00 0.00 N ATOM 166 CA GLY A 12 18.678 7.377 -13.971 1.00 0.00 C ATOM 167 C GLY A 12 18.598 7.171 -12.442 1.00 0.00 C ATOM 168 O GLY A 12 19.144 7.958 -11.665 1.00 0.00 O ATOM 0 H GLY A 12 20.211 6.055 -14.573 1.00 0.00 H new ATOM 0 HA2 GLY A 12 19.314 8.236 -14.185 1.00 0.00 H new ATOM 0 HA3 GLY A 12 17.685 7.612 -14.354 1.00 0.00 H new ATOM 172 N ILE A 13 17.922 6.084 -12.042 1.00 0.00 N ATOM 173 CA ILE A 13 17.793 5.624 -10.628 1.00 0.00 C ATOM 174 C ILE A 13 19.163 5.166 -10.023 1.00 0.00 C ATOM 175 O ILE A 13 20.159 4.990 -10.735 1.00 0.00 O ATOM 176 CB ILE A 13 16.681 4.505 -10.568 1.00 0.00 C ATOM 177 CG1 ILE A 13 17.092 3.216 -11.351 1.00 0.00 C ATOM 178 CG2 ILE A 13 15.285 5.038 -10.977 1.00 0.00 C ATOM 179 CD1 ILE A 13 16.026 2.200 -11.757 1.00 0.00 C ATOM 0 H ILE A 13 17.433 5.477 -12.700 1.00 0.00 H new ATOM 0 HA ILE A 13 17.484 6.458 -9.998 1.00 0.00 H new ATOM 0 HB ILE A 13 16.595 4.208 -9.523 1.00 0.00 H new ATOM 0 HG12 ILE A 13 17.598 3.537 -12.261 1.00 0.00 H new ATOM 0 HG13 ILE A 13 17.829 2.689 -10.745 1.00 0.00 H new ATOM 0 HG21 ILE A 13 14.556 4.230 -10.919 1.00 0.00 H new ATOM 0 HG22 ILE A 13 14.990 5.842 -10.302 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.325 5.418 -11.998 1.00 0.00 H new ATOM 0 HD11 ILE A 13 16.496 1.373 -12.290 1.00 0.00 H new ATOM 0 HD12 ILE A 13 15.527 1.820 -10.865 1.00 0.00 H new ATOM 0 HD13 ILE A 13 15.293 2.681 -12.405 1.00 0.00 H new ATOM 191 N GLN A 14 19.198 4.973 -8.695 1.00 0.00 N ATOM 192 CA GLN A 14 20.401 4.461 -7.993 1.00 0.00 C ATOM 193 C GLN A 14 19.912 3.560 -6.837 1.00 0.00 C ATOM 194 O GLN A 14 19.315 4.076 -5.890 1.00 0.00 O ATOM 195 CB GLN A 14 21.274 5.655 -7.505 1.00 0.00 C ATOM 196 CG GLN A 14 22.591 5.294 -6.783 1.00 0.00 C ATOM 197 CD GLN A 14 23.664 4.663 -7.686 1.00 0.00 C ATOM 198 OE1 GLN A 14 24.428 5.354 -8.359 1.00 0.00 O ATOM 199 NE2 GLN A 14 23.741 3.342 -7.722 1.00 0.00 N ATOM 0 H GLN A 14 18.408 5.162 -8.078 1.00 0.00 H new ATOM 0 HA GLN A 14 21.036 3.869 -8.652 1.00 0.00 H new ATOM 0 HB2 GLN A 14 21.517 6.276 -8.368 1.00 0.00 H new ATOM 0 HB3 GLN A 14 20.672 6.266 -6.832 1.00 0.00 H new ATOM 0 HG2 GLN A 14 23.001 6.197 -6.330 1.00 0.00 H new ATOM 0 HG3 GLN A 14 22.367 4.603 -5.970 1.00 0.00 H new ATOM 0 HE21 GLN A 14 23.103 2.778 -7.160 1.00 0.00 H new ATOM 0 HE22 GLN A 14 24.438 2.888 -8.312 1.00 0.00 H new ATOM 208 N LYS A 15 20.179 2.239 -6.901 1.00 0.00 N ATOM 209 CA LYS A 15 19.729 1.278 -5.858 1.00 0.00 C ATOM 210 C LYS A 15 20.763 1.106 -4.711 1.00 0.00 C ATOM 211 O LYS A 15 21.980 1.103 -4.931 1.00 0.00 O ATOM 212 CB LYS A 15 19.299 -0.071 -6.506 1.00 0.00 C ATOM 213 CG LYS A 15 18.781 -1.127 -5.496 1.00 0.00 C ATOM 214 CD LYS A 15 17.896 -2.229 -6.087 1.00 0.00 C ATOM 215 CE LYS A 15 17.281 -3.180 -5.041 1.00 0.00 C ATOM 216 NZ LYS A 15 18.258 -4.100 -4.430 1.00 0.00 N ATOM 0 H LYS A 15 20.704 1.808 -7.662 1.00 0.00 H new ATOM 0 HA LYS A 15 18.848 1.700 -5.375 1.00 0.00 H new ATOM 0 HB2 LYS A 15 18.519 0.125 -7.241 1.00 0.00 H new ATOM 0 HB3 LYS A 15 20.149 -0.488 -7.046 1.00 0.00 H new ATOM 0 HG2 LYS A 15 19.640 -1.595 -5.014 1.00 0.00 H new ATOM 0 HG3 LYS A 15 18.219 -0.613 -4.716 1.00 0.00 H new ATOM 0 HD2 LYS A 15 17.091 -1.765 -6.657 1.00 0.00 H new ATOM 0 HD3 LYS A 15 18.487 -2.815 -6.790 1.00 0.00 H new ATOM 0 HE2 LYS A 15 16.812 -2.587 -4.255 1.00 0.00 H new ATOM 0 HE3 LYS A 15 16.491 -3.764 -5.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 17.799 -4.638 -3.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 18.614 -4.758 -5.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 19.052 -3.554 -4.039 1.00 0.00 H new ATOM 230 N ARG A 16 20.226 0.901 -3.489 1.00 0.00 N ATOM 231 CA ARG A 16 21.027 0.459 -2.322 1.00 0.00 C ATOM 232 C ARG A 16 20.160 -0.488 -1.448 1.00 0.00 C ATOM 233 O ARG A 16 19.086 -0.106 -0.969 1.00 0.00 O ATOM 234 CB ARG A 16 21.532 1.701 -1.532 1.00 0.00 C ATOM 235 CG ARG A 16 22.483 1.385 -0.353 1.00 0.00 C ATOM 236 CD ARG A 16 23.075 2.618 0.365 1.00 0.00 C ATOM 237 NE ARG A 16 23.981 3.447 -0.475 1.00 0.00 N ATOM 238 CZ ARG A 16 25.284 3.181 -0.706 1.00 0.00 C ATOM 239 NH1 ARG A 16 25.930 2.130 -0.208 1.00 0.00 N ATOM 240 NH2 ARG A 16 25.958 4.015 -1.477 1.00 0.00 N ATOM 0 H ARG A 16 19.236 1.035 -3.282 1.00 0.00 H new ATOM 0 HA ARG A 16 21.908 -0.095 -2.645 1.00 0.00 H new ATOM 0 HB2 ARG A 16 22.045 2.369 -2.224 1.00 0.00 H new ATOM 0 HB3 ARG A 16 20.669 2.243 -1.147 1.00 0.00 H new ATOM 0 HG2 ARG A 16 21.942 0.784 0.378 1.00 0.00 H new ATOM 0 HG3 ARG A 16 23.304 0.772 -0.724 1.00 0.00 H new ATOM 0 HD2 ARG A 16 22.256 3.244 0.720 1.00 0.00 H new ATOM 0 HD3 ARG A 16 23.623 2.281 1.245 1.00 0.00 H new ATOM 0 HE ARG A 16 23.587 4.281 -0.910 1.00 0.00 H new ATOM 0 HH11 ARG A 16 25.438 1.465 0.389 1.00 0.00 H new ATOM 0 HH12 ARG A 16 26.917 1.989 -0.423 1.00 0.00 H new ATOM 0 HH21 ARG A 16 25.492 4.830 -1.877 1.00 0.00 H new ATOM 0 HH22 ARG A 16 26.944 3.845 -1.673 1.00 0.00 H new ATOM 254 N VAL A 17 20.682 -1.707 -1.210 1.00 0.00 N ATOM 255 CA VAL A 17 20.051 -2.718 -0.316 1.00 0.00 C ATOM 256 C VAL A 17 20.578 -2.579 1.143 1.00 0.00 C ATOM 257 O VAL A 17 21.782 -2.437 1.386 1.00 0.00 O ATOM 258 CB VAL A 17 20.184 -4.154 -0.931 1.00 0.00 C ATOM 259 CG1 VAL A 17 21.612 -4.740 -0.935 1.00 0.00 C ATOM 260 CG2 VAL A 17 19.239 -5.186 -0.281 1.00 0.00 C ATOM 0 H VAL A 17 21.555 -2.026 -1.630 1.00 0.00 H new ATOM 0 HA VAL A 17 18.980 -2.531 -0.246 1.00 0.00 H new ATOM 0 HB VAL A 17 19.893 -3.985 -1.968 1.00 0.00 H new ATOM 0 HG11 VAL A 17 21.596 -5.735 -1.380 1.00 0.00 H new ATOM 0 HG12 VAL A 17 22.269 -4.093 -1.516 1.00 0.00 H new ATOM 0 HG13 VAL A 17 21.981 -4.807 0.089 1.00 0.00 H new ATOM 0 HG21 VAL A 17 19.382 -6.158 -0.753 1.00 0.00 H new ATOM 0 HG22 VAL A 17 19.461 -5.263 0.783 1.00 0.00 H new ATOM 0 HG23 VAL A 17 18.205 -4.867 -0.414 1.00 0.00 H new ATOM 270 N ILE A 18 19.644 -2.680 2.104 1.00 0.00 N ATOM 271 CA ILE A 18 19.955 -2.754 3.555 1.00 0.00 C ATOM 272 C ILE A 18 20.301 -4.240 3.914 1.00 0.00 C ATOM 273 O ILE A 18 21.453 -4.519 4.260 1.00 0.00 O ATOM 274 CB ILE A 18 18.810 -2.129 4.431 1.00 0.00 C ATOM 275 CG1 ILE A 18 18.269 -0.732 3.981 1.00 0.00 C ATOM 276 CG2 ILE A 18 19.237 -2.015 5.917 1.00 0.00 C ATOM 277 CD1 ILE A 18 16.739 -0.687 3.942 1.00 0.00 C ATOM 0 H ILE A 18 18.645 -2.713 1.902 1.00 0.00 H new ATOM 0 HA ILE A 18 20.829 -2.144 3.786 1.00 0.00 H new ATOM 0 HB ILE A 18 17.992 -2.836 4.290 1.00 0.00 H new ATOM 0 HG12 ILE A 18 18.636 0.034 4.664 1.00 0.00 H new ATOM 0 HG13 ILE A 18 18.663 -0.493 2.993 1.00 0.00 H new ATOM 0 HG21 ILE A 18 18.424 -1.579 6.497 1.00 0.00 H new ATOM 0 HG22 ILE A 18 19.469 -3.006 6.306 1.00 0.00 H new ATOM 0 HG23 ILE A 18 20.119 -1.379 5.994 1.00 0.00 H new ATOM 0 HD11 ILE A 18 16.412 0.303 3.624 1.00 0.00 H new ATOM 0 HD12 ILE A 18 16.371 -1.434 3.239 1.00 0.00 H new ATOM 0 HD13 ILE A 18 16.343 -0.898 4.936 1.00 0.00 H new ATOM 289 N GLN A 19 19.317 -5.163 3.823 1.00 0.00 N ATOM 290 CA GLN A 19 19.506 -6.605 4.118 1.00 0.00 C ATOM 291 C GLN A 19 19.200 -7.407 2.829 1.00 0.00 C ATOM 292 O GLN A 19 18.046 -7.486 2.396 1.00 0.00 O ATOM 293 CB GLN A 19 18.580 -7.079 5.270 1.00 0.00 C ATOM 294 CG GLN A 19 18.864 -6.493 6.680 1.00 0.00 C ATOM 295 CD GLN A 19 17.734 -5.624 7.247 1.00 0.00 C ATOM 296 OE1 GLN A 19 17.202 -5.869 8.329 1.00 0.00 O ATOM 297 NE2 GLN A 19 17.351 -4.593 6.516 1.00 0.00 N ATOM 0 H GLN A 19 18.365 -4.929 3.542 1.00 0.00 H new ATOM 0 HA GLN A 19 20.534 -6.771 4.440 1.00 0.00 H new ATOM 0 HB2 GLN A 19 17.552 -6.836 5.002 1.00 0.00 H new ATOM 0 HB3 GLN A 19 18.645 -8.165 5.334 1.00 0.00 H new ATOM 0 HG2 GLN A 19 19.054 -7.315 7.370 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.776 -5.897 6.635 1.00 0.00 H new ATOM 0 HE21 GLN A 19 17.804 -4.406 5.621 1.00 0.00 H new ATOM 0 HE22 GLN A 19 16.602 -3.984 6.846 1.00 0.00 H new ATOM 306 N GLU A 20 20.233 -8.056 2.260 1.00 0.00 N ATOM 307 CA GLU A 20 20.069 -9.058 1.172 1.00 0.00 C ATOM 308 C GLU A 20 19.278 -10.305 1.672 1.00 0.00 C ATOM 309 O GLU A 20 19.658 -10.940 2.662 1.00 0.00 O ATOM 310 CB GLU A 20 21.451 -9.484 0.619 1.00 0.00 C ATOM 311 CG GLU A 20 22.163 -8.398 -0.215 1.00 0.00 C ATOM 312 CD GLU A 20 23.513 -8.856 -0.768 1.00 0.00 C ATOM 313 OE1 GLU A 20 23.541 -9.479 -1.853 1.00 0.00 O ATOM 314 OE2 GLU A 20 24.553 -8.596 -0.124 1.00 0.00 O ATOM 0 H GLU A 20 21.204 -7.907 2.535 1.00 0.00 H new ATOM 0 HA GLU A 20 19.496 -8.594 0.369 1.00 0.00 H new ATOM 0 HB2 GLU A 20 22.093 -9.763 1.454 1.00 0.00 H new ATOM 0 HB3 GLU A 20 21.324 -10.374 0.003 1.00 0.00 H new ATOM 0 HG2 GLU A 20 21.519 -8.104 -1.043 1.00 0.00 H new ATOM 0 HG3 GLU A 20 22.312 -7.513 0.403 1.00 0.00 H new ATOM 321 N GLY A 21 18.155 -10.601 0.997 1.00 0.00 N ATOM 322 CA GLY A 21 17.125 -11.516 1.531 1.00 0.00 C ATOM 323 C GLY A 21 17.407 -13.027 1.439 1.00 0.00 C ATOM 324 O GLY A 21 18.520 -13.489 1.710 1.00 0.00 O ATOM 0 H GLY A 21 17.934 -10.220 0.077 1.00 0.00 H new ATOM 0 HA2 GLY A 21 16.963 -11.266 2.580 1.00 0.00 H new ATOM 0 HA3 GLY A 21 16.191 -11.315 1.007 1.00 0.00 H new ATOM 328 N ARG A 22 16.340 -13.784 1.137 1.00 0.00 N ATOM 329 CA ARG A 22 16.326 -15.263 1.276 1.00 0.00 C ATOM 330 C ARG A 22 15.702 -15.907 0.007 1.00 0.00 C ATOM 331 O ARG A 22 14.706 -15.431 -0.550 1.00 0.00 O ATOM 332 CB ARG A 22 15.546 -15.724 2.543 1.00 0.00 C ATOM 333 CG ARG A 22 16.160 -15.346 3.914 1.00 0.00 C ATOM 334 CD ARG A 22 15.683 -13.991 4.471 1.00 0.00 C ATOM 335 NE ARG A 22 16.385 -13.653 5.734 1.00 0.00 N ATOM 336 CZ ARG A 22 16.552 -12.403 6.212 1.00 0.00 C ATOM 337 NH1 ARG A 22 16.088 -11.305 5.618 1.00 0.00 N ATOM 338 NH2 ARG A 22 17.220 -12.256 7.341 1.00 0.00 N ATOM 0 H ARG A 22 15.462 -13.397 0.790 1.00 0.00 H new ATOM 0 HA ARG A 22 17.359 -15.593 1.388 1.00 0.00 H new ATOM 0 HB2 ARG A 22 14.540 -15.307 2.494 1.00 0.00 H new ATOM 0 HB3 ARG A 22 15.443 -16.808 2.504 1.00 0.00 H new ATOM 0 HG2 ARG A 22 15.918 -16.127 4.635 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.246 -15.325 3.819 1.00 0.00 H new ATOM 0 HD2 ARG A 22 15.860 -13.209 3.733 1.00 0.00 H new ATOM 0 HD3 ARG A 22 14.608 -14.025 4.647 1.00 0.00 H new ATOM 0 HE ARG A 22 16.770 -14.423 6.281 1.00 0.00 H new ATOM 0 HH11 ARG A 22 15.568 -11.379 4.743 1.00 0.00 H new ATOM 0 HH12 ARG A 22 16.252 -10.390 6.038 1.00 0.00 H new ATOM 0 HH21 ARG A 22 17.592 -13.074 7.824 1.00 0.00 H new ATOM 0 HH22 ARG A 22 17.365 -11.324 7.730 1.00 0.00 H new ATOM 393 N PRO A 26 12.094 -14.657 -8.478 1.00 0.00 N ATOM 394 CA PRO A 26 11.261 -15.221 -9.586 1.00 0.00 C ATOM 395 C PRO A 26 11.285 -14.379 -10.909 1.00 0.00 C ATOM 396 O PRO A 26 12.270 -13.695 -11.201 1.00 0.00 O ATOM 397 CB PRO A 26 9.895 -15.400 -8.876 1.00 0.00 C ATOM 398 CG PRO A 26 9.850 -14.307 -7.816 1.00 0.00 C ATOM 399 CD PRO A 26 11.286 -14.258 -7.309 1.00 0.00 C ATOM 0 HA PRO A 26 11.625 -16.160 -10.003 1.00 0.00 H new ATOM 0 HB2 PRO A 26 9.069 -15.300 -9.580 1.00 0.00 H new ATOM 0 HB3 PRO A 26 9.812 -16.389 -8.426 1.00 0.00 H new ATOM 0 HG2 PRO A 26 9.538 -13.351 -8.236 1.00 0.00 H new ATOM 0 HG3 PRO A 26 9.149 -14.549 -7.017 1.00 0.00 H new ATOM 0 HD2 PRO A 26 11.552 -13.260 -6.962 1.00 0.00 H new ATOM 0 HD3 PRO A 26 11.436 -14.937 -6.470 1.00 0.00 H new ATOM 407 N ASP A 27 10.236 -14.492 -11.748 1.00 0.00 N ATOM 408 CA ASP A 27 10.228 -13.954 -13.143 1.00 0.00 C ATOM 409 C ASP A 27 10.430 -12.412 -13.258 1.00 0.00 C ATOM 410 O ASP A 27 11.395 -11.988 -13.900 1.00 0.00 O ATOM 411 CB ASP A 27 8.956 -14.414 -13.913 1.00 0.00 C ATOM 412 CG ASP A 27 8.856 -15.921 -14.192 1.00 0.00 C ATOM 413 OD1 ASP A 27 9.479 -16.397 -15.167 1.00 0.00 O ATOM 414 OD2 ASP A 27 8.159 -16.632 -13.435 1.00 0.00 O ATOM 0 H ASP A 27 9.366 -14.957 -11.488 1.00 0.00 H new ATOM 0 HA ASP A 27 11.111 -14.385 -13.615 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.078 -14.110 -13.343 1.00 0.00 H new ATOM 0 HB3 ASP A 27 8.918 -13.884 -14.864 1.00 0.00 H new ATOM 419 N PHE A 28 9.540 -11.588 -12.658 1.00 0.00 N ATOM 420 CA PHE A 28 9.583 -10.095 -12.752 1.00 0.00 C ATOM 421 C PHE A 28 9.576 -9.506 -14.206 1.00 0.00 C ATOM 422 O PHE A 28 10.389 -8.639 -14.545 1.00 0.00 O ATOM 423 CB PHE A 28 10.723 -9.495 -11.875 1.00 0.00 C ATOM 424 CG PHE A 28 10.573 -9.617 -10.350 1.00 0.00 C ATOM 425 CD1 PHE A 28 9.735 -8.729 -9.665 1.00 0.00 C ATOM 426 CD2 PHE A 28 11.358 -10.518 -9.625 1.00 0.00 C ATOM 427 CE1 PHE A 28 9.684 -8.743 -8.275 1.00 0.00 C ATOM 428 CE2 PHE A 28 11.304 -10.527 -8.234 1.00 0.00 C ATOM 429 CZ PHE A 28 10.479 -9.632 -7.561 1.00 0.00 C ATOM 0 H PHE A 28 8.766 -11.933 -12.091 1.00 0.00 H new ATOM 0 HA PHE A 28 8.628 -9.771 -12.340 1.00 0.00 H new ATOM 0 HB2 PHE A 28 11.659 -9.975 -12.162 1.00 0.00 H new ATOM 0 HB3 PHE A 28 10.818 -8.438 -12.122 1.00 0.00 H new ATOM 0 HD1 PHE A 28 9.125 -8.030 -10.218 1.00 0.00 H new ATOM 0 HD2 PHE A 28 12.007 -11.208 -10.144 1.00 0.00 H new ATOM 0 HE1 PHE A 28 9.028 -8.064 -7.751 1.00 0.00 H new ATOM 0 HE2 PHE A 28 11.904 -11.231 -7.676 1.00 0.00 H new ATOM 0 HZ PHE A 28 10.456 -9.628 -6.481 1.00 0.00 H new ATOM 439 N GLN A 29 8.645 -9.973 -15.062 1.00 0.00 N ATOM 440 CA GLN A 29 8.555 -9.532 -16.477 1.00 0.00 C ATOM 441 C GLN A 29 7.140 -9.846 -17.035 1.00 0.00 C ATOM 442 O GLN A 29 6.854 -10.970 -17.461 1.00 0.00 O ATOM 443 CB GLN A 29 9.716 -10.090 -17.360 1.00 0.00 C ATOM 444 CG GLN A 29 9.886 -11.630 -17.424 1.00 0.00 C ATOM 445 CD GLN A 29 11.249 -12.070 -17.974 1.00 0.00 C ATOM 446 OE1 GLN A 29 11.446 -12.194 -19.182 1.00 0.00 O ATOM 447 NE2 GLN A 29 12.213 -12.312 -17.097 1.00 0.00 N ATOM 0 H GLN A 29 7.938 -10.660 -14.800 1.00 0.00 H new ATOM 0 HA GLN A 29 8.690 -8.451 -16.513 1.00 0.00 H new ATOM 0 HB2 GLN A 29 9.572 -9.724 -18.377 1.00 0.00 H new