USER MOD reduce.3.24.130724 H: found=0, std=0, add=869, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 872 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 49 GLN : amide:sc= 0.289 K(o=0.59,f=-0.0019) USER MOD Set 1.2: A 51 TYR OH : rot 119:sc= 0.305 USER MOD Set 2.1: A 44 SER OG : rot 133:sc= 0.285 USER MOD Set 2.2: A 131 LYS NZ :NH3+ -120:sc= -0.973 (180deg=-3.92!) USER MOD Single : A 8 TYR OH : rot 180:sc= -0.012 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc=-0.00601 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 CYS SG : rot -22:sc= -0.178 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -169:sc= -2.5 (180deg=-2.88) USER MOD Single : A 45 SER OG : rot 24:sc= 0.0667 USER MOD Single : A 56 ASN : amide:sc= -0.295 K(o=-0.3,f=-2.9!) USER MOD Single : A 57 CYS SG : rot 180:sc= -0.955 USER MOD Single : A 58 MET CE :methyl -158:sc= -0.103 (180deg=-0.687) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot 66:sc= -3.51! USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 170:sc= -4.52! USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= -0.155 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -0.211 X(o=-0.21,f=-0.42) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.0166 K(o=-0.017,f=-0.69) USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 TYR OH : rot -173:sc= 1.25 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 104 SER OG : rot 54:sc= -0.158 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HE2:sc= -2.78 K(o=-2.8,f=-4.1) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.00345 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 CYS SG : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= -0.0388 K(o=-0.039,f=-3.2!) USER MOD Single : A 122 ASN : amide:sc= -3.66! C(o=-3.7!,f=-4.2!) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot -88:sc= -0.102 USER MOD ----------------------------------------------------------------- ATOM 13 N LEU A 2 -6.678 16.858 9.403 1.00 0.00 N ATOM 14 CA LEU A 2 -5.735 15.754 9.441 1.00 0.00 C ATOM 15 C LEU A 2 -5.784 15.093 10.821 1.00 0.00 C ATOM 16 O LEU A 2 -5.869 15.779 11.838 1.00 0.00 O ATOM 17 CB LEU A 2 -4.337 16.227 9.036 1.00 0.00 C ATOM 18 CG LEU A 2 -4.168 16.640 7.573 1.00 0.00 C ATOM 19 CD1 LEU A 2 -4.283 15.430 6.644 1.00 0.00 C ATOM 20 CD2 LEU A 2 -5.156 17.747 7.197 1.00 0.00 C ATOM 0 HA LEU A 2 -6.012 14.993 8.712 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.065 17.074 9.666 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -3.628 15.428 9.252 1.00 0.00 H new ATOM 0 HG LEU A 2 -3.165 17.048 7.448 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -4.159 15.752 5.610 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -3.508 14.705 6.894 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -5.264 14.970 6.766 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -5.014 18.022 6.152 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -6.175 17.390 7.343 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -4.983 