USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1037 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 116 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 117 GLN : amide:sc= 0.75 K(o=0.75,f=0.1) USER MOD Set 2.1: A 110 GLN : amide:sc= 0.186 K(o=-1,f=-5.1!) USER MOD Set 2.2: A 113 GLN : amide:sc= -1.21 K(o=-1,f=-2.1!) USER MOD Single : A 1 MET CE :methyl -149:sc= -0.314 (180deg=-1.44!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0.0392 USER MOD Single : A 4 GLN : amide:sc= -0.0255 K(o=-0.025,f=-1.6!) USER MOD Single : A 8 CYS SG : rot 142:sc= -1.34 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0669 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 20 CYS SG : rot 85:sc= 1.37 USER MOD Single : A 21 GLN :FLIP amide:sc= -1.57 F(o=-3.6!,f=-1.6) USER MOD Single : A 25 SER OG : rot -97:sc= 1.23 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 32 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.12) USER MOD Single : A 34 CYS SG : rot 120:sc= -1.15 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl -136:sc= -0.106 (180deg=-0.821) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.058 USER MOD Single : A 45 GLN :FLIP amide:sc= -0.239 F(o=-2.1,f=-0.24) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 HIS :FLIP no HD1:sc= -5.24! C(o=-5.9!,f=-5.2!) USER MOD Single : A 50 GLN : amide:sc= -0.107 K(o=-0.11,f=-1.3) USER MOD Single : A 53 CYS SG : rot -32:sc= -2.22 USER MOD Single : A 60 ASN : amide:sc= -0.179 X(o=-0.18,f=-0.62) USER MOD Single : A 62 SER OG : rot 180:sc= 0.107 USER MOD Single : A 68 GLN : amide:sc= -0.0748 X(o=-0.075,f=-0.0025) USER MOD Single : A 69 GLN : amide:sc= -1.4 K(o=-1.4,f=-3.6) USER MOD Single : A 71 CYS SG : rot 59:sc= -5.61! USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -1.98! K(o=-2!,f=-3.3) USER MOD Single : A 99 TYR OH : rot -17:sc= 0.116 USER MOD Single : A 100 HIS : no HD1:sc= -13! C(o=-13!,f=-25!) USER MOD Single : A 101 SER OG : rot -166:sc= -2.6! USER MOD Single : A 105 HIS : no HE2:sc= -3.72 K(o=-3.7,f=-5.2!) USER MOD Single : A 109 HIS : no HD1:sc= -0.0334 X(o=-0.033,f=0) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.0997 USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.646 11.991 17.977 1.00 0.00 N ATOM 2 CA MET A 1 6.369 12.748 18.116 1.00 0.00 C ATOM 3 C MET A 1 5.170 11.854 17.784 1.00 0.00 C ATOM 4 O MET A 1 4.256 11.710 18.572 1.00 0.00 O ATOM 5 CB MET A 1 6.477 13.894 17.111 1.00 0.00 C ATOM 6 CG MET A 1 5.110 14.562 16.954 1.00 0.00 C ATOM 7 SD MET A 1 5.287 16.082 15.989 1.00 0.00 S ATOM 8 CE MET A 1 6.193 17.031 17.234 1.00 0.00 C ATOM 0 H1 MET A 1 8.446 12.615 18.206 1.00 0.00 H new ATOM 0 H2 MET A 1 7.641 11.180 18.628 1.00 0.00 H new ATOM 0 H3 MET A 1 7.742 11.650 16.999 1.00 0.00 H new ATOM 0 HA MET A 1 6.217 13.107 19.134 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.213 14.622 17.451 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.823 13.517 16.148 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.417 13.883 16.458 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.689 14.788 17.934 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.950 18.089 17.133 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.912 16.687 18.229 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.264 16.890 17.091 1.00 0.00 H new ATOM 20 N LEU A 2 5.162 11.256 16.624 1.00 0.00 N ATOM 21 CA LEU A 2 4.014 10.377 16.250 1.00 0.00 C ATOM 22 C LEU A 2 4.337 8.914 16.569 1.00 0.00 C ATOM 23 O LEU A 2 5.403 8.426 16.262 1.00 0.00 O ATOM 24 CB LEU A 2 3.837 10.582 14.743 1.00 0.00 C ATOM 25 CG LEU A 2 2.494 10.000 14.301 1.00 0.00 C ATOM 26 CD1 LEU A 2 1.588 11.127 13.804 1.00 0.00 C ATOM 27 CD2 LEU A 2 2.722 8.991 13.172 1.00 0.00 C ATOM 0 H LEU A 2 5.896 11.336 15.921 1.00 0.00 H new ATOM 0 HA LEU A 2 3.106 10.621 16.802 1.00 0.00 H new ATOM 0 HB2 LEU A 2 3.881 11.644 14.502 1.00 0.00 H new ATOM 0 HB3 LEU A 2 4.650 10.098 14.202 1.00 0.00 H new ATOM 0 HG LEU A 2 2.020 9.499 15.145 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.631 10.712 13.489 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.425 11.845 14.608 1.00 0.00 H new ATOM 0 HD13 LEU A 2 2.061 11.629 12.960 1.00 0.00 H new ATOM 0 HD21 LEU A 2 1.765 8.576 12.856 1.00 0.00 H new ATOM 0 HD22 LEU A 2 3.197 9.491 12.328 1.00 0.00 H new ATOM 0 HD23 LEU A 2 3.367 8.187 13.527 1.00 0.00 H new ATOM 39 N SER A 3 3.424 8.220 17.196 1.00 0.00 N ATOM 40 CA SER A 3 3.666 6.790 17.556 1.00 0.00 C ATOM 41 C SER A 3 4.410 6.051 16.434 1.00 0.00 C ATOM 42 O SER A 3 5.617 6.143 16.317 1.00 0.00 O ATOM 43 CB SER A 3 2.270 6.203 17.773 1.00 0.00 C ATOM 44 OG SER A 3 1.557 7.025 18.686 1.00 0.00 O ATOM 0 H SER A 3 2.514 8.585 17.477 1.00 0.00 H new ATOM 0 HA SER A 3 4.295 6.692 18.441 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.736 6.143 16.825 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.345 5.187 18.161 1.00 0.00 H new ATOM 0 HG SER A 3 0.661 6.655 18.828 1.00 0.00 H new ATOM 50 N GLN A 4 3.716 5.310 15.610 1.00 0.00 N ATOM 51 CA GLN A 4 4.417 4.581 14.518 1.00 0.00 C ATOM 52 C GLN A 4 3.496 4.390 13.310 1.00 0.00 C ATOM 53 O GLN A 4 2.289 4.485 13.407 1.00 0.00 O ATOM 54 CB GLN A 4 4.819 3.238 15.125 1.00 0.00 C ATOM 55 CG GLN A 4 5.765 3.488 16.299 1.00 0.00 C ATOM 56 CD GLN A 4 6.497 2.196 16.659 1.00 0.00 C ATOM 57 OE1 GLN A 4 6.222 1.151 16.104 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.425 2.226 17.575 1.00 0.00 N ATOM 0 H GLN A 4 2.705 5.180 15.647 1.00 0.00 H new ATOM 0 HA GLN A 4 5.284 5.131 14.152 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.935 2.697 15.462 1.00 0.00 H new ATOM 0 HB3 GLN A 4 5.306 2.616 14.374 1.00 0.00 H new ATOM 0 HG2 GLN A 4 6.485 4.264 16.039 1.00 0.00 H new ATOM 0 HG3 GLN A 4 5.203 3.850 17.160 1.00 0.00 H new ATOM 0 HE21 GLN A 4 7.655 3.104 18.040 1.00 0.00 H new ATOM 0 HE22 GLN A 4 7.921 1.371 17.826 1.00 0.00 H new ATOM 67 N ILE A 5 4.072 4.129 12.174 1.00 0.00 N ATOM 68 CA ILE A 5 3.273 3.937 10.938 1.00 0.00 C ATOM 69 C ILE A 5 3.301 2.461 10.528 1.00 0.00 C ATOM 70 O ILE A 5 4.347 1.844 10.489 1.00 0.00 O ATOM 71 CB ILE A 5 3.983 4.797 9.893 1.00 0.00 C ATOM 72 CG1 ILE A 5 4.027 6.253 10.363 1.00 0.00 C ATOM 73 CG2 ILE A 5 3.237 4.709 8.564 1.00 0.00 C ATOM 74 CD1 ILE A 5 4.944 7.057 9.441 1.00 0.00 C ATOM 0 H ILE A 5 5.080 4.039 12.048 1.00 0.00 H new ATOM 0 HA ILE A 5 2.226 4.215 11.060 1.00 0.00 H new ATOM 0 HB ILE A 5 5.002 4.432 9.760 1.00 0.00 H new ATOM 0 HG12 ILE A 5 3.024 6.679 10.358 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.390 6.304 11.390 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.745 5.323 7.820 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.216 3.673 8.226 1.00 0.00 H new ATOM 0 HG23 ILE A 5 2.216 5.068 8.695 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.976 8.094 9.774 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.949 6.635 9.469 1.00 0.00 H new ATOM 0 HD13 ILE A 5 4.562 7.016 8.421 1.00 0.00 H new ATOM 86 N ALA A 6 2.170 1.888 10.218 1.00 0.00 N ATOM 87 CA ALA A 6 2.157 0.454 9.812 1.00 0.00 C ATOM 88 C ALA A 6 2.260 0.350 8.296 1.00 0.00 C ATOM 89 O ALA A 6 1.364 0.740 7.571 1.00 0.00 O ATOM 90 CB ALA A 6 0.819 -0.097 10.297 1.00 0.00 C ATOM 0 H ALA A 6 1.259 2.348 10.228 1.00 0.00 H new ATOM 0 HA ALA A 6 2.993 -0.103 10.235 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.742 -1.151 10.031 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.752 0.010 11.380 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.006 0.456 9.827 1.00 0.00 H new ATOM 96 N ILE A 7 3.345 -0.169 7.806 1.00 0.00 N ATOM 97 CA ILE A 7 3.491 -0.285 6.336 1.00 0.00 C ATOM 98 C ILE A 7 3.709 -1.739 5.934 1.00 0.00 C ATOM 99 O ILE A 7 4.579 -2.416 6.446 1.00 0.00 O ATOM 100 CB ILE A 7 4.705 0.569 5.993 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.411 2.019 6.373 1.00 0.00 C ATOM 102 CG2 ILE A 7 4.990 0.480 4.492 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.575 2.906 5.942 1.00 0.00 C ATOM 0 H ILE A 7 4.131 -0.515 8.355 1.00 0.00 H new ATOM 0 HA ILE A 7 2.600 0.048 5.803 1.00 0.00 H new ATOM 0 HB ILE A 7 5.576 0.211 6.542 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.490 2.352 5.894 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.258 2.100 7.449 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.859 1.092 4.250 1.00 0.00 H new ATOM 0 HG22 ILE A 7 5.189 -0.557 4.220 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.125 0.841 3.935 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.364 3.940 6.214 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.487 2.578 6.442 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.707 2.834 4.862 1.00 0.00 H new ATOM 115 N CYS A 8 2.929 -2.217 5.009 1.00 0.00 N ATOM 116 CA CYS A 8 3.085 -3.622 4.550 1.00 0.00 C ATOM 117 C CYS A 8 3.651 -3.615 3.132 1.00 0.00 C ATOM 118 O CYS A 8 3.195 -2.877 2.282 1.00 0.00 O ATOM 119 CB CYS A 8 1.671 -4.205 4.567 1.00 0.00 C ATOM 120 SG CYS A 8 1.691 -5.863 3.844 1.00 0.00 S ATOM 0 H CYS A 8 2.186 -1.692 4.548 1.00 0.00 H new ATOM 0 HA CYS A 8 3.761 -4.206 5.175 1.00 0.00 H new ATOM 0 HB2 CYS A 8 1.296 -4.248 5.590 1.00 0.00 H new ATOM 0 HB3 CYS A 8 0.994 -3.561 4.006 1.00 0.00 H new ATOM 0 HG CYS A 8 0.876 -6.633 4.502 1.00 0.00 H new ATOM 126 N ILE A 9 4.650 -4.404 2.864 1.00 0.00 N ATOM 127 CA ILE A 9 5.224 -4.391 1.493 1.00 0.00 C ATOM 128 C ILE A 9 5.207 -5.783 0.876 1.00 0.00 C ATOM 129 O ILE A 9 5.263 -6.787 1.558 1.00 0.00 O ATOM 130 CB ILE A 9 6.661 -3.918 1.674 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.369 -3.899 0.307 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.389 -4.866 2.632 1.00 0.00 C ATOM 133 CD1 ILE A 9 7.935 -5.282 -0.030 1.00 0.00 C ATOM 0 H ILE A 9 5.088 -5.048 3.523 1.00 0.00 H new ATOM 0 HA ILE A 9 4.651 -3.748 0.825 1.00 0.00 H new ATOM 0 HB ILE A 9 6.670 -2.912 2.092 1.00 0.00 H new ATOM 0 HG12 ILE A 9 6.667 -3.590 -0.467 1.00 0.00 H new ATOM 0 HG13 ILE A 9 8.174 -3.164 0.319 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.418 -4.531 2.764 1.00 0.00 H new ATOM 0 HG22 ILE A 9 6.882 -4.869 3.597 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.386 -5.874 2.218 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.431 -5.246 -1.000 1.00 0.00 H new ATOM 0 HD12 ILE A 9 8.654 -5.577 0.734 1.00 0.00 H new ATOM 0 HD13 ILE A 9 7.123 -6.009 -0.064 1.00 0.00 H new ATOM 145 N TRP A 10 5.161 -5.841 -0.420 1.00 0.00 N ATOM 146 CA TRP A 10 5.179 -7.160 -1.100 1.00 0.00 C ATOM 147 C TRP A 10 6.330 -7.191 -2.090 1.00 0.00 C ATOM 148 O TRP A 10 6.416 -6.372 -2.981 1.00 0.00 O ATOM 149 CB TRP A 10 3.858 -7.294 -1.848 1.00 0.00 C ATOM 150 CG TRP A 10 3.916 -8.544 -2.669 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.791 -9.560 -2.470 1.00 0.00 C ATOM 152 CD2 TRP A 10 3.100 -8.930 -3.812 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.570 -10.538 -3.419 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.535 -10.199 -4.268 1.00 0.00 C ATOM 155 CE3 TRP A 10 2.039 -8.312 -4.491 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.935 -10.829 -5.359 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.435 -8.947 -5.589 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.883 -10.200 -6.023 1.00 0.00 C ATOM 0 H TRP A 10 5.112 -5.032 -1.039 1.00 0.00 H new ATOM 0 HA TRP A 10 5.305 -7.974 -0.386 1.00 0.00 H new ATOM 0 HB2 TRP A 10 3.025 -7.338 -1.146 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.692 -6.426 -2.486 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.541 -9.598 -1.694 1.00 0.00 H new ATOM 0 HE1 TRP A 10 5.105 -11.404 -3.485 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.685 -7.344 -4.168 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 3.283 -11.797 -5.687 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.617 -8.464 -6.103 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.415 -10.678 -6.870 1.00 0.00 H new ATOM 169 N VAL A 11 7.218 -8.117 -1.941 1.00 0.00 N ATOM 170 CA VAL A 11 8.358 -8.180 -2.878 1.00 0.00 C ATOM 171 C VAL A 11 9.040 -9.540 -2.753 1.00 0.00 C ATOM 172 O VAL A 11 9.465 -9.938 -1.687 1.00 0.00 O ATOM 173 CB VAL A 11 9.273 -7.046 -2.430 1.00 0.00 C ATOM 174 CG1 VAL A 11 9.739 -7.295 -1.001 1.00 0.00 C ATOM 175 CG2 VAL A 11 10.482 -6.978 -3.356 1.00 0.00 C ATOM 0 H VAL A 11 7.206 -8.832 -1.214 1.00 0.00 H new ATOM 0 HA VAL A 11 8.073 -8.072 -3.924 1.00 0.00 H new ATOM 0 HB VAL A 11 8.728 -6.103 -2.470 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.393 -6.482 -0.685 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.874 -7.343 -0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.284 -8.238 -0.955 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.138 -6.168 -3.038 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.025 -7.922 -3.315 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.148 -6.795 -4.377 1.00 0.00 H new ATOM 185 N GLU A 12 9.125 -10.264 -3.830 1.00 0.00 N ATOM 186 CA GLU A 12 9.756 -11.615 -3.774 1.00 0.00 C ATOM 187 C GLU A 12 11.286 -11.510 -3.724 1.00 0.00 C ATOM 188 O GLU A 12 11.971 -12.475 -3.450 1.00 0.00 O ATOM 189 CB GLU A 12 9.295 -12.313 -5.053 1.00 0.00 C ATOM 190 CG GLU A 12 7.784 -12.550 -4.984 1.00 0.00 C ATOM 191 CD GLU A 12 7.358 -13.482 -6.121 1.00 0.00 C ATOM 192 OE1 GLU A 12 7.900 -13.349 -7.205 1.00 0.00 O ATOM 193 OE2 GLU A 12 6.495 -14.312 -5.886 1.00 0.00 O ATOM 0 H GLU A 12 8.785 -9.981 -4.749 1.00 0.00 H new ATOM 0 HA GLU A 12 9.466 -12.165 -2.879 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.540 -11.703 -5.922 1.00 0.00 H new ATOM 0 HB3 GLU A 12 9.818 -13.262 -5.172 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.518 -12.988 -4.022 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.253 -11.601 -5.060 1.00 0.00 H new ATOM 200 N SER A 13 11.825 -10.348 -3.980 1.00 0.00 N ATOM 201 CA SER A 13 13.313 -10.185 -3.941 1.00 0.00 C ATOM 202 C SER A 13 13.729 -9.477 -2.647 1.00 0.00 C ATOM 203 O SER A 13 13.240 -8.409 -2.339 1.00 0.00 O ATOM 204 CB SER A 13 13.646 -9.313 -5.152 1.00 0.00 C ATOM 205 OG SER A 13 15.054 -9.306 -5.360 1.00 0.00 O ATOM 0 H SER A 13 11.303 -9.504 -4.214 1.00 0.00 H new ATOM 0 HA SER A 13 13.835 -11.141 -3.968 1.00 0.00 H new ATOM 0 HB2 SER A 13 13.139 -9.694 -6.038 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.286 -8.297 -4.991 1.00 0.00 H new ATOM 0 HG SER A 13 15.267 -8.748 -6.137 1.00 0.00 H new ATOM 211 N THR A 14 14.625 -10.054 -1.886 1.00 0.00 N ATOM 212 CA THR A 14 15.051 -9.388 -0.619 1.00 0.00 C ATOM 213 C THR A 14 15.781 -8.087 -0.940 1.00 0.00 C ATOM 214 O THR A 14 15.571 -7.074 -0.302 1.00 0.00 O ATOM 215 CB THR A 14 16.010 -10.358 0.066 1.00 0.00 C ATOM 216 OG1 THR A 14 15.658 -11.695 -0.261 1.00 0.00 O ATOM 217 CG2 THR A 14 15.933 -10.159 1.581 1.00 0.00 C ATOM 0 H THR A 14 15.075 -10.947 -2.085 1.00 0.00 H new ATOM 0 HA THR A 14 14.197 -9.150 0.015 1.00 0.00 H new ATOM 0 HB THR A 14 17.027 -10.165 -0.276 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.277 -12.313 0.180 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.617 -10.850 2.074 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.212 -9.135 1.828 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.915 -10.350 1.922 1.00 0.00 H new ATOM 225 N ALA A 15 16.641 -8.103 -1.922 1.00 0.00 N ATOM 226 CA ALA A 15 17.378 -6.859 -2.272 1.00 0.00 C ATOM 227 C ALA A 15 16.377 -5.729 -2.489 1.00 0.00 C ATOM 228 O ALA A 15 16.562 -4.619 -2.028 1.00 0.00 O ATOM 229 CB ALA A 15 18.126 -7.185 -3.565 1.00 0.00 C ATOM 0 H ALA A 15 16.863 -8.919 -2.493 1.00 0.00 H new ATOM 0 HA ALA A 15 18.066 -6.538 -1.490 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.695 -6.312 -3.886 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.807 -8.018 -3.391 1.00 0.00 H new ATOM 0 HB3 ALA A 15 17.410 -7.457 -4.341 1.00 0.00 H new ATOM 235 N ILE A 16 15.300 -6.015 -3.161 1.00 0.00 N ATOM 236 CA ILE A 16 14.259 -4.979 -3.382 1.00 0.00 C ATOM 237 C ILE A 16 13.563 -4.703 -2.050 1.00 0.00 C ATOM 238 O ILE A 16 13.336 -3.572 -1.668 1.00 0.00 O ATOM 239 CB ILE A 16 13.301 -5.618 -4.383 1.00 0.00 C ATOM 240 CG1 ILE