ATOM 0 HB3 GLN A 29 10.651 -9.663 -16.997 1.00 0.00 H new ATOM 0 HG2 GLN A 29 9.755 -12.044 -16.424 1.00 0.00 H new ATOM 0 HG3 GLN A 29 9.098 -12.050 -18.049 1.00 0.00 H new ATOM 0 HE21 GLN A 29 12.033 -12.204 -16.099 1.00 0.00 H new ATOM 0 HE22 GLN A 29 13.135 -12.606 -17.420 1.00 0.00 H new ATOM 456 N ASP A 30 6.255 -8.829 -17.010 1.00 0.00 N ATOM 457 CA ASP A 30 4.835 -8.917 -17.474 1.00 0.00 C ATOM 458 C ASP A 30 4.012 -10.124 -16.913 1.00 0.00 C ATOM 459 O ASP A 30 3.536 -10.987 -17.658 1.00 0.00 O ATOM 460 CB ASP A 30 4.702 -8.732 -19.014 1.00 0.00 C ATOM 461 CG ASP A 30 5.171 -7.374 -19.561 1.00 0.00 C ATOM 462 OD1 ASP A 30 4.373 -6.411 -19.560 1.00 0.00 O ATOM 463 OD2 ASP A 30 6.342 -7.269 -19.989 1.00 0.00 O ATOM 0 H ASP A 30 6.501 -7.902 -16.662 1.00 0.00 H new ATOM 0 HA ASP A 30 4.347 -8.059 -17.011 1.00 0.00 H new ATOM 0 HB2 ASP A 30 5.272 -9.519 -19.507 1.00 0.00 H new ATOM 0 HB3 ASP A 30 3.657 -8.874 -19.290 1.00 0.00 H new ATOM 468 N GLY A 31 3.869 -10.150 -15.580 1.00 0.00 N ATOM 469 CA GLY A 31 3.056 -11.144 -14.858 1.00 0.00 C ATOM 470 C GLY A 31 3.850 -11.707 -13.675 1.00 0.00 C ATOM 471 O GLY A 31 4.510 -12.734 -13.834 1.00 0.00 O ATOM 0 H GLY A 31 4.320 -9.474 -14.964 1.00 0.00 H new ATOM 0 HA2 GLY A 31 2.134 -10.684 -14.502 1.00 0.00 H new ATOM 0 HA3 GLY A 31 2.770 -11.951 -15.532 1.00 0.00 H new ATOM 475 N THR A 32 3.781 -11.035 -12.511 1.00 0.00 N ATOM 476 CA THR A 32 4.336 -11.527 -11.226 1.00 0.00 C ATOM 477 C THR A 32 3.575 -10.723 -10.121 1.00 0.00 C ATOM 478 O THR A 32 3.517 -9.489 -10.150 1.00 0.00 O ATOM 479 CB THR A 32 5.896 -11.385 -11.205 1.00 0.00 C ATOM 480 OG1 THR A 32 6.480 -12.504 -11.860 1.00 0.00 O ATOM 481 CG2 THR A 32 6.558 -11.285 -9.827 1.00 0.00 C ATOM 0 H THR A 32 3.333 -10.122 -12.430 1.00 0.00 H new ATOM 0 HA THR A 32 4.182 -12.593 -11.059 1.00 0.00 H new ATOM 0 HB THR A 32 6.075 -10.433 -11.704 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.930 -12.755 -12.631 1.00 0.00 H new ATOM 0 HG21 THR A 32 7.637 -11.191 -9.948 1.00 0.00 H new ATOM 0 HG22 THR A 32 6.174 -10.411 -9.301 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.335 -12.182 -9.250 1.00 0.00 H new ATOM 489 N LYS A 33 3.039 -11.422 -9.106 1.00 0.00 N ATOM 490 CA LYS A 33 2.448 -10.776 -7.902 1.00 0.00 C ATOM 491 C LYS A 33 3.560 -10.547 -6.845 1.00 0.00 C ATOM 492 O LYS A 33 3.896 -11.457 -6.084 1.00 0.00 O ATOM 493 CB LYS A 33 1.325 -11.720 -7.383 1.00 0.00 C ATOM 494 CG LYS A 33 0.660 -11.415 -6.014 1.00 0.00 C ATOM 495 CD LYS A 33 -0.708 -10.719 -6.057 1.00 0.00 C ATOM 496 CE LYS A 33 -0.677 -9.255 -6.521 1.00 0.00 C ATOM 497 NZ LYS A 33 -2.028 -8.682 -6.416 1.00 0.00 N ATOM 0 H LYS A 33 2.999 -12.441 -9.088 1.00 0.00 H new ATOM 0 HA LYS A 33 2.019 -9.800 -8.127 1.00 0.00 H new ATOM 0 HB2 LYS A 33 0.536 -11.738 -8.135 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.739 -12.727 -7.331 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.548 -12.354 -5.472 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.342 -10.792 -5.435 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.364 -11.281 -6.721 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.151 -10.760 -5.062 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.021 -8.683 -5.910 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.323 -9.195 -7.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.959 -7.654 -6.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.557 -8.878 -7.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.524 -9.109 -5.608 1.00 0.00 H new ATOM 511 N ALA A 34 4.086 -9.316 -6.777 1.00 0.00 N ATOM 512 CA ALA A 34 5.068 -8.917 -5.741 1.00 0.00 C ATOM 513 C ALA A 34 4.336 -8.236 -4.559 1.00 0.00 C ATOM 514 O ALA A 34 3.822 -7.119 -4.672 1.00 0.00 O ATOM 515 CB ALA A 34 6.134 -8.028 -6.407 1.00 0.00 C ATOM 0 H ALA A 34 3.850 -8.569 -7.430 1.00 0.00 H new ATOM 0 HA ALA A 34 5.579 -9.781 -5.316 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.869 -7.721 -5.663 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.631 -8.588 -7.199 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.657 -7.144 -6.832 1.00 0.00 H new ATOM 521 N THR A 35 4.307 -8.956 -3.427 1.00 0.00 N ATOM 522 CA THR A 35 3.701 -8.484 -2.154 1.00 0.00 C ATOM 523 C THR A 35 4.857 -7.976 -1.248 1.00 0.00 C ATOM 524 O THR A 35 5.811 -8.699 -0.938 1.00 0.00 O ATOM 525 CB THR A 35 2.897 -9.635 -1.481 1.00 0.00 C ATOM 526 OG1 THR A 35 1.905 -10.143 -2.370 1.00 0.00 O ATOM 527 CG2 THR A 35 2.187 -9.207 -0.186 1.00 0.00 C ATOM 0 H THR A 35 4.705 -9.893 -3.360 1.00 0.00 H new ATOM 0 HA THR A 35 2.995 -7.673 -2.331 1.00 0.00 H new ATOM 0 HB THR A 35 3.636 -10.397 -1.235 1.00 0.00 H new ATOM 0 HG1 THR A 35 1.411 -10.866 -1.930 1.00 0.00 H new ATOM 0 HG21 THR A 35 1.646 -10.057 0.230 1.00 0.00 H new ATOM 0 HG22 THR A 35 2.926 -8.858 0.536 1.00 0.00 H new ATOM 0 HG23 THR A 35 1.485 -8.402 -0.405 1.00 0.00 H new ATOM 535 N PHE A 36 4.751 -6.707 -0.838 1.00 0.00 N ATOM 536 CA PHE A 36 5.834 -6.000 -0.105 1.00 0.00 C ATOM 537 C PHE A 36 5.261 -4.779 0.670 1.00 0.00 C ATOM 538 O PHE A 36 4.142 -4.320 0.432 1.00 0.00 O ATOM 539 CB PHE A 36 7.029 -5.637 -1.047 1.00 0.00 C ATOM 540 CG PHE A 36 6.770 -4.816 -2.318 1.00 0.00 C ATOM 541 CD1 PHE A 36 6.829 -3.421 -2.301 1.00 0.00 C ATOM 542 CD2 PHE A 36 6.493 -5.475 -3.518 1.00 0.00 C ATOM 543 CE1 PHE A 36 6.581 -2.694 -3.458 1.00 0.00 C ATOM 544 CE2 PHE A 36 6.248 -4.747 -4.674 1.00 0.00 C ATOM 545 CZ PHE A 36 6.291 -3.357 -4.644 1.00 0.00 C ATOM 0 H PHE A 36 3.922 -6.135 -0.998 1.00 0.00 H new ATOM 0 HA PHE A 36 6.250 -6.677 0.641 1.00 0.00 H new ATOM 0 HB2 PHE A 36 7.761 -5.092 -0.450 1.00 0.00 H new ATOM 0 HB3 PHE A 36 7.499 -6.572 -1.353 1.00 0.00 H new ATOM 0 HD1 PHE A 36 7.069 -2.905 -1.383 1.00 0.00 H new ATOM 0 HD2 PHE A 36 6.469 -6.554 -3.546 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.614 -1.615 -3.436 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.024 -5.260 -5.597 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.099 -2.792 -5.544 1.00 0.00 H new ATOM 555 N HIS A 37 6.057 -4.235 1.598 1.00 0.00 N ATOM 556 CA HIS A 37 5.792 -2.916 2.235 1.00 0.00 C ATOM 557 C HIS A 37 6.479 -1.749 1.476 1.00 0.00 C ATOM 558 O HIS A 37 7.417 -1.954 0.710 1.00 0.00 O ATOM 559 CB HIS A 37 6.323 -2.994 3.687 1.00 0.00 C ATOM 560 CG HIS A 37 5.392 -3.701 4.664 1.00 0.00 C ATOM 561 ND1 HIS A 37 4.216 -3.145 5.096 1.00 0.00 N ATOM 562 CD2 HIS A 37 5.638 -4.898 5.355 1.00 0.00 C ATOM 563 CE1 HIS A 37 3.864 -4.051 6.044 1.00 0.00 C ATOM 564 NE2 HIS A 37 4.636 -5.159 6.278 1.00 0.00 N ATOM 0 H HIS A 37 6.906 -4.688 1.936 1.00 0.00 H new ATOM 0 HA HIS A 37 4.722 -2.711 2.212 1.00 0.00 H new ATOM 0 HB2 HIS A 37 7.283 -3.510 3.682 1.00 0.00 H new ATOM 0 HB3 HIS A 37 6.507 -1.982 4.048 1.00 0.00 H new ATOM 0 HD2 HIS A 37 6.496 -5.533 5.189 1.00 0.00 H new ATOM 0 HE1 HIS A 37 2.964 -3.897 6.621 1.00 0.00 H new ATOM 0 HE2 HIS A 37 4.512 -5.935 6.929 1.00 0.00 H new ATOM 572 N TYR A 38 5.999 -0.517 1.714 1.00 0.00 N ATOM 573 CA TYR A 38 6.504 0.712 1.037 1.00 0.00 C ATOM 574 C TYR A 38 6.493 1.902 2.039 1.00 0.00 C ATOM 575 O TYR A 38 5.557 2.057 2.830 1.00 0.00 O ATOM 576 CB TYR A 38 5.665 0.984 -0.260 1.00 0.00 C ATOM 577 CG TYR A 38 4.344 1.791 -0.181 1.00 0.00 C ATOM 578 CD1 TYR A 38 3.177 1.215 0.330 1.00 0.00 C ATOM 579 CD2 TYR A 38 4.291 3.097 -0.675 1.00 0.00 C ATOM 580 CE1 TYR A 38 1.970 1.908 0.291 1.00 0.00 C ATOM 581 CE2 TYR A 38 3.089 3.800 -0.700 1.00 0.00 C ATOM 582 CZ TYR A 38 1.924 3.194 -0.234 1.00 0.00 C ATOM 583 OH TYR A 38 0.726 3.853 -0.315 1.00 0.00 O ATOM 0 H TYR A 38 5.249 -0.334 2.380 1.00 0.00 H new ATOM 0 HA TYR A 38 7.538 0.578 0.719 1.00 0.00 H new ATOM 0 HB2 TYR A 38 6.317 1.501 -0.964 1.00 0.00 H new ATOM 0 HB3 TYR A 38 5.426 0.015 -0.699 1.00 0.00 H new ATOM 0 HD1 TYR A 38 3.212 0.224 0.759 1.00 0.00 H new ATOM 0 HD2 TYR A 38 5.192 3.566 -1.041 1.00 0.00 H new ATOM 0 HE1 TYR A 38 1.070 1.446 0.669 1.00 0.00 H new ATOM 0 HE2 TYR A 38 3.060 4.811 -1.079 1.00 0.00 H new ATOM 0 HH TYR A 38 0.867 4.741 -0.704 1.00 0.00 H new ATOM 593 N ARG A 39 7.513 2.772 1.964 1.00 0.00 N ATOM 594 CA ARG A 39 7.596 3.981 2.825 1.00 0.00 C ATOM 595 C ARG A 39 8.253 5.105 1.995 1.00 0.00 C ATOM 596 O ARG A 39 9.481 5.213 1.903 1.00 0.00 O ATOM 597 CB ARG A 39 8.358 3.665 4.137 1.00 0.00 C ATOM 598 CG ARG A 39 8.004 4.543 5.362 1.00 0.00 C ATOM 599 CD ARG A 39 9.024 5.652 5.700 1.00 0.00 C ATOM 600 NE ARG A 39 10.382 5.153 6.055 1.00 0.00 N ATOM 601 CZ ARG A 39 10.748 4.707 7.273 1.00 0.00 C ATOM 602 NH1 ARG A 39 9.944 4.687 8.333 1.00 0.00 N ATOM 603 NH2 ARG A 39 11.982 4.264 7.424 1.00 0.00 N ATOM 0 H ARG A 39 8.296 2.668 1.318 1.00 0.00 H new ATOM 0 HA ARG A 39 6.606 4.314 3.136 1.00 0.00 H new ATOM 0 HB2 ARG A 39 8.173 2.623 4.398 1.00 0.00 H new ATOM 0 HB3 ARG A 39 9.427 3.761 3.944 1.00 0.00 H new ATOM 0 HG2 ARG A 39 7.033 5.007 5.187 1.00 0.00 H new ATOM 0 HG3 ARG A 39 7.895 3.896 6.232 1.00 0.00 H new ATOM 0 HD2 ARG A 39 9.109 6.323 4.845 1.00 0.00 H new ATOM 0 HD3 ARG A 39 8.638 6.242 6.531 1.00 0.00 H new ATOM 0 HE ARG A 39 11.089 5.149 5.320 1.00 0.00 H new ATOM 0 HH11 ARG A 39 8.985 5.023 8.252 1.00 0.00 H new ATOM 0 HH12 ARG A 39 10.287 4.335 9.227 1.00 0.00 H new ATOM 0 HH21 ARG A 39 12.625 4.267 6.632 1.00 0.00 H new ATOM 0 HH22 ARG A 39 12.292 3.919 8.332 1.00 0.00 H new ATOM 617 N THR A 40 7.399 5.940 1.387 1.00 0.00 N ATOM 618 CA THR A 40 7.839 7.066 0.533 1.00 0.00 C ATOM 619 C THR A 40 8.020 8.318 1.417 1.00 0.00 C ATOM 620 O THR A 40 7.076 8.786 2.058 1.00 0.00 O ATOM 621 CB THR A 40 6.865 7.310 -0.647 1.00 0.00 C ATOM 622 OG1 THR A 40 5.531 7.523 -0.207 1.00 0.00 O ATOM 623 CG2 THR A 40 6.875 6.147 -1.639 1.00 0.00 C ATOM 0 H THR A 40 6.386 5.859 1.469 1.00 0.00 H new ATOM 0 HA THR A 40 8.796 6.820 0.073 1.00 0.00 H new ATOM 0 HB THR A 40 7.222 8.213 -1.143 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.914 7.389 -0.957 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.179 6.356 -2.452 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.879 6.023 -2.044 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.573 5.232 -1.130 1.00 0.00 H new ATOM 631 N LEU A 41 9.255 8.834 1.446 1.00 0.00 N ATOM 632 CA LEU A 41 9.601 10.066 2.183 1.00 0.00 C ATOM 633 C LEU A 41 10.493 10.984 1.305 1.00 0.00 C ATOM 634 O LEU A 41 11.204 10.538 0.401 1.00 0.00 O ATOM 635 CB LEU A 41 10.183 9.705 3.581 1.00 0.00 C ATOM 636 CG LEU A 41 11.651 9.193 3.690 1.00 0.00 C ATOM 637 CD1 LEU A 41 12.263 9.592 5.045 1.00 0.00 C ATOM 638 CD2 LEU A 41 11.774 7.674 3.475 1.00 0.00 C ATOM 0 H LEU A 41 10.047 8.412 0.960 1.00 0.00 H new ATOM 0 HA LEU A 41 8.710 10.658 2.391 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.098 10.592 4.209 1.00 0.00 H new ATOM 0 HB3 LEU A 41 9.537 8.943 4.017 1.00 0.00 H new ATOM 0 HG LEU A 41 12.208 9.672 2.885 1.00 0.00 H new ATOM 0 HD11 LEU A 41 13.288 9.226 5.103 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.259 10.678 5.140 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.675 9.155 5.852 1.00 0.00 H new ATOM 0 HD21 LEU A 41 12.819 7.378 3.563 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.184 7.151 4.228 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.406 7.416 2.482 1.00 0.00 H new ATOM 650 N HIS A 42 10.474 12.289 1.613 1.00 0.00 N ATOM 651 CA HIS A 42 11.268 13.312 0.882 1.00 0.00 C ATOM 652 C HIS A 42 12.793 13.170 1.162 1.00 0.00 C ATOM 653 O HIS A 42 13.216 12.969 2.304 1.00 0.00 O ATOM 654 CB HIS A 42 10.722 14.717 1.260 1.00 0.00 C ATOM 655 CG HIS A 42 9.402 15.074 0.564 1.00 0.00 C ATOM 656 ND1 HIS A 42 8.138 14.691 0.975 1.00 0.00 N ATOM 657 CD2 HIS A 42 9.318 15.738 -0.663 1.00 0.00 C ATOM 658 CE1 HIS A 42 7.390 15.192 -0.055 1.00 0.00 C ATOM 659 NE2 HIS A 42 8.001 15.844 -1.097 1.00 0.00 N ATOM 0 H HIS A 42 9.912 12.674 2.372 1.00 0.00 H new ATOM 0 HA HIS A 42 11.157 13.165 -0.192 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.577 14.762 2.339 1.00 0.00 H new ATOM 0 HB3 HIS A 42 11.470 15.468 1.007 1.00 0.00 H new ATOM 0 HD2 HIS A 42 10.169 16.121 -1.206 1.00 0.00 H new ATOM 0 HE1 HIS A 42 6.316 15.074 -0.048 1.00 0.00 H new ATOM 0 HE2 HIS A 42 7.609 16.275 -1.934 1.00 0.00 H new ATOM 667 N SER A 43 13.600 13.249 0.085 1.00 0.00 N ATOM 668 CA SER A 43 15.070 13.002 0.146 1.00 0.00 C ATOM 669 C SER A 43 15.841 14.106 0.934 1.00 0.00 C ATOM 670 O SER A 43 16.395 13.817 1.998 1.00 0.00 O ATOM 671 CB SER A 43 15.650 12.804 -1.281 1.00 0.00 C ATOM 672 OG SER A 43 15.078 11.688 -1.948 1.00 0.00 O ATOM 0 H SER A 43 13.263 13.483 -0.849 1.00 0.00 H new ATOM 0 HA SER A 43 15.216 12.080 0.708 1.00 0.00 H new ATOM 0 HB2 SER A 43 15.475 13.705 -1.870 1.00 0.00 H new ATOM 0 HB3 SER A 43 16.730 12.671 -1.216 1.00 0.00 H new ATOM 0 HG SER A 43 14.621 11.991 -2.760 1.00 0.00 H new ATOM 678 N ASP A 44 15.852 15.351 0.417 1.00 0.00 N ATOM 679 CA ASP A 44 16.464 16.535 1.090 1.00 0.00 C ATOM 680 C ASP A 44 15.602 17.846 1.011 1.00 0.00 C ATOM 681 O ASP A 44 15.923 18.802 1.723 1.00 0.00 O ATOM 682 CB ASP A 44 17.902 16.723 0.519 1.00 0.00 C ATOM 683 CG ASP A 44 18.816 17.654 1.329 1.00 0.00 C ATOM 684 OD1 ASP A 44 19.325 17.230 2.390 1.00 0.00 O ATOM 685 OD2 ASP A 44 19.024 18.813 0.909 1.00 0.00 O ATOM 0 H ASP A 44 15.435 15.574 -0.487 1.00 0.00 H new ATOM 0 HA ASP A 44 16.508 16.335 2.161 1.00 0.00 H new ATOM 0 HB2 ASP A 44 18.378 15.745 0.450 1.00 0.00 H new ATOM 0 HB3 ASP A 44 17.824 17.112 -0.496 1.00 0.00 H new ATOM 690 N ASP A 45 14.516 17.904 0.205 1.00 0.00 N ATOM 691 CA ASP A 45 13.563 19.051 0.143 1.00 0.00 C ATOM 692 C ASP A 45 12.917 19.437 1.508 1.00 0.00 C ATOM 693 O ASP A 45 13.015 20.597 1.915 1.00 0.00 O ATOM 694 