18.619 7.828 1.00 0.00 H new ATOM 32 N PRO A 3 -5.727 13.734 10.810 1.00 0.00 N ATOM 33 CA PRO A 3 -5.765 12.974 12.047 1.00 0.00 C ATOM 34 C PRO A 3 -4.427 13.059 12.784 1.00 0.00 C ATOM 35 O PRO A 3 -3.420 13.463 12.205 1.00 0.00 O ATOM 36 CB PRO A 3 -6.124 11.558 11.629 1.00 0.00 C ATOM 37 CG PRO A 3 -5.818 11.473 10.142 1.00 0.00 C ATOM 38 CD PRO A 3 -5.627 12.890 9.624 1.00 0.00 C ATOM 0 HA PRO A 3 -6.496 13.362 12.756 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -5.543 10.826 12.190 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -7.176 11.348 11.824 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -4.920 10.879 9.970 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -6.633 10.979 9.612 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -4.659 13.006 9.136 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -6.388 13.149 8.888 1.00 0.00 H new ATOM 46 N PRO A 4 -4.460 12.660 14.084 1.00 0.00 N ATOM 47 CA PRO A 4 -3.262 12.687 14.905 1.00 0.00 C ATOM 48 C PRO A 4 -2.321 11.537 14.541 1.00 0.00 C ATOM 49 O PRO A 4 -2.763 10.407 14.346 1.00 0.00 O ATOM 50 CB PRO A 4 -3.764 12.612 16.338 1.00 0.00 C ATOM 51 CG PRO A 4 -5.186 12.079 16.252 1.00 0.00 C ATOM 52 CD PRO A 4 -5.633 12.175 14.803 1.00 0.00 C ATOM 0 HA PRO A 4 -2.668 13.588 14.752 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -3.136 11.954 16.938 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -3.742 13.593 16.812 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -5.228 11.046 16.597 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -5.850 12.657 16.895 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -5.957 11.206 14.424 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -6.475 12.858 14.693 1.00 0.00 H new ATOM 60 N PRO A 5 -1.006 11.875 14.457 1.00 0.00 N ATOM 61 CA PRO A 5 0.001 10.883 14.119 1.00 0.00 C ATOM 62 C PRO A 5 0.278 9.957 15.305 1.00 0.00 C ATOM 63 O PRO A 5 0.433 10.419 16.435 1.00 0.00 O ATOM 64 CB PRO A 5 1.219 11.688 13.696 1.00 0.00 C ATOM 65 CG PRO A 5 1.008 13.087 14.253 1.00 0.00 C ATOM 66 CD PRO A 5 -0.445 13.204 14.681 1.00 0.00 C ATOM 0 HA PRO A 5 -0.317 10.216 13.318 1.00 0.00 H new ATOM 0 HB2 PRO A 5 2.135 11.246 14.088 1.00 0.00 H new ATOM 0 HB3 PRO A 5 1.315 11.710 12.610 1.00 0.00 H new ATOM 0 HG2 PRO A 5 1.671 13.265 15.100 1.00 0.00 H new ATOM 0 HG3 PRO A 5 1.246 13.838 13.499 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -0.527 13.497 15.728 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -0.970 13.959 14.096 1.00 0.00 H new ATOM 74 N GLU A 6 0.334 8.668 15.008 1.00 0.00 N ATOM 75 CA GLU A 6 0.590 7.673 16.036 1.00 0.00 C ATOM 76 C GLU A 6 2.083 7.349 16.100 1.00 0.00 C ATOM 77 O GLU A 6 2.800 7.503 15.112 1.00 0.00 O ATOM 78 CB GLU A 6 -0.235 6.408 15.791 1.00 0.00 C ATOM 79 CG GLU A 6 -1.355 6.274 16.825 1.00 0.00 C ATOM 80 CD GLU A 6 -1.991 4.884 16.768 1.00 0.00 C ATOM 81 OE1 GLU A 6 -2.395 4.489 15.653 1.00 0.00 O ATOM 82 OE2 GLU A 6 -2.058 4.246 17.843 1.00 0.00 O ATOM 0 H GLU