A 16 14.002 -5.745 -5.738 1.00 0.00 C ATOM 241 CG2 ILE A 16 12.046 -4.758 -4.521 1.00 0.00 C ATOM 242 CD1 ILE A 16 13.144 -6.594 -6.673 1.00 0.00 C ATOM 0 H ILE A 16 15.096 -6.927 -3.569 1.00 0.00 H new ATOM 0 HA ILE A 16 14.647 -4.030 -3.752 1.00 0.00 H new ATOM 0 HB ILE A 16 13.010 -6.608 -4.031 1.00 0.00 H new ATOM 0 HG12 ILE A 16 14.164 -4.758 -6.171 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.983 -6.202 -5.611 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.366 -5.219 -5.237 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.553 -4.676 -3.552 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.323 -3.764 -4.872 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.641 -6.686 -7.639 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.005 -7.585 -6.240 1.00 0.00 H new ATOM 0 HD13 ILE A 16 12.173 -6.118 -6.808 1.00 0.00 H new ATOM 254 N LEU A 17 13.254 -5.749 -1.330 1.00 0.00 N ATOM 255 CA LEU A 17 12.602 -5.592 -0.003 1.00 0.00 C ATOM 256 C LEU A 17 13.481 -4.722 0.889 1.00 0.00 C ATOM 257 O LEU A 17 13.016 -3.819 1.554 1.00 0.00 O ATOM 258 CB LEU A 17 12.531 -7.019 0.560 1.00 0.00 C ATOM 259 CG LEU A 17 12.283 -6.992 2.071 1.00 0.00 C ATOM 260 CD1 LEU A 17 13.613 -6.771 2.787 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.314 -5.860 2.429 1.00 0.00 C ATOM 0 H LEU A 17 13.429 -6.714 -1.610 1.00 0.00 H new ATOM 0 HA LEU A 17 11.621 -5.122 -0.063 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.732 -7.571 0.065 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.462 -7.546 0.348 1.00 0.00 H new ATOM 0 HG LEU A 17 11.844 -7.940 2.382 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.447 -6.750 3.864 1.00 0.00 H new ATOM 0 HD12 LEU A 17 14.298 -7.582 2.541 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.045 -5.822 2.468 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.146 -5.852 3.506 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.740 -4.905 2.121 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.366 -6.017 1.915 1.00 0.00 H new ATOM 273 N GLN A 18 14.754 -4.999 0.909 1.00 0.00 N ATOM 274 CA GLN A 18 15.676 -4.202 1.764 1.00 0.00 C ATOM 275 C GLN A 18 15.643 -2.723 1.367 1.00 0.00 C ATOM 276 O GLN A 18 15.604 -1.851 2.210 1.00 0.00 O ATOM 277 CB GLN A 18 17.054 -4.820 1.527 1.00 0.00 C ATOM 278 CG GLN A 18 17.091 -6.203 2.180 1.00 0.00 C ATOM 279 CD GLN A 18 18.538 -6.651 2.364 1.00 0.00 C ATOM 280 OE1 GLN A 18 19.241 -6.888 1.404 1.00 0.00 O ATOM 281 NE2 GLN A 18 19.015 -6.779 3.572 1.00 0.00 N ATOM 0 H GLN A 18 15.196 -5.743 0.370 1.00 0.00 H new ATOM 0 HA GLN A 18 15.398 -4.230 2.818 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.253 -4.901 0.458 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.831 -4.183 1.948 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.585 -6.173 3.145 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.554 -6.922 1.561 1.00 0.00 H new ATOM 0 HE21 GLN A 18 18.423 -6.579 4.378 1.00 0.00 H new ATOM 0 HE22 GLN A 18 19.980 -7.079 3.710 1.00 0.00 H new ATOM 290 N ASP A 19 15.640 -2.430 0.098 1.00 0.00 N ATOM 291 CA ASP A 19 15.592 -1.002 -0.326 1.00 0.00 C ATOM 292 C ASP A 19 14.304 -0.347 0.186 1.00 0.00 C ATOM 293 O ASP A 19 14.277 0.823 0.516 1.00 0.00 O ATOM 294 CB ASP A 19 15.606 -1.036 -1.856 1.00 0.00 C ATOM 295 CG ASP A 19 16.982 -1.497 -2.340 1.00 0.00 C ATOM 296 OD1 ASP A 19 17.716 -2.047 -1.535 1.00 0.00 O ATOM 297 OD2 ASP A 19 17.278 -1.290 -3.504 1.00 0.00 O ATOM 0 H ASP A 19 15.668 -3.111 -0.661 1.00 0.00 H new ATOM 0 HA ASP A 19 16.426 -0.424 0.072 1.00 0.00 H new ATOM 0 HB2 ASP A 19 14.834 -1.712 -2.223 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.380 -0.047 -2.255 1.00 0.00 H new ATOM 302 N CYS A 20 13.237 -1.097 0.245 1.00 0.00 N ATOM 303 CA CYS A 20 11.942 -0.528 0.726 1.00 0.00 C ATOM 304 C CYS A 20 12.025 -0.172 2.212 1.00 0.00 C ATOM 305 O CYS A 20 11.516 0.843 2.644 1.00 0.00 O ATOM 306 CB CYS A 20 10.919 -1.638 0.510 1.00 0.00 C ATOM 307 SG CYS A 20 10.888 -2.100 -1.240 1.00 0.00 S ATOM 0 H CYS A 20 13.205 -2.082 -0.019 1.00 0.00 H new ATOM 0 HA CYS A 20 11.681 0.388 0.196 1.00 0.00 H new ATOM 0 HB2 CYS A 20 11.172 -2.504 1.121 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.931 -1.303 0.826 1.00 0.00 H new ATOM 0 HG CYS A 20 11.819 -2.976 -1.474 1.00 0.00 H new ATOM 313 N GLN A 21 12.660 -0.997 3.001 1.00 0.00 N ATOM 314 CA GLN A 21 12.769 -0.693 4.453 1.00 0.00 C ATOM 315 C GLN A 21 13.813 0.396 4.645 1.00 0.00 C ATOM 316 O GLN A 21 13.656 1.296 5.447 1.00 0.00 O ATOM 317 CB GLN A 21 13.229 -1.991 5.118 1.00 0.00 C ATOM 318 CG GLN A 21 12.534 -3.181 4.463 1.00 0.00 C ATOM 319 CD GLN A 21 12.488 -4.357 5.433 1.00 0.00 C ATOM 320 OE1 GLN A 21 11.396 -5.054 5.521 1.00 0.00 O flip ATOM 321 NE2 GLN A 21 13.450 -4.641 6.118 1.00 0.00 N flip ATOM 0 H GLN A 21 13.106 -1.865 2.702 1.00 0.00 H new ATOM 0 HA GLN A 21 11.828 -0.346 4.880 1.00 0.00 H new ATOM 0 HB2 GLN A 21 14.310 -2.094 5.027 1.00 0.00 H new ATOM 0 HB3 GLN A 21 13.000 -1.966 6.183 1.00 0.00 H new ATOM 0 HG2 GLN A 21 11.522 -2.904 4.167 1.00 0.00 H new ATOM 0 HG3 GLN A 21 13.065 -3.468 3.555 1.00 0.00 H new ATOM 0 HE21 GLN A 21 14.307 -4.092 6.047 1.00 0.00 H new ATOM 0 HE22 GLN A 21 13.401 -5.429 6.764 1.00 0.00 H new ATOM 330 N ARG A 22 14.878 0.326 3.893 1.00 0.00 N ATOM 331 CA ARG A 22 15.933 1.362 4.012 1.00 0.00 C ATOM 332 C ARG A 22 15.273 2.730 4.011 1.00 0.00 C ATOM 333 O ARG A 22 15.365 3.480 4.962 1.00 0.00 O ATOM 334 CB ARG A 22 16.789 1.183 2.763 1.00 0.00 C ATOM 335 CG ARG A 22 17.779 0.043 2.990 1.00 0.00 C ATOM 336 CD ARG A 22 18.581 0.332 4.256 1.00 0.00 C ATOM 337 NE ARG A 22 19.986 -0.049 3.922 1.00 0.00 N ATOM 338 CZ ARG A 22 20.991 0.483 4.572 1.00 0.00 C ATOM 339 NH1 ARG A 22 20.776 1.340 5.532 1.00 0.00 N ATOM 340 NH2 ARG A 22 22.216 0.155 4.256 1.00 0.00 N ATOM 0 H ARG A 22 15.059 -0.404 3.204 1.00 0.00 H new ATOM 0 HA ARG A 22 16.525 1.276 4.923 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.156 0.965 1.903 1.00 0.00 H new ATOM 0 HB3 ARG A 22 17.324 2.106 2.539 1.00 0.00 H new ATOM 0 HG2 ARG A 22 17.248 -0.904 3.088 1.00 0.00 H new ATOM 0 HG3 ARG A 22 18.447 -0.053 2.134 1.00 0.00 H new ATOM 0 HD2 ARG A 22 18.513 1.384 4.534 1.00 0.00 H new ATOM 0 HD3 ARG A 22 18.206 -0.246 5.101 1.00 0.00 H new ATOM 0 HE ARG A 22 20.164 -0.728 3.182 1.00 0.00 H new ATOM 0 HH11 ARG A 22 19.821 1.599 5.780 1.00 0.00 H new ATOM 0 HH12 ARG A 22 21.563 1.751 6.035 1.00 0.00 H new ATOM 0 HH21 ARG A 22 22.387 -0.514 3.505 1.00 0.00 H new ATOM 0 HH22 ARG A 22 23.001 0.568 4.760 1.00 0.00 H new ATOM 354 N ALA A 23 14.575 3.045 2.956 1.00 0.00 N ATOM 355 CA ALA A 23 13.873 4.350 2.906 1.00 0.00 C ATOM 356 C ALA A 23 12.841 4.386 4.038 1.00 0.00 C ATOM 357 O ALA A 23 12.858 5.269 4.873 1.00 0.00 O ATOM 358 CB ALA A 23 13.206 4.387 1.529 1.00 0.00 C ATOM 0 H ALA A 23 14.462 2.456 2.131 1.00 0.00 H new ATOM 0 HA ALA A 23 14.530 5.210 3.037 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.663 5.325 1.413 1.00 0.00 H new ATOM 0 HB2 ALA A 23 13.968 4.310 0.753 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.511 3.552 1.439 1.00 0.00 H new ATOM 364 N LEU A 24 11.960 3.415 4.098 1.00 0.00 N ATOM 365 CA LEU A 24 10.967 3.391 5.207 1.00 0.00 C ATOM 366 C LEU A 24 11.591 2.717 6.434 1.00 0.00 C ATOM 367 O LEU A 24 11.188 1.647 6.845 1.00 0.00 O ATOM 368 CB LEU A 24 9.803 2.569 4.667 1.00 0.00 C ATOM 369 CG LEU A 24 9.278 3.245 3.406 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.098 2.454 2.854 1.00 0.00 C ATOM 371 CD2 LEU A 24 8.836 4.671 3.738 1.00 0.00 C ATOM 0 H LEU A 24 11.889 2.647 3.431 1.00 0.00 H new ATOM 0 HA LEU A 24 10.646 4.386 5.516 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.128 1.553 4.445 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.013 2.495 5.414 1.00 0.00 H new ATOM 0 HG LEU A 24 10.068 3.278 2.656 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.724 2.939 1.952 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.420 1.441 2.614 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.305 2.415 3.601 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.460 5.155 2.836 1.00 0.00 H new ATOM 0 HD22 LEU A 24 8.047 4.642 4.490 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.685 5.234 4.125 1.00 0.00 H new ATOM 383 N SER A 25 12.582 3.338 7.014 1.00 0.00 N ATOM 384 CA SER A 25 13.249 2.741 8.209 1.00 0.00 C ATOM 385 C SER A 25 12.947 3.577 9.454 1.00 0.00 C ATOM 386 O SER A 25 13.254 3.189 10.565 1.00 0.00 O ATOM 387 CB SER A 25 14.744 2.778 7.889 1.00 0.00 C ATOM 388 OG SER A 25 15.119 4.106 7.549 1.00 0.00 O ATOM 0 H SER A 25 12.960 4.236 6.712 1.00 0.00 H new ATOM 0 HA SER A 25 12.901 1.728 8.413 1.00 0.00 H new ATOM 0 HB2 SER A 25 15.320 2.434 8.748 1.00 0.00 H new ATOM 0 HB3 SER A 25 14.968 2.102 7.064 1.00 0.00 H new ATOM 0 HG SER A 25 15.127 4.204 6.574 1.00 0.00 H new ATOM 394 N ALA A 26 12.343 4.722 9.273 1.00 0.00 N ATOM 395 CA ALA A 26 12.013 5.592 10.439 1.00 0.00 C ATOM 396 C ALA A 26 11.516 4.742 11.609 1.00 0.00 C ATOM 397 O ALA A 26 10.718 3.842 11.440 1.00 0.00 O ATOM 398 CB ALA A 26 10.892 6.510 9.939 1.00 0.00 C ATOM 0 H ALA A 26 12.063 5.093 8.365 1.00 0.00 H new ATOM 0 HA ALA A 26 12.878 6.152 10.794 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.590 7.185 10.740 1.00 0.00 H new ATOM 0 HB2 ALA A 26 11.250 7.092 9.090 1.00 0.00 H new ATOM 0 HB3 ALA A 26 10.038 5.907 9.631 1.00 0.00 H new ATOM 404 N ASP A 27 11.976 5.021 12.795 1.00 0.00 N ATOM 405 CA ASP A 27 11.523 4.233 13.972 1.00 0.00 C ATOM 406 C ASP A 27 9.999 4.219 14.019 1.00 0.00 C ATOM 407 O ASP A 27 9.388 3.342 14.598 1.00 0.00 O ATOM 408 CB ASP A 27 12.095 4.974 15.178 1.00 0.00 C ATOM 409 CG ASP A 27 13.622 4.898 15.141 1.00 0.00 C ATOM 410 OD1 ASP A 27 14.137 4.028 14.458 1.00 0.00 O ATOM 411 OD2 ASP A 27 14.249 5.713 15.795 1.00 0.00 O ATOM 0 H ASP A 27 12.647 5.762 13.000 1.00 0.00 H new ATOM 0 HA ASP A 27 11.853 3.195 13.942 1.00 0.00 H new ATOM 0 HB2 ASP A 27 11.771 6.015 15.167 1.00 0.00 H new ATOM 0 HB3 ASP A 27 11.720 4.533 16.102 1.00 0.00 H new ATOM 416 N ARG A 28 9.383 5.190 13.407 1.00 0.00 N ATOM 417 CA ARG A 28 7.897 5.251 13.400 1.00 0.00 C ATOM 418 C ARG A 28 7.339 4.439 12.234 1.00 0.00 C ATOM 419 O ARG A 28 6.317 4.775 11.677 1.00 0.00 O ATOM 420 CB ARG A 28 7.563 6.726 13.196 1.00 0.00 C ATOM 421 CG ARG A 28 8.035 7.153 11.806 1.00 0.00 C ATOM 422 CD ARG A 28 7.589 8.587 11.537 1.00 0.00 C ATOM 423 NE ARG A 28 7.955 8.848 10.116 1.00 0.00 N ATOM 424 CZ ARG A 28 8.082 10.075 9.686 1.00 0.00 C ATOM 425 NH1 ARG A 28 7.941 11.079 10.509 1.00 0.00 N ATOM 426 NH2 ARG A 28 8.358 10.296 8.429 1.00 0.00 N ATOM 0 H ARG A 28 9.848 5.948 12.908 1.00 0.00 H new ATOM 0 HA ARG A 28 7.471 4.846 14.318 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.489 6.887 13.295 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.048 7.332 13.961 1.00 0.00 H new ATOM 0 HG2 ARG A 28 9.121 7.080 11.740 1.00 0.00 H new ATOM 0 HG3 ARG A 28 7.624 6.485 11.049 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.517 8.703 11.695 1.00 0.00 H new ATOM 0 HD3 ARG A 28 8.088 9.287 12.207 1.00 0.00 H new ATOM 0 HE ARG A 28 8.107 8.067 9.478 1.00 0.00 H new ATOM 0 HH11 ARG A 28 7.731 10.907 11.492 1.00 0.00 H new ATOM 0 HH12 ARG A 28 8.041 12.035 10.169 1.00 0.00 H new ATOM 0 HH21 ARG A 28 8.474 9.512 7.787 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.458 11.253 8.089 1.00 0.00 H new ATOM 440 N TYR A 29 7.997 3.383 11.841 1.00 0.00 N ATOM 441 CA TYR A 29 7.475 2.584 10.706 1.00 0.00 C ATOM 442 C TYR A 29 7.299 1.121 11.106 1.00 0.00 C ATOM 443 O TYR A 29 8.026 0.593 11.922 1.00 0.00 O ATOM 444 CB TYR A 29 8.531 2.702 9.613 1.00 0.00 C ATOM 445 CG TYR A 29 8.250 3.913 8.766 1.00 0.00 C ATOM 446 CD1 TYR A 29 6.939 4.216 8.384 1.00 0.00 C ATOM 447 CD2 TYR A 29 9.303 4.738 8.371 1.00 0.00 C ATOM 448 CE1 TYR A 29 6.683 5.348 7.606 1.00 0.00 C ATOM 449 CE2 TYR A 29 9.051 5.870 7.597 1.00 0.00 C ATOM 450 CZ TYR A 29 7.740 6.179 7.215 1.00 0.00 C ATOM 451 OH TYR A 29 7.496 7.296 6.449 1.00 0.00 O ATOM 0 H TYR A 29 8.866 3.044 12.255 1.00 0.00 H new ATOM 0 HA TYR A 29 6.499 2.943 10.380 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.523 2.780 10.059 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.530 1.805 8.994 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.125 3.575 8.690 1.00 0.00 H new ATOM 0 HD2 TYR A 29 10.315 4.500 8.665 1.00 0.00 H new ATOM 0 HE1 TYR A 29 5.672 5.582 7.307 1.00 0.00 H new ATOM 0 HE2 TYR A 29 9.867 6.508 7.292 1.00 0.00 H new ATOM 0 HH TYR A 29 8.340 7.760 6.269 1.00 0.00 H new ATOM 461 N GLN A 30 6.353 0.459 10.509 1.00 0.00 N ATOM 462 CA GLN A 30 6.136 -0.982 10.814 1.00 0.00 C ATOM 463 C GLN A 30 6.177 -1.753 9.502 1.00 0.00 C ATOM 464 O GLN A 30 5.165 -1.991 8.872 1.00 0.00 O ATOM 465 CB GLN A 30 4.756 -1.068 11.461 1.00 0.00 C ATOM 466 CG GLN A 30 4.873 -1.835 12.778 1.00 0.00 C ATOM 467 CD GLN A 30 3.561 -1.728 13.557 1.00 0.00 C ATOM 468 OE1 GLN A 30 3.151 -0.649 13.933 1.00 0.00 O ATOM 469 NE2 GLN A 30 2.881 -2.810 13.813 1.00 0.00 N ATOM 0 H GLN A 30 5.716 0.855 9.818 1.00 0.00 H new ATOM 0 HA GLN A 30 6.892 -1.401 11.478 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.361 -0.068 11.641 1.00 0.00 H new ATOM 0 HB3 GLN A 30 4.057 -1.571 10.793 1.00 0.00 H new ATOM 0 HG2 GLN A 30 5.105 -2.882 12.581 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.693 -1.433 13.372 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.226 -3.716 13.497 1.00 0.00 H new ATOM 0 HE22 GLN A 30 2.004 -2.751 14.330 1.00 0.00 H new ATOM 478 N LEU A 31 7.347 -2.108 9.068 1.00 0.00 N ATOM 479 CA LEU A 31 7.471 -2.819 7.779 1.00 0.00 C ATOM 480 C LEU A 31 7.130 -4.304 7.931 1.00 0.00 C ATOM 481 O LEU A 31 7.726 -5.015 8.716 1.00 0.00 O ATOM 482 CB LEU A 31 8.943 -2.656 7.394 1.00 0.00 C ATOM 483 CG LEU A 31 9.216 -1.235 6.892 1.00 0.00 C ATOM 484 CD1 LEU A 31 8.502 -1.018 5.559 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.724 -0.203 7.907 1.00 0.00 C ATOM 0 H LEU A 31 8.226 -1.934 9.555 1.00 0.00 H new ATOM 0 HA LEU A 31 6.788 -2.421 7.028 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.575 -2.871 8.255 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.204 -3.377 6.619 1.00 0.00 H new ATOM 0 HG LEU A 31 10.291 -1.112 6.760 1.00 0.00 H new ATOM 0 HD11 LEU A 31 8.697 -0.007 5.202 1.00 0.00 H new ATOM 0 HD12 LEU A 31 8.870 -1.738 4.828 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.429 -1.155 5.694 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.927 0.801 7.533 1.00 0.00 H new ATOM 0 HD22 LEU A 31 7.651 -0.324 8.058 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.243 -0.349 8.855 1.00 0.00 H new ATOM 497 N GLN A 32 6.200 -4.782 7.154 1.00 0.00 N ATOM 498 CA GLN A 32 5.843 -6.227 7.212 1.00 0.00 C ATOM 499 C GLN A 32 6.102 -6.834 5.835 1.00 0.00 C ATOM 500 O GLN A 32 5.439 -6.508 4.869 1.00 0.00 O ATOM 501 CB GLN A 32 4.353 -6.275 7.561 1.00 0.00 C ATOM 502 CG GLN A 32 3.914 -7.731 7.720 1.00 0.00 C ATOM 503 CD GLN A 32 4.503 -8.302 9.011 1.00 0.00 C ATOM 504 OE1 GLN A 32 4.126 -7.901 10.093 1.00 0.00 O ATOM 505 NE2 GLN A 32 5.419 -9.229 8.943 1.00 0.00 N ATOM 0 H GLN A 32 5.669 -4.232 6.478 1.00 0.00 H new ATOM 0 HA GLN A 32 6.424 -6.785 7.946 1.00 0.00 H new ATOM 0 HB2 GLN A 32 4.167 -5.725 8.483 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.769 -5.791 6.778 1.00 0.00 H new ATOM 0 HG2 GLN A 32 2.826 -7.794 7.745 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.247 -8.318 6.864 1.00 0.00 H new ATOM 0 HE21 GLN A 32 5.736 -9.567 8.034 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.817 -9.616 9.799 1.00 0.00 H new ATOM 514 N VAL A 33 7.082 -7.683 5.722 1.00 0.00 N ATOM 515 CA VAL A 33 7.399 -8.268 4.389 1.00 0.00 C ATOM 516 C VAL A 33 6.580 -9.529 4.113 1.00 0.00 C ATOM 517 O VAL A 33 6.501 -10.427 4.927 1.00 0.00 O ATOM 518 CB VAL A 33 8.882 -8.605 4.454 1.00 0.00 C ATOM 519 CG1 VAL A 33 9.381 -8.945 3.046 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.645 -7.396 5.004 1.00 0.00 C ATOM 0 H VAL A 33 7.676 -7.997 6.490 1.00 0.00 H new ATOM 