CB ASP A 45 12.499 18.692 -0.931 1.00 0.00 C ATOM 695 CG ASP A 45 11.551 19.822 -1.356 1.00 0.00 C ATOM 696 OD1 ASP A 45 11.924 20.630 -2.233 1.00 0.00 O ATOM 697 OD2 ASP A 45 10.424 19.899 -0.816 1.00 0.00 O ATOM 0 H ASP A 45 14.268 17.147 -0.432 1.00 0.00 H new ATOM 0 HA ASP A 45 14.115 19.951 -0.128 1.00 0.00 H new ATOM 0 HB2 ASP A 45 13.018 18.329 -1.818 1.00 0.00 H new ATOM 0 HB3 ASP A 45 11.898 17.865 -0.553 1.00 0.00 H new ATOM 702 N GLU A 46 12.275 18.468 2.187 1.00 0.00 N ATOM 703 CA GLU A 46 11.723 18.642 3.552 1.00 0.00 C ATOM 704 C GLU A 46 12.279 17.587 4.561 1.00 0.00 C ATOM 705 O GLU A 46 12.407 17.907 5.746 1.00 0.00 O ATOM 706 CB GLU A 46 10.171 18.617 3.447 1.00 0.00 C ATOM 707 CG GLU A 46 9.381 19.023 4.711 1.00 0.00 C ATOM 708 CD GLU A 46 9.539 20.495 5.111 1.00 0.00 C ATOM 709 OE1 GLU A 46 8.848 21.358 4.526 1.00 0.00 O ATOM 710 OE2 GLU A 46 10.356 20.792 6.009 1.00 0.00 O ATOM 0 H GLU A 46 12.122 17.535 1.805 1.00 0.00 H new ATOM 0 HA GLU A 46 12.043 19.602 3.958 1.00 0.00 H new ATOM 0 HB2 GLU A 46 9.875 19.280 2.634 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.866 17.609 3.165 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.324 18.815 4.546 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.703 18.396 5.543 1.00 0.00 H new ATOM 717 N GLY A 47 12.542 16.338 4.121 1.00 0.00 N ATOM 718 CA GLY A 47 12.694 15.178 5.025 1.00 0.00 C ATOM 719 C GLY A 47 11.401 14.504 5.566 1.00 0.00 C ATOM 720 O GLY A 47 11.512 13.617 6.416 1.00 0.00 O ATOM 0 H GLY A 47 12.654 16.106 3.134 1.00 0.00 H new ATOM 0 HA2 GLY A 47 13.273 14.418 4.500 1.00 0.00 H new ATOM 0 HA3 GLY A 47 13.289 15.497 5.881 1.00 0.00 H new ATOM 724 N THR A 48 10.203 14.907 5.093 1.00 0.00 N ATOM 725 CA THR A 48 8.899 14.423 5.621 1.00 0.00 C ATOM 726 C THR A 48 8.454 13.100 4.943 1.00 0.00 C ATOM 727 O THR A 48 8.612 12.922 3.733 1.00 0.00 O ATOM 728 CB THR A 48 7.830 15.548 5.484 1.00 0.00 C ATOM 729 OG1 THR A 48 6.682 15.217 6.261 1.00 0.00 O ATOM 730 CG2 THR A 48 7.356 15.865 4.051 1.00 0.00 C ATOM 0 H THR A 48 10.107 15.579 4.332 1.00 0.00 H new ATOM 0 HA THR A 48 9.015 14.189 6.679 1.00 0.00 H new ATOM 0 HB THR A 48 8.340 16.444 5.838 1.00 0.00 H new ATOM 0 HG1 THR A 48 6.012 15.927 6.174 1.00 0.00 H new ATOM 0 HG21 THR A 48 6.614 16.663 4.081 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.207 16.184 3.449 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.912 14.973 3.609 1.00 0.00 H new ATOM 738 N VAL A 49 7.815 12.221 5.727 1.00 0.00 N ATOM 739 CA VAL A 49 7.184 10.983 5.203 1.00 0.00 C ATOM 740 C VAL A 49 5.761 11.332 4.692 1.00 0.00 C ATOM 741 O VAL A 49 4.859 11.676 5.464 1.00 0.00 O ATOM 742 CB VAL A 49 7.306 9.787 6.197 1.00 0.00 C ATOM 743 CG1 VAL A 49 6.765 10.057 7.620 1.00 0.00 C ATOM 744 CG2 VAL A 49 6.693 8.484 5.646 1.00 0.00 C ATOM 0 H VAL A 49 7.716 12.338 6.735 1.00 0.00 H new ATOM 0 HA VAL A 49 7.726 10.601 4.338 1.00 0.00 H new ATOM 0 HB VAL A 49 8.384 9.661 6.294 1.00 0.00 H new ATOM 0 HG11 VAL A 49 6.895 9.166 8.234 1.00 0.00 H new ATOM 0 HG12 VAL A 49 7.312 10.888 8.066 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.706 10.308 7.565 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.808 7.688 6.382 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.634 8.638 5.441 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.203 8.203 4.725 1.00 0.00 H new ATOM 754 N LEU A 50 5.610 11.228 3.363 1.00 0.00 N ATOM 755 CA LEU A 50 4.305 11.373 2.680 1.00 0.00 C ATOM 756 C LEU A 50 3.389 10.113 2.760 1.00 0.00 C ATOM 757 O LEU A 50 2.165 10.268 2.799 1.00 0.00 O ATOM 758 CB LEU A 50 4.532 11.867 1.219 1.00 0.00 C ATOM 759 CG LEU A 50 5.123 10.854 0.190 1.00 0.00 C ATOM 760 CD1 LEU A 50 4.100 10.461 -0.888 1.00 0.00 C ATOM 761 CD2 LEU A 50 6.428 11.342 -0.455 1.00 0.00 C ATOM 0 H LEU A 50 6.385 11.041 2.727 1.00 0.00 H new ATOM 0 HA LEU A 50 3.740 12.129 3.225 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.575 12.217 0.832 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.196 12.731 1.257 1.00 0.00 H new ATOM 0 HG LEU A 50 5.366 9.963 0.769 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.556 9.755 -1.582 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.234 9.998 -0.416 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.784 11.351 -1.432 1.00 0.00 H new ATOM 0 HD21 LEU A 50 6.788 10.593 -1.160 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.245 12.278 -0.982 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.179 11.502 0.319 1.00 0.00 H new ATOM 773 N ASP A 51 3.973 8.891 2.748 1.00 0.00 N ATOM 774 CA ASP A 51 3.214 7.623 2.784 1.00 0.00 C ATOM 775 C ASP A 51 4.045 6.554 3.548 1.00 0.00 C ATOM 776 O ASP A 51 5.271 6.482 3.417 1.00 0.00 O ATOM 777 CB ASP A 51 2.829 7.152 1.349 1.00 0.00 C ATOM 778 CG ASP A 51 1.414 6.568 1.239 1.00 0.00 C ATOM 779 OD1 ASP A 51 1.081 5.629 1.998 1.00 0.00 O ATOM 780 OD2 ASP A 51 0.632 7.039 0.385 1.00 0.00 O ATOM 0 H ASP A 51 4.984 8.759 2.713 1.00 0.00 H new ATOM 0 HA ASP A 51 2.275 7.778 3.316 1.00 0.00 H new ATOM 0 HB2 ASP A 51 2.916 7.997 0.666 1.00 0.00 H new ATOM 0 HB3 ASP A 51 3.547 6.401 1.020 1.00 0.00 H new ATOM 785 N ASP A 52 3.364 5.723 4.353 1.00 0.00 N ATOM 786 CA ASP A 52 4.010 4.730 5.245 1.00 0.00 C ATOM 787 C ASP A 52 3.057 3.519 5.432 1.00 0.00 C ATOM 788 O ASP A 52 1.900 3.664 5.841 1.00 0.00 O ATOM 789 CB ASP A 52 4.474 5.374 6.582 1.00 0.00 C ATOM 790 CG ASP A 52 3.448 6.154 7.431 1.00 0.00 C ATOM 791 OD1 ASP A 52 2.513 5.538 7.990 1.00 0.00 O ATOM 792 OD2 ASP A 52 3.579 7.394 7.538 1.00 0.00 O ATOM 0 H ASP A 52 2.346 5.716 4.408 1.00 0.00 H new ATOM 0 HA ASP A 52 4.925 4.360 4.783 1.00 0.00 H new ATOM 0 HB2 ASP A 52 4.882 4.579 7.206 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.296 6.053 6.353 1.00 0.00 H new ATOM 797 N SER A 53 3.579 2.325 5.112 1.00 0.00 N ATOM 798 CA SER A 53 2.816 1.043 5.147 1.00 0.00 C ATOM 799 C SER A 53 3.313 0.062 6.240 1.00 0.00 C ATOM 800 O SER A 53 2.492 -0.461 6.994 1.00 0.00 O ATOM 801 CB SER A 53 2.853 0.425 3.736 1.00 0.00 C ATOM 802 OG SER A 53 2.053 -0.740 3.632 1.00 0.00 O ATOM 0 H SER A 53 4.549 2.209 4.818 1.00 0.00 H new ATOM 0 HA SER A 53 1.784 1.254 5.429 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.510 1.163 3.011 1.00 0.00 H new ATOM 0 HB3 SER A 53 3.883 0.179 3.478 1.00 0.00 H new ATOM 0 HG SER A 53 1.582 -0.890 4.478 1.00 0.00 H new ATOM 808 N ARG A 54 4.635 -0.185 6.334 1.00 0.00 N ATOM 809 CA ARG A 54 5.274 -0.872 7.487 1.00 0.00 C ATOM 810 C ARG A 54 5.222 -0.132 8.856 1.00 0.00 C ATOM 811 O ARG A 54 5.254 -0.797 9.895 1.00 0.00 O ATOM 812 CB ARG A 54 6.731 -1.301 7.129 1.00 0.00 C ATOM 813 CG ARG A 54 7.683 -0.290 6.426 1.00 0.00 C ATOM 814 CD ARG A 54 8.262 0.849 7.282 1.00 0.00 C ATOM 815 NE ARG A 54 9.207 0.360 8.318 1.00 0.00 N ATOM 816 CZ ARG A 54 9.325 0.869 9.560 1.00 0.00 C ATOM 817 NH1 ARG A 54 8.604 1.886 10.027 1.00 0.00 N ATOM 818 NH2 ARG A 54 10.214 0.322 10.369 1.00 0.00 N ATOM 0 H ARG A 54 5.299 0.087 5.609 1.00 0.00 H new ATOM 0 HA ARG A 54 4.650 -1.750 7.654 1.00 0.00 H new ATOM 0 HB2 ARG A 54 7.215 -1.614 8.054 1.00 0.00 H new ATOM 0 HB3 ARG A 54 6.663 -2.182 6.491 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.517 -0.851 6.003 1.00 0.00 H new ATOM 0 HG3 ARG A 54 7.143 0.157 5.591 1.00 0.00 H new ATOM 0 HD2 ARG A 54 8.774 1.561 6.635 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.446 1.387 7.764 1.00 0.00 H new ATOM 0 HE ARG A 54 9.814 -0.422 8.070 1.00 0.00 H new ATOM 0 HH11 ARG A 54 7.907 2.333 9.431 1.00 0.00 H new ATOM 0 HH12 ARG A 54 8.749 2.218 10.980 1.00 0.00 H new ATOM 0 HH21 ARG A 54 10.784 -0.460 10.046 1.00 0.00 H new ATOM 0 HH22 ARG A 54 10.331 0.681 11.316 1.00 0.00 H new ATOM 832 N ALA A 55 5.090 1.212 8.863 1.00 0.00 N ATOM 833 CA ALA A 55 4.701 1.980 10.070 1.00 0.00 C ATOM 834 C ALA A 55 3.291 1.646 10.653 1.00 0.00 C ATOM 835 O ALA A 55 3.125 1.586 11.875 1.00 0.00 O ATOM 836 CB ALA A 55 4.794 3.476 9.737 1.00 0.00 C ATOM 0 H ALA A 55 5.248 1.793 8.040 1.00 0.00 H new ATOM 0 HA ALA A 55 5.396 1.689 10.858 1.00 0.00 H new ATOM 0 HB1 ALA A 55 4.512 4.062 10.612 1.00 0.00 H new ATOM 0 HB2 ALA A 55 5.816 3.722 9.450 1.00 0.00 H new ATOM 0 HB3 ALA A 55 4.120 3.708 8.912 1.00 0.00 H new ATOM 842 N ARG A 56 2.306 1.402 9.767 1.00 0.00 N ATOM 843 CA ARG A 56 0.990 0.808 10.129 1.00 0.00 C ATOM 844 C ARG A 56 1.045 -0.711 10.491 1.00 0.00 C ATOM 845 O ARG A 56 0.278 -1.153 11.350 1.00 0.00 O ATOM 846 CB ARG A 56 -0.023 0.993 8.956 1.00 0.00 C ATOM 847 CG ARG A 56 -0.191 2.405 8.344 1.00 0.00 C ATOM 848 CD ARG A 56 -0.793 3.486 9.265 1.00 0.00 C ATOM 849 NE ARG A 56 -2.255 3.311 9.480 1.00 0.00 N ATOM 850 CZ ARG A 56 -2.824 2.825 10.600 1.00 0.00 C ATOM 851 NH1 ARG A 56 -2.147 2.447 11.682 1.00 0.00 N ATOM 852 NH2 ARG A 56 -4.140 2.715 10.626 1.00 0.00 N ATOM 0 H ARG A 56 2.395 1.610 8.772 1.00 0.00 H new ATOM 0 HA ARG A 56 0.673 1.342 11.025 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.271 0.316 8.154 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -1.001 0.665 9.307 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.787 2.750 8.007 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -0.822 2.321 7.459 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -0.283 3.461 10.228 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -0.609 4.469 8.832 1.00 0.00 H new ATOM 0 HE ARG A 56 -2.877 3.581 8.718 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -1.130 2.517 11.697 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -2.646 2.087 12.496 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -4.691 2.994 9.814 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -4.605 2.351 11.458 1.00 0.00 H new ATOM 866 N GLY A 57 1.892 -1.502 9.797 1.00 0.00 N ATOM 867 CA GLY A 57 1.835 -2.978 9.823 1.00 0.00 C ATOM 868 C GLY A 57 0.774 -3.637 8.916 1.00 0.00 C ATOM 869 O GLY A 57 0.132 -4.595 9.356 1.00 0.00 O ATOM 0 H GLY A 57 2.635 -1.134 9.203 1.00 0.00 H new ATOM 0 HA2 GLY A 57 2.814 -3.363 9.540 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.652 -3.295 10.850 1.00 0.00 H new ATOM 873 N LYS A 58 0.612 -3.159 7.667 1.00 0.00 N ATOM 874 CA LYS A 58 -0.297 -3.788 6.675 1.00 0.00 C ATOM 875 C LYS A 58 0.292 -3.589 5.230 1.00 0.00 C ATOM 876 O LYS A 58 0.325 -2.451 4.762 1.00 0.00 O ATOM 877 CB LYS A 58 -1.794 -3.400 6.841 1.00 0.00 C ATOM 878 CG LYS A 58 -2.201 -1.943 7.150 1.00 0.00 C ATOM 879 CD LYS A 58 -1.894 -0.947 6.018 1.00 0.00 C ATOM 880 CE LYS A 58 -2.647 0.395 6.102 1.00 0.00 C ATOM 881 NZ LYS A 58 -4.074 0.278 5.742 1.00 0.00 N ATOM 0 H LYS A 58 1.099 -2.335 7.315 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.329 -4.860 6.868 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.304 -3.687 5.921 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -2.200 -4.022 7.638 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.269 -1.914 7.364 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.686 -1.618 8.054 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -0.823 -0.745 6.014 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -2.132 -1.420 5.065 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.564 0.789 7.115 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.169 1.116 5.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.528 1.210 5.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.158 -0.071 4.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.542 -0.388 6.389 1.00 0.00 H new ATOM 895 N PRO A 59 0.781 -4.625 4.486 1.00 0.00 N ATOM 896 CA PRO A 59 1.540 -4.436 3.217 1.00 0.00 C ATOM 897 C PRO A 59 0.667 -4.206 1.956 1.00 0.00 C ATOM 898 O PRO A 59 -0.494 -4.619 1.871 1.00 0.00 O ATOM 899 CB PRO A 59 2.380 -5.730 3.123 1.00 0.00 C ATOM 900 CG PRO A 59 1.644 -6.779 3.954 1.00 0.00 C ATOM 901 CD PRO A 59 0.880 -5.992 5.010 1.00 0.00 C ATOM 0 HA PRO A 59 2.133 -3.522 3.242 1.00 0.00 H new ATOM 0 HB2 PRO A 59 2.480 -6.054 2.087 1.00 0.00 H new ATOM 0 HB3 PRO A 59 3.388 -5.568 3.505 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.966 -7.367 3.335 1.00 0.00 H new ATOM 0 HG3 PRO A 59 2.343 -7.478 4.414 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.108 -6.420 5.179 1.00 0.00 H new ATOM 0 HD3 PRO A 59 1.403 -6.009 5.966 1.00 0.00 H new ATOM 909 N MET A 60 1.302 -3.562 0.966 1.00 0.00 N ATOM 910 CA MET A 60 0.724 -3.354 -0.389 1.00 0.00 C ATOM 911 C MET A 60 0.945 -4.585 -1.331 1.00 0.00 C ATOM 912 O MET A 60 1.607 -5.571 -0.984 1.00 0.00 O ATOM 913 CB MET A 60 1.272 -2.009 -0.959 1.00 0.00 C ATOM 914 CG MET A 60 2.803 -1.860 -1.042 1.00 0.00 C ATOM 915 SD MET A 60 3.563 -3.174 -1.999 1.00 0.00 S ATOM 916 CE MET A 60 3.191 -2.652 -3.663 1.00 0.00 C ATOM 0 H MET A 60 2.236 -3.165 1.073 1.00 0.00 H new ATOM 0 HA MET A 60 -0.361 -3.275 -0.320 1.00 0.00 H new ATOM 0 HB2 MET A 60 0.863 -1.873 -1.960 1.00 0.00 H new ATOM 0 HB3 MET A 60 0.885 -1.197 -0.344 1.00 0.00 H new ATOM 0 HG2 MET A 60 3.049 -0.898 -1.491 1.00 0.00 H new ATOM 0 HG3 MET A 60 3.221 -1.858 -0.035 1.00 0.00 H new ATOM 0 HE1 MET A 60 3.391 -3.471 -4.354 1.00 0.00 H new ATOM 0 HE2 MET A 60 2.140 -2.369 -3.729 1.00 0.00 H new ATOM 0 HE3 MET A 60 3.814 -1.796 -3.924 1.00 0.00 H new ATOM 926 N GLU A 61 0.367 -4.489 -2.541 1.00 0.00 N ATOM 927 CA GLU A 61 0.474 -5.532 -3.596 1.00 0.00 C ATOM 928 C GLU A 61 0.589 -4.839 -4.980 1.00 0.00 C ATOM 929 O GLU A 61 -0.322 -4.136 -5.430 1.00 0.00 O ATOM 930 CB GLU A 61 -0.737 -6.504 -3.546 1.00 0.00 C ATOM 931 CG GLU A 61 -0.534 -7.686 -2.576 1.00 0.00 C ATOM 932 CD GLU A 61 -1.792 -8.530 -2.351 1.00 0.00 C ATOM 933 OE1 GLU A 61 -2.777 -8.012 -1.781 1.00 0.00 O ATOM 934 OE2 GLU A 61 -1.796 -9.722 -2.733 1.00 0.00 O ATOM 0 H GLU A 61 -0.192 -3.684 -2.824 1.00 0.00 H new ATOM 0 HA GLU A 61 1.367 -6.132 -3.423 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.627 -5.949 -3.249 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.923 -6.893 -4.547 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.258 -8.328 -2.962 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.191 -7.300 -1.616 1.00 0.00 H new ATOM 941 N LEU A 62 1.732 -5.085 -5.644 1.00 0.00 N ATOM 942 CA LEU A 62 2.038 -4.576 -7.001 1.00 0.00 C ATOM 943 C LEU A 62 1.949 -5.777 -7.980 1.00 0.00 C ATOM 944 O LEU A 62 2.554 -6.836 -7.780 1.00 0.00 O ATOM 945 CB LEU A 62 3.433 -3.882 -6.985 1.00 0.00 C ATOM 946 CG LEU A 62 4.163 -3.630 -8.334 1.00 0.00 C ATOM 947 CD1 LEU A 62 3.705 -2.342 -9.014 1.00 0.00 C ATOM 948 CD2 LEU A 62 5.682 -3.715 -8.215 1.00 0.00 C ATOM 0 H LEU A 62 2.484 -5.651 -5.251 1.00 0.00 H new ATOM 0 HA LEU A 62 1.327 -3.819 -7.334 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.316 -2.919 -6.489 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.093 -4.484 -6.361 1.00 0.00 H new ATOM 0 HG LEU A 62 3.867 -4.449 -8.989 1.00 0.00 H new ATOM 0 HD11 LEU A 62 4.246 -2.214 -9.952 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.635 -2.398 -9.217 1.00 0.00 H new ATOM 0 HD13 LEU A 62 3.906 -1.494 -8.360 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.134 -3.530 -9.189 1.00 0.00 H new ATOM 0 HD22 LEU A 62 6.034 -2.967 -7.504 1.00 0.00 H new ATOM 0 HD23 LEU A 62 5.965 -4.708 -7.867 1.00 0.00 H new ATOM 960 N ILE A 63 1.246 -5.525 -9.090 1.00 0.00 N ATOM 961 CA ILE A 63 1.192 -6.444 -10.256 1.00 0.00 C ATOM 962 C ILE A 63 2.289 -5.930 -11.236 1.00 0.00 C ATOM 963 O ILE A 63 2.306 -4.760 -11.637 1.00 0.00 O ATOM 964 CB ILE A 63 -0.239 -6.509 -10.910 1.00 0.00 C ATOM 965 CG1 ILE A 63 -1.349 -7.149 -10.023 1.00 0.00 C ATOM 966 CG2 ILE A 63 -0.252 -7.291 -12.254 1.00 0.00 C ATOM 967 CD1 ILE A 63 -1.723 -6.370 -8.759 1.00 0.00 C ATOM 0 H ILE A 63 0.693 -4.677 -9.215 1.00 0.00 H new ATOM 0 HA ILE A 63 1.383 -7.476 -9.961 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.467 -5.453 -11.056 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -2.246 -7.273 -10.630 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.023 -8.147 -9.729 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.264 -7.303 -12.658 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.417 -6.805 -12.964 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.082 -8.314 -12.083 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -2.503 -6.906 -8.219 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -0.845 -6.268 -8.121 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.087 -5.381 -9.036 1.00 0.00 H new ATOM 979 N ILE A 64 3.158 -6.859 -11.664 1.00 0.00 N ATOM 980 CA ILE A 64 4.170 -6.580 -12.726 1.00 0.00 C ATOM 981 C ILE A 64 3.447 -6.599 -14.115 1.00 0.00 C ATOM 982 O ILE A 64 2.939 -7.637 -14.540 1.00 0.00 O ATOM 983 CB ILE A 64 5.427 -7.523 -12.685 1.00 0.00 C ATOM 984 CG1 ILE A 64 6.129 -7.687 -11.302 1.00 0.00 C ATOM 985 CG2 ILE A 64 6.488 -7.119 -13.740 1.00 0.00 C ATOM 986 CD1 ILE A 64 6.738 -6.444 -10.658 1.00 0.00 C ATOM 0 H ILE A 64 3.190 -7.811 -11.300 1.00 0.00 H new ATOM 0 HA ILE A 64 4.590 -5.592 -12.541 1.00 0.00 H new ATOM 0 HB ILE A 64 4.995 -8.497 -12.917 1.00 0.00 H new ATOM 0 HG12 ILE A 64 5.401 -8.102 -10.605 1.00 0.00 H new ATOM 0 HG13 ILE A 64 6.921 -8.427 -11.415 1.00 0.00 H new ATOM 0 HG21 ILE A 64 7.340 -7.796 -13.677 1.00 0.00 H new ATOM 0 HG22 ILE A 64 6.051 -7.177 -14.737 1.00 0.00 H new ATOM 0 HG23 ILE A 64 6.821 -6.099 -13.549 1.00 0.00 H new ATOM 0 HD11 ILE A 64 7.189 -6.713 -9.703 1.00 0.00 H new ATOM 0 HD12 ILE A 64 7.502 -6.030 -11.317 1.00 0.00 H new ATOM 0 HD13 ILE A 64 5.958 -5.700 -10.494 1.00 0.00 H new ATOM 998 N GLY A 65 3.422 -5.443 -14.799 1.00 0.00 N ATOM 999 CA GLY A 65 3.129 -5.336 -16.253 1.00 0.00 C ATOM 1000 C GLY A 65 1.852 -5.989 -16.824 1.00 0.00 C ATOM 1001 O GLY A 65 1.939 -6.790 -17.759 1.00 0.00 O ATOM 0 H GLY A 65 3.606 -4.541 -14.360 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.092 -4.275 -16.501 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.979 -5.759 -16.789 1.00 0.00 H new ATOM 1005 N LYS A 66 0.687 -5.648 -16.251 1.00 0.00 N ATOM 1006 CA LYS A 66 -0.624 -6.237 -16.638 1.00 0.00 C ATOM 1007 C LYS A 66 -1.751 -5.296 -16.117 1.00 0.00 C ATOM 1008 O LYS A 66 -2.438 -4.671 -16.930 1.00 0.00 O ATOM 1009 CB LYS A 66 -0.751 -7.725 -16.184 1.00 0.00 C ATOM 1010 CG LYS A 66 -2.039 -8.446 -16.641 1.00 0.00 C ATOM 1011 CD LYS A 66 -2.134 -9.929 -16.212 1.00 0.00 C ATOM 1012 CE LYS A 66 -2.209 -10.219 -14.696 1.00 0.00 C ATOM 1013 NZ LYS A 66 -3.414 -9.671 -14.043 1.00 0.00 N ATOM 0 H LYS A 66 0.617 -4.956 -15.505 1.00 0.00 H new ATOM 0 HA LYS A 66 -0.717 -6.294 -17.723 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.109 -8.278 -16.562 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -0.700 -7.761 -15.096 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.900 -7.910 -16.242 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -2.104 -8.391 -17.728 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.016 -10.362 -16.683 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -1.268 -10.454 -16.615 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.181 -11.297 -14.540 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -1.325 -9.804 -14.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -3.396 -9.904 -13.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -3.433 -8.638 -14.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -4.263 -10.085 -14.478 1.00 0.00 H new ATOM 1027 N LYS A 67 -1.936 -5.204 -14.782 1.00 0.00 N ATOM 1028 CA LYS A 67 -2.931 -4.309 -14.142 1.00 0.00 C ATOM 1029 C LYS A 67 -2.333 -2.925 -13.751 1.00 0.00 C ATOM 1030 O LYS A 67 -2.970 -1.902 -14.019 1.00 0.00 O ATOM 1031 CB LYS A 67 -3.604 -5.067 -12.957 1.00 0.00 C ATOM 1032 CG LYS A 67 -4.812 -4.375 -12.274 1.00 0.00 C ATOM 1033 CD LYS A 67 -4.449 -3.488 -11.063 1.00 0.00 C ATOM 1034 CE LYS A 67 -5.677 -2.803 -10.436 1.00 0.00 C ATOM 1035 NZ LYS A 67 -5.312 -2.012 -9.249 1.00 0.00 N ATOM 0 H LYS A 67 -1.396 -5.752 -14.112 1.00 0.00 H new ATOM 0 HA LYS A 67 -3.708 -4.059 -14.864 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.933 -6.041 -13.321 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -2.844 -5.250 -12.197 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.328 -3.763 -13.014 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -5.515 -5.141 -11.948 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -3.953 -4.098 -10.307 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -3.735 -2.727 -11.377 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.149 -2.155 -11.174 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.413 -3.558 -10.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -6.164 -1.566 -8.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -4.885 -2.635 -8.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -4.629 -1.276 -9.519 1.00 0.00 H new ATOM 1049 N PHE A 68 -1.163 -2.891 -13.076 1.00 0.00 N ATOM 1050 CA PHE A 68 -0.687 -1.696 -12.342 1.00 0.00 C ATOM 1051 C PHE A 68 -0.130 -0.589 -13.275 1.00 0.00 C ATOM 1052 O PHE A 68 0.585 -0.843 -14.251 1.00 0.00 O ATOM 1053 CB PHE A 68 0.381 -2.137 -11.305 1.00 0.00 C ATOM 1054 CG PHE A 68 0.383 -1.315 -10.008 1.00 0.00 C ATOM 1055 CD1 PHE A 68 1.187 -0.177 -9.867 1.00 0.00 C ATOM 1056 CD2 PHE A 68 -0.323 -1.798 -8.901 1.00 0.00 C ATOM 1057 CE1 PHE A 68 1.304 0.448 -8.628 1.00 0.00 C ATOM 1058 CE2 PHE A 68 -0.203 -1.173 -7.666 1.00 0.00 C ATOM 1059 CZ PHE A 68 0.621 -0.065 -7.527 1.00 0.00 C ATOM 0 H PHE A 68 -0.525 -3.685 -13.024 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.543 -1.251 -11.835 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.217 -3.185 -11.056 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.367 -2.069 -11.765 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.718 0.217 -10.721 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -0.964 -2.661 -9.007 1.00 0.00 H new ATOM 0 HE1 PHE A 68 1.922 1.327 -8.521 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.751 -1.549 -6.815 1.00 0.00 H new ATOM 0 HZ PHE A 68 0.734 0.402 -6.560 1.00 0.00 H new ATOM 1069 N LYS A 69 -0.485 0.647 -12.914 1.00 0.00 N ATOM 1070 CA LYS A 69 -0.208 1.854 -13.737 1.00 0.00 C ATOM 1071 C LYS A 69 1.173 2.546 -13.515 1.00 0.00 C ATOM 1072 O LYS A 69 1.606 3.258 -14.425 1.00 0.00 O ATOM 1073 CB LYS A 69 -1.366 2.873 -13.547 1.00 0.00 C ATOM 1074 CG LYS A 69 -2.821 2.392 -13.782 1.00 0.00 C ATOM 1075 CD LYS A 69 -3.123 1.657 -15.105 1.00 0.00 C ATOM 1076 CE LYS A 69 -2.963 2.522 -16.369 1.00 0.00 C ATOM 1077 NZ LYS A 69 -3.307 1.762 -17.582 1.00 0.00 N ATOM 0 H LYS A 69 -0.974 0.852 -12.043 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.150 1.493 -14.764 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.305 3.258 -12.529 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -1.182 3.713 -14.217 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.094 1.730 -12.960 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.476 3.261 -13.723 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.462 0.794 -15.185 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.143 1.275 -15.069 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.603 3.401 -16.294 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -1.936 2.880 -16.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.190 2.370 -18.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -2.680 0.936 -17.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.295 1.442 -17.523 1.00 0.00 H new ATOM 1091 N LEU A 70 1.843 2.376 -12.352 1.00 0.00 N ATOM 1092 CA LEU A 70 3.129 3.040 -12.026 1.00 0.00 C ATOM 1093 C LEU A 70 4.304 2.033 -12.268 1.00 0.00 C ATOM 1094 O LEU A 70 4.509 1.162 -11.414 1.00 0.00 O ATOM 1095 CB LEU A 70 3.037 3.612 -10.579 1.00 0.00 C ATOM 1096 CG LEU A 70 4.049 4.671 -10.055 1.00 0.00 C ATOM 1097 CD1 LEU A 70 5.064 4.099 -9.061 1.00 0.00 C ATOM 1098 CD2 LEU A 70 4.707 5.550 -11.134 1.00 0.00 C ATOM 0 H LEU A 70 1.504 1.769 -11.606 1.00 0.00 H new ATOM 0 HA LEU A 70 3.335 3.890 -12.677 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.042 4.045 -10.473 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.088 2.762 -9.899 1.00 0.00 H new ATOM 0 HG LEU A 70 3.419 5.364 -9.498 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.740 4.890 -8.735 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.538 3.692 -8.197 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.638 3.307 -9.542 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.394 6.253 -10.662 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.257 4.919 -11.832 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.937 6.102 -11.673 1.00 0.00 H new ATOM 1110 N PRO A 71 5.085 2.092 -13.393 1.00 0.00 N ATOM 1111 CA PRO A 71 6.179 1.120 -13.690 1.00 0.00 C ATOM 1112 C PRO A 71 7.525 1.264 -12.910 1.00 0.00 C ATOM 1113 O PRO A 71 8.336 0.336 -12.958 1.00 0.00 O ATOM 1114 CB PRO A 71 6.380 1.335 -15.204 1.00 0.00 C ATOM 1115 CG PRO A 71 6.067 2.815 -15.435 1.00 0.00 C ATOM 1116 CD PRO A 71 4.916 3.086 -14.469 1.00 0.00 C ATOM 0 HA PRO A 71 5.885 0.121 -13.369 1.00 0.00 H new ATOM 0 HB2 PRO A 71 7.400 1.095 -15.505 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.716 0.695 -15.786 1.00 0.00 H new ATOM 0 HG2 PRO A 71 6.929 3.447 -15.221 1.00 0.00 H new ATOM 0 HG3 PRO A 71 5.779 3.009 -16.468 1.00 0.00 H new ATOM 0 HD2 PRO A 71 4.958 4.103 -14.078 1.00 0.00 H new ATOM 0 HD3 PRO A 71 3.951 2.974 -14.963 1.00 0.00 H new ATOM 1124 N VAL A 72 7.764 2.392 -12.208 1.00 0.00 N ATOM 1125 CA VAL A 72 8.953 2.568 -11.321 1.00 0.00 C ATOM 1126 C VAL A 72 8.941 1.661 -10.051 1.00 0.00 C ATOM 1127 O VAL A 72 10.008 1.168 -9.694 1.00 0.00 O ATOM 1128 CB VAL A 72 9.265 4.069 -11.033 1.00 0.00 C ATOM 1129 CG1 VAL A 72 8.224 4.808 -10.183 1.00 0.00 C ATOM 1130 CG2 VAL A 72 10.673 4.297 -10.434 1.00 0.00 C ATOM 0 H VAL A 72 7.149 3.205 -12.234 1.00 0.00 H new ATOM 0 HA VAL A 72 9.804 2.197 -11.892 1.00 0.00 H new ATOM 0 HB VAL A 72 9.224 4.508 -12.030 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.537 5.843 -10.043 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.259 4.786 -10.689 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.135 4.321 -9.212 1.00 0.00 H new ATOM 0 HG21 VAL A 72 10.825 5.362 -10.258 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.759 3.757 -9.491 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.428 3.933 -11.131 1.00 0.00 H new ATOM 1140 N TRP A 73 7.779 1.387 -9.416 1.00 0.00 N ATOM 1141 CA TRP A 73 7.632 0.280 -8.422 1.00 0.00 C ATOM 1142 C TRP A 73 8.092 -1.120 -8.919 1.00 0.00 C ATOM 1143 O TRP A 73 8.734 -1.834 -8.151 1.00 0.00 O ATOM 1144 CB TRP A 73 6.167 0.261 -7.881 1.00 0.00 C ATOM 1145 CG TRP A 73 5.840 1.299 -6.790 1.00 0.00 C ATOM 1146 CD1 TRP A 73 6.559 2.485 -6.529 1.00 0.00 C ATOM 1147 CD2 TRP A 73 4.786 1.315 -5.887 1.00 0.00 C ATOM 1148 NE1 TRP A 73 6.003 3.220 -5.482 1.00 0.00 N ATOM 1149 CE2 TRP A 73 4.903 2.490 -5.103 1.00 0.00 C ATOM 1150 CE3 TRP A 73 3.701 0.429 -5.681 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 3.944 2.789 -4.114 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 2.754 0.752 -4.703 1.00 0.00 C ATOM 1153 CH2 TRP A 73 2.872 1.915 -3.938 1.00 0.00 C ATOM 0 H TRP A 73 6.921 1.916 -9.570 1.00 0.00 H new ATOM 0 HA TRP A 73 8.325 0.499 -7.609 1.00 0.00 H new ATOM 0 HB2 TRP A 73 5.488 0.417 -8.719 1.00 0.00 H new ATOM 0 HB3 TRP A 73 5.959 -0.733 -7.484 1.00 0.00 H new ATOM 0 HD1 TRP A 73 7.439 2.789 -7.077 1.00 0.00 H