A 6 0.206 8.289 14.070 1.00 0.00 H new ATOM 0 HA GLU A 6 0.286 8.086 16.998 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -0.662 6.437 14.789 1.00 0.00 H new ATOM 0 HB3 GLU A 6 0.413 5.533 15.836 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -0.957 6.455 17.823 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.115 7.033 16.643 1.00 0.00 H new ATOM 89 N PRO A 7 2.521 6.897 17.306 1.00 0.00 N ATOM 90 CA PRO A 7 3.917 6.551 17.514 1.00 0.00 C ATOM 91 C PRO A 7 4.256 5.215 16.849 1.00 0.00 C ATOM 92 O PRO A 7 3.660 4.188 17.174 1.00 0.00 O ATOM 93 CB PRO A 7 4.096 6.527 19.023 1.00 0.00 C ATOM 94 CG PRO A 7 2.698 6.401 19.607 1.00 0.00 C ATOM 95 CD PRO A 7 1.702 6.703 18.499 1.00 0.00 C ATOM 0 HA PRO A 7 4.600 7.267 17.057 1.00 0.00 H new ATOM 0 HB2 PRO A 7 4.724 5.690 19.328 1.00 0.00 H new ATOM 0 HB3 PRO A 7 4.585 7.436 19.373 1.00 0.00 H new ATOM 0 HG2 PRO A 7 2.538 5.398 20.001 1.00 0.00 H new ATOM 0 HG3 PRO A 7 2.567 7.095 20.438 1.00 0.00 H new ATOM 0 HD2 PRO A 7 0.997 5.882 18.366 1.00 0.00 H new ATOM 0 HD3 PRO A 7 1.116 7.593 18.726 1.00 0.00 H new ATOM 103 N TYR A 8 5.210 5.270 15.933 1.00 0.00 N ATOM 104 CA TYR A 8 5.635 4.078 15.221 1.00 0.00 C ATOM 105 C TYR A 8 6.916 3.502 15.829 1.00 0.00 C ATOM 106 O TYR A 8 7.862 4.239 16.103 1.00 0.00 O ATOM 107 CB TYR A 8 5.920 4.522 13.785 1.00 0.00 C ATOM 108 CG TYR A 8 6.255 3.373 12.833 1.00 0.00 C ATOM 109 CD1 TYR A 8 5.373 2.322 12.683 1.00 0.00 C ATOM 110 CD2 TYR A 8 7.438 3.388 12.122 1.00 0.00 C ATOM 111 CE1 TYR A 8 5.688 1.240 11.786 1.00 0.00 C ATOM 112 CE2 TYR A 8 7.753 2.306 11.225 1.00 0.00 C ATOM 113 CZ TYR A 8 6.862 1.286 11.101 1.00 0.00 C ATOM 114 OH TYR A 8 7.159 0.264 10.255 1.00 0.00 O ATOM 0 H TYR A 8 5.702 6.123 15.667 1.00 0.00 H new ATOM 0 HA TYR A 8 4.867 3.306 15.275 1.00 0.00 H new ATOM 0 HB2 TYR A 8 5.051 5.056 13.402 1.00 0.00 H new ATOM 0 HB3 TYR A 8 6.750 5.228 13.792 1.00 0.00 H new ATOM 0 HD1 TYR A 8 4.447 2.311 13.238 1.00 0.00 H new ATOM 0 HD2 TYR A 8 8.127 4.211 12.238 1.00 0.00 H new ATOM 0 HE1 TYR A 8 5.007 0.411 11.660 1.00 0.00 H new ATOM 0 HE2 TYR A 8 8.676 2.305 10.664 1.00 0.00 H new ATOM 0 HH TYR A 8 8.028 0.431 9.833 1.00 0.00 H new ATOM 207 N SER A 14 7.974 -9.302 7.216 1.00 0.00 N ATOM 208 CA SER A 14 8.222 -10.363 6.254 1.00 0.00 C ATOM 209 C SER A 14 7.246 -10.244 5.082 1.00 0.00 C ATOM 210 O SER A 14 6.038 -10.126 5.285 1.00 0.00 O ATOM 211 CB SER A 14 8.100 -11.740 6.909 1.00 0.00 C ATOM 212 OG SER A 14 9.200 -12.585 6.585 1.00 0.00 O ATOM 0 HA SER A 14 9.241 -10.257 5.882 1.00 0.00 H new ATOM 0 HB2 SER A 14 8.040 -11.623 7.991 1.00 0.00 H new ATOM 0 HB3 SER A 14 7.172 -12.213 6.587 1.00 0.00 H new ATOM 0 HG SER A 14 9.085 -13.454 7.024 1.00 0.00 H new ATOM 218 N TYR A 15 7.805 -10.280 3.881 1.00 0.00 N ATOM 219 CA TYR A 15 6.999 -10.178 2.677 1.00 0.00 C ATOM 220 C TYR A 15 6.837 -11.544 2.009 1.00 0.00 C ATOM 221 O TYR A 15 7.750 -12.367 2.040 1.00 0.00 O ATOM 222 CB TYR A 15 7.766 -9.248 1.734 1.00 0.00 C ATOM 223 