0 HA VAL A 33 7.159 -7.573 3.584 1.00 0.00 H new ATOM 0 HB VAL A 33 9.045 -9.461 5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.443 -9.187 3.085 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.827 -9.801 2.661 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.228 -8.089 2.389 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.709 -7.629 5.054 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.492 -6.540 4.348 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.278 -7.158 6.003 1.00 0.00 H new ATOM 530 N CYS A 34 5.993 -9.605 2.950 1.00 0.00 N ATOM 531 CA CYS A 34 5.197 -10.816 2.586 1.00 0.00 C ATOM 532 C CYS A 34 5.865 -11.527 1.405 1.00 0.00 C ATOM 533 O CYS A 34 5.995 -10.977 0.330 1.00 0.00 O ATOM 534 CB CYS A 34 3.816 -10.289 2.195 1.00 0.00 C ATOM 535 SG CYS A 34 2.846 -9.978 3.691 1.00 0.00 S ATOM 0 H CYS A 34 6.029 -8.880 2.233 1.00 0.00 H new ATOM 0 HA CYS A 34 5.129 -11.536 3.402 1.00 0.00 H new ATOM 0 HB2 CYS A 34 3.915 -9.371 1.615 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.305 -11.013 1.561 1.00 0.00 H new ATOM 0 HG CYS A 34 2.514 -8.722 3.740 1.00 0.00 H new ATOM 541 N GLU A 35 6.305 -12.742 1.601 1.00 0.00 N ATOM 542 CA GLU A 35 6.987 -13.486 0.499 1.00 0.00 C ATOM 543 C GLU A 35 6.087 -13.595 -0.736 1.00 0.00 C ATOM 544 O GLU A 35 6.557 -13.588 -1.857 1.00 0.00 O ATOM 545 CB GLU A 35 7.257 -14.875 1.077 1.00 0.00 C ATOM 546 CG GLU A 35 8.303 -14.779 2.191 1.00 0.00 C ATOM 547 CD GLU A 35 8.628 -16.184 2.697 1.00 0.00 C ATOM 548 OE1 GLU A 35 7.729 -17.008 2.714 1.00 0.00 O ATOM 549 OE2 GLU A 35 9.769 -16.410 3.061 1.00 0.00 O ATOM 0 H GLU A 35 6.222 -13.254 2.479 1.00 0.00 H new ATOM 0 HA GLU A 35 7.897 -12.980 0.174 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.334 -15.302 1.469 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.609 -15.544 0.292 1.00 0.00 H new ATOM 0 HG2 GLU A 35 9.206 -14.296 1.818 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.926 -14.163 3.008 1.00 0.00 H new ATOM 556 N SER A 36 4.807 -13.713 -0.546 1.00 0.00 N ATOM 557 CA SER A 36 3.898 -13.842 -1.717 1.00 0.00 C ATOM 558 C SER A 36 2.931 -12.663 -1.777 1.00 0.00 C ATOM 559 O SER A 36 3.078 -11.690 -1.063 1.00 0.00 O ATOM 560 CB SER A 36 3.147 -15.148 -1.470 1.00 0.00 C ATOM 561 OG SER A 36 4.004 -16.051 -0.783 1.00 0.00 O ATOM 0 H SER A 36 4.350 -13.726 0.366 1.00 0.00 H new ATOM 0 HA SER A 36 4.435 -13.846 -2.666 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.248 -14.960 -0.882 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.824 -15.582 -2.416 1.00 0.00 H new ATOM 0 HG SER A 36 3.529 -16.892 -0.619 1.00 0.00 H new ATOM 567 N GLY A 37 1.927 -12.760 -2.601 1.00 0.00 N ATOM 568 CA GLY A 37 0.920 -11.671 -2.697 1.00 0.00 C ATOM 569 C GLY A 37 -0.258 -12.099 -1.844 1.00 0.00 C ATOM 570 O GLY A 37 -0.977 -11.299 -1.282 1.00 0.00 O ATOM 0 H GLY A 37 1.760 -13.555 -3.218 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.334 -10.727 -2.342 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.614 -11.515 -3.732 1.00 0.00 H new ATOM 574 N GLU A 38 -0.419 -13.385 -1.719 1.00 0.00 N ATOM 575 CA GLU A 38 -1.496 -13.932 -0.880 1.00 0.00 C ATOM 576 C GLU A 38 -1.153 -13.629 0.572 1.00 0.00 C ATOM 577 O GLU A 38 -2.008 -13.312 1.376 1.00 0.00 O ATOM 578 CB GLU A 38 -1.457 -15.428 -1.167 1.00 0.00 C ATOM 579 CG GLU A 38 -2.163 -15.706 -2.495 1.00 0.00 C ATOM 580 CD GLU A 38 -2.392 -17.209 -2.652 1.00 0.00 C ATOM 581 OE1 GLU A 38 -2.714 -17.844 -1.662 1.00 0.00 O ATOM 582 OE2 GLU A 38 -2.243 -17.699 -3.759 1.00 0.00 O ATOM 0 H GLU A 38 0.166 -14.085 -2.175 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.485 -13.519 -1.076 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.425 -15.775 -1.211 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.944 -15.977 -0.361 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -3.116 -15.178 -2.529 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.561 -15.332 -3.323 1.00 0.00 H new ATOM 589 N MET A 39 0.109 -13.698 0.900 1.00 0.00 N ATOM 590 CA MET A 39 0.526 -13.378 2.287 1.00 0.00 C ATOM 591 C MET A 39 0.185 -11.914 2.568 1.00 0.00 C ATOM 592 O MET A 39 -0.280 -11.566 3.636 1.00 0.00 O ATOM 593 CB MET A 39 2.037 -13.623 2.331 1.00 0.00 C ATOM 594 CG MET A 39 2.308 -15.129 2.276 1.00 0.00 C ATOM 595 SD MET A 39 1.766 -15.897 3.826 1.00 0.00 S ATOM 596 CE MET A 39 3.106 -15.282 4.871 1.00 0.00 C ATOM 0 H MET A 39 0.864 -13.962 0.267 1.00 0.00 H new ATOM 0 HA MET A 39 0.023 -13.984 3.040 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.522 -13.124 1.492 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.459 -13.199 3.242 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.780 -15.574 1.433 1.00 0.00 H new ATOM 0 HG3 MET A 39 3.371 -15.313 2.119 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.468 -16.087 5.510 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.921 -14.923 4.243 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.738 -14.464 5.491 1.00 0.00 H new ATOM 606 N LEU A 40 0.385 -11.059 1.600 1.00 0.00 N ATOM 607 CA LEU A 40 0.040 -9.624 1.793 1.00 0.00 C ATOM 608 C LEU A 40 -1.441 -9.519 2.153 1.00 0.00 C ATOM 609 O LEU A 40 -1.816 -8.850 3.095 1.00 0.00 O ATOM 610 CB LEU A 40 0.332 -8.961 0.437 1.00 0.00 C ATOM 611 CG LEU A 40 -0.548 -7.718 0.252 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.411 -6.809 1.471 1.00 0.00 C ATOM 613 CD2 LEU A 40 -0.107 -6.958 -1.001 1.00 0.00 C ATOM 0 H LEU A 40 0.772 -11.294 0.686 1.00 0.00 H new ATOM 0 HA LEU A 40 0.605 -9.145 2.593 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.384 -8.682 0.380 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.146 -9.670 -0.370 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.588 -8.026 0.142 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.036 -5.926 1.339 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.728 -7.348 2.364 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.629 -6.503 1.582 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.733 -6.075 -1.131 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.934 -6.652 -0.893 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.207 -7.605 -1.873 1.00 0.00 H new ATOM 625 N LEU A 41 -2.286 -10.185 1.415 1.00 0.00 N ATOM 626 CA LEU A 41 -3.739 -10.131 1.721 1.00 0.00 C ATOM 627 C LEU A 41 -3.987 -10.547 3.168 1.00 0.00 C ATOM 628 O LEU A 41 -4.620 -9.844 3.929 1.00 0.00 O ATOM 629 CB LEU A 41 -4.372 -11.155 0.782 1.00 0.00 C ATOM 630 CG LEU A 41 -4.243 -10.684 -0.664 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.634 -11.820 -1.608 1.00 0.00 C ATOM 632 CD2 LEU A 41 -5.176 -9.496 -0.884 1.00 0.00 C ATOM 0 H LEU A 41 -2.031 -10.763 0.614 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.149 -9.129 1.591 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -3.885 -12.122 0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.423 -11.293 1.036 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.213 -10.388 -0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.542 -11.483 -2.641 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -3.975 -12.672 -1.444 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.665 -12.116 -1.414 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.091 -9.152 -1.915 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.204 -9.799 -0.687 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.900 -8.687 -0.208 1.00 0.00 H new ATOM 644 N GLU A 42 -3.488 -11.687 3.556 1.00 0.00 N ATOM 645 CA GLU A 42 -3.706 -12.146 4.952 1.00 0.00 C ATOM 646 C GLU A 42 -3.337 -11.029 5.920 1.00 0.00 C ATOM 647 O GLU A 42 -3.996 -10.818 6.919 1.00 0.00 O ATOM 648 CB GLU A 42 -2.781 -13.350 5.131 1.00 0.00 C ATOM 649 CG GLU A 42 -3.269 -14.183 6.319 1.00 0.00 C ATOM 650 CD GLU A 42 -2.245 -15.275 6.640 1.00 0.00 C ATOM 651 OE1 GLU A 42 -1.487 -15.626 5.752 1.00 0.00 O ATOM 652 OE2 GLU A 42 -2.241 -15.739 7.767 1.00 0.00 O ATOM 0 H GLU A 42 -2.941 -12.317 2.969 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.745 -12.412 5.148 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.772 -13.956 4.225 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.757 -13.016 5.301 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.416 -13.542 7.188 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -4.234 -14.633 6.088 1.00 0.00 H new ATOM 659 N TYR A 43 -2.293 -10.304 5.636 1.00 0.00 N ATOM 660 CA TYR A 43 -1.904 -9.201 6.550 1.00 0.00 C ATOM 661 C TYR A 43 -2.969 -8.099 6.546 1.00 0.00 C ATOM 662 O TYR A 43 -3.376 -7.613 7.581 1.00 0.00 O ATOM 663 CB TYR A 43 -0.584 -8.659 6.008 1.00 0.00 C ATOM 664 CG TYR A 43 -0.245 -7.407 6.768 1.00 0.00 C ATOM 665 CD1 TYR A 43 -0.738 -6.174 6.331 1.00 0.00 C ATOM 666 CD2 TYR A 43 0.545 -7.479 7.918 1.00 0.00 C ATOM 667 CE1 TYR A 43 -0.437 -5.008 7.044 1.00 0.00 C ATOM 668 CE2 TYR A 43 0.846 -6.315 8.632 1.00 0.00 C ATOM 669 CZ TYR A 43 0.357 -5.080 8.195 1.00 0.00 C ATOM 670 OH TYR A 43 0.657 -3.932 8.900 1.00 0.00 O ATOM 0 H TYR A 43 -1.698 -10.427 4.817 1.00 0.00 H new ATOM 0 HA TYR A 43 -1.807 -9.551 7.578 1.00 0.00 H new ATOM 0 HB2 TYR A 43 0.207 -9.400 6.123 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.669 -8.446 4.942 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -1.351 -6.121 5.443 1.00 0.00 H new ATOM 0 HD2 TYR A 43 0.923 -8.433 8.255 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -0.816 -4.055 6.707 1.00 0.00 H new ATOM 0 HE2 TYR A 43 1.456 -6.370 9.521 1.00 0.00 H new ATOM 0 HH TYR A 43 1.216 -4.159 9.672 1.00 0.00 H new ATOM 680 N ALA A 44 -3.414 -7.690 5.385 1.00 0.00 N ATOM 681 CA ALA A 44 -4.439 -6.607 5.311 1.00 0.00 C ATOM 682 C ALA A 44 -5.848 -7.174 5.534 1.00 0.00 C ATOM 683 O ALA A 44 -6.791 -6.443 5.763 1.00 0.00 O ATOM 684 CB ALA A 44 -4.299 -6.040 3.898 1.00 0.00 C ATOM 0 H ALA A 44 -3.111 -8.060 4.484 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.292 -5.846 6.078 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.019 -5.234 3.756 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.289 -5.653 3.760 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.488 -6.828 3.169 1.00 0.00 H new ATOM 690 N GLN A 45 -5.997 -8.472 5.474 1.00 0.00 N ATOM 691 CA GLN A 45 -7.346 -9.083 5.686 1.00 0.00 C ATOM 692 C GLN A 45 -7.698 -9.097 7.164 1.00 0.00 C ATOM 693 O GLN A 45 -8.750 -9.553 7.561 1.00 0.00 O ATOM 694 CB GLN A 45 -7.227 -10.515 5.172 1.00 0.00 C ATOM 695 CG GLN A 45 -7.397 -10.501 3.664 1.00 0.00 C ATOM 696 CD GLN A 45 -7.640 -11.919 3.150 1.00 0.00 C ATOM 697 OE1 GLN A 45 -6.644 -12.595 2.651 1.00 0.00 O flip ATOM 698 NE2 GLN A 45 -8.749 -12.417 3.203 1.00 0.00 N flip ATOM 0 H GLN A 45 -5.245 -9.136 5.288 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.125 -8.521 5.171 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.257 -10.934 5.440 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -7.986 -11.147 5.633 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.234 -9.858 3.391 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.507 -10.083 3.194 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -9.528 -11.887 3.594 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -8.900 -13.364 2.857 1.00 0.00 H new ATOM 707 N THR A 46 -6.821 -8.616 7.984 1.00 0.00 N ATOM 708 CA THR A 46 -7.101 -8.619 9.438 1.00 0.00 C ATOM 709 C THR A 46 -6.697 -7.267 10.015 1.00 0.00 C ATOM 710 O THR A 46 -6.453 -7.119 11.195 1.00 0.00 O ATOM 711 CB THR A 46 -6.237 -9.760 9.989 1.00 0.00 C ATOM 712 OG1 THR A 46 -4.900 -9.308 10.143 1.00 0.00 O ATOM 713 CG2 THR A 46 -6.269 -10.947 9.009 1.00 0.00 C ATOM 0 H THR A 46 -5.921 -8.220 7.713 1.00 0.00 H new ATOM 0 HA THR A 46 -8.151 -8.769 9.690 1.00 0.00 H new ATOM 0 HB THR A 46 -6.627 -10.078 10.956 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.347 -10.036 10.497 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.655 -11.758 9.400 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.296 -11.293 8.891 1.00 0.00 H new ATOM 0 HG23 THR A 46 -5.879 -10.631 8.042 1.00 0.00 H new ATOM 721 N HIS A 47 -6.622 -6.282 9.164 1.00 0.00 N ATOM 722 CA HIS A 47 -6.227 -4.921 9.605 1.00 0.00 C ATOM 723 C HIS A 47 -6.068 -4.020 8.378 1.00 0.00 C ATOM 724 O HIS A 47 -4.975 -3.843 7.886 1.00 0.00 O ATOM 725 CB HIS A 47 -4.874 -5.113 10.292 1.00 0.00 C ATOM 726 CG HIS A 47 -5.014 -4.898 11.772 1.00 0.00 C ATOM 727 ND1 HIS A 47 -6.110 -4.680 12.565 1.00 0.00 N flip ATOM 728 CD2 HIS A 47 -3.920 -4.890 12.623 1.00 0.00 C flip ATOM 729 CE1 HIS A 47 -5.709 -4.538 13.891 1.00 0.00 C flip ATOM 730 NE2 HIS A 47 -4.380 -4.673 13.869 1.00 0.00 N flip ATOM 0 H HIS A 47 -6.821 -6.367 8.167 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.961 -4.460 10.265 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.497 -6.117 10.096 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.146 -4.413 9.882 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.888 -5.032 12.338 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -6.337 -4.358 14.751 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -3.786 -4.618 14.696 1.00 0.00 H new ATOM 738 N ARG A 48 -7.136 -3.454 7.873 1.00 0.00 N ATOM 739 CA ARG A 48 -6.997 -2.568 6.673 1.00 0.00 C ATOM 740 C ARG A 48 -6.711 -1.141 7.132 1.00 0.00 C ATOM 741 O ARG A 48 -5.750 -0.516 6.730 1.00 0.00 O ATOM 742 CB ARG A 48 -8.346 -2.601 5.936 1.00 0.00 C ATOM 743 CG ARG A 48 -9.051 -3.945 6.130 1.00 0.00 C ATOM 744 CD ARG A 48 -10.131 -4.108 5.052 1.00 0.00 C ATOM 745 NE ARG A 48 -10.507 -5.552 5.072 1.00 0.00 N ATOM 746 CZ ARG A 48 -11.586 -5.955 4.450 1.00 0.00 C ATOM 747 NH1 ARG A 48 -12.353 -5.091 3.840 1.00 0.00 N ATOM 748 NH2 ARG A 48 -11.902 -7.223 4.444 1.00 0.00 N ATOM 0 H ARG A 48 -8.085 -3.563 8.232 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.185 -2.902 6.027 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.984 -1.797 6.303 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.187 -2.421 4.873 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.330 -4.760 6.066 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.500 -3.994 7.122 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.994 -3.476 5.263 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -9.754 -3.815 4.072 1.00 0.00 H new ATOM 0 HE ARG A 48 -9.924 -6.224 5.570 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.112 -4.100 3.848 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.193 -5.407 3.356 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -11.308 -7.899 4.924 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -12.743 -7.537 3.959 1.00 0.00 H new ATOM 762 N ASP A 49 -7.567 -0.626 7.967 1.00 0.00 N ATOM 763 CA ASP A 49 -7.395 0.772 8.471 1.00 0.00 C ATOM 764 C ASP A 49 -6.121 0.906 9.316 1.00 0.00 C ATOM 765 O ASP A 49 -5.499 1.950 9.352 1.00 0.00 O ATOM 766 CB ASP A 49 -8.632 1.036 9.329 1.00 0.00 C ATOM 767 CG ASP A 49 -9.292 2.345 8.886 1.00 0.00 C ATOM 768 OD1 ASP A 49 -8.748 2.992 8.007 1.00 0.00 O ATOM 769 OD2 ASP A 49 -10.330 2.676 9.433 1.00 0.00 O ATOM 0 H ASP A 49 -8.387 -1.114 8.328 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.296 1.485 7.652 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -9.337 0.210 9.233 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -8.352 1.095 10.381 1.00 0.00 H new ATOM 774 N GLN A 50 -5.730 -0.135 10.001 1.00 0.00 N ATOM 775 CA GLN A 50 -4.498 -0.053 10.844 1.00 0.00 C ATOM 776 C GLN A 50 -3.261 0.089 9.952 1.00 0.00 C ATOM 777 O GLN A 50 -2.184 0.412 10.412 1.00 0.00 O ATOM 778 CB GLN A 50 -4.454 -1.371 11.619 1.00 0.00 C ATOM 779 CG GLN A 50 -5.716 -1.507 12.478 1.00 0.00 C ATOM 780 CD GLN A 50 -5.789 -0.347 13.474 1.00 0.00 C ATOM 781 OE1 GLN A 50 -4.773 0.151 13.917 1.00 0.00 O ATOM 782 NE2 GLN A 50 -6.956 0.101 13.855 1.00 0.00 N ATOM 0 H GLN A 50 -6.207 -1.036 10.015 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.511 0.808 11.512 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.382 -2.209 10.926 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.567 -1.403 12.251 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.602 -1.510 11.843 