new ATOM 0 HE1 TRP A 73 6.337 4.099 -5.088 1.00 0.00 H new ATOM 0 HE3 TRP A 73 3.607 -0.475 -6.265 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 4.038 3.676 -3.505 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 1.917 0.090 -4.536 1.00 0.00 H new ATOM 0 HH2 TRP A 73 2.119 2.141 -3.197 1.00 0.00 H new ATOM 1164 N GLU A 74 7.812 -1.460 -10.188 1.00 0.00 N ATOM 1165 CA GLU A 74 8.270 -2.722 -10.846 1.00 0.00 C ATOM 1166 C GLU A 74 9.806 -2.804 -11.128 1.00 0.00 C ATOM 1167 O GLU A 74 10.396 -3.867 -10.935 1.00 0.00 O ATOM 1168 CB GLU A 74 7.474 -2.945 -12.169 1.00 0.00 C ATOM 1169 CG GLU A 74 5.930 -2.823 -12.137 1.00 0.00 C ATOM 1170 CD GLU A 74 5.227 -2.846 -13.500 1.00 0.00 C ATOM 1171 OE1 GLU A 74 5.783 -3.377 -14.487 1.00 0.00 O ATOM 1172 OE2 GLU A 74 4.089 -2.331 -13.581 1.00 0.00 O ATOM 0 H GLU A 74 7.255 -0.867 -10.804 1.00 0.00 H new ATOM 0 HA GLU A 74 8.067 -3.515 -10.127 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.847 -2.231 -12.904 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.719 -3.941 -12.539 1.00 0.00 H new ATOM 0 HG2 GLU A 74 5.533 -3.638 -11.532 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.669 -1.894 -11.631 1.00 0.00 H new ATOM 1179 N THR A 75 10.437 -1.698 -11.573 1.00 0.00 N ATOM 1180 CA THR A 75 11.917 -1.569 -11.742 1.00 0.00 C ATOM 1181 C THR A 75 12.703 -1.479 -10.387 1.00 0.00 C ATOM 1182 O THR A 75 13.787 -2.060 -10.285 1.00 0.00 O ATOM 1183 CB THR A 75 12.188 -0.353 -12.685 1.00 0.00 C ATOM 1184 OG1 THR A 75 11.455 -0.478 -13.903 1.00 0.00 O ATOM 1185 CG2 THR A 75 13.661 -0.171 -13.088 1.00 0.00 C ATOM 0 H THR A 75 9.933 -0.850 -11.832 1.00 0.00 H new ATOM 0 HA THR A 75 12.301 -2.482 -12.197 1.00 0.00 H new ATOM 0 HB THR A 75 11.876 0.509 -12.095 1.00 0.00 H new ATOM 0 HG1 THR A 75 10.513 -0.261 -13.742 1.00 0.00 H new ATOM 0 HG21 THR A 75 13.755 0.696 -13.742 1.00 0.00 H new ATOM 0 HG22 THR A 75 14.267 -0.019 -12.195 1.00 0.00 H new ATOM 0 HG23 THR A 75 14.007 -1.061 -13.613 1.00 0.00 H new ATOM 1193 N ILE A 76 12.153 -0.803 -9.351 1.00 0.00 N ATOM 1194 CA ILE A 76 12.595 -0.922 -7.926 1.00 0.00 C ATOM 1195 C ILE A 76 12.680 -2.417 -7.451 1.00 0.00 C ATOM 1196 O ILE A 76 13.740 -2.842 -6.980 1.00 0.00 O ATOM 1197 CB ILE A 76 11.694 0.009 -7.014 1.00 0.00 C ATOM 1198 CG1 ILE A 76 11.963 1.533 -7.232 1.00 0.00 C ATOM 1199 CG2 ILE A 76 11.761 -0.296 -5.494 1.00 0.00 C ATOM 1200 CD1 ILE A 76 10.870 2.484 -6.704 1.00 0.00 C ATOM 0 H ILE A 76 11.380 -0.149 -9.474 1.00 0.00 H new ATOM 0 HA ILE A 76 13.620 -0.562 -7.832 1.00 0.00 H new ATOM 0 HB ILE A 76 10.688 -0.236 -7.353 1.00 0.00 H new ATOM 0 HG12 ILE A 76 12.907 1.790 -6.750 1.00 0.00 H new ATOM 0 HG13 ILE A 76 12.091 1.712 -8.300 1.00 0.00 H new ATOM 0 HG21 ILE A 76 11.111 0.394 -4.956 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.433 -1.320 -5.314 1.00 0.00 H new ATOM 0 HG23 ILE A 76 12.786 -0.176 -5.144 1.00 0.00 H new ATOM 0 HD11 ILE A 76 11.157 3.516 -6.907 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.926 2.265 -7.202 1.00 0.00 H new ATOM 0 HD13 ILE A 76 10.754 2.344 -5.629 1.00 0.00 H new ATOM 1212 N VAL A 77 11.575 -3.182 -7.576 1.00 0.00 N ATOM 1213 CA VAL A 77 11.489 -4.577 -7.054 1.00 0.00 C ATOM 1214 C VAL A 77 11.995 -5.732 -7.967 1.00 0.00 C ATOM 1215 O VAL A 77 12.140 -6.847 -7.455 1.00 0.00 O ATOM 1216 CB VAL A 77 10.072 -4.897 -6.489 1.00 0.00 C ATOM 1217 CG1 VAL A 77 9.700 -3.995 -5.293 1.00 0.00 C ATOM 1218 CG2 VAL A 77 8.921 -5.069 -7.501 1.00 0.00 C ATOM 0 H VAL A 77 10.722 -2.862 -8.035 1.00 0.00 H new ATOM 0 HA VAL A 77 12.226 -4.560 -6.251 1.00 0.00 H new ATOM 0 HB VAL A 77 10.190 -5.917 -6.122 1.00 0.00 H new ATOM 0 HG11 VAL A 77 8.704 -4.257 -4.936 1.00 0.00 H new ATOM 0 HG12 VAL A 77 10.423 -4.139 -4.490 1.00 0.00 H new ATOM 0 HG13 VAL A 77 9.710 -2.951 -5.608 1.00 0.00 H new ATOM 0 HG21 VAL A 77 7.996 -5.288 -6.967 1.00 0.00 H new ATOM 0 HG22 VAL A 77 8.800 -4.150 -8.074 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.152 -5.891 -8.178 1.00 0.00 H new ATOM 1228 N CYS A 78 12.283 -5.515 -9.266 1.00 0.00 N ATOM 1229 CA CYS A 78 12.895 -6.563 -10.132 1.00 0.00 C ATOM 1230 C CYS A 78 14.291 -7.117 -9.697 1.00 0.00 C ATOM 1231 O CYS A 78 14.624 -8.250 -10.055 1.00 0.00 O ATOM 1232 CB CYS A 78 12.929 -6.089 -11.597 1.00 0.00 C ATOM 1233 SG CYS A 78 14.083 -4.693 -11.814 1.00 0.00 S ATOM 0 H CYS A 78 12.106 -4.631 -9.744 1.00 0.00 H new ATOM 0 HA CYS A 78 12.235 -7.422 -10.011 1.00 0.00 H new ATOM 0 HB2 CYS A 78 13.228 -6.915 -12.242 1.00 0.00 H new ATOM 0 HB3 CYS A 78 11.928 -5.788 -11.908 1.00 0.00 H new ATOM 0 HG CYS A 78 13.733 -3.715 -11.032 1.00 0.00 H new ATOM 1239 N THR A 79 15.067 -6.339 -8.915 1.00 0.00 N ATOM 1240 CA THR A 79 16.319 -6.799 -8.248 1.00 0.00 C ATOM 1241 C THR A 79 16.125 -7.167 -6.724 1.00 0.00 C ATOM 1242 O THR A 79 17.060 -7.015 -5.932 1.00 0.00 O ATOM 1243 CB THR A 79 17.406 -5.700 -8.448 1.00 0.00 C ATOM 1244 OG1 THR A 79 16.982 -4.474 -7.874 1.00 0.00 O ATOM 1245 CG2 THR A 79 17.765 -5.430 -9.910 1.00 0.00 C ATOM 0 H THR A 79 14.846 -5.362 -8.722 1.00 0.00 H new ATOM 0 HA THR A 79 16.636 -7.732 -8.713 1.00 0.00 H new ATOM 0 HB THR A 79 18.295 -6.092 -7.954 1.00 0.00 H new ATOM 0 HG1 THR A 79 16.315 -4.053 -8.456 1.00 0.00 H new ATOM 0 HG21 THR A 79 18.528 -4.653 -9.960 1.00 0.00 H new ATOM 0 HG22 THR A 79 18.147 -6.343 -10.365 1.00 0.00 H new ATOM 0 HG23 THR A 79 16.876 -5.101 -10.448 1.00 0.00 H new ATOM 1253 N MET A 80 14.935 -7.665 -6.317 1.00 0.00 N ATOM 1254 CA MET A 80 14.593 -8.005 -4.907 1.00 0.00 C ATOM 1255 C MET A 80 13.891 -9.397 -4.865 1.00 0.00 C ATOM 1256 O MET A 80 13.081 -9.742 -5.730 1.00 0.00 O ATOM 1257 CB MET A 80 13.674 -6.933 -4.251 1.00 0.00 C ATOM 1258 CG MET A 80 14.354 -5.624 -3.809 1.00 0.00 C ATOM 1259 SD MET A 80 13.111 -4.360 -3.443 1.00 0.00 S ATOM 1260 CE MET A 80 12.507 -4.861 -1.818 1.00 0.00 C ATOM 0 H MET A 80 14.169 -7.847 -6.966 1.00 0.00 H new ATOM 0 HA MET A 80 15.522 -8.033 -4.337 1.00 0.00 H new ATOM 0 HB2 MET A 80 12.882 -6.685 -4.957 1.00 0.00 H new ATOM 0 HB3 MET A 80 13.196 -7.380 -3.380 1.00 0.00 H new ATOM 0 HG2 MET A 80 14.968 -5.806 -2.927 1.00 0.00 H new ATOM 0 HG3 MET A 80 15.021 -5.270 -4.595 1.00 0.00 H new ATOM 0 HE1 MET A 80 11.427 -4.723 -1.773 1.00 0.00 H new ATOM 0 HE2 MET A 80 12.746 -5.911 -1.649 1.00 0.00 H new ATOM 0 HE3 MET A 80 12.983 -4.252 -1.049 1.00 0.00 H new ATOM 1270 N ARG A 81 14.200 -10.173 -3.814 1.00 0.00 N ATOM 1271 CA ARG A 81 13.655 -11.544 -3.580 1.00 0.00 C ATOM 1272 C ARG A 81 12.807 -11.609 -2.267 1.00 0.00 C ATOM 1273 O ARG A 81 12.641 -10.601 -1.574 1.00 0.00 O ATOM 1274 CB ARG A 81 14.850 -12.543 -3.617 1.00 0.00 C ATOM 1275 CG ARG A 81 15.981 -12.317 -2.587 1.00 0.00 C ATOM 1276 CD ARG A 81 17.137 -13.310 -2.749 1.00 0.00 C ATOM 1277 NE ARG A 81 18.248 -12.927 -1.851 1.00 0.00 N ATOM 1278 CZ ARG A 81 19.446 -13.541 -1.812 1.00 0.00 C ATOM 1279 NH1 ARG A 81 19.764 -14.599 -2.556 1.00 0.00 N ATOM 1280 NH2 ARG A 81 20.361 -13.064 -0.989 1.00 0.00 N ATOM 0 H ARG A 81 14.845 -9.872 -3.084 1.00 0.00 H new ATOM 0 HA ARG A 81 12.952 -11.824 -4.365 1.00 0.00 H new ATOM 0 HB2 ARG A 81 14.456 -13.549 -3.473 1.00 0.00 H new ATOM 0 HB3 ARG A 81 15.288 -12.512 -4.615 1.00 0.00 H new ATOM 0 HG2 ARG A 81 16.363 -11.301 -2.690 1.00 0.00 H new ATOM 0 HG3 ARG A 81 15.572 -12.403 -1.580 1.00 0.00 H new ATOM 0 HD2 ARG A 81 16.798 -14.319 -2.515 1.00 0.00 H new ATOM 0 HD3 ARG A 81 17.479 -13.320 -3.784 1.00 0.00 H new ATOM 0 HE ARG A 81 18.096 -12.143 -1.217 1.00 0.00 H new ATOM 0 HH11 ARG A 81 19.081 -14.991 -3.204 1.00 0.00 H new ATOM 0 HH12 ARG A 81 20.691 -15.017 -2.478 1.00 0.00 H new ATOM 0 HH21 ARG A 81 20.150 -12.253 -0.407 1.00 0.00 H new ATOM 0 HH22 ARG A 81 21.279 -13.506 -0.935 1.00 0.00 H new ATOM 1294 N GLU A 82 12.278 -12.803 -1.916 1.00 0.00 N ATOM 1295 CA GLU A 82 11.449 -13.020 -0.690 1.00 0.00 C ATOM 1296 C GLU A 82 12.261 -12.736 0.606 1.00 0.00 C ATOM 1297 O GLU A 82 13.174 -13.492 0.956 1.00 0.00 O ATOM 1298 CB GLU A 82 10.876 -14.468 -0.610 1.00 0.00 C ATOM 1299 CG GLU A 82 9.936 -14.951 -1.738 1.00 0.00 C ATOM 1300 CD GLU A 82 10.655 -15.596 -2.930 1.00 0.00 C ATOM 1301 OE1 GLU A 82 11.239 -16.690 -2.771 1.00 0.00 O ATOM 1302 OE2 GLU A 82 10.635 -15.011 -4.031 1.00 0.00 O ATOM 0 H GLU A 82 12.409 -13.649 -2.470 1.00 0.00 H new ATOM 0 HA GLU A 82 10.620 -12.317 -0.766 1.00 0.00 H new ATOM 0 HB2 GLU A 82 11.720 -15.157 -0.564 1.00 0.00 H new ATOM 0 HB3 GLU A 82 10.337 -14.560 0.333 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.230 -15.670 -1.323 1.00 0.00 H new ATOM 0 HG3 GLU A 82 9.353 -14.103 -2.097 1.00 0.00 H new ATOM 1309 N GLY A 83 11.936 -11.623 1.281 1.00 0.00 N ATOM 1310 CA GLY A 83 12.717 -11.161 2.454 1.00 0.00 C ATOM 1311 C GLY A 83 13.849 -10.123 2.230 1.00 0.00 C ATOM 1312 O GLY A 83 14.604 -9.901 3.179 1.00 0.00 O ATOM 0 H GLY A 83 11.145 -11.025 1.042 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.016 -10.736 3.172 1.00 0.00 H new ATOM 0 HA3 GLY A 83 13.161 -12.039 2.923 1.00 0.00 H new ATOM 1316 N GLU A 84 13.988 -9.491 1.043 1.00 0.00 N ATOM 1317 CA GLU A 84 15.045 -8.483 0.767 1.00 0.00 C ATOM 1318 C GLU A 84 14.490 -7.060 1.022 1.00 0.00 C ATOM 1319 O GLU A 84 13.398 -6.718 0.567 1.00 0.00 O ATOM 1320 CB GLU A 84 15.575 -8.661 -0.682 1.00 0.00 C ATOM 1321 CG GLU A 84 16.812 -7.789 -0.994 1.00 0.00 C ATOM 1322 CD GLU A 84 17.574 -8.153 -2.268 1.00 0.00 C ATOM 1323 OE1 GLU A 84 18.072 -9.296 -2.377 1.00 0.00 O ATOM 1324 OE2 GLU A 84 17.711 -7.281 -3.152 1.00 0.00 O ATOM 0 H GLU A 84 13.373 -9.663 0.248 1.00 0.00 H new ATOM 0 HA GLU A 84 15.888 -8.629 1.442 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.829 -9.709 -0.842 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.779 -8.415 -1.385 1.00 0.00 H new ATOM 0 HG2 GLU A 84 16.492 -6.750 -1.068 1.00 0.00 H new ATOM 0 HG3 GLU A 84 17.500 -7.851 -0.151 1.00 0.00 H new ATOM 1331 N ILE A 85 15.270 -6.243 1.745 1.00 0.00 N ATOM 1332 CA ILE A 85 14.840 -4.893 2.190 1.00 0.00 C ATOM 1333 C ILE A 85 15.852 -3.893 1.567 1.00 0.00 C ATOM 1334 O ILE A 85 17.042 -3.951 1.881 1.00 0.00 O ATOM 1335 CB ILE A 85 14.750 -4.785 3.757 1.00 0.00 C ATOM 1336 CG1 ILE A 85 13.886 -5.887 4.458 1.00 0.00 C ATOM 1337 CG2 ILE A 85 14.183 -3.408 4.171 1.00 0.00 C ATOM 1338 CD1 ILE A 85 14.673 -7.124 4.919 1.00 0.00 C ATOM 0 H ILE A 85 16.214 -6.490 2.041 1.00 0.00 H new ATOM 0 HA ILE A 85 13.828 -4.668 1.852 1.00 0.00 H new ATOM 0 HB ILE A 85 15.778 -4.926 4.092 1.00 0.00 H new ATOM 0 HG12 ILE A 85 13.391 -5.445 5.323 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.103 -6.207 3.771 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.127 -3.349 5.258 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.836 -2.619 3.798 1.00 0.00 H new ATOM 0 HG23 ILE A 85 13.186 -3.283 3.749 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.993 -7.832 5.393 1.00 0.00 H new ATOM 0 HD12 ILE A 85 15.146 -7.596 4.058 1.00 0.00 H new ATOM 0 HD13 ILE A 85 15.439 -6.823 5.634 1.00 0.00 H new ATOM 1350 N ALA A 86 15.359 -2.977 0.714 1.00 0.00 N ATOM 1351 CA ALA A 86 16.196 -1.939 0.059 1.00 0.00 C ATOM 1352 C ALA A 86 15.516 -0.548 0.115 1.00 0.00 C ATOM 1353 O ALA A 86 14.333 -0.414 -0.219 1.00 0.00 O ATOM 1354 CB ALA A 86 16.481 -2.366 -1.396 1.00 0.00 C ATOM 0 H ALA A 86 14.373 -2.930 0.456 1.00 0.00 H new ATOM 0 HA ALA A 86 17.140 -1.849 0.597 1.00 0.00 H new ATOM 0 HB1 ALA A 86 17.095 -1.609 -1.884 1.00 0.00 H new ATOM 0 HB2 ALA A 86 17.010 -3.319 -1.399 1.00 0.00 H new ATOM 0 HB3 ALA A 86 15.540 -2.472 -1.935 1.00 0.00 H new ATOM 1360 N GLN A 87 16.292 0.484 0.516 1.00 0.00 N ATOM 1361 CA GLN A 87 15.817 1.896 0.558 1.00 0.00 C ATOM 1362 C GLN A 87 16.705 2.794 -0.325 1.00 0.00 C ATOM 1363 O GLN A 87 17.938 2.739 -0.231 1.00 0.00 O ATOM 1364 CB GLN A 87 15.617 2.438 1.989 1.00 0.00 C ATOM 1365 CG GLN A 87 16.847 2.827 2.837 1.00 0.00 C ATOM 1366 CD GLN A 87 17.599 4.145 2.545 1.00 0.00 C ATOM 1367 OE1 GLN A 87 18.820 4.218 2.684 1.00 0.00 O ATOM 1368 NE2 GLN A 87 16.915 5.200 2.130 1.00 0.00 N ATOM 0 H GLN A 87 17.259 0.369 0.819 1.00 0.00 H new ATOM 0 HA GLN A 87 14.814 1.914 0.131 1.00 0.00 H new ATOM 0 HB2 GLN A 87 14.979 3.319 1.918 1.00 0.00 H new ATOM 0 HB3 GLN A 87 15.061 1.685 2.548 1.00 0.00 H new ATOM 0 HG2 GLN A 87 16.526 2.860 3.878 1.00 0.00 H new ATOM 0 HG3 GLN A 87 17.570 2.015 2.752 1.00 0.00 H new ATOM 0 HE21 GLN A 87 15.903 5.139 2.015 1.00 0.00 H new ATOM 0 HE22 GLN A 87 17.400 6.074 1.925 1.00 0.00 H new ATOM 1377 N PHE A 88 16.075 3.603 -1.201 1.00 0.00 N ATOM 1378 CA PHE A 88 16.805 4.285 -2.298 1.00 0.00 C ATOM 1379 C PHE A 88 15.941 5.304 -3.090 1.00 0.00 C ATOM 1380 O PHE A 88 14.720 5.154 -3.213 1.00 0.00 O ATOM 1381 CB PHE A 88 17.457 3.262 -3.263 1.00 0.00 C ATOM 1382 CG PHE A 88 16.562 2.297 -4.054 1.00 0.00 C ATOM 1383 CD1 PHE A 88 16.175 1.083 -3.475 1.00 0.00 C ATOM 1384 CD2 PHE A 88 16.290 2.533 -5.407 1.00 0.00 C ATOM 1385 CE1 PHE A 88 15.568 0.103 -4.246 1.00 0.00 C ATOM 1386 CE2 PHE A 88 15.723 1.530 -6.188 1.00 0.00 C ATOM 1387 CZ PHE A 88 15.389 0.310 -5.607 1.00 0.00 C ATOM 0 H PHE A 88 15.075 3.801 -1.175 1.00 0.00 H new ATOM 0 HA PHE A 88 17.588 4.863 -1.808 1.00 0.00 H new ATOM 0 HB2 PHE A 88 18.050 3.824 -3.984 1.00 0.00 H new ATOM 0 HB3 PHE A 88 18.153 2.659 -2.680 1.00 0.00 H new ATOM 0 HD1 PHE A 88 16.350 0.909 -2.424 1.00 0.00 H new ATOM 0 HD2 PHE A 88 16.520 3.493 -5.845 1.00 0.00 H new ATOM 0 HE1 PHE A 88 15.236 -0.818 -3.789 1.00 0.00 H new ATOM 0 HE2 PHE A 88 15.543 1.698 -7.240 1.00 0.00 H new ATOM 0 HZ PHE A 88 14.987 -0.483 -6.221 1.00 0.00 H new ATOM 1397 N LEU A 89 16.624 6.298 -3.696 1.00 0.00 N ATOM 1398 CA LEU A 89 15.973 