CG TYR A 15 7.751 -7.779 2.159 1.00 0.00 C ATOM 224 CD1 TYR A 15 6.586 -7.210 2.634 1.00 0.00 C ATOM 225 CD2 TYR A 15 8.902 -7.022 2.069 1.00 0.00 C ATOM 226 CE1 TYR A 15 6.572 -5.827 3.035 1.00 0.00 C ATOM 227 CE2 TYR A 15 8.887 -5.640 2.469 1.00 0.00 C ATOM 228 CZ TYR A 15 7.723 -5.109 2.932 1.00 0.00 C ATOM 229 OH TYR A 15 7.709 -3.803 3.310 1.00 0.00 O ATOM 0 H TYR A 15 8.807 -10.378 3.716 1.00 0.00 H new ATOM 0 HA TYR A 15 6.002 -9.805 2.912 1.00 0.00 H new ATOM 0 HB2 TYR A 15 8.800 -9.586 1.669 1.00 0.00 H new ATOM 0 HB3 TYR A 15 7.340 -9.330 0.734 1.00 0.00 H new ATOM 0 HD1 TYR A 15 5.686 -7.802 2.705 1.00 0.00 H new ATOM 0 HD2 TYR A 15 9.814 -7.467 1.698 1.00 0.00 H new ATOM 0 HE1 TYR A 15 5.668 -5.370 3.409 1.00 0.00 H new ATOM 0 HE2 TYR A 15 9.781 -5.037 2.403 1.00 0.00 H new ATOM 0 HH TYR A 15 8.600 -3.416 3.183 1.00 0.00 H new ATOM 239 N PRO A 16 5.637 -11.749 1.402 1.00 0.00 N ATOM 240 CA PRO A 16 5.344 -13.001 0.727 1.00 0.00 C ATOM 241 C PRO A 16 6.074 -13.085 -0.615 1.00 0.00 C ATOM 242 O PRO A 16 6.469 -14.167 -1.045 1.00 0.00 O ATOM 243 CB PRO A 16 3.831 -13.025 0.582 1.00 0.00 C ATOM 244 CG PRO A 16 3.372 -11.587 0.759 1.00 0.00 C ATOM 245 CD PRO A 16 4.531 -10.797 1.345 1.00 0.00 C ATOM 0 HA PRO A 16 5.692 -13.871 1.285 1.00 0.00 H new ATOM 0 HB2 PRO A 16 3.538 -13.411 -0.395 1.00 0.00 H new ATOM 0 HB3 PRO A 16 3.377 -13.675 1.330 1.00 0.00 H new ATOM 0 HG2 PRO A 16 3.066 -11.163 -0.198 1.00 0.00 H new ATOM 0 HG3 PRO A 16 2.506 -11.541 1.419 1.00 0.00 H new ATOM 0 HD2 PRO A 16 4.780 -9.938 0.722 1.00 0.00 H new ATOM 0 HD3 PRO A 16 4.288 -10.413 2.336 1.00 0.00 H new ATOM 253 N SER A 17 6.231 -11.927 -1.240 1.00 0.00 N ATOM 254 CA SER A 17 6.907 -11.855 -2.524 1.00 0.00 C ATOM 255 C SER A 17 8.359 -12.315 -2.378 1.00 0.00 C ATOM 256 O SER A 17 8.882 -13.017 -3.241 1.00 0.00 O ATOM 257 CB SER A 17 6.855 -10.437 -3.095 1.00 0.00 C ATOM 258 OG SER A 17 7.628 -9.522 -2.324 1.00 0.00 O ATOM 0 H SER A 17 5.901 -11.031 -0.881 1.00 0.00 H new ATOM 0 HA SER A 17 6.391 -12.517 -3.219 1.00 0.00 H new ATOM 0 HB2 SER A 17 7.222 -10.446 -4.121 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.820 -10.098 -3.129 1.00 0.00 H new ATOM 0 HG SER A 17 7.570 -8.628 -2.722 1.00 0.00 H new ATOM 264 N LYS A 18 8.970 -11.900 -1.277 1.00 0.00 N ATOM 265 CA LYS A 18 10.351 -12.261 -1.006 1.00 0.00 C ATOM 266 C LYS A 18 10.416 -13.081 0.283 1.00 0.00 C ATOM 267 O LYS A 18 11.138 -12.726 1.214 1.00 0.00 O ATOM 268 CB LYS A 18 11.237 -11.014 -0.988 1.00 0.00 C ATOM 269 CG LYS A 18 11.889 -10.783 -2.352 1.00 0.00 C ATOM 270 CD LYS A 18 12.613 -9.437 -2.393 1.00 0.00 C ATOM 271 CE LYS A 18 11.951 -8.490 -3.397 1.00 0.00 C ATOM 272 NZ LYS A 18 12.903 -7.440 -3.823 1.00 0.00 N ATOM 0 H LYS A 18 8.533 -11.317 -0.563 1.00 0.00 H new ATOM 0 HA LYS A 18 10.744 -12.891 -1.804 1.00 0.00 H new ATOM 0 HB2 LYS A 18 10.640 -10.144 -0.715 1.00 0.00 H new ATOM 0 HB3 LYS A 18 12.009 -11.123 -0.226 1.00 0.00 H new ATOM 0 HG2 LYS A 18 12.595 -11.586 -2.562 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.129 -10.815 -3.132 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.605 -8.985 -1.401 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.657 -9.590 -2.665 1.00 0.00 H new ATOM 0 HE2 LYS A 18 11.608 -9.053 -4.265 1.00 0.00 H new ATOM 0 HE3 LYS A 18 11.071 -8.031 -2.