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.704 -2.457 13.012 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.809 -0.317 13.483 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -7.014 0.869 14.524 1.00 0.00 H new ATOM 791 N ILE A 51 -3.411 -0.152 8.678 1.00 0.00 N ATOM 792 CA ILE A 51 -2.250 -0.032 7.751 1.00 0.00 C ATOM 793 C ILE A 51 -2.041 1.431 7.372 1.00 0.00 C ATOM 794 O ILE A 51 -2.978 2.151 7.083 1.00 0.00 O ATOM 795 CB ILE A 51 -2.628 -0.862 6.527 1.00 0.00 C ATOM 796 CG1 ILE A 51 -3.196 -2.211 6.982 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.387 -1.090 5.661 1.00 0.00 C ATOM 798 CD1 ILE A 51 -2.359 -2.773 8.138 1.00 0.00 C ATOM 0 H ILE A 51 -4.289 -0.427 8.238 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.320 -0.382 8.199 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.381 -0.331 5.944 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -4.232 -2.090 7.298 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -3.197 -2.914 6.149 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.657 -1.683 4.787 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -0.987 -0.129 5.338 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.632 -1.621 6.240 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.771 -3.731 8.453 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -1.330 -2.912 7.808 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.381 -2.076 8.975 1.00 0.00 H new ATOM 810 N ASP A 52 -0.820 1.881 7.389 1.00 0.00 N ATOM 811 CA ASP A 52 -0.549 3.304 7.056 1.00 0.00 C ATOM 812 C ASP A 52 0.057 3.452 5.658 1.00 0.00 C ATOM 813 O ASP A 52 0.107 4.539 5.121 1.00 0.00 O ATOM 814 CB ASP A 52 0.431 3.756 8.124 1.00 0.00 C ATOM 815 CG ASP A 52 -0.342 4.086 9.402 1.00 0.00 C ATOM 816 OD1 ASP A 52 -1.552 4.212 9.319 1.00 0.00 O ATOM 817 OD2 ASP A 52 0.287 4.207 10.440 1.00 0.00 O ATOM 0 H ASP A 52 0.003 1.324 7.619 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.461 3.901 7.041 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.163 2.973 8.319 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.984 4.631 7.782 1.00 0.00 H new ATOM 822 N CYS A 53 0.521 2.384 5.061 1.00 0.00 N ATOM 823 CA CYS A 53 1.109 2.508 3.690 1.00 0.00 C ATOM 824 C CYS A 53 1.539 1.143 3.142 1.00 0.00 C ATOM 825 O CYS A 53 2.414 0.495 3.686 1.00 0.00 O ATOM 826 CB CYS A 53 2.324 3.421 3.859 1.00 0.00 C ATOM 827 SG CYS A 53 2.102 4.909 2.855 1.00 0.00 S ATOM 0 H CYS A 53 0.520 1.443 5.455 1.00 0.00 H new ATOM 0 HA CYS A 53 0.385 2.908 2.980 1.00 0.00 H new ATOM 0 HB2 CYS A 53 2.446 3.692 4.908 1.00 0.00 H new ATOM 0 HB3 CYS A 53 3.231 2.897 3.557 1.00 0.00 H new ATOM 0 HG CYS A 53 1.417 4.615 1.790 1.00 0.00 H new ATOM 833 N LEU A 54 0.947 0.703 2.057 1.00 0.00 N ATOM 834 CA LEU A 54 1.361 -0.614 1.483 1.00 0.00 C ATOM 835 C LEU A 54 2.348 -0.390 0.334 1.00 0.00 C ATOM 836 O LEU A 54 2.168 0.484 -0.490 1.00 0.00 O ATOM 837 CB LEU A 54 0.080 -1.277 0.966 1.00 0.00 C ATOM 838 CG LEU A 54 0.332 -2.774 0.734 1.00 0.00 C ATOM 839 CD1 LEU A 54 -0.980 -3.550 0.896 1.00 0.00 C ATOM 840 CD2 LEU A 54 0.877 -2.993 -0.681 1.00 0.00 C ATOM 0 H LEU A 54 0.207 1.190 1.552 1.00 0.00 H new ATOM 0 HA LEU A 54 1.855 -1.241 2.225 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.728 -1.141 1.685 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.237 -0.803 0.037 1.00 0.00 H new ATOM 0 HG LEU A 54 1.059 -3.130 1.464 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.797 -4.612 0.731 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.369 -3.401 1.903 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -1.708 -3.190 0.169 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.055 -4.056 -0.842 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.152 -2.632 -1.410 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.813 -2.447 -0.799 1.00 0.00 H new ATOM 852 N ILE A 55 3.384 -1.179 0.266 1.00 0.00 N ATOM 853 CA ILE A 55 4.377 -1.023 -0.839 1.00 0.00 C ATOM 854 C ILE A 55 4.115 -2.092 -1.894 1.00 0.00 C ATOM 855 O ILE A 55 3.852 -3.231 -1.570 1.00 0.00 O ATOM 856 CB ILE A 55 5.744 -1.261 -0.206 1.00 0.00 C ATOM 857 CG1 ILE A 55 6.044 -0.208 0.859 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.825 -1.206 -1.287 1.00 0.00 C ATOM 859 CD1 ILE A 55 7.347 -0.594 1.560 1.00 0.00 C ATOM 0 H ILE A 55 3.588 -1.927 0.928 1.00 0.00 H new ATOM 0 HA ILE A 55 4.316 -0.042 -1.311 1.00 0.00 H new ATOM 0 HB ILE A 55 5.736 -2.243 0.267 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.135 0.778 0.403 1.00 0.00 H new ATOM 0 HG13 ILE A 55 5.227 -0.152 1.579 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.802 -1.376 -0.834 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.632 -1.976 -2.034 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.812 -0.226 -1.765 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.581 0.145 2.326 1.00 0.00 H new ATOM 0 HD12 ILE A 55 7.234 -1.574 2.024 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.156 -0.629 0.830 1.00 0.00 H new ATOM 871 N LEU A 56 4.175 -1.753 -3.148 1.00 0.00 N ATOM 872 CA LEU A 56 3.912 -2.783 -4.185 1.00 0.00 C ATOM 873 C LEU A 56 4.927 -2.707 -5.325 1.00 0.00 C ATOM 874 O LEU A 56 5.463 -1.664 -5.635 1.00 0.00 O ATOM 875 CB LEU A 56 2.508 -2.469 -4.688 1.00 0.00 C ATOM 876 CG LEU A 56 1.499 -2.823 -3.596 1.00 0.00 C ATOM 877 CD1 LEU A 56 0.085 -2.653 -4.141 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.707 -4.279 -3.168 1.00 0.00 C ATOM 0 H LEU A 56 4.392 -0.819 -3.497 1.00 0.00 H new ATOM 0 HA LEU A 56 3.997 -3.793 -3.783 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.428 -1.413 -4.947 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.297 -3.036 -5.594 1.00 0.00 H new ATOM 0 HG LEU A 56 1.641 -2.166 -2.738 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.637 -2.905 -3.364 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.063 -1.619 -4.453 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.057 -3.314 -4.996 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.989 -4.535 -2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.561 -4.935 -4.026 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.719 -4.404 -2.784 1.00 0.00 H new ATOM 890 N VAL A 57 5.184 -3.823 -5.949 1.00 0.00 N ATOM 891 CA VAL A 57 6.156 -3.849 -7.075 1.00 0.00 C ATOM 892 C VAL A 57 5.441 -4.298 -8.357 1.00 0.00 C ATOM 893 O VAL A 57 5.022 -5.432 -8.479 1.00 0.00 O ATOM 894 CB VAL A 57 7.202 -4.884 -6.648 1.00 0.00 C ATOM 895 CG1 VAL A 57 8.293 -4.999 -7.716 1.00 0.00 C ATOM 896 CG2 VAL A 57 7.830 -4.460 -5.314 1.00 0.00 C ATOM 0 H VAL A 57 4.759 -4.723 -5.725 1.00 0.00 H new ATOM 0 HA VAL A 57 6.603 -2.876 -7.280 1.00 0.00 H new ATOM 0 HB VAL A 57 6.717 -5.853 -6.530 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.032 -5.737 -7.403 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.846 -5.310 -8.660 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.779 -4.032 -7.846 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.574 -5.197 -5.011 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.309 -3.488 -5.430 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.054 -4.394 -4.551 1.00 0.00 H new ATOM 906 N ALA A 58 5.296 -3.422 -9.315 1.00 0.00 N ATOM 907 CA ALA A 58 4.606 -3.811 -10.581 1.00 0.00 C ATOM 908 C ALA A 58 5.453 -4.823 -11.350 1.00 0.00 C ATOM 909 O ALA A 58 4.947 -5.617 -12.117 1.00 0.00 O ATOM 910 CB ALA A 58 4.458 -2.515 -11.367 1.00 0.00 C ATOM 0 H ALA A 58 5.624 -2.457 -9.277 1.00 0.00 H new ATOM 0 HA ALA A 58 3.640 -4.283 -10.400 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.958 -2.719 -12.314 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.866 -1.805 -10.790 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.444 -2.093 -11.561 1.00 0.00 H new ATOM 916 N ALA A 59 6.738 -4.802 -11.142 1.00 0.00 N ATOM 917 CA ALA A 59 7.631 -5.764 -11.850 1.00 0.00 C ATOM 918 C ALA A 59 7.058 -7.182 -11.766 1.00 0.00 C ATOM 919 O ALA A 59 7.376 -8.038 -12.565 1.00 0.00 O ATOM 920 CB ALA A 59 8.956 -5.686 -11.093 1.00 0.00 C ATOM 0 H ALA A 59 7.212 -4.158 -10.509 1.00 0.00 H new ATOM 0 HA ALA A 59 7.740 -5.527 -12.908 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.676 -6.366 -11.549 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.341 -4.667 -11.137 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.798 -5.969 -10.052 1.00 0.00 H new ATOM 926 N ASN A 60 6.227 -7.434 -10.794 1.00 0.00 N ATOM 927 CA ASN A 60 5.640 -8.794 -10.638 1.00 0.00 C ATOM 928 C ASN A 60 4.661 -9.108 -11.772 1.00 0.00 C ATOM 929 O ASN A 60 4.156 -8.221 -12.431 1.00 0.00 O ATOM 930 CB ASN A 60 4.908 -8.734 -9.302 1.00 0.00 C ATOM 931 CG ASN A 60 5.898 -8.991 -8.168 1.00 0.00 C ATOM 932 OD1 ASN A 60 6.432 -8.064 -7.594 1.00 0.00 O ATOM 933 ND2 ASN A 60 6.174 -10.219 -7.824 1.00 0.00 N ATOM 0 H ASN A 60 5.927 -6.752 -10.097 1.00 0.00 H new ATOM 0 HA ASN A 60 6.399 -9.576 -10.670 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.439 -7.758 -9.176 1.00 0.00 H new ATOM 0 HB3 ASN A 60 4.110 -9.477 -9.278 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.839 -10.401 -7.072 1.00 0.00 H new ATOM 0 HD22 ASN A 60 5.725 -10.997 -8.307 1.00 0.00 H new ATOM 940 N PRO A 61 4.430 -10.378 -11.950 1.00 0.00 N ATOM 941 CA PRO A 61 3.501 -10.853 -13.001 1.00 0.00 C ATOM 942 C PRO A 61 2.045 -10.606 -12.591 1.00 0.00 C ATOM 943 O PRO A 61 1.422 -9.652 -13.013 1.00 0.00 O ATOM 944 CB PRO A 61 3.796 -12.349 -13.091 1.00 0.00 C ATOM 945 CG PRO A 61 4.369 -12.719 -11.756 1.00 0.00 C ATOM 946 CD PRO A 61 5.021 -11.483 -11.189 1.00 0.00 C ATOM 0 HA PRO A 61 3.635 -10.338 -13.952 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.890 -12.917 -13.301 1.00 0.00 H new ATOM 0 HB3 PRO A 61 4.500 -12.564 -13.895 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.586 -13.081 -11.089 1.00 0.00 H new ATOM 0 HG3 PRO A 61 5.097 -13.524 -11.860 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.822 -11.382 -10.122 1.00 0.00 H new ATOM 0 HD3 PRO A 61 6.104 -11.514 -11.309 1.00 0.00 H new ATOM 954 N SER A 62 1.498 -11.471 -11.787 1.00 0.00 N ATOM 955 CA SER A 62 0.079 -11.310 -11.357 1.00 0.00 C ATOM 956 C SER A 62 -0.038 -10.341 -10.171 1.00 0.00 C ATOM 957 O SER A 62 -1.034 -10.325 -9.474 1.00 0.00 O ATOM 958 CB SER A 62 -0.364 -12.717 -10.954 1.00 0.00 C ATOM 959 OG SER A 62 0.562 -13.667 -11.472 1.00 0.00 O ATOM 0 H SER A 62 1.974 -12.289 -11.406 1.00 0.00 H new ATOM 0 HA SER A 62 -0.541 -10.889 -12.149 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.416 -12.797 -9.868 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.364 -12.920 -11.337 1.00 0.00 H new ATOM 0 HG SER A 62 0.283 -14.570 -11.214 1.00 0.00 H new ATOM 965 N PHE A 63 0.956 -9.523 -9.942 1.00 0.00 N ATOM 966 CA PHE A 63 0.870 -8.554 -8.807 1.00 0.00 C ATOM 967 C PHE A 63 -0.409 -7.719 -8.924 1.00 0.00 C ATOM 968 O PHE A 63 -1.111 -7.504 -7.956 1.00 0.00 O ATOM 969 CB PHE A 63 2.128 -7.676 -8.930 1.00 0.00 C ATOM 970 CG PHE A 63 1.837 -6.265 -8.461 1.00 0.00 C ATOM 971 CD1 PHE A 63 1.524 -6.018 -7.123 1.00 0.00 C ATOM 972 CD2 PHE A 63 1.866 -5.206 -9.375 1.00 0.00 C ATOM 973 CE1 PHE A 63 1.243 -4.718 -6.699 1.00 0.00 C ATOM 974 CE2 PHE A 63 1.584 -3.906 -8.952 1.00 0.00 C ATOM 975 CZ PHE A 63 1.273 -3.660 -7.612 1.00 0.00 C ATOM 0 H PHE A 63 1.818 -9.483 -10.486 1.00 0.00 H new ATOM 0 HA PHE A 63 0.828 -9.049 -7.837 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.937 -8.103 -8.337 1.00 0.00 H new ATOM 0 HB3 PHE A 63 2.467 -7.659 -9.966 1.00 0.00 H new ATOM 0 HD1 PHE A 63 1.499 -6.833 -6.415 1.00 0.00 H new ATOM 0 HD2 PHE A 63 2.107 -5.395 -10.411 1.00 0.00 H new ATOM 0 HE1 PHE A 63 1.002 -4.529 -5.663 1.00 0.00 H new ATOM 0 HE2 PHE A 63 1.606 -3.091 -9.660 1.00 0.00 H new ATOM 0 HZ PHE A 63 1.056 -2.655 -7.283 1.00 0.00 H new ATOM 985 N ARG A 64 -0.715 -7.245 -10.097 1.00 0.00 N ATOM 986 CA ARG A 64 -1.945 -6.426 -10.262 1.00 0.00 C ATOM 987 C ARG A 64 -3.154 -7.178 -9.708 1.00 0.00 C ATOM 988 O ARG A 64 -4.003 -6.610 -9.050 1.00 0.00 O ATOM 989 CB ARG A 64 -2.087 -6.221 -11.766 1.00 0.00 C ATOM 990 CG ARG A 64 -1.450 -4.889 -12.155 1.00 0.00 C ATOM 991 CD ARG A 64 0.064 -5.062 -12.304 1.00 0.00 C ATOM 992 NE ARG A 64 0.330 -4.794 -13.744 1.00 0.00 N ATOM 993 CZ ARG A 64 0.306 -5.762 -14.627 1.00 0.00 C ATOM 994 NH1 ARG A 64 0.095 -7.000 -14.264 1.00 0.00 N ATOM 995 NH2 ARG A 64 0.495 -5.487 -15.887 1.00 0.00 N ATOM 0 H ARG A 64 -0.169 -7.389 -10.946 1.00 0.00 H new ATOM 0 HA ARG A 64 -1.885 -5.478 -9.727 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.606 -7.038 -12.303 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.140 -6.230 -12.048 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -1.878 -4.530 -13.091 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -1.666 -4.137 -11.397 1.00 0.00 H new ATOM 0 HD2 ARG A 64 0.608 -4.367 -11.664 1.00 0.00 H new ATOM 0 HD3 ARG A 64 0.378 -6.067 -12.023 1.00 0.00 H new ATOM 0 HE ARG A 64 0.534 -3.842 -14.048 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -0.054 -7.225 -13.280 1.00 0.00 H new ATOM 0 HH12 ARG A 64 0.080 -7.741 -14.964 1.00 0.00 H new ATOM 0 HH21 ARG A 64 0.660 -4.524 -16.180 1.00 0.00 H new ATOM 0 HH22 ARG A 64 0.478 -6.235 -16.580 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.235 -8.455 -9.958 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.386 -9.237 -9.431 1.00 0.00 C ATOM 1011 C ALA A 65 -4.398 -9.143 -7.908 1.00 0.00 C ATOM 1012 O ALA A 65 -5.438 -9.064 -7.287 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.127 -10.674 -9.885 1.00 0.00 C ATOM 0 H ALA A 65 -2.557 -8.988 -10.502 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.349 -8.874 -9.789 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -4.934 -11.317 -9.535 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.081 -10.709 -10.973 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.181 -11.022 -9.471 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.244 -9.145 -7.308 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.176 -9.048 -5.827 1.00 0.00 C ATOM 1021 C VAL A 66 -3.702 -7.686 -5.367 1.00 0.00 C ATOM 1022 O VAL A 66 -4.474 -7.597 -4.433 1.00 0.00 O ATOM 1023 CB VAL A 66 -1.697 -9.187 -5.502 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.497 -9.128 -3.988 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.190 -10.528 -6.036 1.00 0.00 C ATOM 0 H VAL A 66 -2.342 -9.210 -7.781 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.779 -9.806 -5.328 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.141 -8.374 -5.968 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.436 -9.228 -3.757 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.863 -8.173 -3.610 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.049 -9.941 -3.516 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.130 -10.634 -5.806 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.746 -11.340 -5.567 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.333 -10.567 -7.116 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.299 -6.622 -6.014 1.00 0.00 N ATOM 1036 CA VAL A 67 -3.799 -5.282 -5.594 1.00 0.00 C ATOM 1037 C VAL A 67 -5.316 -5.241 -5.766 1.00 0.00 C ATOM 1038 O VAL A 67 -6.036 -4.758 -4.916 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.124 -4.266 -6.514 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.252 -2.874 -5.892 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -1.644 -4.614 -6.671 1.00 0.00 C ATOM 0 H VAL A 67 -2.654 -6.623 -6.804 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.573 -5.065 -4.550 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.603 -4.285 -7.493 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -2.773 -2.140 -6.541 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.306 -2.623 -5.776 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -2.768 -2.866 -4.916 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.167 -3.887 -7.328 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.160 -4.594 -5.695 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.548 -5.610 -7.103 1.00 0.00 H new ATOM 1051 N GLN A 68 -5.814 -5.771 -6.854 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.289 -5.787 -7.057 1.00 0.00 C ATOM 1053 C GLN A 68 -7.923 -6.576 -5.915 1.00 0.00 C ATOM 1054 O GLN A 68 -9.010 -6.280 -5.464 1.00 0.00 O ATOM 1055 CB GLN A 68 -7.504 -6.513 -8.384 1.00 0.00 C ATOM 1056 CG GLN A 68 -6.989 -5.643 -9.528 1.00 0.00 C ATOM 1057 CD GLN A 68 -6.962 -6.461 -10.817 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -7.948 -7.062 -11.194 1.00 0.00 O ATOM 1059 NE2 GLN A 68 -5.860 -6.518 -11.513 1.00 0.00 N ATOM 0 H GLN A 68 -5.265 -6.190 -7.605 1.00 0.00 H new ATOM 0 HA GLN A 68 -7.730 -4.790 -7.073 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -6.982 -7.470 -8.376 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -8.563 -6.729 -8.525 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -7.630 -4.770 -9.652 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -5.989 -5.275 -9.297 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -5.031 -6.014 -11.198 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -5.827 -7.067 -12.372 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.227 -7.576 -5.444 1.00 0.00 N ATOM 1069 CA GLN A 69 -7.753 -8.398 -4.323 1.00 0.00 C ATOM 1070 C GLN A 69 -7.982 -7.508 -3.103 1.00 0.00 C ATOM 1071 O GLN A 69 -8.991 -7.602 -2.436 1.00 0.00 O ATOM 1072 CB GLN A 69 -6.648 -9.419 -4.047 1.00 0.00 C ATOM 1073 CG GLN A 69 -7.267 -10.781 -3.739 1.00 0.00 C ATOM 1074 CD GLN A 69 -6.476 -11.875 -4.459 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -6.066 -12.843 -3.852 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -6.243 -11.758 -5.738 1.00 0.00 N ATOM 0 H GLN A 69 -6.311 -7.858 -5.792 1.00 0.00 H new ATOM 0 HA GLN A 69 -8.704 -8.879 -4.554 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -5.988 -9.496 -4.911 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.037 -9.089 -3.207 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -7.261 -10.961 -2.664 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -8.309 -10.800 -4.059 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -6.588 -10.944 -6.247 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -5.716 -12.480 -6.229 1.00 0.00 H new ATOM 1085 N LEU A 70 -7.058 -6.627 -2.816 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.240 -5.719 -1.650 1.00 0.00 C ATOM 1087 C LEU A 70 -8.512 -4.895 -1.863 1.00 0.00 C ATOM 1088 O LEU A 70 -9.366 -4.806 -1.003 1.00 0.00 O ATOM 1089 CB LEU A 70 -6.004 -4.811 -1.653 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.841 -5.500 -0.936 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.630 -5.555 -1.865 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.470 -4.696 0.310 1.00 0.00 C ATOM 0 H LEU A 70 -6.191 -6.499 -3.337 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.339 -6.252 -0.704 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.720 -4.575 -2.678 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.236 -3.867 -1.161 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.137 -6.511 -0.655 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.802 -6.046 -1.354 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.886 -6.116 -2.764 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.337 -4.542 -2.141 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.642 -5.183 0.824 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.174 -3.689 0.018 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.330 -4.642 0.978 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.642 -4.308 -3.022 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.854 -3.498 -3.335 1.00 0.00 C ATOM 1106 C CYS A 71 -11.110 -4.373 -3.293 1.00 0.00 C ATOM 1107 O CYS A 71 -12.159 -3.951 -2.849 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.617 -2.985 -4.754 1.00 0.00 C ATOM 1109 SG CYS A 71 -8.179 -1.885 -4.769 1.00 0.00 S ATOM 0 H CYS A 71 -7.953 -4.356 -3.773 1.00 0.00 H new ATOM 0 HA CYS A 71 -10.007 -2.691 -2.618 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.454 -3.823 -5.432 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.499 -2.453 -5.111 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.135 -2.529 -4.339 1.00 0.00 H new ATOM 1115 N PHE A 72 -11.016 -5.587 -3.764 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.214 -6.472 -3.757 1.00 0.00 C ATOM 1117 C PHE A 72 -12.754 -6.624 -2.339 1.00 0.00 C ATOM 1118 O PHE A 72 -13.948 -6.624 -2.116 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.728 -7.821 -4.287 1.00 0.00 C ATOM 1120 CG PHE A 72 -12.905 -8.763 -4.378 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -13.406 -9.373 -3.220 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -13.502 -9.020 -5.619 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -14.504 -10.238 -3.303 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -14.600 -9.887 -5.701 1.00 0.00 C ATOM 1125 CZ PHE A 72 -15.101 -10.494 -4.544 1.00 0.00 C ATOM 0 H PHE A 72 -10.168 -6.001 -4.150 1.00 0.00 H new ATOM 0 HA PHE A 72 -13.021 -6.064 -4.365 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.267 -7.697 -5.267 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.965 -8.233 -3.626 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -12.945 -9.176 -2.263 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -13.116 -8.550 -6.512 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -14.890 -10.708 -2.411 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -15.060 -10.087 -6.658 1.00 0.00 H new ATOM 0 HZ PHE A 72 -15.949 -11.160 -4.608 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.886 -6.746 -1.380 1.00 0.00 N ATOM 1136 CA GLU A 73 -12.348 -6.892 0.024 1.00 0.00 C ATOM 1137 C GLU A 73 -12.609 -5.510 0.620 1.00 0.00 C ATOM 1138 O GLU A 73 -13.292 -5.368 1.614 1.00 0.00 O ATOM 1139 CB GLU A 73 -11.185 -7.573 0.739 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.742 -8.789 -0.075 1.00 0.00 C ATOM 1141 CD GLU A 73 -9.607 -9.511 0.653 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -9.329 -9.148 1.783 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -9.034 -10.416 0.067 1.00 0.00 O ATOM 0 H GLU A 73 -10.874 -6.751 -1.507 1.00 0.00 H new ATOM 0 HA GLU A 73 -13.273 -7.462 0.113 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -10.355 -6.876 0.856 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.487 -7.880 1.740 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.583 -9.467 -0.221 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -10.410 -8.475 -1.065 1.00 0.00 H new ATOM 1150 N GLY A 74 -12.067 -4.489 0.016 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.277 -3.116 0.544 1.00 0.00 C ATOM 1152 C GLY A 74 -11.024 -2.657 1.286 1.00 0.00 C ATOM 1153 O GLY A 74 -11.037 -1.665 1.984 1.00 0.00 O ATOM 0 H GLY A 74 -11.487 -4.548 -0.821 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.499 -2.431 -0.274 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.136 -3.101 1.215 1.00 0.00 H new ATOM 1157 N VAL A 75 -9.932 -3.361 1.149 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.701 -2.927 1.862 1.00 0.00 C ATOM 1159 C VAL A 75 -8.005 -1.814 1.067 1.00 0.00 C ATOM 1160 O VAL A 75 -7.103 -2.064 0.292 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.815 -4.176 1.937 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.558 -3.858 2.749 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.580 -5.317 2.619 1.00 0.00 C ATOM 0 H VAL A 75 -9.841 -4.205 0.583 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.914 -2.528 2.854 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.537 -4.479 0.928 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.926 -4.745 2.804 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.008 -3.050 2.267 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.843 -3.553 3.756 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.945 -6.202 2.669 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.861 -5.015 3.628 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.478 -5.547 2.045 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.418 -0.584 1.250 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.772 0.536 0.499 1.00 0.00 C ATOM 1175 C VAL A 76 -6.805 1.292 1.415 1.00 0.00 C ATOM 1176 O VAL A 76 -7.170 1.756 2.475 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.916 1.456 0.060 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.444 2.344 -1.097 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -10.112 0.621 -0.404 1.00 0.00 C ATOM 0 H VAL A 76 -9.169 -0.308 1.882 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.198 0.174 -0.354 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.215 2.077 0.905 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.258 2.998 -1.409 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.598 2.948 -0.770 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.140 1.718 -1.936 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.920 1.284 -0.714 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.814 -0.006 -1.245 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.455 -0.010 0.416 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.572 1.412 1.014 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.570 2.131 1.857 1.00 0.00 C ATOM 1191 C VAL A 77 -3.639 2.954 0.975 1.00 0.00 C ATOM 1192 O VAL A 77 -3.570 2.739 -0.214 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.760 1.027 2.534 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.577 0.378 3.649 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -3.389 -0.034 1.493 1.00 0.00 C ATOM 0 H VAL A 77 -5.210 1.042 0.135 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.048 2.805 2.568 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.857 1.460 2.965 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.987 -0.407 4.123 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.842 1.131 4.391 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.486 -0.054 3.230 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.810 -0.825 1.970 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.298 -0.457 1.065 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.794 0.424 0.703 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.911 3.835 1.594 1.00 0.00 N ATOM 1206 CA PRO A 78 -1.929 4.658 0.849 1.00 0.00 C ATOM 1207 C PRO A 78 -0.842 3.732 0.314 1.00 0.00 C ATOM 1208 O PRO A 78 0.153 3.466 0.961 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.390 5.615 1.905 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.634 4.910 3.195 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.915 4.147 3.022 1.00 0.00 C ATOM 0 HA PRO A 78 -2.337 5.198 -0.005 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.329 5.817 1.756 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.905 6.575 1.872 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.810 4.237 3.433 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.713 5.621 4.018 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.935 3.245 3.634 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.783 4.743 3.304 1.00 0.00 H new ATOM 1219 N ALA A 79 -1.061 3.198 -0.846 1.00 0.00 N ATOM 1220 CA ALA A 79 -0.092 2.238 -1.426 1.00 0.00 C ATOM 1221 C ALA A 79 0.829 2.907 -2.446 1.00 0.00 C ATOM 1222 O ALA A 79 0.391 3.619 -3.328 1.00 0.00 O ATOM 1223 CB ALA A 79 -0.986 1.210 -2.103 1.00 0.00 C ATOM 0 H ALA A 79 -1.879 3.387 -1.425 1.00 0.00 H new ATOM 0 HA ALA A 79 0.573 1.811 -0.675 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.369 0.443 -2.571 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.637 0.749 -1.360 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.594 1.701 -2.863 1.00 0.00 H new ATOM 1229 N ILE A 80 2.104 2.657 -2.339 1.00 0.00 N ATOM 1230 CA ILE A 80 3.071 3.243 -3.306 1.00 0.00 C ATOM 1231 C ILE A 80 3.433 2.174 -4.341 1.00 0.00 C ATOM 1232 O ILE A 80 3.829 1.080 -3.993 1.00 0.00 O ATOM 1233 CB ILE A 80 4.286 3.614 -2.453 1.00 0.00 C ATOM 1234 CG1 ILE A 80 3.852 4.592 -1.357 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.353 4.272 -3.331 1.00 0.00 C ATOM 1236 CD1 ILE A 80 4.855 4.550 -0.199 1.00 0.00 C ATOM 0 H ILE A 80 2.520 2.068 -1.618 1.00 0.00 H new ATOM 0 HA ILE A 80 2.684 4.107 -3.847 1.00 0.00 H new ATOM 0 HB ILE A 80 4.701 2.713 -2.000 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.791 5.602 -1.761 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.856 4.332 -0.998 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.216 4.534 -2.719 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.660 3.577 -4.113 1.00 0.00 H new ATOM 0 HG23 ILE A 80 4.944 5.174 -3.787 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.543 5.247 0.578 1.00 0.00 H new ATOM 0 HD12 ILE A 80 4.894 3.541 0.212 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.843 4.832 -0.563 1.00 0.00 H new ATOM 1248 N VAL A 81 3.291 2.464 -5.608 1.00 0.00 N ATOM 1249 CA VAL A 81 3.620 1.431 -6.632 1.00 0.00 C ATOM 1250 C VAL A 81 5.009 1.690 -7.212 1.00 0.00 C ATOM 1251 O VAL A 81 5.421 2.819 -7.375 1.00 0.00 O ATOM 1252 CB VAL A 81 2.533 1.567 -7.692 1.00 0.00 C ATOM 1253 CG1 VAL A 81 2.651 0.420 -8.695 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.165 1.503 -7.009 1.00 0.00 C ATOM 0 H VAL A 81 2.966 3.359 -5.974 1.00 0.00 H new ATOM 0 HA VAL A 81 3.646 0.422 -6.220 1.00 0.00 H new ATOM 0 HB VAL A 81 2.645 2.517 -8.215 1.00 0.00 H new ATOM 0 HG11 VAL A 81 1.874 0.518 -9.453 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.630 0.454 -9.173 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.534 -0.531 -8.176 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.379 1.599 -7.758 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.060 0.548 -6.494 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.080 2.316 -6.288 1.00 0.00 H new ATOM 1264 N VAL A 82 5.743 0.652 -7.500 1.00 0.00 N ATOM 1265 CA VAL A 82 7.121 0.842 -8.037 1.00 0.00 C ATOM 1266 C VAL A 82 7.241 0.335 -9.476 1.00 0.00 C ATOM 1267 O VAL A 82 6.439 -0.450 -9.941 1.00 0.00 O ATOM 1268 CB VAL A 82 8.006 -0.004 -7.126 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.476 0.310 -7.402 1.00 0.00 C ATOM 1270 CG2 VAL A 82 7.677 0.298 -5.665 1.00 0.00 C ATOM 0 H VAL A 82 5.450 -0.318 -7.387 1.00 0.00 H new ATOM 0 HA VAL A 82 7.398 1.896 -8.055 1.00 0.00 H new ATOM 0 HB VAL A 82 7.822 -1.060 -7.323 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.106 -0.295 -6.750 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.707 0.083 -8.443 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.665 1.366 -7.210 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.310 -0.308 -5.017 1.00 0.00 H new ATOM 0 HG22 VAL A 82 7.855 1.354 -5.463 1.00 0.00 H new ATOM 0 HG23 VAL A 82 6.630 0.063 -5.472 1.00 0.00 H new ATOM 1280 N GLY A 83 8.262 0.765 -10.169 1.00 0.00 N ATOM 1281 CA GLY A 83 8.474 0.298 -11.569 1.00 0.00 C ATOM 1282 C GLY A 83 7.465 0.947 -12.517 1.00 0.00 C ATOM 1283 O GLY A 83 7.241 0.471 -13.611 1.00 0.00 O ATOM 0 H GLY A 83 8.961 1.423 -9.823 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.488 0.540 -11.888 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.376 -0.787 -11.614 1.00 0.00 H new ATOM 1287 N ASP A 84 6.862 2.031 -12.122 1.00 0.00 N ATOM 1288 CA ASP A 84 5.881 2.697 -13.027 1.00 0.00 C ATOM 1289 C ASP A 84 6.529 3.908 -13.699 1.00 0.00 C ATOM 1290 O ASP A 84 6.888 4.871 -13.049 1.00 0.00 O ATOM 1291 CB ASP A 84 4.732 3.136 -12.117 1.00 0.00 C ATOM 1292 CG ASP A 84 3.680 3.883 -12.942 1.00 0.00 C ATOM 1293 OD1 ASP A 84 2.784 3.231 -13.454 1.00 0.00 O ATOM 1294 OD2 ASP A 84 3.788 5.093 -13.047 1.00 0.00 O ATOM 0 H ASP A 84 7.003 2.484 -11.219 1.00 0.00 H new ATOM 0 HA ASP A 84 5.536 2.037 -13.823 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.282 2.267 -11.637 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.110 3.779 -11.322 1.00 0.00 H new ATOM 1299 N ARG A 85 6.686 3.876 -14.995 1.00 0.00 N ATOM 1300 CA ARG A 85 7.315 5.037 -15.682 1.00 0.00 C ATOM 1301 C ARG A 85 6.412 6.263 -15.570 1.00 0.00 C ATOM 1302 O ARG A 85 5.211 6.150 -15.431 1.00 0.00 O ATOM 1303 CB