7.333 -4.543 1.00 0.00 C ATOM 1399 C LEU A 89 15.757 6.897 -6.018 1.00 0.00 C ATOM 1400 O LEU A 89 16.541 6.128 -6.586 1.00 0.00 O ATOM 1401 CB LEU A 89 16.626 8.742 -4.399 1.00 0.00 C ATOM 1402 CG LEU A 89 18.154 8.937 -4.624 1.00 0.00 C ATOM 1403 CD1 LEU A 89 18.578 8.865 -6.106 1.00 0.00 C ATOM 1404 CD2 LEU A 89 18.603 10.285 -4.022 1.00 0.00 C ATOM 0 H LEU A 89 17.635 6.410 -3.616 1.00 0.00 H new ATOM 0 HA LEU A 89 14.966 7.436 -4.139 1.00 0.00 H new ATOM 0 HB2 LEU A 89 16.112 9.406 -5.094 1.00 0.00 H new ATOM 0 HB3 LEU A 89 16.402 9.098 -3.393 1.00 0.00 H new ATOM 0 HG LEU A 89 18.647 8.106 -4.120 1.00 0.00 H new ATOM 0 HD11 LEU A 89 19.656 9.010 -6.184 1.00 0.00 H new ATOM 0 HD12 LEU A 89 18.313 7.889 -6.513 1.00 0.00 H new ATOM 0 HD13 LEU A 89 18.066 9.645 -6.669 1.00 0.00 H new ATOM 0 HD21 LEU A 89 19.673 10.417 -4.182 1.00 0.00 H new ATOM 0 HD22 LEU A 89 18.061 11.098 -4.505 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.392 10.294 -2.953 1.00 0.00 H new ATOM 1416 N CYS A 90 14.680 7.436 -6.623 1.00 0.00 N ATOM 1417 CA CYS A 90 14.423 7.329 -8.080 1.00 0.00 C ATOM 1418 C CYS A 90 14.266 8.745 -8.680 1.00 0.00 C ATOM 1419 O CYS A 90 13.582 9.604 -8.112 1.00 0.00 O ATOM 1420 CB CYS A 90 13.153 6.505 -8.377 1.00 0.00 C ATOM 1421 SG CYS A 90 13.261 4.846 -7.624 1.00 0.00 S ATOM 0 H CYS A 90 13.963 7.958 -6.120 1.00 0.00 H new ATOM 0 HA CYS A 90 15.271 6.816 -8.533 1.00 0.00 H new ATOM 0 HB2 CYS A 90 12.277 7.027 -7.991 1.00 0.00 H new ATOM 0 HB3 CYS A 90 13.019 6.411 -9.455 1.00 0.00 H new ATOM 0 HG CYS A 90 12.585 3.999 -8.342 1.00 0.00 H new ATOM 1427 N ASP A 91 14.851 8.954 -9.874 1.00 0.00 N ATOM 1428 CA ASP A 91 14.735 10.228 -10.633 1.00 0.00 C ATOM 1429 C ASP A 91 13.268 10.562 -11.025 1.00 0.00 C ATOM 1430 O ASP A 91 12.470 9.671 -11.332 1.00 0.00 O ATOM 1431 CB ASP A 91 15.660 10.162 -11.886 1.00 0.00 C ATOM 1432 CG ASP A 91 17.159 10.434 -11.661 1.00 0.00 C ATOM 1433 OD1 ASP A 91 17.658 10.314 -10.519 1.00 0.00 O ATOM 1434 OD2 ASP A 91 17.851 10.756 -12.652 1.00 0.00 O ATOM 0 H ASP A 91 15.418 8.250 -10.345 1.00 0.00 H new ATOM 0 HA ASP A 91 15.059 11.042 -9.984 1.00 0.00 H new ATOM 0 HB2 ASP A 91 15.558 9.172 -12.331 1.00 0.00 H new ATOM 0 HB3 ASP A 91 15.291 10.880 -12.618 1.00 0.00 H new ATOM 1439 N ILE A 92 12.943 11.868 -11.004 1.00 0.00 N ATOM 1440 CA ILE A 92 11.610 12.410 -11.401 1.00 0.00 C ATOM 1441 C ILE A 92 11.062 12.017 -12.803 1.00 0.00 C ATOM 1442 O ILE A 92 9.847 11.879 -12.924 1.00 0.00 O ATOM 1443 CB ILE A 92 11.475 13.965 -11.178 1.00 0.00 C ATOM 1444 CG1 ILE A 92 12.792 14.803 -11.201 1.00 0.00 C ATOM 1445 CG2 ILE A 92 10.629 14.235 -9.921 1.00 0.00 C ATOM 1446 CD1 ILE A 92 12.625 16.324 -11.339 1.00 0.00 C ATOM 0 H ILE A 92 13.598 12.592 -10.709 1.00 0.00 H new ATOM 0 HA ILE A 92 10.963 11.883 -10.699 1.00 0.00 H new ATOM 0 HB ILE A 92 10.964 14.334 -12.067 1.00 0.00 H new ATOM 0 HG12 ILE A 92 13.343 14.601 -10.283 1.00 0.00 H new ATOM 0 HG13 ILE A 92 13.409 14.450 -12.027 1.00 0.00 H new ATOM 0 HG21 ILE A 92 10.537 15.310 -9.769 1.00 0.00 H new ATOM 0 HG22 ILE A 92 9.638 13.800 -10.049 1.00 0.00 H new ATOM 0 HG23 ILE A 92 11.113 13.786 -9.054 1.00 0.00 H new ATOM 0 HD11 ILE A 92 13.606 16.799 -11.343 1.00 0.00 H new ATOM 0 HD12 ILE A 92 12.108 16.550 -12.272 1.00 0.00 H new ATOM 0 HD13 ILE A 92 12.042 16.704 -10.500 1.00 0.00 H new ATOM 1458 N LYS A 93 11.905 11.784 -13.824 1.00 0.00 N ATOM 1459 CA LYS A 93 11.482 11.084 -15.081 1.00 0.00 C ATOM 1460 C LYS A 93 10.711 9.719 -14.937 1.00 0.00 C ATOM 1461 O LYS A 93 9.918 9.371 -15.815 1.00 0.00 O ATOM 1462 CB LYS A 93 12.718 10.949 -16.018 1.00 0.00 C ATOM 1463 CG LYS A 93 13.785 9.904 -15.594 1.00 0.00 C ATOM 1464 CD LYS A 93 15.141 9.957 -16.332 1.00 0.00 C ATOM 1465 CE LYS A 93 15.176 9.333 -17.742 1.00 0.00 C ATOM 1466 NZ LYS A 93 14.553 10.179 -18.777 1.00 0.00 N ATOM 0 H LYS A 93 12.886 12.064 -13.817 1.00 0.00 H new ATOM 0 HA LYS A 93 10.712 11.724 -15.512 1.00 0.00 H new ATOM 0 HB2 LYS A 93 12.365 10.693 -17.017 1.00 0.00 H new ATOM 0 HB3 LYS A 93 13.202 11.923 -16.091 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.974 10.024 -14.527 1.00 0.00 H new ATOM 0 HG3 LYS A 93 13.361 8.909 -15.733 1.00 0.00 H new ATOM 0 HD2 LYS A 93 15.447 11.000 -16.412 1.00 0.00 H new ATOM 0 HD3 LYS A 93 15.886 9.453 -15.716 1.00 0.00 H new ATOM 0 HE2 LYS A 93 16.212 9.139 -18.019 1.00 0.00 H new ATOM 0 HE3 LYS A 93 14.667 8.370 -17.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 14.895 9.888 -19.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 13.519 10.072 -18.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 14.805 11.174 -18.610 1.00 0.00 H new ATOM 1480 N HIS A 94 10.960 8.971 -13.844 1.00 0.00 N ATOM 1481 CA HIS A 94 10.282 7.693 -13.518 1.00 0.00 C ATOM 1482 C HIS A 94 9.102 7.917 -12.518 1.00 0.00 C ATOM 1483 O HIS A 94 8.036 7.329 -12.721 1.00 0.00 O ATOM 1484 CB HIS A 94 11.306 6.666 -12.963 1.00 0.00 C ATOM 1485 CG HIS A 94 12.562 6.393 -13.797 1.00 0.00 C ATOM 1486 ND1 HIS A 94 12.611 5.646 -14.960 1.00 0.00 N ATOM 1487 CD2 HIS A 94 13.827 6.935 -13.524 1.00 0.00 C ATOM 1488 CE1 HIS A 94 13.929 5.815 -15.289 1.00 0.00 C ATOM 1489 NE2 HIS A 94 14.750 6.570 -14.489 1.00 0.00 N ATOM 0 H HIS A 94 11.653 9.241 -13.146 1.00 0.00 H new ATOM 0 HA HIS A 94 9.855 7.287 -14.435 1.00 0.00 H new ATOM 0 HB2 HIS A 94 11.625 7.008 -11.978 1.00 0.00 H new ATOM 0 HB3 HIS A 94 10.787 5.719 -12.818 1.00 0.00 H new ATOM 0 HD2 HIS A 94 14.052 7.557 -12.670 1.00 0.00 H new ATOM 0 HE1 HIS A 94 14.324 5.353 -16.181 1.00 0.00 H new ATOM 0 HE2 HIS A 94 15.741 6.794 -14.579 1.00 0.00 H new ATOM 1497 N VAL A 95 9.275 8.754 -11.460 1.00 0.00 N ATOM 1498 CA VAL A 95 8.192 9.093 -10.481 1.00 0.00 C ATOM 1499 C VAL A 95 7.309 10.340 -10.863 1.00 0.00 C ATOM 1500 O VAL A 95 6.642 10.914 -9.996 1.00 0.00 O ATOM 1501 CB VAL A 95 8.789 9.181 -9.031 1.00 0.00 C ATOM 1502 CG1 VAL A 95 9.476 7.874 -8.583 1.00 0.00 C ATOM 1503 CG2 VAL A 95 9.748 10.364 -8.767 1.00 0.00 C ATOM 0 H VAL A 95 10.163 9.214 -11.257 1.00 0.00 H new ATOM 0 HA VAL A 95 7.476 8.272 -10.517 1.00 0.00 H new ATOM 0 HB VAL A 95 7.897 9.360 -8.430 1.00 0.00 H new ATOM 0 HG11 VAL A 95 9.868 7.997 -7.574 1.00 0.00 H new ATOM 0 HG12 VAL A 95 8.751 7.060 -8.594 1.00 0.00 H new ATOM 0 HG13 VAL A 95 10.294 7.641 -9.264 1.00 0.00 H new ATOM 0 HG21 VAL A 95 10.099 10.325 -7.736 1.00 0.00 H new ATOM 0 HG22 VAL A 95 10.601 10.299 -9.443 1.00 0.00 H new ATOM 0 HG23 VAL A 95 9.222 11.304 -8.936 1.00 0.00 H new ATOM 1513 N VAL A 96 7.251 10.719 -12.158 1.00 0.00 N ATOM 1514 CA VAL A 96 6.382 11.814 -12.690 1.00 0.00 C ATOM 1515 C VAL A 96 4.849 11.526 -12.550 1.00 0.00 C ATOM 1516 O VAL A 96 4.090 12.428 -12.188 1.00 0.00 O ATOM 1517 CB VAL A 96 6.880 12.238 -14.134 1.00 0.00 C ATOM 1518 CG1 VAL A 96 5.868 12.178 -15.305 1.00 0.00 C ATOM 1519 CG2 VAL A 96 7.522 13.645 -14.134 1.00 0.00 C ATOM 0 H VAL A 96 7.812 10.271 -12.882 1.00 0.00 H new ATOM 0 HA VAL A 96 6.496 12.694 -12.058 1.00 0.00 H new ATOM 0 HB VAL A 96 7.603 11.448 -14.337 1.00 0.00 H new ATOM 0 HG11 VAL A 96 6.357 12.497 -16.225 1.00 0.00 H new ATOM 0 HG12 VAL A 96 5.507 11.156 -15.422 1.00 0.00 H new ATOM 0 HG13 VAL A 96 5.027 12.838 -15.093 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.849 13.896 -15.143 1.00 0.00 H new ATOM 0 HG22 VAL A 96 6.790 14.379 -13.797 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.380 13.653 -13.462 1.00 0.00 H new ATOM 1529 N LEU A 97 4.431 10.282 -12.852 1.00 0.00 N ATOM 1530 CA LEU A 97 3.051 9.782 -12.611 1.00 0.00 C ATOM 1531 C LEU A 97 2.826 8.967 -11.291 1.00 0.00 C ATOM 1532 O LEU A 97 1.757 8.377 -11.132 1.00 0.00 O ATOM 1533 CB LEU A 97 2.570 9.017 -13.881 1.00 0.00 C ATOM 1534 CG LEU A 97 3.385 7.746 -14.289 1.00 0.00 C ATOM 1535 CD1 LEU A 97 2.477 6.538 -14.580 1.00 0.00 C ATOM 1536 CD2 LEU A 97 4.333 7.999 -15.479 1.00 0.00 C ATOM 0 H LEU A 97 5.043 9.584 -13.275 1.00 0.00 H new ATOM 0 HA LEU A 97 2.431 10.661 -12.435 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.533 8.720 -13.726 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.581 9.712 -14.721 1.00 0.00 H new ATOM 0 HG LEU A 97 4.001 7.508 -13.421 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.090 5.681 -14.859 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.898 6.295 -13.689 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.799 6.781 -15.398 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.872 7.082 -15.717 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.752 8.314 -16.346 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.046 8.781 -15.216 1.00 0.00 H new ATOM 1548 N TYR A 98 3.751 9.002 -10.309 1.00 0.00 N ATOM 1549 CA TYR A 98 3.456 8.623 -8.902 1.00 0.00 C ATOM 1550 C TYR A 98 2.355 9.490 -8.181 1.00 0.00 C ATOM 1551 O TYR A 98 1.499 8.844 -7.573 1.00 0.00 O ATOM 1552 CB TYR A 98 4.789 8.540 -8.106 1.00 0.00 C ATOM 1553 CG TYR A 98 4.667 8.047 -6.646 1.00 0.00 C ATOM 1554 CD1 TYR A 98 4.048 6.827 -6.340 1.00 0.00 C ATOM 1555 CD2 TYR A 98 5.056 8.895 -5.604 1.00 0.00 C ATOM 1556 CE1 TYR A 98 3.769 6.494 -5.017 1.00 0.00 C ATOM 1557 CE2 TYR A 98 4.797 8.548 -4.282 1.00 0.00 C ATOM 1558 CZ TYR A 98 4.132 7.359 -3.990 1.00 0.00 C ATOM 1559 OH TYR A 98 3.809 7.049 -2.693 1.00 0.00 O ATOM 0 H TYR A 98 4.717 9.291 -10.462 1.00 0.00 H new ATOM 0 HA TYR A 98 2.988 7.639 -8.932 1.00 0.00 H new ATOM 0 HB2 TYR A 98 5.469 7.875 -8.639 1.00 0.00 H new ATOM 0 HB3 TYR A 98 5.249 9.528 -8.099 1.00 0.00 H new ATOM 0 HD1 TYR A 98 3.786 6.143 -7.134 1.00 0.00 H new ATOM 0 HD2 TYR A 98 5.560 9.824 -5.827 1.00 0.00 H new ATOM 0 HE1 TYR A 98 3.271 5.564 -4.788 1.00 0.00 H new ATOM 0 HE2 TYR A 98 5.112 9.201 -3.481 1.00 0.00 H new ATOM 0 HH TYR A 98 3.784 6.075 -2.586 1.00 0.00 H new ATOM 1569 N PRO A 99 2.273 10.859 -8.200 1.00 0.00 N ATOM 1570 CA PRO A 99 1.071 11.600 -7.711 1.00 0.00 C ATOM 1571 C PRO A 99 -0.268 11.437 -8.506 1.00 0.00 C ATOM 1572 O PRO A 99 -1.285 11.965 -8.054 1.00 0.00 O ATOM 1573 CB PRO A 99 1.569 13.057 -7.721 1.00 0.00 C ATOM 1574 CG PRO A 99 2.609 13.124 -8.840 1.00 0.00 C ATOM 1575 CD PRO A 99 3.233 11.736 -8.897 1.00 0.00 C ATOM 0 HA PRO A 99 0.758 11.203 -6.745 1.00 0.00 H new ATOM 0 HB2 PRO A 99 0.749 13.751 -7.905 1.00 0.00 H new ATOM 0 HB3 PRO A 99 2.007 13.329 -6.761 1.00 0.00 H new ATOM 0 HG2 PRO A 99 2.146 13.386 -9.791 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.361 13.885 -8.632 1.00 0.00 H new ATOM 0 HD2 PRO A 99 3.387 11.414 -9.927 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.208 11.721 -8.410 1.00 0.00 H new ATOM 1583 N LEU A 100 -0.275 10.727 -9.651 1.00 0.00 N ATOM 1584 CA LEU A 100 -1.506 10.377 -10.413 1.00 0.00 C ATOM 1585 C LEU A 100 -2.020 8.942 -10.057 1.00 0.00 C ATOM 1586 O LEU A 100 -3.225 8.751 -9.876 1.00 0.00 O ATOM 1587 CB LEU A 100 -1.274 10.538 -11.948 1.00 0.00 C ATOM 1588 CG LEU A 100 -0.523 11.800 -12.477 1.00 0.00 C ATOM 1589 CD1 LEU A 100 -0.489 11.813 -14.017 1.00 0.00 C ATOM 1590 CD2 LEU A 100 -1.049 13.141 -11.932 1.00 0.00 C ATOM 0 H LEU A 100 0.578 10.373 -10.083 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.288 11.077 -10.117 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.724 9.662 -12.290 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -2.250 10.510 -12.432 1.00 0.00 H new ATOM 0 HG LEU A 100 0.491 11.710 -12.088 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.039 12.702 -14.362 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.026 10.922 -14.377 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -1.508 11.824 -14.403 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.466 13.959 -12.355 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -2.097 13.260 -12.209 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.957 13.154 -10.846 1.00 0.00 H new ATOM 1602 N VAL A 101 -1.110 7.949 -9.955 1.00 0.00 N ATOM 1603 CA VAL A 101 -1.421 6.546 -9.540 1.00 0.00 C ATOM 1604 C VAL A 101 -1.661 6.371 -8.009 1.00 0.00 C ATOM 1605 O VAL A 101 -2.448 5.502 -7.639 1.00 0.00 O ATOM 1606 CB VAL A 101 -0.326 5.562 -10.074 1.00 0.00 C ATOM 1607 CG1 VAL A 101 -0.599 4.076 -9.711 1.00 0.00 C ATOM 1608 CG2 VAL A 101 -0.136 5.678 -11.604 1.00 0.00 C ATOM 0 H VAL A 101 -0.121 8.092 -10.160 1.00 0.00 H new ATOM 0 HA VAL A 101 -2.377 6.296 -10.001 1.00 0.00 H new ATOM 0 HB VAL A 101 0.589 5.870 -9.569 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.199 3.451 -10.112 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.635 3.967 -8.627 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -1.553 3.766 -10.139 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.633 4.977 -11.929 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -1.075 5.445 -12.106 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.168 6.694 -11.857 1.00 0.00 H new ATOM 1618 N ALA A 102 -1.039 7.179 -7.136 1.00 0.00 N ATOM 1619 CA ALA A 102 -1.510 7.377 -5.737 1.00 0.00 C ATOM 1620 C ALA A 102 -3.012 7.752 -5.534 1.00 0.00 C ATOM 1621 O ALA A 102 -3.585 7.363 -4.512 1.00 0.00 O ATOM 1622 CB ALA A 102 -0.634 8.457 -5.086 1.00 0.00 C ATOM 0 H ALA A 102 -0.202 7.714 -7.367 1.00 0.00 H new ATOM 0 HA ALA A 102 -1.419 6.396 -5.271 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -0.960 8.620 -4.059 1.00 0.00 H new ATOM 0 HB2 ALA A 102 0.406 8.132 -5.089 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.725 9.387 -5.647 1.00 0.00 H new ATOM 1628 N LYS A 103 -3.651 8.447 -6.504 1.00 0.00 N ATOM 1629 CA LYS A 103 -5.130 8.606 -6.536 1.00 0.00 C ATOM 1630 C LYS A 103 -5.966 7.358 -7.005 1.00 0.00 C ATOM 1631 O LYS A 103 -7.184 7.483 -7.166 1.00 0.00 O ATOM 1632 CB LYS A 103 -5.497 9.864 -7.382 1.00 0.00 C ATOM 1633 CG LYS A 103 -5.451 11.221 -6.655 1.00 0.00 C ATOM 1634 CD LYS A 103 -4.059 11.673 -6.175 1.00 0.00 C ATOM 1635 CE LYS A 103 -3.903 13.192 -5.963 1.00 0.00 C ATOM 1636 NZ LYS A 103 -3.881 13.964 -7.220 1.00 0.00 N ATOM 0 H LYS A 103 -3.169 8.908 -7.276 1.00 0.00 H new ATOM 0 HA LYS A 103 -5.420 8.725 -5.492 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.819 9.911 -8.234 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.502 9.725 -7.781 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -5.851 11.984 -7.323 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.115 11.173 -5.792 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.832 11.166 -5.237 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -3.316 11.345 -6.902 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -4.723 13.550 -5.341 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -2.981 13.381 -5.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.757 14.974 -7.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.093 13.637 -7.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.778 13.826 -7.728 1.00 0.00 H new ATOM 1650 N SER A 104 -5.362 6.165 -7.177 1.00 0.00 N ATOM 1651 CA SER A 104 -6.087 4.900 -7.472 1.00 0.00 C ATOM 1652 C SER A 104 -5.550 3.676 -6.670 1.00 0.00 C ATOM 1653 O SER A 104 -6.365 2.866 -6.224 1.00 0.00 O ATOM 1654 CB SER A 104 -6.085 4.606 -8.990 1.00 0.00 C ATOM 1655 OG SER A 104 -6.810 5.597 -9.708 1.00 0.00 O ATOM 0 H SER A 104 -4.351 6.045 -7.116 1.00 0.00 H new ATOM 0 HA SER A 104 -7.114 5.054 -7.141 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.058 4.568 -9.354 1.00 0.00 H new ATOM 0 HB3 SER A 104 -6.525 3.626 -9.174 1.00 0.00 H new ATOM 0 HG SER A 104 -6.791 5.387 -10.665 1.00 0.00 H new ATOM 1661 N LEU A 105 -4.224 3.526 -6.437 1.00 0.00 N ATOM 1662 CA LEU A 105 -3.672 2.544 -5.450 1.00 0.00 C ATOM 1663 C LEU A 105 -4.194 2.677 -3.974 1.00 0.00 C ATOM 1664 O LEU A 105 -4.265 1.668 -3.269 1.00 0.00 O ATOM 1665 CB LEU A 105 -2.120 2.453 -5.608 1.00 0.00 C ATOM 1666 CG LEU A 105 -1.195 3.364 -4.746 1.00 0.00 C ATOM 1667 CD1 LEU A 105 -0.875 2.762 -3.360 1.00 0.00 C ATOM 1668 CD2 LEU A 105 0.128 3.678 -5.473 1.00 0.00 C ATOM 0 H LEU A 105 -3.508 4.071 -6.917 1.00 0.00 H new ATOM 0 HA LEU A 105 -4.089 1.570 -5.706 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.834 1.420 -5.410 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.888 2.653 -6.654 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.758 4.285 -4.594 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -0.227 3.443 -2.808 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -1.801 2.613 -2.805 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.370 1.804 -3.487 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.748 4.315 -4.842 1.00 0.00 H new ATOM 0 HD22 LEU A 105 0.658 2.749 -5.682 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.085 4.192 -6.410 1.00 0.00 H new ATOM 2135 N ASP A 137 0.527 16.088 0.917 1.00 0.00 N ATOM 2136 CA ASP A 137 1.900 15.519 0.952 1.00 0.00 C ATOM 2137 C ASP A 137 2.416 15.008 -0.429 1.00 0.00 C ATOM 2138 O ASP A 137 3.528 15.367 -0.823 1.00 0.00 O ATOM 2139 CB ASP A 137 1.948 14.385 2.006 1.00 0.00 C ATOM 2140 CG ASP A 137 1.736 14.787 3.475 1.00 0.00 C ATOM 2141 OD1 ASP A 137 0.573 14.813 3.933 1.00 0.00 O ATOM 2142 OD2 ASP A 137 2.734 15.075 4.173 1.00 0.00 O ATOM 0 HA ASP A 137 2.574 16.331 1.226 1.00 0.00 H new ATOM 0 HB2 ASP A 137 1.190 13.647 1.744 1.00 0.00 H new ATOM 0 HB3 ASP A 137 2.916 13.890 1.927 1.00 0.00 H new ATOM 2147 N LEU A 138 1.623 14.189 -1.157 1.00 0.00 N ATOM 2148 CA LEU A 138 1.894 13.850 -2.586 1.00 0.00 C ATOM 2149 C LEU A 138 1.437 14.926 -3.626 1.00 0.00 C ATOM 2150 O LEU A 138 1.994 14.946 -4.727 1.00 0.00 O ATOM 2151 CB LEU A 138 1.351 12.433 -2.918 1.00 0.00 C ATOM 2152 CG LEU A 138 -0.158 12.155 -2.648 1.00 0.00 C ATOM 2153 CD1 LEU A 138 -0.971 12.142 -3.949 1.00 0.00 C ATOM 2154 CD2 LEU A 138 -0.348 10.869 -1.821 1.00 0.00 C ATOM 0 H LEU A 138 0.785 13.745 -0.782 1.00 0.00 H new ATOM 0 HA LEU A 138 2.979 13.847 -2.689 1.00 0.00 H new ATOM 0 HB2 LEU A 138 1.545 12.238 -3.973 1.00 0.00 H new ATOM 0 HB3 LEU A 138 1.933 11.709 -2.348 1.00 0.00 H new ATOM 0 HG LEU A 138 -0.548 12.977 -2.048 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -2.019 11.945 -3.721 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -0.883 13.110 -4.443 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -0.590 11.362 -4.608 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.411 10.701 -1.648 1.00 0.00 H new ATOM 0 HD22 LEU A 138 0.070 10.022 -2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 138 0.163 10.973 -0.864 1.00 0.00 H new ATOM 2166 N ASP A 139 0.487 15.830 -3.290 1.00 0.00 N ATOM 2167 CA ASP A 139 0.228 17.060 -4.101 1.00 0.00 C ATOM 2168 C ASP A 139 1.270 18.223 -3.938 1.00 0.00 C ATOM 2169 O ASP A 139 1.234 19.167 -4.733 1.00 0.00 O ATOM 2170 CB ASP A 139 -1.223 17.553 -3.859 1.00 0.00 C ATOM 2171 CG ASP A 139 -2.316 16.670 -4.490 1.00 0.00 C ATOM 2172 OD1 ASP A 139 -2.762 15.697 -3.845 1.00 0.00 O ATOM 2173 OD2 ASP A 139 -2.725 16.945 -5.640 1.00 0.00 O ATOM 0 H ASP A 139 -0.113 15.739 -2.470 1.00 0.00 H new ATOM 0 HA ASP A 139 0.355 16.754 -5.139 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -1.398 17.612 -2.785 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -1.319 18.564 -4.254 1.00 0.00 H new ATOM 2178 N ALA A 140 2.246 18.133 -3.005 1.00 0.00 N ATOM 2179 CA ALA A 140 3.535 18.871 -3.089 1.00 0.00 C ATOM 2180 C ALA A 140 4.394 18.640 -4.375 1.00 0.00 C ATOM 2181 O ALA A 140 5.092 19.563 -4.794 1.00 0.00 O ATOM 2182 CB ALA A 140 4.370 18.513 -1.847 1.00 0.00 C ATOM 0 H ALA A 140 2.166 17.549 -2.173 1.00 0.00 H new ATOM 0 HA ALA A 140 3.264 19.926 -3.139 1.00 0.00 H new ATOM 0 HB1 ALA A 140 5.322 19.042 -1.884 1.00 0.00 H new ATOM 0 HB2 ALA A 140 3.828 18.804 -0.948 1.00 0.00 H new ATOM 0 HB3 ALA A 140 4.552 17.439 -1.829 1.00 0.00 H new ATOM 2188 N LEU A 141 4.334 17.446 -4.998 1.00 0.00 N ATOM 2189 CA LEU A 141 4.943 17.166 -6.334 1.00 0.00 C ATOM 2190 C LEU A 141 4.242 17.854 -7.539 1.00 0.00 C ATOM 2191 O LEU A 141 4.915 18.302 -8.468 1.00 0.00 O ATOM 2192 CB LEU A 141 4.982 15.634 -6.631 1.00 0.00 C ATOM 2193 CG LEU A 141 5.408 14.671 -5.496 1.00 0.00 C ATOM 2194 CD1 LEU A 141 5.170 13.207 -5.898 1.00 0.00 C ATOM 2195 CD2 LEU A 141 6.859 14.896 -5.038 1.00 0.00 C ATOM 0 H LEU A 141 3.861 16.638 -4.594 1.00 0.00 H new ATOM 0 HA LEU A 141 5.944 17.588 -6.248 1.00 0.00 H new ATOM 0 HB2 LEU A 141 3.988 15.335 -6.963 1.00 0.00 H new ATOM 0 HB3 LEU A 141 5.659 15.476 -7.471 1.00 0.00 H new ATOM 0 HG LEU A 141 4.776 14.898 -4.638 1.00 0.00 H new ATOM 0 HD11 LEU A 141 5.478 12.551 -5.083 1.00 0.00 H new ATOM 0 HD12 LEU A 141 4.111 13.054 -6.107 1.00 0.00 H new ATOM 0 HD13 LEU A 141 5.752 12.975 -6.790 1.00 0.00 H new ATOM 0 HD21 LEU A 141 7.102 14.193 -4.241 1.00 0.00 H new ATOM 0 HD22 LEU A 141 7.534 14.739 -5.879 1.00 0.00 H new ATOM 0 HD23 LEU A 141 6.970 15.916 -4.669 1.00 0.00 H new ATOM 2207 N GLN A 142 2.901 17.930 -7.520 1.00 0.00 N ATOM 2208 CA GLN A 142 2.095 18.709 -8.505 1.00 0.00 C ATOM 2209 C GLN A 142 2.448 20.226 -8.633 1.00 0.00 C ATOM 2210 O GLN A 142 2.436 20.762 -9.745 1.00 0.00 O ATOM 2211 CB GLN A 142 0.590 18.531 -8.163 1.00 0.00 C ATOM 2212 CG GLN A 142 0.036 17.087 -8.153 1.00 0.00 C ATOM 2213 CD GLN A 142 -0.122 16.443 -9.539 1.00 0.00 C ATOM 2214 OE1 GLN A 142 -1.176 16.528 -10.169 1.00 0.00 O ATOM 2215 NE2 GLN A 142 0.913 15.788 -10.040 1.00 0.00 N ATOM 0 H GLN A 142 2.332 17.453 -6.821 1.00 0.00 H new ATOM 0 HA GLN A 142 2.344 18.299 -9.484 1.00 0.00 H new ATOM 0 HB2 GLN A 142 0.412 18.968 -7.181 1.00 0.00 H new ATOM 0 HB3 GLN A 142 0.009 19.111 -8.880 1.00 0.00 H new ATOM 0 HG2 GLN A 142 0.699 16.464 -7.553 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -0.935 17.090 -7.657 1.00 0.00 H new ATOM 0 HE21 GLN A 142 1.782 15.724 -9.509 1.00 0.00 H new ATOM 0 HE22 GLN A 142 0.842 15.347 -10.957 1.00 0.00 H new ATOM 2224 N GLN A 143 2.788 20.884 -7.509 1.00 0.00 N ATOM 2225 CA GLN A 143 3.414 22.230 -7.496 1.00 0.00 C ATOM 2226 C GLN A 143 4.962 22.222 -7.692 1.00 0.00 C ATOM 2227 O GLN A 143 5.469 23.165 -8.308 1.00 0.00 O ATOM 2228 CB GLN A 143 2.986 23.022 -6.225 1.00 0.00 C ATOM 2229 CG GLN A 143 3.249 22.367 -4.847 1.00 0.00 C ATOM 2230 CD GLN A 143 2.844 23.247 -3.658 1.00 0.00 C ATOM 2231 OE1 GLN A 143 1.677 23.303 -3.271 1.00 0.00 O ATOM 2232 NE2 GLN A 143 3.793 23.944 -3.051 1.00 0.00 N ATOM 0 H GLN A 143 2.637 20.499 -6.576 1.00 0.00 H new ATOM 0 HA GLN A 143 3.033 22.750 -8.375 1.00 0.00 H new ATOM 0 HB2 GLN A 143 3.497 23.985 -6.242 1.00 0.00 H new ATOM 0 HB3 GLN A 143 1.918 23.226 -6.301 1.00 0.00 H new ATOM 0 HG2 GLN A 143 2.704 21.425 -4.793 1.00 0.00 H new ATOM 0 HG3 GLN A 143 4.309 22.127 -4.765 1.00 0.00 H new ATOM 0 HE21 GLN A 143 4.756 23.889 -3.381 1.00 0.00 H new ATOM 0 HE22 GLN A 143 3.560 24.536 -2.253 1.00 0.00 H new ATOM 2241 N ASN A 144 5.714 21.222 -7.169 1.00 0.00 N ATOM 2242 CA ASN A 144 7.201 21.224 -7.219 1.00 0.00 C ATOM 2243 C ASN A 144 7.722 19.751 -7.196 1.00 0.00 C ATOM 2244 O ASN A 144 7.915 19.218 -6.101 1.00 0.00 O ATOM 2245 CB ASN A 144 7.880 22.166 -6.177 1.00 0.00 C ATOM 2246 CG ASN A 144 7.337 22.223 -4.732 1.00 0.00 C ATOM 2247 OD1 ASN A 144 6.638 23.164 -4.358 1.00 0.00 O ATOM 2248 ND2 ASN A 144 7.624 21.238 -3.901 1.00 0.00 N ATOM 0 H ASN A 144 5.317 20.403 -6.708 1.00 0.00 H new ATOM 0 HA ASN A 144 7.506 21.673 -8.164 1.00 0.00 H new ATOM 0 HB2 ASN A 144 8.931 21.884 -6.119 1.00 0.00 H new ATOM 0 HB3 ASN A 144 7.843 23.178 -6.580 1.00 0.00 H new ATOM 0 HD21 ASN A 144 7.266 21.256 -2.946 1.00 0.00 H new ATOM 0 HD22 ASN A 144 8.204 20.459 -4.214 1.00 0.00 H new ATOM 2255 N PRO A 145 7.968 19.050 -8.345 1.00 0.00 N ATOM 2256 CA PRO A 145 8.410 17.628 -8.350 1.00 0.00 C ATOM 2257 C PRO A 145 9.938 17.462 -8.098 1.00 0.00 C ATOM 2258 O PRO A 145 10.755 18.231 -8.617 1.00 0.00 O ATOM 2259 CB PRO A 145 7.945 17.157 -9.742 1.00 0.00 C ATOM 2260 CG PRO A 145 7.966 18.400 -10.634 1.00 0.00 C ATOM 2261 CD PRO A 145 7.617 19.551 -9.690 1.00 0.00 C ATOM 0 HA PRO A 145 7.990 17.032 -7.540 1.00 0.00 H new ATOM 0 HB2 PRO A 145 8.606 16.384 -10.134 1.00 0.00 H new ATOM 0 HB3 PRO A 145 6.945 16.727 -9.695 1.00 0.00 H new ATOM 0 HG2 PRO A 145 8.945 18.544 -11.092 1.00 0.00 H new ATOM 0 HG3 PRO A 145 7.243 18.319 -11.446 1.00 0.00 H new ATOM 0 HD2 PRO A 145 8.180 20.451 -9.937 1.00 0.00 H new ATOM 0 HD3 PRO A 145 6.560 19.809 -9.753 1.00 0.00 H new ATOM 2269 N GLN A 146 10.305 16.446 -7.289 1.00 0.00 N ATOM 2270 CA GLN A 146 11.721 16.165 -6.913 1.00 0.00 C ATOM 2271 C GLN A 146 11.923 14.632 -6.619 1.00 0.00 C ATOM 2272 O GLN A 146 10.945 13.964 -6.256 1.00 0.00 O ATOM 2273 CB GLN A 146 12.171 17.101 -5.748 1.00 0.00 C ATOM 2274 CG GLN A 146 11.752 16.756 -4.297 1.00 0.00 C ATOM 2275 CD GLN A 146 10.255 16.540 -4.040 1.00 0.00 C ATOM 2276 OE1 GLN A 146 9.809 15.415 -3.825 1.00 0.00 O ATOM 2277 NE2 GLN A 146 9.450 17.587 -4.070 1.00 0.00 N ATOM 0 H GLN A 146 9.637 15.796 -6.876 1.00 0.00 H new ATOM 0 HA GLN A 146 12.377 16.394 -7.753 1.00 0.00 H new ATOM 0 HB2 GLN A 146 13.259 17.154 -5.771 1.00 0.00 H new ATOM 0 HB3 GLN A 146 11.798 18.101 -5.968 1.00 0.00 H new ATOM 0 HG2 GLN A 146 12.282 15.852 -3.997 1.00 0.00 H new ATOM 0 HG3 GLN A 146 12.096 17.559 -3.645 1.00 0.00 H new ATOM 0 HE21 GLN A 146 9.829 18.517 -4.249 1.00 0.00 H new ATOM 0 HE22 GLN A 146 8.449 17.466 -3.914 1.00 0.00 H new ATOM 2286 N PRO A 147 13.138 14.013 -6.741 1.00 0.00 N ATOM 2287 CA PRO A 147 13.321 12.545 -6.557 1.00 0.00 C ATOM 2288 C PRO A 147 13.140 12.086 -5.075 1.00 0.00 C ATOM 2289 O PRO A 147 13.746 12.657 -4.165 1.00 0.00 O ATOM 2290 CB PRO A 147 14.757 12.329 -7.071 1.00 0.00 C ATOM 2291 CG PRO A 147 15.476 13.664 -6.892 1.00 0.00 C ATOM 2292 CD PRO A 147 14.383 14.702 -7.142 1.00 0.00 C ATOM 0 HA PRO A 147 12.575 11.952 -7.086 1.00 0.00 H new ATOM 0 HB2 PRO A 147 15.257 11.539 -6.511 1.00 0.00 H new ATOM 0 HB3 PRO A 147 14.755 12.025 -8.118 1.00 0.00 H new ATOM 0 HG2 PRO A 147 15.898 13.760 -5.892 1.00 0.00 H new ATOM 0 HG3 PRO A 147 16.300 13.773 -7.597 1.00 0.00 H new ATOM 0 HD2 PRO A 147 14.547 15.604 -6.553 1.00 0.00 H new ATOM 0 HD3 PRO A 147 14.352 15.005 -8.189 1.00 0.00 H new ATOM 2300 N LEU A 148 12.277 11.080 -4.868 1.00 0.00 N ATOM 2301 CA LEU A 148 11.856 10.630 -3.500 1.00 0.00 C ATOM 2302 C LEU A 148 12.550 9.306 -3.058 1.00 0.00 C ATOM 2303 O LEU A 148 12.947 8.494 -3.893 1.00 0.00 O ATOM 2304 CB LEU A 148 10.321 10.399 -3.457 1.00 0.00 C ATOM 2305 CG LEU A 148 9.399 11.596 -3.804 1.00 0.00 C ATOM 2306 CD1 LEU A 148 8.032 11.093 -4.295 1.00 0.00 C ATOM 2307 CD2 LEU A 148 9.280 12.556 -2.608 1.00 0.00 C ATOM 0 H LEU A 148 11.846 10.550 -5.625 1.00 0.00 H new ATOM 0 HA LEU A 148 12.155 11.425 -2.816 1.00 0.00 H new ATOM 0 HB2 LEU A 148 10.086 9.585 -4.143 1.00 0.00 H new ATOM 0 HB3 LEU A 148 10.062 10.056 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 148 9.844 12.165 -4.620 1.00 0.00 H new ATOM 0 HD11 LEU A 148 7.396 11.945 -4.535 1.00 0.00 H new ATOM 0 HD12 LEU A 148 8.168 10.480 -5.186 1.00 0.00 H new ATOM 0 HD13 LEU A 148 7.561 10.497 -3.513 1.00 0.00 H new ATOM 0 HD21 LEU A 148 8.629 13.389 -2.873 1.00 0.00 H new ATOM 0 HD22 LEU A 148 8.859 12.024 -1.755 1.00 0.00 H new ATOM 0 HD23 LEU A 148 10.268 12.937 -2.347 1.00 0.00 H new ATOM 2319 N ILE A 149 12.596 9.075 -1.730 1.00 0.00 N ATOM 2320 CA ILE A 149 13.146 7.826 -1.110 1.00 0.00 C ATOM 2321 C ILE A 149 11.996 6.793 -0.965 1.00 0.00 C ATOM 2322 O ILE A 149 11.086 6.990 -0.163 1.00 0.00 O ATOM 2323 CB ILE A 149 13.885 8.100 