ARG A 85 7.463 4.628 -17.146 1.00 0.00 C ATOM 1304 CG ARG A 85 8.576 3.587 -17.292 1.00 0.00 C ATOM 1305 CD ARG A 85 9.048 3.558 -18.750 1.00 0.00 C ATOM 1306 NE ARG A 85 9.676 2.219 -18.941 1.00 0.00 N ATOM 1307 CZ ARG A 85 10.886 1.993 -18.507 1.00 0.00 C ATOM 1308 NH1 ARG A 85 11.529 2.923 -17.853 1.00 0.00 N ATOM 1309 NH2 ARG A 85 11.451 0.834 -18.717 1.00 0.00 N ATOM 0 H ARG A 85 6.409 3.104 -15.601 1.00 0.00 H new ATOM 0 HA ARG A 85 8.277 5.294 -15.238 1.00 0.00 H new ATOM 0 HB2 ARG A 85 6.522 4.220 -17.514 1.00 0.00 H new ATOM 0 HB3 ARG A 85 7.691 5.503 -17.755 1.00 0.00 H new ATOM 0 HG2 ARG A 85 9.408 3.832 -16.632 1.00 0.00 H new ATOM 0 HG3 ARG A 85 8.212 2.603 -16.995 1.00 0.00 H new ATOM 0 HD2 ARG A 85 8.213 3.701 -19.435 1.00 0.00 H new ATOM 0 HD3 ARG A 85 9.762 4.358 -18.947 1.00 0.00 H new ATOM 0 HE ARG A 85 9.158 1.477 -19.412 1.00 0.00 H new ATOM 0 HH11 ARG A 85 11.085 3.825 -17.682 1.00 0.00 H new ATOM 0 HH12 ARG A 85 12.475 2.747 -17.514 1.00 0.00 H new ATOM 0 HH21 ARG A 85 10.946 0.104 -19.221 1.00 0.00 H new ATOM 0 HH22 ARG A 85 12.397 0.659 -18.377 1.00 0.00 H new ATOM 1323 N ASP A 86 6.982 7.429 -15.630 1.00 0.00 N ATOM 1324 CA ASP A 86 6.160 8.666 -15.529 1.00 0.00 C ATOM 1325 C ASP A 86 5.627 9.059 -16.913 1.00 0.00 C ATOM 1326 O ASP A 86 6.188 9.899 -17.589 1.00 0.00 O ATOM 1327 CB ASP A 86 7.130 9.722 -15.003 1.00 0.00 C ATOM 1328 CG ASP A 86 6.357 10.976 -14.594 1.00 0.00 C ATOM 1329 OD1 ASP A 86 5.142 10.965 -14.713 1.00 0.00 O ATOM 1330 OD2 ASP A 86 6.993 11.926 -14.169 1.00 0.00 O ATOM 0 H ASP A 86 7.984 7.582 -15.745 1.00 0.00 H new ATOM 0 HA ASP A 86 5.291 8.545 -14.882 1.00 0.00 H new ATOM 0 HB2 ASP A 86 7.682 9.329 -14.149 1.00 0.00 H new ATOM 0 HB3 ASP A 86 7.864 9.970 -15.770 1.00 0.00 H new ATOM 1335 N SER A 87 4.548 8.455 -17.338 1.00 0.00 N ATOM 1336 CA SER A 87 3.976 8.789 -18.677 1.00 0.00 C ATOM 1337 C SER A 87 2.466 9.037 -18.562 1.00 0.00 C ATOM 1338 O SER A 87 1.724 8.190 -18.107 1.00 0.00 O ATOM 1339 CB SER A 87 4.248 7.553 -19.539 1.00 0.00 C ATOM 1340 OG SER A 87 5.562 7.632 -20.077 1.00 0.00 O ATOM 0 H SER A 87 4.037 7.744 -16.815 1.00 0.00 H new ATOM 0 HA SER A 87 4.416 9.692 -19.101 1.00 0.00 H new ATOM 0 HB2 SER A 87 4.142 6.648 -18.940 1.00 0.00 H new ATOM 0 HB3 SER A 87 3.517 7.490 -20.345 1.00 0.00 H new ATOM 0 HG SER A 87 5.738 6.841 -20.628 1.00 0.00 H new ATOM 1346 N GLU A 88 2.004 10.191 -18.976 1.00 0.00 N ATOM 1347 CA GLU A 88 0.542 10.487 -18.892 1.00 0.00 C ATOM 1348 C GLU A 88 -0.228 9.679 -19.946 1.00 0.00 C ATOM 1349 O GLU A 88 -1.440 9.722 -20.011 1.00 0.00 O ATOM 1350 CB GLU A 88 0.419 11.993 -19.157 1.00 0.00 C ATOM 1351 CG GLU A 88 0.661 12.292 -20.639 1.00 0.00 C ATOM 1352 CD GLU A 88 0.692 13.809 -20.852 1.00 0.00 C ATOM 1353 OE1 GLU A 88 0.706 14.526 -19.865 1.00 0.00 O ATOM 1354 OE2 GLU A 88 0.698 14.227 -21.998 1.00 0.00 O ATOM 0 H GLU A 88 2.576 10.939 -19.368 1.00 0.00 H new ATOM 0 HA GLU A 88 0.122 10.215 -17.924 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.572 12.341 -18.866 1.00 0.00 H new ATOM 0 HB3 GLU A 88 1.140 12.537 -18.547 1.00 0.00 H new ATOM 0 HG2 GLU A 88 1.603 11.849 -20.962 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -0.126 11.844 -21.245 1.00 0.00 H new ATOM 1361 N ASP A 89 0.471 8.937 -20.765 1.00 0.00 N ATOM 1362 CA ASP A 89 -0.213 8.115 -21.811 1.00 0.00 C ATOM 1363 C ASP A 89 -1.127 7.075 -21.149 1.00 0.00 C ATOM 1364 O ASP A 89 -0.698 6.353 -20.270 1.00 0.00 O ATOM 1365 CB ASP A 89 0.931 7.422 -22.556 1.00 0.00 C ATOM 1366 CG ASP A 89 0.386 6.648 -23.757 1.00 0.00 C ATOM 1367 OD1 ASP A 89 -0.822 6.570 -23.888 1.00 0.00 O ATOM 1368 OD2 ASP A 89 1.188 6.144 -24.523 1.00 0.00 O ATOM 0 H ASP A 89 1.488 8.864 -20.756 1.00 0.00 H new ATOM 0 HA ASP A 89 -0.839 8.712 -22.473 1.00 0.00 H new ATOM 0 HB2 ASP A 89 1.658 8.162 -22.890 1.00 0.00 H new ATOM 0 HB3 ASP A 89 1.454 6.743 -21.883 1.00 0.00 H new ATOM 1373 N PRO A 90 -2.359 7.031 -21.588 1.00 0.00 N ATOM 1374 CA PRO A 90 -3.329 6.066 -21.023 1.00 0.00 C ATOM 1375 C PRO A 90 -3.193 4.700 -21.702 1.00 0.00 C ATOM 1376 O PRO A 90 -3.502 3.676 -21.125 1.00 0.00 O ATOM 1377 CB PRO A 90 -4.679 6.690 -21.356 1.00 0.00 C ATOM 1378 CG PRO A 90 -4.440 7.543 -22.565 1.00 0.00 C ATOM 1379 CD PRO A 90 -2.965 7.869 -22.629 1.00 0.00 C ATOM 0 HA PRO A 90 -3.184 5.893 -19.957 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -5.426 5.923 -21.559 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.052 7.286 -20.523 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -4.753 7.019 -23.468 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.029 8.458 -22.507 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -2.551 7.643 -23.612 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -2.784 8.927 -22.442 1.00 0.00 H new ATOM 1387 N ASP A 91 -2.745 4.675 -22.928 1.00 0.00 N ATOM 1388 CA ASP A 91 -2.604 3.370 -23.640 1.00 0.00 C ATOM 1389 C ASP A 91 -1.700 2.424 -22.844 1.00 0.00 C ATOM 1390 O ASP A 91 -1.967 1.244 -22.738 1.00 0.00 O ATOM 1391 CB ASP A 91 -1.958 3.713 -24.982 1.00 0.00 C ATOM 1392 CG ASP A 91 -2.904 4.593 -25.797 1.00 0.00 C ATOM 1393 OD1 ASP A 91 -4.011 4.825 -25.341 1.00 0.00 O ATOM 1394 OD2 ASP A 91 -2.504 5.019 -26.868 1.00 0.00 O ATOM 0 H ASP A 91 -2.471 5.497 -23.466 1.00 0.00 H new ATOM 0 HA ASP A 91 -3.563 2.868 -23.764 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -1.013 4.231 -24.820 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -1.731 2.800 -25.532 1.00 0.00 H new ATOM 1399 N GLU A 92 -0.638 2.932 -22.282 1.00 0.00 N ATOM 1400 CA GLU A 92 0.281 2.058 -21.492 1.00 0.00 C ATOM 1401 C GLU A 92 -0.438 1.514 -20.253 1.00 0.00 C ATOM 1402 O GLU A 92 -1.186 2.222 -19.609 1.00 0.00 O ATOM 1403 CB GLU A 92 1.433 2.972 -21.079 1.00 0.00 C ATOM 1404 CG GLU A 92 2.180 3.459 -22.325 1.00 0.00 C ATOM 1405 CD GLU A 92 3.631 2.972 -22.278 1.00 0.00 C ATOM 1406 OE1 GLU A 92 3.953 2.206 -21.384 1.00 0.00 O ATOM 1407 OE2 GLU A 92 4.395 3.373 -23.138 1.00 0.00 O ATOM 0 H GLU A 92 -0.365 3.913 -22.334 1.00 0.00 H new ATOM 0 HA GLU A 92 0.624 1.196 -22.064 1.00 0.00 H new ATOM 0 HB2 GLU A 92 1.050 3.824 -20.517 1.00 0.00 H new ATOM 0 HB3 GLU A 92 2.116 2.436 -20.420 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.690 3.086 -23.224 1.00 0.00 H new ATOM 0 HG3 GLU A 92 2.153 4.547 -22.375 1.00 0.00 H new ATOM 1414 N PRO A 93 -0.189 0.262 -19.966 1.00 0.00 N ATOM 1415 CA PRO A 93 -0.824 -0.399 -18.799 1.00 0.00 C ATOM 1416 C PRO A 93 -0.110 -0.027 -17.490 1.00 0.00 C ATOM 1417 O PRO A 93 0.244 -0.884 -16.705 1.00 0.00 O ATOM 1418 CB PRO A 93 -0.653 -1.883 -19.099 1.00 0.00 C ATOM 1419 CG PRO A 93 0.539 -1.974 -20.001 1.00 0.00 C ATOM 1420 CD PRO A 93 0.695 -0.646 -20.702 1.00 0.00 C ATOM 0 HA PRO A 93 -1.864 -0.102 -18.663 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -0.497 -2.453 -18.183 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -1.542 -2.291 -19.581 1.00 0.00 H new ATOM 0 HG2 PRO A 93 1.435 -2.209 -19.426 1.00 0.00 H new ATOM 0 HG3 PRO A 93 0.407 -2.776 -20.728 1.00 0.00 H new ATOM 0 HD2 PRO A 93 1.729 -0.302 -20.675 1.00 0.00 H new ATOM 0 HD3 PRO A 93 0.409 -0.715 -21.752 1.00 0.00 H new ATOM 1428 N ALA A 94 0.098 1.236 -17.243 1.00 0.00 N ATOM 1429 CA ALA A 94 0.782 1.641 -15.978 1.00 0.00 C ATOM 1430 C ALA A 94 0.086 2.855 -15.353 1.00 0.00 C ATOM 1431 O ALA A 94 0.656 3.923 -15.240 1.00 0.00 O ATOM 1432 CB ALA A 94 2.213 1.989 -16.391 1.00 0.00 C ATOM 0 H ALA A 94 -0.173 2.004 -17.857 1.00 0.00 H new ATOM 0 HA ALA A 94 0.757 0.850 -15.229 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.780 2.297 -15.513 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.685 1.115 -16.840 1.00 0.00 H new ATOM 0 HB3 ALA A 94 2.195 2.803 -17.115 1.00 0.00 H new ATOM 1438 N LYS A 95 -1.142 2.693 -14.938 1.00 0.00 N ATOM 1439 CA LYS A 95 -1.876 3.833 -14.313 1.00 0.00 C ATOM 1440 C LYS A 95 -2.526 3.392 -12.990 1.00 0.00 C ATOM 1441 O LYS A 95 -1.979 2.593 -12.257 1.00 0.00 O ATOM 1442 CB LYS A 95 -2.939 4.243 -15.339 1.00 0.00 C ATOM 1443 CG LYS A 95 -4.048 3.191 -15.374 1.00 0.00 C ATOM 1444 CD LYS A 95 -4.943 3.414 -16.591 1.00 0.00 C ATOM 1445 CE LYS A 95 -6.222 2.590 -16.423 1.00 0.00 C ATOM 1446 NZ LYS A 95 -6.685 2.312 -17.808 1.00 0.00 N ATOM 0 H LYS A 95 -1.669 1.822 -15.004 1.00 0.00 H new ATOM 0 HA LYS A 95 -1.213 4.664 -14.071 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -3.355 5.216 -15.078 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -2.487 4.343 -16.326 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -3.612 2.193 -15.411 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -4.641 3.246 -14.461 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.186 4.472 -16.691 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.421 3.119 -17.502 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -6.027 1.666 -15.879 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -6.975 3.140 -15.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -7.559 1.750 -17.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -6.869 3.210 -18.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -5.951 1.781 -18.319 1.00 0.00 H new ATOM 1460 N GLU A 96 -3.681 3.923 -12.675 1.00 0.00 N ATOM 1461 CA GLU A 96 -4.365 3.555 -11.394 1.00 0.00 C ATOM 1462 C GLU A 96 -4.892 2.111 -11.430 1.00 0.00 C ATOM 1463 O GLU A 96 -5.374 1.603 -10.443 1.00 0.00 O ATOM 1464 CB GLU A 96 -5.534 4.538 -11.270 1.00 0.00 C ATOM 1465 CG GLU A 96 -5.005 5.975 -11.226 1.00 0.00 C ATOM 1466 CD GLU A 96 -6.183 6.957 -11.275 1.00 0.00 C ATOM 1467 OE1 GLU A 96 -7.285 6.549 -10.945 1.00 0.00 O ATOM 1468 OE2 GLU A 96 -5.961 8.099 -11.643 1.00 0.00 O ATOM 0 H GLU A 96 -4.183 4.598 -13.251 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.678 3.610 -10.550 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -6.213 4.417 -12.114 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -6.106 4.324 -10.367 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.425 6.132 -10.317 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -4.335 6.153 -12.067 1.00 0.00 H new ATOM 1475 N GLN A 97 -4.814 1.449 -12.549 1.00 0.00 N ATOM 1476 CA GLN A 97 -5.324 0.045 -12.614 1.00 0.00 C ATOM 1477 C GLN A 97 -4.542 -0.852 -11.650 1.00 0.00 C ATOM 1478 O GLN A 97 -5.003 -1.905 -11.253 1.00 0.00 O ATOM 1479 CB GLN A 97 -5.105 -0.405 -14.062 1.00 0.00 C ATOM 1480 CG GLN A 97 -3.627 -0.738 -14.287 1.00 0.00 C ATOM 1481 CD GLN A 97 -3.366 -1.005 -15.777 1.00 0.00 C ATOM 1482 OE1 GLN A 97 -2.276 -1.389 -16.149 1.00 0.00 O ATOM 1483 NE2 GLN A 97 -4.318 -0.812 -16.652 1.00 0.00 N ATOM 0 H GLN A 97 -4.423 1.813 -13.418 1.00 0.00 H new ATOM 0 HA GLN A 97 -6.374 -0.018 -12.327 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -5.720 -1.279 -14.277 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -5.418 0.382 -14.748 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -3.004 0.088 -13.943 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -3.350 -1.613 -13.699 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -5.236 -0.489 -16.345 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -4.143 -0.984 -17.642 1.00 0.00 H new ATOM 1492 N LEU A 98 -3.365 -0.440 -11.267 1.00 0.00 N ATOM 1493 CA LEU A 98 -2.556 -1.261 -10.329 1.00 0.00 C ATOM 1494 C LEU A 98 -3.258 -1.329 -8.978 1.00 0.00 C ATOM 1495 O LEU A 98 -3.376 -2.377 -8.380 1.00 0.00 O ATOM 1496 CB LEU A 98 -1.219 -0.524 -10.213 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.447 -0.661 -11.527 1.00 0.00 C ATOM 1498 CD1 LEU A 98 0.937 -0.030 -11.378 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.300 -2.144 -11.872 1.00 0.00 C ATOM 0 H LEU A 98 -2.929 0.433 -11.565 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.419 -2.287 -10.672 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.390 0.529 -9.987 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.634 -0.936 -9.390 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.989 -0.152 -12.324 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.485 -0.129 -12.315 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.831 1.026 -11.130 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.484 -0.536 -10.583 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.249 -2.247 -12.808 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.243 -2.651 -11.074 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.288 -2.592 -11.980 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.738 -0.211 -8.509 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.454 -0.177 -7.202 1.00 0.00 C ATOM 1513 C TYR A 99 -5.521 0.926 -7.245 1.00 0.00 C ATOM 1514 O TYR A 99 -6.032 1.260 -8.291 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.363 0.141 -6.169 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.750 -0.349 -4.783 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -5.044 -0.828 -4.517 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.799 -0.315 -3.755 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.376 -1.267 -3.226 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -3.132 -0.754 -2.470 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.418 -1.228 -2.206 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.740 -1.660 -0.936 1.00 0.00 O ATOM 0 H TYR A 99 -3.664 0.691 -8.980 1.00 0.00 H new ATOM 0 HA TYR A 99 -4.966 -1.109 -6.962 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.426 -0.325 -6.473 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.189 1.217 -6.141 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -5.782 -0.858 -5.305 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.803 0.052 -3.956 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.370 -1.635 -3.020 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.394 -0.726 -1.682 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.715 -1.701 -0.842 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.859 1.503 -6.131 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.882 2.592 -6.143 1.00 0.00 C ATOM 1534 C HIS A 100 -6.336 3.808 -6.898 1.00 0.00 C ATOM 1535 O HIS A 100 -5.206 3.816 -7.342 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.138 2.939 -4.674 1.00 0.00 C ATOM 1537 CG HIS A 100 -5.835 3.057 -3.931 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -4.595 2.990 -4.575 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -5.552 3.200 -2.594 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -3.637 3.083 -3.634 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.183 3.213 -2.442 1.00 0.00 N ATOM 0 H HIS A 100 -5.476 1.273 -5.214 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.801 2.285 -6.642 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -7.690 3.877 -4.605 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -7.758 2.170 -4.214 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -6.278 3.287 -1.799 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -2.575 3.055 -3.828 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.679 3.307 -1.560 1.00 0.00 H new ATOM 1549 N SER A 101 -7.129 4.830 -7.059 1.00 0.00 N ATOM 1550 CA SER A 101 -6.651 6.034 -7.801 1.00 0.00 C ATOM 1551 C SER A 101 -5.673 6.854 -6.952 1.00 0.00 C ATOM 1552 O SER A 101 -5.063 7.789 -7.429 1.00 0.00 O ATOM 1553 CB SER A 101 -7.914 6.842 -8.084 1.00 0.00 C ATOM 1554 OG SER A 101 -8.291 7.545 -6.908 1.00 0.00 O ATOM 0 H SER A 101 -8.086 4.886 -6.710 1.00 0.00 H new ATOM 0 HA SER A 101 -6.115 5.763 -8.711 1.00 0.00 H new ATOM 0 HB2 SER A 101 -7.737 7.543 -8.900 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.720 6.180 -8.401 1.00 0.00 H new ATOM 0 HG SER A 101 -9.205 7.883 -7.008 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.520 6.525 -5.698 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.583 7.308 -4.837 1.00 0.00 C ATOM 1562 C ALA A 102 -3.180 6.695 -4.865 1.00 0.00 C ATOM 1563 O ALA A 102 -2.197 7.368 -4.630 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.178 7.227 -3.432 1.00 0.00 C ATOM 0 H ALA A 102 -5.999 5.754 -5.233 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.477 8.337 -5.179 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.546 7.780 -2.737 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.179 7.660 -3.435 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.235 6.184 -3.120 1.00 0.00 H new ATOM 1570 N GLU A 103 -3.083 5.421 -5.138 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.749 4.754 -5.173 1.00 0.00 C ATOM 1572 C GLU A 103 -0.684 5.677 -5.774 1.00 0.00 C ATOM 1573 O GLU A 103 -0.814 6.151 -6.885 1.00 0.00 O ATOM 1574 CB GLU A 103 -1.946 3.506 -6.056 1.00 0.00 C ATOM 1575 CG GLU A 103 -1.739 3.851 -7.539 1.00 0.00 C ATOM 1576 CD GLU A 103 -1.904 2.589 -8.386 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -1.940 1.515 -7.811 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -1.989 2.718 -9.596 1.00 0.00 O ATOM 0 H GLU A 103 -3.875 4.811 -5.339 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.401 4.499 -4.172 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -1.243 2.728 -5.757 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.948 3.104 -5.908 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -2.459 4.607 -7.851 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -0.746 4.275 -7.689 1.00 0.00 H new ATOM 1585 N LEU A 104 0.380 5.918 -5.061 1.00 0.00 N ATOM 1586 CA LEU A 104 1.454 6.779 -5.622 1.00 0.00 C ATOM 1587 C LEU A 104 2.401 5.903 -6.434 1.00 0.00 C ATOM 1588 O LEU A 104 2.517 4.719 -6.194 1.00 0.00 O ATOM 1589 CB LEU A 104 2.183 7.388 -4.426 1.00 0.00 C ATOM 1590 CG LEU A 104 1.772 8.854 -4.273 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.341 8.929 -3.743 1.00 0.00 C ATOM 1592 CD2 LEU A 104 2.715 9.556 -3.291 1.00 0.00 C ATOM 0 H LEU A 104 0.551 5.559 -4.122 1.00 0.00 H new ATOM 0 HA LEU A 104 1.064 7.562 -6.273 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.942 6.835 -3.519 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.261 7.314 -4.567 1.00 0.00 H new ATOM 0 HG LEU A 104 1.829 9.347 -5.244 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.048 9.973 -3.634 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.333 8.434 -4.443 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.286 8.433 -2.774 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.419 10.600 -3.185 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.662 9.063 -2.320 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.736 9.505 -3.668 1.00 0.00 H new ATOM 1604 N HIS A 105 3.072 6.456 -7.393 1.00 0.00 N ATOM 1605 CA HIS A 105 3.995 5.619 -8.205 1.00 0.00 C ATOM 1606 C HIS A 105 5.441 6.007 -7.915 1.00 0.00 C ATOM 1607 O HIS A 105 5.774 7.168 -7.795 1.00 0.00 O ATOM 1608 CB HIS A 105 3.620 5.909 -9.647 1.00 0.00 C ATOM 1609 CG HIS A 105 2.126 5.801 -9.801 1.00 0.00 C ATOM 1610 ND1 HIS A 105 1.425 6.517 -10.758 1.00 0.00 N ATOM 1611 CD2 HIS A 105 1.186 5.067 -9.120 1.00 0.00 C ATOM 1612 CE1 HIS A 105 0.123 6.203 -10.627 1.00 0.00 C ATOM 1613 NE2 HIS A 105 -0.079 5.323 -9.642 1.00 0.00 N ATOM 0 H HIS A 105 3.026 7.441 -7.652 1.00 0.00 H new ATOM 0 HA HIS A 105 3.910 4.556 -7.980 1.00 0.00 H new ATOM 0 HB2 HIS A 105 3.956 6.907 -9.929 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.118 5.205 -10.314 1.00 0.00 H new ATOM 0 HD1 HIS A 105 1.823 7.164 -11.438 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.396 4.393 -8.303 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -0.663 6.613 -11.243 1.00 0.00 H new ATOM 1621 N LEU A 106 6.301 5.040 -7.778 1.00 0.00 N ATOM 1622 CA LEU A 106 7.718 5.356 -7.466 1.00 0.00 C ATOM 1623 C LEU A 106 8.671 4.637 -8.427 1.00 0.00 C ATOM 1624 O LEU A 106 8.437 3.515 -8.829 1.00 0.00 O ATOM 1625 CB LEU A 106 7.906 4.849 -6.040 1.00 0.00 C ATOM 1626 CG LEU A 106 9.273 5.284 -5.526 1.00 0.00 C ATOM 1627 CD1 LEU A 106 9.420 6.795 -5.713 1.00 0.00 C ATOM 1628 CD2 LEU A 106 9.391 4.932 -4.039 1.00 0.00 C ATOM 0 H LEU A 106 6.084 4.047 -7.868 1.00 0.00 H new ATOM 0 HA LEU A 106 7.937 6.419 -7.569 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.120 5.243 -5.395 1.00 0.00 H new ATOM 0 HB3 LEU A 106 7.824 3.762 -6.015 1.00 0.00 H new ATOM 0 HG LEU A 106 10.059 4.771 -6.080 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.396 7.114 -5.347 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.331 7.041 -6.771 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.638 7.309 -5.154 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.368 5.242 -3.668 1.00 0.00 H new ATOM 0 HD22 LEU A 106 8.610 5.448 -3.480 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.279 3.856 -3.910 1.00 0.00 H new ATOM 1640 N GLY A 107 9.747 5.280 -8.797 1.00 0.00 N ATOM 1641 CA GLY A 107 10.718 4.640 -9.733 1.00 0.00 C ATOM 1642 C GLY A 107 11.337 3.404 -9.078 1.00 0.00 C ATOM 1643 O GLY A 107 11.323 3.251 -7.873 1.00 0.00 O ATOM 0 H GLY A 107 9.996 6.221 -8.492 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.213 4.358 -10.657 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.500 5.350 -10.001 1.00 0.00 H new ATOM 1647 N ILE A 108 11.885 2.517 -9.867 1.00 0.00 N ATOM 1648 CA ILE A 108 12.508 1.298 -9.302 1.00 0.00 C ATOM 1649 C ILE A 108 13.647 1.670 -8.348 1.00 0.00 C ATOM 1650 O ILE A 108 13.745 1.155 -7.251 1.00 0.00 O ATOM 1651 CB ILE A 108 13.044 0.565 -10.521 1.00 0.00 C ATOM 1652 CG1 ILE A 108 11.878 0.114 -11.401 1.00 0.00 C ATOM 1653 CG2 ILE A 108 13.831 -0.643 -10.055 1.00 0.00 C ATOM 1654 CD1 ILE A 108 10.904 -0.718 -10.565 1.00 0.00 C ATOM 0 H ILE A 108 11.925 2.591 -10.884 1.00 0.00 H new ATOM 0 HA ILE A 108 11.809 0.694 -8.722 1.00 0.00 H new ATOM 0 HB ILE A 108 13.690 1.226 -11.099 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.367 0.981 -11.819 1.00 0.00 H new ATOM 0 HG13 ILE A 108 12.248 -0.474 -12.241 1.00 0.00 H new ATOM 0 HG21 ILE A 108 14.222 -1.179 -10.920 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.659 -0.317 -9.426 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.179 -1.304 -9.483 1.00 0.00 H new ATOM 0 HD11 ILE A 108 10.072 -1.041 -11.190 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.420 -1.592 -10.168 1.00 0.00 H new ATOM 0 HD13 ILE A 108 10.525 -0.115 -9.740 1.00 0.00 H new ATOM 1666 N HIS A 109 14.506 2.564 -8.754 1.00 0.00 N ATOM 1667 CA HIS A 109 15.630 2.975 -7.865 1.00 0.00 C ATOM 1668 C HIS A 109 15.192 4.148 -6.982 1.00 0.00 C ATOM 1669 O HIS A 109 15.947 4.642 -6.167 1.00 0.00 O ATOM 1670 CB HIS A 109 16.748 3.411 -8.816 1.00 0.00 C ATOM 1671 CG HIS A 109 17.626 2.234 -9.157 1.00 0.00 C ATOM 1672 ND1 HIS A 109 18.900 2.392 -9.688 1.00 0.00 N ATOM 1673 CD2 HIS A 109 17.429 0.879 -9.056 1.00 0.00 C ATOM 1674 CE1 HIS A 109 19.414 1.164 -9.881 1.00 0.00 C ATOM 1675 NE2 HIS A 109 18.558 0.205 -9.512 1.00 0.00 N ATOM 0 H HIS A 109 14.479 3.028 -9.662 1.00 0.00 H new ATOM 0 HA HIS A 109 15.951 2.172 -7.201 1.00 0.00 H new ATOM 0 HB2 HIS A 109 16.319 3.830 -9.726 1.00 0.00 H new ATOM 0 HB3 HIS A 109 17.344 4.197 -8.353 1.00 0.00 H new ATOM 0 HD2 HIS A 109 16.533 0.407 -8.680 1.00 0.00 H new ATOM 0 HE1 HIS A 109 20.398 0.976 -10.285 1.00 0.00 H new ATOM 0 HE2 HIS A 109 18.702 -0.804 -9.555 1.00 0.00 H new ATOM 1683 N GLN A 110 13.977 4.600 -7.143 1.00 0.00 N ATOM 1684 CA GLN A 110 13.486 5.751 -6.322 1.00 0.00 C ATOM 1685 C GLN A 110 12.852 5.255 -5.023 1.00 0.00 C ATOM 1686 O GLN A 110 12.131 5.974 -4.361 1.00 0.00 O ATOM 1687 CB GLN A 110 12.422 6.436 -7.175 1.00 0.00 C ATOM 1688 CG GLN A 110 13.059 7.081 -8.404 1.00 0.00 C ATOM 1689 CD GLN A 110 12.018 7.970 -9.082 1.00 0.00 C ATOM 1690 OE1 GLN A 110 11.252 8.641 -8.417 1.00 0.00 O ATOM 1691 NE2 GLN A 110 11.949 8.009 -10.383 1.00 0.00 N ATOM 0 H GLN A 110 13.301 4.223 -7.807 1.00 0.00 H new ATOM 0 HA GLN A 110 14.302 6.422 -6.054 1.00 0.00 H new ATOM 0 HB2 GLN A 110 11.672 5.709 -7.486 1.00 0.00 H new ATOM 0 HB3 GLN A 110 11.906 7.194 -6.585 1.00 0.00 H new ATOM 0 HG2 GLN A 110 13.929 7.670 -8.114 1.00 0.00 H new ATOM 0 HG3 GLN A 110 13.410 6.314 -9.095 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.589 7.448 -10.945 1.00 0.00 H new ATOM 0 HE22 GLN A 110 11.255 8.601 -10.839 1.00 0.00 H new ATOM 1700 N LEU A 111 13.104 4.035 -4.660 1.00 0.00 N ATOM 1701 CA LEU A 111 12.505 3.490 -3.411 1.00 0.00 C ATOM 1702 C LEU A 111 12.856 4.372 -2.216 1.00 0.00 C ATOM 1703 O LEU A 111 12.093 4.508 -1.281 1.00 0.00 O ATOM 1704 CB LEU A 111 13.129 2.107 -3.271 1.00 0.00 C ATOM 1705 CG LEU A 111 12.689 1.246 -4.449 1.00 0.00 C ATOM 1706 CD1 LEU A 111 13.351 -0.126 -4.354 1.00 0.00 C ATOM 1707 CD2 LEU A 111 11.173 1.085 -4.401 1.00 0.00 C ATOM 0 H LEU A 111 13.701 3.387 -5.174 1.00 0.00 H new ATOM 0 HA LEU A 111 11.416 3.452 -3.448 1.00 0.00 H new ATOM 0 HB2 LEU A 111 14.216 2.185 -3.246 1.00 0.00 H new ATOM 0 HB3 LEU A 111 12.820 1.647 -2.332 1.00 0.00 H new ATOM 0 HG LEU A 111 12.982 1.721 -5.385 1.00 0.00 H new ATOM 0 HD11 LEU A 111 13.036 -0.741 -5.197 1.00 0.00 H new ATOM 0 HD12 LEU A 111 14.435 -0.009 -4.375 1.00 0.00 H new ATOM 0 HD13 LEU A 111 13.056 -0.609 -3.422 1.00 0.00 H new ATOM 0 HD21 LEU A 111 10.846 0.470 -5.240 1.00 0.00 H new ATOM 0 HD22 LEU A 111 10.888 0.604 -3.465 1.00 0.00 H new ATOM 0 HD23 LEU A 111 10.701 2.065 -4.464 1.00 0.00 H new ATOM 1719 N GLU A 112 14.003 4.977 -2.244 1.00 0.00 N ATOM 1720 CA GLU A 112 14.414 5.861 -1.119 1.00 0.00 C ATOM 1721 C GLU A 112 13.350 6.936 -0.872 1.00 0.00 C ATOM 1722 O GLU A 112 13.296 7.540 0.181 1.00 0.00 O ATOM 1723 CB GLU A 112 15.711 6.497 -1.601 1.00 0.00 C ATOM 1724 CG GLU A 112 15.414 7.344 -2.835 1.00 0.00 C ATOM 1725 CD GLU A 112 16.676 7.463 -3.689 1.00 0.00 C ATOM 1726 OE1 GLU A 112 17.617 6.733 -3.426 1.00 0.00 O ATOM 1727 OE2 GLU A 112 16.679 8.283 -4.593 1.00 0.00 O ATOM 0 H GLU A 112 14.681 4.899 -3.002 1.00 0.00 H new ATOM 0 HA GLU A 112 14.536 5.320 -0.181 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.144 7.115 -0.814 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.444 5.726 -1.840 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.611 6.890 -3.416 1.00 0.00 H new ATOM 0 HG3 GLU A 112 15.070 8.334 -2.535 1.00 0.00 H new ATOM 1734 N GLN A 113 12.505 7.177 -1.841 1.00 0.00 N ATOM 1735 CA GLN A 113 11.439 8.211 -1.673 1.00 0.00 C ATOM 1736 C GLN A 113 10.259 7.621 -0.905 1.00 0.00 C ATOM 1737 O GLN A 113 9.365 8.320 -0.482 1.00 0.00 O ATOM 1738 CB GLN A 113 11.023 8.567 -3.097 1.00 0.00 C ATOM 1739 CG GLN A 113 12.155 9.333 -3.781 1.00 0.00 C ATOM 1740 CD GLN A 113 11.813 9.549 -5.253 1.00 0.00 C ATOM 1741 OE1 GLN A 113 10.691 9.873 -5.590 1.00 0.00 O ATOM 1742 NE2 GLN A 113 12.740 9.373 -6.151 1.00 0.00 N ATOM 0 H GLN A 113 12.507 6.702 -2.743 1.00 0.00 H new ATOM 0 HA GLN A 113 11.782 9.082 -1.114 1.00 0.00 H new ATOM 0 HB2 GLN A 113 10.792 7.661 -3.657 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.117 9.172 -3.082 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.307 10.293 -3.288 1.00 0.00 H new ATOM 0 HG3 GLN A 113 13.089 8.778 -3.692 1.00 0.00 H new ATOM 0 HE21 GLN A 113 13.681 9.101 -5.866 1.00 0.00 H new ATOM 0 HE22 GLN A 113 12.525 9.507 -7.139 1.00 0.00 H new ATOM 1751 N LEU A 114 10.255 6.330 -0.725 1.00 0.00 N ATOM 1752 CA LEU A 114 9.140 5.671 0.010 1.00 0.00 C ATOM 1753 C LEU A 114 8.733 6.456 1.262 1.00 0.00 C ATOM 1754 O LEU A 114 7.563 6.686 1.468 1.00 0.00 O ATOM 1755 CB LEU A 114 9.681 4.299 0.385 1.00 0.00 C ATOM 1756 CG LEU A 114 9.558 3.365 -0.816 1.00 0.00 C ATOM 1757 CD1 LEU A 114 10.698 2.346 -0.798 1.00 0.00 C ATOM 1758 CD2 LEU A 114 8.223 2.633 -0.737 1.00 0.00 C ATOM 0 H LEU A 114 10.983 5.698 -1.059 1.00 0.00 H new ATOM 0 HA LEU A 114 8.240 5.614 -0.602 1.00 0.00 H new ATOM 0 HB2 LEU A 114 10.723 4.378 0.694 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.127 3.896 1.233 1.00 0.00 H new ATOM 0 HG LEU A 114 9.612 3.944 -1.738 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.606 1.682 -1.657 1.00 0.00 H new ATOM 0 HD12 LEU A 114 11.654 2.868 -0.844 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.648 1.761 0.120 1.00 0.00 H new ATOM 0 HD21 LEU A 114 8.125 1.963 -1.591 1.00 0.00 H new ATOM 0 HD22 LEU A 114 8.179 2.054 0.186 1.00 0.00 H new ATOM 0 HD23 LEU A 114 7.409 3.358 -0.749 1.00 0.00 H new ATOM 1770 N PRO A 115 9.688 6.849 2.068 1.00 0.00 N ATOM 1771 CA PRO A 115 9.347 7.614 3.293 1.00 0.00 C ATOM 1772 C PRO A 115 8.668 8.929 2.911 1.00 0.00 C ATOM 1773 O PRO A 115 7.600 9.242 3.396 1.00 0.00 O ATOM 1774 CB PRO A 115 10.696 7.810 3.987 1.00 0.00 C ATOM 1775 CG PRO A 115 11.705 7.663 2.897 1.00 0.00 C ATOM 1776 CD PRO A 115 11.134 6.648 1.937 1.00 0.00 C ATOM 0 HA PRO A 115 8.639 7.112 3.953 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.761 8.791 4.458 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.849 7.069 4.772 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.882 8.616 2.398 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.663 7.328 3.295 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.475 6.821 0.916 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.426 5.632 2.203 1.00 0.00 H new ATOM 1784 N TYR A 116 9.242 9.680 2.015 1.00 0.00 N ATOM 1785 CA TYR A 116 8.576 10.940 1.588 1.00 0.00 C ATOM 1786 C TYR A 116 7.316 10.567 0.793 1.00 0.00 C ATOM 1787 O TYR A 116 6.319 11.260 0.817 1.00 0.00 O ATOM 1788 CB TYR A 116 9.636 11.690 0.755 1.00 0.00 C ATOM 1789 CG TYR A 116 9.199 11.884 -0.678 1.00 0.00 C ATOM 1790 CD1 TYR A 116 8.036 12.607 -0.964 1.00 0.00 C ATOM 1791 CD2 TYR A 116 9.968 11.350 -1.717 1.00 0.00 C ATOM 1792 CE1 TYR A 116 7.641 12.797 -2.292 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.574 11.538 -3.046 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.411 12.262 -3.334 1.00 0.00 C ATOM 1795 OH TYR A 116 8.020 12.450 -4.645 1.00 0.00 O ATOM 0 H TYR A 116 10.134 9.479 1.564 1.00 0.00 H new ATOM 0 HA TYR A 116 8.243 11.580 2.405 1.00 0.00 H new ATOM 0 HB2 TYR A 116 9.832 12.662 1.209 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.573 11.134 0.776 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.444 13.018 -0.160 1.00 0.00 H new ATOM 0 HD2 TYR A 116 10.866 10.793 -1.493 1.00 0.00 H new ATOM 0 HE1 TYR A 116 6.744 13.355 -2.515 1.00 0.00 H new ATOM 0 HE2 TYR A 116 10.166 11.125 -3.849 1.00 0.00 H new ATOM 0 HH TYR A 116 8.663 12.016 -5.244 1.00 0.00 H new ATOM 1805 N GLN A 117 7.348 9.447 0.124 1.00 0.00 N ATOM 1806 CA GLN A 117 6.154 8.987 -0.636 1.00 0.00 C ATOM 1807 C GLN A 117 5.094 8.509 0.358 1.00 0.00 C ATOM 1808 O GLN A 117 3.913 8.702 0.169 1.00 0.00 O ATOM 1809 CB GLN A 117 6.648 7.821 -1.498 1.00 0.00 C ATOM 1810 CG GLN A 117 7.435 8.356 -2.699 1.00 0.00 C ATOM 1811 CD GLN A 117 6.461 8.737 -3.817 1.00 0.00 C ATOM 1812 OE1 GLN A 117 5.875 7.881 -4.444 1.00 0.00 O ATOM 1813 NE2 GLN A 117 6.269 9.995 -4.100 1.00 0.00 N ATOM 0 H GLN A 117 8.157 8.827 0.072 1.00 0.00 H new ATOM 0 HA GLN A 117 5.711 9.772 -1.249 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.279 7.160 -0.904 1.00 0.00 H new ATOM 0 HB3 GLN A 117 5.801 7.228 -1.842 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.024 9.224 -2.404 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.136 7.601 -3.054 1.00 0.00 H new ATOM 0 HE21 GLN A 117 6.761 10.717 -3.574 1.00 0.00 H new ATOM 0 HE22 GLN A 117 5.627 10.257 -4.848 1.00 0.00 H new ATOM 1822 N VAL A 118 5.523 7.891 1.425 1.00 0.00 N ATOM 1823 CA VAL A 118 4.558 7.406 2.453 1.00 0.00 C ATOM 1824 C VAL A 118 3.820 8.603 3.059 1.00 0.00 C ATOM 1825 O VAL A 118 2.608 8.625 3.113 1.00 0.00 O ATOM 1826 CB VAL A 118 5.421 6.689 3.501 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.691 6.635 4.848 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.699 5.262 3.026 1.00 0.00 C ATOM 0 H VAL A 118 6.504 7.700 1.630 1.00 0.00 H new ATOM 0 HA VAL A 118 3.799 6.738 2.047 1.00 0.00 H new ATOM 0 HB VAL A 118 6.356 7.236 3.626 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.316 6.124 5.580 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.485 7.649 5.191 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.752 6.094 4.731 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.312 4.745 3.765 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.756 4.730 2.901 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.228 