0.254 1.00 0.00 C ATOM 2324 CG1 ILE A 149 15.153 8.992 0.132 1.00 0.00 C ATOM 2325 CG2 ILE A 149 14.256 6.815 1.039 1.00 0.00 C ATOM 2326 CD1 ILE A 149 16.374 8.384 -0.576 1.00 0.00 C ATOM 0 H ILE A 149 12.253 9.747 -1.043 1.00 0.00 H new ATOM 0 HA ILE A 149 13.914 7.415 -1.766 1.00 0.00 H new ATOM 0 HB ILE A 149 13.132 8.651 0.817 1.00 0.00 H new ATOM 0 HG12 ILE A 149 14.875 9.904 -0.397 1.00 0.00 H new ATOM 0 HG13 ILE A 149 15.457 9.286 1.137 1.00 0.00 H new ATOM 0 HG21 ILE A 149 14.761 7.088 1.966 1.00 0.00 H new ATOM 0 HG22 ILE A 149 13.350 6.256 1.271 1.00 0.00 H new ATOM 0 HG23 ILE A 149 14.918 6.197 0.433 1.00 0.00 H new ATOM 0 HD11 ILE A 149 17.186 9.112 -0.591 1.00 0.00 H new ATOM 0 HD12 ILE A 149 16.697 7.491 -0.041 1.00 0.00 H new ATOM 0 HD13 ILE A 149 16.106 8.118 -1.599 1.00 0.00 H new ATOM 2338 N PHE A 150 12.118 5.667 -1.680 1.00 0.00 N ATOM 2339 CA PHE A 150 11.157 4.540 -1.630 1.00 0.00 C ATOM 2340 C PHE A 150 11.840 3.405 -0.825 1.00 0.00 C ATOM 2341 O PHE A 150 12.696 2.679 -1.349 1.00 0.00 O ATOM 2342 CB PHE A 150 10.818 4.074 -3.078 1.00 0.00 C ATOM 2343 CG PHE A 150 10.021 5.046 -3.962 1.00 0.00 C ATOM 2344 CD1 PHE A 150 10.658 6.158 -4.523 1.00 0.00 C ATOM 2345 CD2 PHE A 150 8.656 4.855 -4.195 1.00 0.00 C ATOM 2346 CE1 PHE A 150 9.925 7.102 -5.229 1.00 0.00 C ATOM 2347 CE2 PHE A 150 7.927 5.802 -4.914 1.00 0.00 C ATOM 2348 CZ PHE A 150 8.559 6.924 -5.428 1.00 0.00 C ATOM 0 H PHE A 150 12.895 5.504 -2.320 1.00 0.00 H new ATOM 0 HA PHE A 150 10.221 4.831 -1.154 1.00 0.00 H new ATOM 0 HB2 PHE A 150 11.754 3.846 -3.587 1.00 0.00 H new ATOM 0 HB3 PHE A 150 10.257 3.142 -3.010 1.00 0.00 H new ATOM 0 HD1 PHE A 150 11.724 6.283 -4.406 1.00 0.00 H new ATOM 0 HD2 PHE A 150 8.164 3.971 -3.817 1.00 0.00 H new ATOM 0 HE1 PHE A 150 10.417 7.978 -5.625 1.00 0.00 H new ATOM 0 HE2 PHE A 150 6.868 5.661 -5.071 1.00 0.00 H new ATOM 0 HZ PHE A 150 7.993 7.658 -5.982 1.00 0.00 H new ATOM 2358 N HIS A 151 11.443 3.256 0.452 1.00 0.00 N ATOM 2359 CA HIS A 151 11.888 2.131 1.308 1.00 0.00 C ATOM 2360 C HIS A 151 10.884 0.969 1.120 1.00 0.00 C ATOM 2361 O HIS A 151 9.854 0.893 1.795 1.00 0.00 O ATOM 2362 CB HIS A 151 12.061 2.617 2.772 1.00 0.00 C ATOM 2363 CG HIS A 151 12.549 1.616 3.840 1.00 0.00 C ATOM 2364 ND1 HIS A 151 13.383 1.987 4.879 1.00 0.00 N ATOM 2365 CD2 HIS A 151 12.191 0.255 3.995 1.00 0.00 C ATOM 2366 CE1 HIS A 151 13.464 0.804 5.562 1.00 0.00 C ATOM 2367 NE2 HIS A 151 12.785 -0.301 5.119 1.00 0.00 N ATOM 0 H HIS A 151 10.810 3.904 0.921 1.00 0.00 H new ATOM 0 HA HIS A 151 12.870 1.755 1.022 1.00 0.00 H new ATOM 0 HB2 HIS A 151 12.760 3.453 2.761 1.00 0.00 H new ATOM 0 HB3 HIS A 151 11.100 3.010 3.104 1.00 0.00 H new ATOM 0 HD2 HIS A 151 11.538 -0.283 3.323 1.00 0.00 H new ATOM 0 HE1 HIS A 151 14.067 0.741 6.456 1.00 0.00 H new ATOM 0 HE2 HIS A 151 12.732 -1.246 5.500 1.00 0.00 H new ATOM 2375 N MET A 152 11.258 0.034 0.236 1.00 0.00 N ATOM 2376 CA MET A 152 10.525 -1.237 0.043 1.00 0.00 C ATOM 2377 C MET A 152 11.082 -2.342 0.978 1.00 0.00 C ATOM 2378 O MET A 152 12.294 -2.448 1.197 1.00 0.00 O ATOM 2379 CB MET A 152 10.576 -1.716 -1.425 1.00 0.00 C ATOM 2380 CG MET A 152 9.982 -0.759 -2.470 1.00 0.00 C ATOM 2381 SD MET A 152 8.342 -0.200 -1.974 1.00 0.00 S ATOM 2382 CE MET A 152 7.884 0.787 -3.409 1.00 0.00 C ATOM 0 H MET A 152 12.075 0.131 -0.367 1.00 0.00 H new ATOM 0 HA MET A 152 9.483 -1.045 0.298 1.00 0.00 H new ATOM 0 HB2 MET A 152 11.617 -1.907 -1.687 1.00 0.00 H new ATOM 0 HB3 MET A 152 10.050 -2.668 -1.494 1.00 0.00 H new ATOM 0 HG2 MET A 152 10.640 0.100 -2.597 1.00 0.00 H new ATOM 0 HG3 MET A 152 9.923 -1.261 -3.436 1.00 0.00 H new ATOM 0 HE1 MET A 152 6.819 1.014 -3.370 1.00 0.00 H new ATOM 0 HE2 MET A 152 8.453 1.717 -3.408 1.00 0.00 H new ATOM 0 HE3 MET A 152 8.103 0.229 -4.319 1.00 0.00 H new ATOM 2392 N GLU A 153 10.171 -3.178 1.505 1.00 0.00 N ATOM 2393 CA GLU A 153 10.519 -4.308 2.386 1.00 0.00 C ATOM 2394 C GLU A 153 9.787 -5.523 1.765 1.00 0.00 C ATOM 2395 O GLU A 153 8.587 -5.690 1.992 1.00 0.00 O ATOM 2396 CB GLU A 153 10.163 -3.905 3.857 1.00 0.00 C ATOM 2397 CG GLU A 153 9.621 -5.018 4.773 1.00 0.00 C ATOM 2398 CD GLU A 153 9.794 -4.732 6.265 1.00 0.00 C ATOM 2399 OE1 GLU A 153 8.895 -4.102 6.867 1.00 0.00 O ATOM 2400 OE2 GLU A 153 10.830 -5.130 6.840 1.00 0.00 O ATOM 0 H GLU A 153 9.170 -3.089 1.332 1.00 0.00 H new ATOM 0 HA GLU A 153 11.573 -4.577 2.453 1.00 0.00 H new ATOM 0 HB2 GLU A 153 11.058 -3.490 4.321 1.00 0.00 H new ATOM 0 HB3 GLU A 153 9.423 -3.106 3.820 1.00 0.00 H new ATOM 0 HG2 GLU A 153 8.562 -5.165 4.562 1.00 0.00 H new ATOM 0 HG3 GLU A 153 10.127 -5.953 4.531 1.00 0.00 H new ATOM 2407 N MET A 154 10.497 -6.385 1.005 1.00 0.00 N ATOM 2408 CA MET A 154 9.884 -7.607 0.430 1.00 0.00 C ATOM 2409 C MET A 154 9.663 -8.713 1.488 1.00 0.00 C ATOM 2410 O MET A 154 10.495 -8.954 2.366 1.00 0.00 O ATOM 2411 CB MET A 154 10.670 -8.091 -0.808 1.00 0.00 C ATOM 2412 CG MET A 154 9.910 -9.103 -1.694 1.00 0.00 C ATOM 2413 SD MET A 154 10.491 -8.999 -3.397 1.00 0.00 S ATOM 2414 CE MET A 154 9.825 -7.392 -3.887 1.00 0.00 C ATOM 0 H MET A 154 11.483 -6.262 0.776 1.00 0.00 H new ATOM 0 HA MET A 154 8.884 -7.344 0.084 1.00 0.00 H new ATOM 0 HB2 MET A 154 10.937 -7.225 -1.414 1.00 0.00 H new ATOM 0 HB3 MET A 154 11.602 -8.547 -0.475 1.00 0.00 H new ATOM 0 HG2 MET A 154 10.057 -10.114 -1.313 1.00 0.00 H new ATOM 0 HG3 MET A 154 8.840 -8.900 -1.654 1.00 0.00 H new ATOM 0 HE1 MET A 154 9.263 -7.499 -4.815 1.00 0.00 H new ATOM 0 HE2 MET A 154 9.165 -7.018 -3.104 1.00 0.00 H new ATOM 0 HE3 MET A 154 10.644 -6.689 -4.037 1.00 0.00 H new ATOM 2424 N LEU A 155 8.497 -9.353 1.354 1.00 0.00 N ATOM 2425 CA LEU A 155 8.072 -10.509 2.182 1.00 0.00 C ATOM 2426 C LEU A 155 7.844 -11.761 1.286 1.00 0.00 C ATOM 2427 O LEU A 155 8.465 -12.799 1.532 1.00 0.00 O ATOM 2428 CB LEU A 155 6.885 -10.190 3.151 1.00 0.00 C ATOM 2429 CG LEU A 155 5.872 -9.063 2.770 1.00 0.00 C ATOM 2430 CD1 LEU A 155 4.427 -9.412 3.141 1.00 0.00 C ATOM 2431 CD2 LEU A 155 6.270 -7.708 3.384 1.00 0.00 C ATOM 0 H LEU A 155 7.802 -9.085 0.657 1.00 0.00 H new ATOM 0 HA LEU A 155 8.890 -10.745 2.863 1.00 0.00 H new ATOM 0 HB2 LEU A 155 6.316 -11.110 3.287 1.00 0.00 H new ATOM 0 HB3 LEU A 155 7.313 -9.933 4.120 1.00 0.00 H new ATOM 0 HG LEU A 155 5.917 -8.978 1.684 1.00 0.00 H new ATOM 0 HD11 LEU A 155 3.769 -8.592 2.853 1.00 0.00 H new ATOM 0 HD12 LEU A 155 4.126 -10.320 2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 155 4.356 -9.573 4.217 1.00 0.00 H new ATOM 0 HD21 LEU A 155 5.541 -6.950 3.096 1.00 0.00 H new ATOM 0 HD22 LEU A 155 6.295 -7.794 4.470 1.00 0.00 H new ATOM 0 HD23 LEU A 155 7.256 -7.420 3.021 1.00 0.00 H new ATOM 2443 N LYS A 156 6.953 -11.674 0.277 1.00 0.00 N ATOM 2444 CA LYS A 156 6.571 -12.810 -0.594 1.00 0.00 C ATOM 2445 C LYS A 156 6.360 -12.243 -2.015 1.00 0.00 C ATOM 2446 O LYS A 156 5.848 -11.143 -2.227 1.00 0.00 O ATOM 2447 CB LYS A 156 5.289 -13.460 -0.004 1.00 0.00 C ATOM 2448 CG LYS A 156 4.559 -14.555 -0.827 1.00 0.00 C ATOM 2449 CD LYS A 156 3.037 -14.646 -0.577 1.00 0.00 C ATOM 2450 CE LYS A 156 2.256 -13.400 -1.050 1.00 0.00 C ATOM 2451 NZ LYS A 156 0.799 -13.608 -0.981 1.00 0.00 N ATOM 0 H LYS A 156 6.473 -10.806 0.040 1.00 0.00 H new ATOM 0 HA LYS A 156 7.335 -13.586 -0.646 1.00 0.00 H new ATOM 0 HB2 LYS A 156 5.553 -13.893 0.961 1.00 0.00 H new ATOM 0 HB3 LYS A 156 4.573 -12.661 0.190 1.00 0.00 H new ATOM 0 HG2 LYS A 156 4.728 -14.366 -1.887 1.00 0.00 H new ATOM 0 HG3 LYS A 156 5.009 -15.521 -0.599 1.00 0.00 H new ATOM 0 HD2 LYS A 156 2.645 -15.525 -1.088 1.00 0.00 H new ATOM 0 HD3 LYS A 156 2.861 -14.792 0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 156 2.530 -12.544 -0.434 1.00 0.00 H new ATOM 0 HE3 LYS A 156 2.541 -13.160 -2.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 0.316 -12.687 -0.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 0.489 -14.169 -1.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 0.562 -14.115 -0.105 1.00 0.00 H new ATOM 2465 N VAL A 157 6.746 -13.056 -2.999 1.00 0.00 N ATOM 2466 CA VAL A 157 6.608 -12.717 -4.432 1.00 0.00 C ATOM 2467 C VAL A 157 6.411 -14.045 -5.217 1.00 0.00 C ATOM 2468 O VAL A 157 7.165 -15.014 -5.068 1.00 0.00 O ATOM 2469 CB VAL A 157 7.717 -11.738 -4.939 1.00 0.00 C ATOM 2470 CG1 VAL A 157 9.167 -12.109 -4.576 1.00 0.00 C ATOM 2471 CG2 VAL A 157 7.585 -11.468 -6.446 1.00 0.00 C ATOM 0 H VAL A 157 7.165 -13.971 -2.834 1.00 0.00 H new ATOM 0 HA VAL A 157 5.718 -12.115 -4.616 1.00 0.00 H new ATOM 0 HB VAL A 157 7.523 -10.822 -4.381 1.00 0.00 H new ATOM 0 HG11 VAL A 157 9.847 -11.359 -4.980 1.00 0.00 H new ATOM 0 HG12 VAL A 157 9.272 -12.147 -3.492 1.00 0.00 H new ATOM 0 HG13 VAL A 157 9.410 -13.084 -4.999 1.00 0.00 H new ATOM 0 HG21 VAL A 157 8.372 -10.784 -6.763 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.677 -12.406 -6.993 1.00 0.00 H new ATOM 0 HG23 VAL A 157 6.612 -11.022 -6.652 1.00 0.00 H new ATOM 2481 N GLU A 158 5.349 -14.051 -6.041 1.00 0.00 N ATOM 2482 CA GLU A 158 4.765 -15.282 -6.625 1.00 0.00 C ATOM 2483 C GLU A 158 4.714 -15.176 -8.174 1.00 0.00 C ATOM 2484 O GLU A 158 4.432 -14.118 -8.744 1.00 0.00 O ATOM 2485 CB GLU A 158 3.331 -15.463 -6.058 1.00 0.00 C ATOM 2486 CG GLU A 158 3.230 -15.924 -4.591 1.00 0.00 C ATOM 2487 CD GLU A 158 1.779 -16.190 -4.179 1.00 0.00 C ATOM 2488 OE1 GLU A 158 1.059 -15.225 -3.843 1.00 0.00 O ATOM 2489 OE2 GLU A 158 1.347 -17.364 -4.208 1.00 0.00 O ATOM 0 H GLU A 158 4.865 -13.199 -6.325 1.00 0.00 H new ATOM 0 HA GLU A 158 5.383 -16.141 -6.364 1.00 0.00 H new ATOM 0 HB2 GLU A 158 2.802 -14.515 -6.156 1.00 0.00 H new ATOM 0 HB3 GLU A 158 2.806 -16.187 -6.681 1.00 0.00 H new ATOM 0 HG2 GLU A 158 3.819 -16.830 -4.453 1.00 0.00 H new ATOM 0 HG3 GLU A 158 3.659 -15.163 -3.940 1.00 0.00 H new ATOM 2496 N SER A 159 4.948 -16.319 -8.843 1.00 0.00 N ATOM 2497 CA SER A 159 4.860 -16.434 -10.324 1.00 0.00 C ATOM 2498 C SER A 159 3.422 -16.816 -10.835 1.00 0.00 C ATOM 2499 O SER A 159 2.661 -17.419 -10.070 1.00 0.00 O ATOM 2500 CB SER A 159 5.932 -17.448 -10.796 1.00 0.00 C ATOM 2501 OG SER A 159 5.690 -18.766 -10.311 1.00 0.00 O ATOM 0 H SER A 159 5.203 -17.192 -8.381 1.00 0.00 H new ATOM 0 HA SER A 159 5.055 -15.455 -10.761 1.00 0.00 H new ATOM 0 HB2 SER A 159 5.957 -17.464 -11.886 1.00 0.00 H new ATOM 0 HB3 SER A 159 6.914 -17.116 -10.460 1.00 0.00 H new ATOM 0 HG SER A 159 6.391 -19.368 -10.637 1.00 0.00 H new ATOM 2507 N PRO A 160 3.000 -16.516 -12.104 1.00 0.00 N ATOM 2508 CA PRO A 160 1.632 -16.810 -12.613 1.00 0.00 C ATOM 2509 C PRO A 160 1.357 -18.329 -12.788 1.00 0.00 C ATOM 2510 O PRO A 160 2.061 -19.029 -13.523 1.00 0.00 O ATOM 2511 CB PRO A 160 1.552 -16.013 -13.930 1.00 0.00 C ATOM 2512 CG PRO A 160 2.999 -15.750 -14.345 1.00 0.00 C ATOM 2513 CD PRO A 160 3.754 -15.649 -13.022 1.00 0.00 C ATOM 0 HA PRO A 160 0.855 -16.513 -11.909 1.00 0.00 H new ATOM 0 HB2 PRO A 160 1.021 -16.577 -14.697 1.00 0.00 H new ATOM 0 HB3 PRO A 160 1.009 -15.078 -13.789 1.00 0.00 H new ATOM 0 HG2 PRO A 160 3.389 -16.557 -14.966 1.00 0.00 H new ATOM 0 HG3 PRO A 160 3.087 -14.831 -14.925 1.00 0.00 H new ATOM 0 HD2 PRO A 160 4.786 -15.983 -13.127 1.00 0.00 H new ATOM 0 HD3 PRO A 160 3.787 -14.621 -12.661 1.00 0.00 H new ATOM 2521 N GLY A 161 0.359 -18.811 -12.037 1.00 0.00 N ATOM 2522 CA GLY A 161 0.237 -20.249 -11.707 1.00 0.00 C ATOM 2523 C GLY A 161 -0.051 -20.467 -10.210 1.00 0.00 C ATOM 2524 O GLY A 161 -1.043 -21.114 -9.862 1.00 0.00 O ATOM 0 H GLY A 161 -0.381 -18.230 -11.642 1.00 0.00 H new ATOM 0 HA2 GLY A 161 -0.563 -20.692 -12.300 1.00 0.00 H new ATOM 0 HA3 GLY A 161 1.158 -20.764 -11.979 1.00 0.00 H new ATOM 2528 N THR A 162 0.830 -19.933 -9.343 1.00 0.00 N ATOM 2529 CA THR A 162 0.650 -19.947 -7.868 1.00 0.00 C ATOM 2530 C THR A 162 -0.115 -18.712 -7.294 1.00 0.00 C ATOM 2531 O THR A 162 -0.803 -18.884 -6.282 1.00 0.00 O ATOM 2532 CB THR A 162 2.004 -20.264 -7.161 1.00 0.00 C ATOM 2533 OG1 THR A 162 1.807 -20.366 -5.754 1.00 0.00 O ATOM 2534 CG2 THR A 162 3.165 -19.288 -7.419 1.00 0.00 C ATOM 0 H THR A 162 1.692 -19.477 -9.641 1.00 0.00 H new ATOM 0 HA THR A 162 -0.033 -20.763 -7.633 1.00 0.00 H new ATOM 0 HB THR A 162 2.314 -21.207 -7.612 1.00 0.00 H new ATOM 0 HG1 THR A 162 2.661 -20.567 -5.318 1.00 0.00 H new ATOM 0 HG21 THR A 162 4.047 -19.619 -6.872 1.00 0.00 H new ATOM 0 HG22 THR A 162 3.388 -19.262 -8.486 1.00 0.00 H new ATOM 0 HG23 THR A 162 2.883 -18.290 -7.083 1.00 0.00 H new ATOM 2542 N TYR A 163 -0.020 -17.503 -7.895 1.00 0.00 N ATOM 2543 CA TYR A 163 -0.683 -16.290 -7.353 1.00 0.00 C ATOM 2544 C TYR A 163 -2.220 -16.265 -7.586 1.00 0.00 C ATOM 2545 O TYR A 163 -2.702 -16.569 -8.682 1.00 0.00 O ATOM 2546 CB TYR A 163 0.053 -14.998 -7.795 1.00 0.00 C ATOM 2547 CG TYR A 163 -0.111 -14.371 -9.198 1.00 0.00 C ATOM 2548 CD1 TYR A 163 -1.296 -13.722 -9.565 1.00 0.00 C ATOM 2549 CD2 TYR A 163 1.012 -14.250 -10.026 1.00 0.00 C ATOM 2550 CE1 TYR A 163 -1.366 -12.992 -10.750 1.00 0.00 C ATOM 2551 CE2 TYR A 163 0.945 -13.513 -11.204 1.00 0.00 C ATOM 2552 CZ TYR A 163 -0.242 -12.889 -11.569 1.00 0.00 C ATOM 2553 OH TYR A 163 -0.296 -12.159 -12.727 1.00 0.00 O ATOM 0 H TYR A 163 0.507 -17.340 -8.753 1.00 0.00 H new ATOM 0 HA TYR A 163 -0.591 -16.333 -6.268 1.00 0.00 H new ATOM 0 HB2 TYR A 163 -0.222 -14.225 -7.077 1.00 0.00 H new ATOM 0 HB3 TYR A 163 1.118 -15.189 -7.665 1.00 0.00 H new ATOM 0 HD1 TYR A 163 -2.163 -13.788 -8.924 1.00 0.00 H new ATOM 0 HD2 TYR A 163 1.937 -14.733 -9.748 1.00 0.00 H new ATOM 0 HE1 TYR A 163 -2.289 -12.507 -11.033 1.00 0.00 H new ATOM 0 HE2 TYR A 163 1.817 -13.426 -11.836 1.00 0.00 H new ATOM 0 HH TYR A 163 0.575 -12.192 -13.175 1.00 0.00 H new