5.292 2.073 1.00 0.00 H new ATOM 1838 N ASP A 119 4.536 9.609 3.494 1.00 0.00 N ATOM 1839 CA ASP A 119 3.850 10.805 4.069 1.00 0.00 C ATOM 1840 C ASP A 119 2.940 11.414 3.005 1.00 0.00 C ATOM 1841 O ASP A 119 1.810 11.777 3.264 1.00 0.00 O ATOM 1842 CB ASP A 119 4.962 11.790 4.441 1.00 0.00 C ATOM 1843 CG ASP A 119 5.874 11.167 5.499 1.00 0.00 C ATOM 1844 OD1 ASP A 119 5.532 11.242 6.667 1.00 0.00 O ATOM 1845 OD2 ASP A 119 6.899 10.626 5.123 1.00 0.00 O ATOM 0 H ASP A 119 5.555 9.654 3.476 1.00 0.00 H new ATOM 0 HA ASP A 119 3.240 10.555 4.937 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.542 12.049 3.555 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.529 12.715 4.821 1.00 0.00 H new ATOM 1850 N ALA A 120 3.428 11.510 1.797 1.00 0.00 N ATOM 1851 CA ALA A 120 2.602 12.075 0.700 1.00 0.00 C ATOM 1852 C ALA A 120 1.484 11.091 0.348 1.00 0.00 C ATOM 1853 O ALA A 120 0.353 11.477 0.122 1.00 0.00 O ATOM 1854 CB ALA A 120 3.567 12.251 -0.473 1.00 0.00 C ATOM 0 H ALA A 120 4.367 11.219 1.526 1.00 0.00 H new ATOM 0 HA ALA A 120 2.127 13.019 0.968 1.00 0.00 H new ATOM 0 HB1 ALA A 120 3.031 12.666 -1.326 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.370 12.929 -0.185 1.00 0.00 H new ATOM 0 HB3 ALA A 120 3.989 11.284 -0.745 1.00 0.00 H new ATOM 1860 N ALA A 121 1.785 9.817 0.310 1.00 0.00 N ATOM 1861 CA ALA A 121 0.730 8.816 -0.014 1.00 0.00 C ATOM 1862 C ALA A 121 -0.349 8.851 1.067 1.00 0.00 C ATOM 1863 O ALA A 121 -1.515 8.637 0.800 1.00 0.00 O ATOM 1864 CB ALA A 121 1.445 7.460 -0.040 1.00 0.00 C ATOM 0 H ALA A 121 2.712 9.431 0.489 1.00 0.00 H new ATOM 0 HA ALA A 121 0.239 9.015 -0.967 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.726 6.674 -0.273 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.226 7.475 -0.800 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.892 7.265 0.935 1.00 0.00 H new ATOM 1870 N LEU A 122 0.025 9.140 2.283 1.00 0.00 N ATOM 1871 CA LEU A 122 -0.997 9.211 3.362 1.00 0.00 C ATOM 1872 C LEU A 122 -1.935 10.383 3.079 1.00 0.00 C ATOM 1873 O LEU A 122 -3.141 10.234 3.054 1.00 0.00 O ATOM 1874 CB LEU A 122 -0.214 9.464 4.654 1.00 0.00 C ATOM 1875 CG LEU A 122 0.627 8.238 5.012 1.00 0.00 C ATOM 1876 CD1 LEU A 122 1.801 8.674 5.892 1.00 0.00 C ATOM 1877 CD2 LEU A 122 -0.233 7.241 5.787 1.00 0.00 C ATOM 0 H LEU A 122 0.985 9.328 2.573 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.596 8.303 3.431 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.432 10.334 4.532 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.904 9.691 5.467 1.00 0.00 H new ATOM 0 HG LEU A 122 0.999 7.771 4.100 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.405 7.804 6.151 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.415 9.393 5.350 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.421 9.136 6.803 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.365 6.366 6.043 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.600 7.710 6.700 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -1.079 6.935 5.172 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.387 11.544 2.850 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.242 12.724 2.554 1.00 0.00 C ATOM 1891 C ALA A 123 -3.081 12.448 1.310 1.00 0.00 C ATOM 1892 O ALA A 123 -4.283 12.631 1.306 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.259 13.861 2.288 1.00 0.00 C ATOM 0 H ALA A 123 -0.383 11.725 2.855 1.00 0.00 H new ATOM 0 HA ALA A 123 -2.929 12.960 3.366 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.811 14.773 2.060 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.641 14.022 3.171 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.623 13.601 1.442 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.459 12.001 0.253 1.00 0.00 N ATOM 1900 CA GLU A 124 -3.235 11.713 -0.982 1.00 0.00 C ATOM 1901 C GLU A 124 -4.334 10.702 -0.675 1.00 0.00 C ATOM 1902 O GLU A 124 -5.446 10.811 -1.155 1.00 0.00 O ATOM 1903 CB GLU A 124 -2.230 11.117 -1.968 1.00 0.00 C ATOM 1904 CG GLU A 124 -2.954 10.806 -3.279 1.00 0.00 C ATOM 1905 CD GLU A 124 -2.243 11.503 -4.439 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -1.207 11.014 -4.854 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -2.750 12.515 -4.895 1.00 0.00 O ATOM 0 H GLU A 124 -1.456 11.825 0.193 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.712 12.607 -1.385 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.413 11.817 -2.144 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -1.789 10.210 -1.556 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.975 9.729 -3.447 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.990 11.140 -3.221 1.00 0.00 H new ATOM 1914 N PHE A 125 -4.038 9.716 0.126 1.00 0.00 N ATOM 1915 CA PHE A 125 -5.077 8.710 0.457 1.00 0.00 C ATOM 1916 C PHE A 125 -6.173 9.338 1.323 1.00 0.00 C ATOM 1917 O PHE A 125 -7.350 9.157 1.080 1.00 0.00 O ATOM 1918 CB PHE A 125 -4.351 7.612 1.224 1.00 0.00 C ATOM 1919 CG PHE A 125 -5.347 6.547 1.594 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -6.190 6.733 2.693 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -5.438 5.381 0.827 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -7.128 5.752 3.028 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -6.375 4.397 1.162 1.00 0.00 C ATOM 1924 CZ PHE A 125 -7.220 4.583 2.263 1.00 0.00 C ATOM 0 H PHE A 125 -3.128 9.567 0.561 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.565 8.322 -0.437 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.553 7.188 0.614 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.884 8.021 2.120 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -6.117 7.634 3.283 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -4.786 5.240 -0.023 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -7.781 5.896 3.876 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.446 3.495 0.572 1.00 0.00 H new ATOM 0 HZ PHE A 125 -7.943 3.824 2.522 1.00 0.00 H new ATOM 1934 N LEU A 126 -5.801 10.070 2.337 1.00 0.00 N ATOM 1935 CA LEU A 126 -6.831 10.695 3.213 1.00 0.00 C ATOM 1936 C LEU A 126 -7.726 11.636 2.399 1.00 0.00 C ATOM 1937 O LEU A 126 -8.930 11.661 2.563 1.00 0.00 O ATOM 1938 CB LEU A 126 -6.034 11.485 4.253 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.299 10.513 5.176 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -4.452 11.299 6.181 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.321 9.658 5.928 1.00 0.00 C ATOM 0 H LEU A 126 -4.833 10.262 2.596 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.486 9.954 3.671 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.320 12.143 3.757 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.703 12.120 4.834 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.649 9.869 4.583 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.929 10.604 6.838 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.725 11.909 5.645 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.099 11.944 6.776 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.800 8.964 6.587 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -6.970 10.303 6.520 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.923 9.097 5.213 1.00 0.00 H new ATOM 1953 N ARG A 127 -7.142 12.413 1.532 1.00 0.00 N ATOM 1954 CA ARG A 127 -7.947 13.367 0.709 1.00 0.00 C ATOM 1955 C ARG A 127 -8.930 12.624 -0.200 1.00 0.00 C ATOM 1956 O ARG A 127 -10.024 13.087 -0.456 1.00 0.00 O ATOM 1957 CB ARG A 127 -6.920 14.129 -0.127 1.00 0.00 C ATOM 1958 CG ARG A 127 -6.103 15.044 0.784 1.00 0.00 C ATOM 1959 CD ARG A 127 -6.007 16.431 0.148 1.00 0.00 C ATOM 1960 NE ARG A 127 -7.342 17.052 0.377 1.00 0.00 N ATOM 1961 CZ ARG A 127 -7.644 17.543 1.549 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -6.784 17.477 2.531 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -8.810 18.095 1.738 1.00 0.00 N ATOM 0 H ARG A 127 -6.138 12.431 1.354 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.548 14.028 1.333 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -6.262 13.429 -0.642 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -7.423 14.717 -0.894 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -6.572 15.113 1.766 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -5.106 14.630 0.935 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -5.213 17.021 0.606 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -5.780 16.363 -0.916 1.00 0.00 H new ATOM 0 HE ARG A 127 -8.021 17.094 -0.383 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -5.874 17.041 2.383 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -7.023 17.861 3.445 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -9.482 18.142 0.972 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -9.050 18.480 2.652 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.551 11.483 -0.699 1.00 0.00 N ATOM 1978 CA LEU A 128 -9.468 10.726 -1.595 1.00 0.00 C ATOM 1979 C LEU A 128 -10.277 9.711 -0.785 1.00 0.00 C ATOM 1980 O LEU A 128 -11.231 9.135 -1.267 1.00 0.00 O ATOM 1981 CB LEU A 128 -8.552 10.016 -2.591 1.00 0.00 C ATOM 1982 CG LEU A 128 -8.985 10.359 -4.019 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -8.575 11.797 -4.348 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -8.315 9.397 -5.007 1.00 0.00 C ATOM 0 H LEU A 128 -7.648 11.042 -0.526 1.00 0.00 H new ATOM 0 HA LEU A 128 -10.186 11.374 -2.097 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.518 10.320 -2.431 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -8.595 8.938 -2.436 1.00 0.00 H new ATOM 0 HG LEU A 128 -10.068 10.263 -4.099 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -8.884 12.040 -5.365 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -9.056 12.481 -3.649 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.493 11.895 -4.264 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.625 9.644 -6.022 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -7.232 9.489 -4.926 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.611 8.374 -4.776 1.00 0.00 H new ATOM 1996 N ALA A 129 -9.902 9.489 0.445 1.00 0.00 N ATOM 1997 CA ALA A 129 -10.652 8.510 1.279 1.00 0.00 C ATOM 1998 C ALA A 129 -12.067 9.030 1.572 1.00 0.00 C ATOM 1999 O ALA A 129 -12.231 10.165 1.970 1.00 0.00 O ATOM 2000 CB ALA A 129 -9.860 8.402 2.577 1.00 0.00 C ATOM 0 H ALA A 129 -9.112 9.941 0.906 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.758 7.548 0.778 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.352 7.696 3.246 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.851 8.053 2.359 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -9.810 9.380 3.055 1.00 0.00 H new ATOM 2006 N PRO A 130 -13.049 8.183 1.379 1.00 0.00 N ATOM 2007 CA PRO A 130 -12.808 6.802 0.891 1.00 0.00 C ATOM 2008 C PRO A 130 -12.397 6.822 -0.583 1.00 0.00 C ATOM 2009 O PRO A 130 -13.104 7.331 -1.432 1.00 0.00 O ATOM 2010 CB PRO A 130 -14.154 6.110 1.077 1.00 0.00 C ATOM 2011 CG PRO A 130 -15.159 7.214 1.070 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.474 8.444 1.606 1.00 0.00 C ATOM 0 HA PRO A 130 -12.003 6.294 1.422 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -14.345 5.397 0.275 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -14.186 5.553 2.013 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.530 7.390 0.060 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -16.020 6.954 1.686 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -14.803 9.343 1.085 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -14.689 8.592 2.664 1.00 0.00 H new ATOM 2020 N VAL A 131 -11.252 6.275 -0.892 1.00 0.00 N ATOM 2021 CA VAL A 131 -10.787 6.264 -2.306 1.00 0.00 C ATOM 2022 C VAL A 131 -11.732 5.421 -3.159 1.00 0.00 C ATOM 2023 O VAL A 131 -12.523 4.651 -2.651 1.00 0.00 O ATOM 2024 CB VAL A 131 -9.397 5.625 -2.267 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -8.694 5.833 -3.612 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -8.567 6.267 -1.152 1.00 0.00 C ATOM 0 H VAL A 131 -10.619 5.835 -0.224 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.763 7.264 -2.739 1.00 0.00 H new ATOM 0 HB VAL A 131 -9.499 4.557 -2.075 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.705 5.377 -3.580 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.282 5.370 -4.405 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.595 6.900 -3.809 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.578 5.810 -1.126 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -8.469 7.336 -1.341 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.063 6.112 -0.194 1.00 0.00 H new ATOM 2036 N GLU A 132 -11.652 5.559 -4.453 1.00 0.00 N ATOM 2037 CA GLU A 132 -12.539 4.760 -5.347 1.00 0.00 C ATOM 2038 C GLU A 132 -11.766 3.573 -5.931 1.00 0.00 C ATOM 2039 O GLU A 132 -10.985 3.722 -6.850 1.00 0.00 O ATOM 2040 CB GLU A 132 -12.963 5.724 -6.457 1.00 0.00 C ATOM 2041 CG GLU A 132 -13.894 6.792 -5.882 1.00 0.00 C ATOM 2042 CD GLU A 132 -14.428 7.664 -7.020 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -13.620 8.248 -7.722 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -15.637 7.733 -7.168 1.00 0.00 O ATOM 0 H GLU A 132 -11.010 6.191 -4.932 1.00 0.00 H new ATOM 0 HA GLU A 132 -13.399 4.351 -4.817 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.085 6.193 -6.900 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.468 5.178 -7.254 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -14.721 6.322 -5.350 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.358 7.406 -5.158 1.00 0.00 H new ATOM 2051 N THR A 133 -11.980 2.395 -5.407 1.00 0.00 N ATOM 2052 CA THR A 133 -11.261 1.197 -5.934 1.00 0.00 C ATOM 2053 C THR A 133 -12.171 0.421 -6.894 1.00 0.00 C ATOM 2054 O THR A 133 -13.285 0.072 -6.558 1.00 0.00 O ATOM 2055 CB THR A 133 -10.935 0.348 -4.702 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.921 0.563 -3.701 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.554 0.726 -4.159 1.00 0.00 C ATOM 0 H THR A 133 -12.622 2.210 -4.636 1.00 0.00 H new ATOM 0 HA THR A 133 -10.362 1.466 -6.488 1.00 0.00 H new ATOM 0 HB THR A 133 -10.930 -0.705 -4.983 1.00 0.00 H new ATOM 0 HG1 THR A 133 -11.712 0.018 -2.914 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.329 0.118 -3.283 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.800 0.549 -4.927 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.548 1.780 -3.881 1.00 0.00 H new ATOM 2065 N MET A 134 -11.713 0.156 -8.092 1.00 0.00 N ATOM 2066 CA MET A 134 -12.570 -0.590 -9.067 1.00 0.00 C ATOM 2067 C MET A 134 -12.628 -2.087 -8.729 1.00 0.00 C ATOM 2068 O MET A 134 -13.657 -2.719 -8.866 1.00 0.00 O ATOM 2069 CB MET A 134 -11.909 -0.387 -10.432 1.00 0.00 C ATOM 2070 CG MET A 134 -11.911 1.096 -10.803 1.00 0.00 C ATOM 2071 SD MET A 134 -11.279 1.279 -12.490 1.00 0.00 S ATOM 2072 CE MET A 134 -11.660 3.036 -12.694 1.00 0.00 C ATOM 0 H MET A 134 -10.790 0.421 -8.436 1.00 0.00 H new ATOM 0 HA MET A 134 -13.597 -0.225 -9.045 1.00 0.00 H new ATOM 0 HB2 MET A 134 -10.886 -0.762 -10.408 1.00 0.00 H new ATOM 0 HB3 MET A 134 -12.441 -0.960 -11.191 1.00 0.00 H new ATOM 0 HG2 MET A 134 -12.921 1.501 -10.733 1.00 0.00 H new ATOM 0 HG3 MET A 134 -11.292 1.660 -10.105 1.00 0.00 H new ATOM 0 HE1 MET A 134 -11.347 3.364 -13.685 1.00 0.00 H new ATOM 0 HE2 MET A 134 -12.733 3.191 -12.583 1.00 0.00 H new ATOM 0 HE3 MET A 134 -11.130 3.614 -11.937 1.00 0.00 H new ATOM 2082 N ALA A 135 -11.536 -2.667 -8.303 1.00 0.00 N ATOM 2083 CA ALA A 135 -11.552 -4.125 -7.983 1.00 0.00 C ATOM 2084 C ALA A 135 -12.080 -4.359 -6.569 1.00 0.00 C ATOM 2085 O ALA A 135 -12.729 -3.469 -6.042 1.00 0.00 O ATOM 2086 CB ALA A 135 -10.095 -4.582 -8.093 1.00 0.00 C ATOM 2087 OXT ALA A 135 -11.828 -5.425 -6.038 1.00 0.00 O ATOM 0 H ALA A 135 -10.641 -2.199 -8.164 1.00 0.00 H new ATOM 0 HA ALA A 135 -12.203 -4.680 -8.659 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -10.030 -5.647 -7.870 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -9.732 -4.400 -9.105 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -9.484 -4.025 -7.383 1.00 0.00 H new TER 2093 ALA A 135