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 12.439 -6.806 -4.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 13.210 -6.893 -2.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 13.731 -7.883 -4.271 1.00 0.00 H new ATOM 597 N CYS A 40 -0.939 -8.607 -13.832 1.00 0.00 N ATOM 598 CA CYS A 40 -1.433 -8.256 -12.512 1.00 0.00 C ATOM 599 C CYS A 40 -2.768 -7.526 -12.678 1.00 0.00 C ATOM 600 O CYS A 40 -2.927 -6.716 -13.590 1.00 0.00 O ATOM 601 CB CYS A 40 -0.417 -7.420 -11.731 1.00 0.00 C ATOM 602 SG CYS A 40 0.155 -6.014 -12.755 1.00 0.00 S ATOM 0 HA CYS A 40 -1.586 -9.162 -11.925 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -0.869 -7.050 -10.810 1.00 0.00 H new ATOM 0 HB3 CYS A 40 0.432 -8.040 -11.443 1.00 0.00 H new ATOM 0 HG CYS A 40 -0.042 -6.284 -14.011 1.00 0.00 H new ATOM 608 N VAL A 41 -3.692 -7.837 -11.781 1.00 0.00 N ATOM 609 CA VAL A 41 -5.007 -7.220 -11.816 1.00 0.00 C ATOM 610 C VAL A 41 -4.942 -5.851 -11.137 1.00 0.00 C ATOM 611 O VAL A 41 -4.088 -5.618 -10.282 1.00 0.00 O ATOM 612 CB VAL A 41 -6.040 -8.154 -11.182 1.00 0.00 C ATOM 613 CG1 VAL A 41 -6.264 -9.394 -12.050 1.00 0.00 C ATOM 614 CG2 VAL A 41 -5.626 -8.545 -9.762 1.00 0.00 C ATOM 0 H VAL A 41 -3.556 -8.508 -11.025 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.325 -7.057 -12.846 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.985 -7.615 -11.119 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -7.003 -10.041 -11.577 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.625 -9.090 -13.033 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.325 -9.936 -12.160 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -6.377 -9.209 -9.334 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.664 -9.056 -9.791 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -5.542 -7.649 -9.148 1.00 0.00 H new ATOM 624 N THR A 42 -5.854 -4.981 -11.543 1.00 0.00 N ATOM 625 CA THR A 42 -5.911 -3.641 -10.984 1.00 0.00 C ATOM 626 C THR A 42 -7.284 -3.380 -10.360 1.00 0.00 C ATOM 627 O THR A 42 -8.308 -3.510 -11.029 1.00 0.00 O ATOM 628 CB THR A 42 -5.551 -2.651 -12.093 1.00 0.00 C ATOM 629 OG1 THR A 42 -4.203 -2.974 -12.423 1.00 0.00 O ATOM 630 CG2 THR A 42 -5.474 -1.208 -11.588 1.00 0.00 C ATOM 0 H THR A 42 -6.560 -5.178 -12.253 1.00 0.00 H new ATOM 0 HA THR A 42 -5.192 -3.520 -10.173 1.00 0.00 H new ATOM 0 HB THR A 42 -6.289 -2.718 -12.892 1.00 0.00 H new ATOM 0 HG1 THR A 42 -3.890 -2.380 -13.137 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.215 -0.546 -12.415 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.440 -0.914 -11.177 1.00 0.00 H new ATOM 0 HG23 THR A 42 -4.712 -1.134 -10.812 1.00 0.00 H new ATOM 638 N MET A 43 -7.261 -3.019 -9.085 1.00 0.00 N ATOM 639 CA MET A 43 -8.490 -2.740 -8.365 1.00 0.00 C ATOM 640 C MET A 43 -9.137 -1.445 -8.862 1.00 0.00 C ATOM 641 O MET A 43 -10.150 -1.480 -9.558 1.00 0.00 O ATOM 642 CB MET A 43 -8.189 -2.619 -6.869 1.00 0.00 C ATOM 643 CG MET A 43 -8.601 -3.889 -6.122 1.00 0.00 C ATOM 644 SD MET A 43 -7.524 -4.149 -4.723 1.00 0.00 S ATOM 645 CE MET A 43 -6.060 -4.732 -5.562 1.00 0.00 C ATOM 0 H MET A 43 -6.410 -2.914 -8.533 1.00 0.00 H new ATOM 0 HA MET A 43 -9.185 -3.561 -8.540 1.00 0.00 H new ATOM 0 HB2 MET A 43 -7.125 -2.436 -6.722 1.00 0.00 H new ATOM 0 HB3 MET A 43 -8.720 -1.761 -6.456 1.00 0.00 H new ATOM 0 HG2 MET A 43 -9.634 -3.804 -5.785 1.00 0.00 H new ATOM 0 HG3 MET A 43 -8.554 -4.747 -6.793 1.00 0.00 H new ATOM 0 HE1 MET A 43 -5.354 -5.126 -4.831 1.00 0.00 H new ATOM 0 HE2 MET A 43 -6.333 -5.519 -6.265 1.00 0.00 H new ATOM 0 HE3 MET A 43 -5.598 -3.907 -6.104 1.00 0.00 H new ATOM 655 N SER A 44 -8.524 -0.333 -8.485 1.00 0.00 N ATOM 656 CA SER A 44 -9.027 0.971 -8.884 1.00 0.00 C ATOM 657 C SER A 44 -7.982 2.048 -8.583 1.00 0.00 C ATOM 658 O SER A 44 -7.229 1.936 -7.617 1.00 0.00 O ATOM 659 CB SER A 44 -10.343 1.295 -8.175 1.00 0.00 C ATOM 660 OG SER A 44 -11.074 2.316 -8.847 1.00 0.00 O ATOM 0 H SER A 44 -7.684 -0.308 -7.908 1.00 0.00 H new ATOM 0 HA SER A 44 -9.220 0.950 -9.957 1.00 0.00 H new ATOM 0 HB2 SER A 44 -10.953 0.394 -8.113 1.00 0.00 H new ATOM 0 HB3 SER A 44 -10.136 1.611 -7.153 1.00 0.00 H new ATOM 0 HG SER A 44 -12.010 2.042 -8.938 1.00 0.00 H new ATOM 666 N SER A 45 -7.972 3.069 -9.429 1.00 0.00 N ATOM 667 CA SER A 45 -7.033 4.166 -9.265 1.00 0.00 C ATOM 668 C SER A 45 -7.723 5.348 -8.581 1.00 0.00 C ATOM 669 O SER A 45 -8.775 5.802 -9.030 1.00 0.00 O ATOM 670 CB SER A 45 -6.452 4.598 -10.613 1.00 0.00 C ATOM 671 OG SER A 45 -7.469 4.975 -11.537 1.00 0.00 O ATOM 0 H SER A 45 -8.598 3.159 -10.229 1.00 0.00 H new ATOM 0 HA SER A 45 -6.210 3.822 -8.638 1.00 0.00 H new ATOM 0 HB2 SER A 45 -5.771 5.435 -10.462 1.00 0.00 H new ATOM 0 HB3 SER A 45 -5.865 3.781 -11.033 1.00 0.00 H new ATOM 0 HG SER A 45 -8.274 5.243 -11.046 1.00 0.00 H new ATOM 677 N ALA A 46 -7.104 5.811 -7.505 1.00 0.00 N ATOM 678 CA ALA A 46 -7.645 6.931 -6.754 1.00 0.00 C ATOM 679 C ALA A 46 -6.504 7.863 -6.343 1.00 0.00 C ATOM 680 O ALA A 46 -5.577 7.447 -5.650 1.00 0.00 O ATOM 681 CB ALA A 46 -8.432 6.406 -5.551 1.00 0.00 C ATOM 0 H ALA A 46 -6.233 5.431 -7.135 1.00 0.00 H new ATOM 0 HA ALA A 46 -8.336 7.508 -7.369 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -8.838 7.246 -4.987 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -9.249 5.773 -5.899 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -7.770 5.824 -4.909 1.00 0.00 H new ATOM 687 N VAL A 47 -6.609 9.107 -6.788 1.00 0.00 N ATOM 688 CA VAL A 47 -5.597 10.102 -6.475 1.00 0.00 C ATOM 689 C VAL A 47 -5.577 10.344 -4.964 1.00 0.00 C ATOM 690 O VAL A 47 -6.585 10.739 -4.382 1.00 0.00 O ATOM 691 CB VAL A 47 -5.849 11.376 -7.282 1.00 0.00 C ATOM 692 CG1 VAL A 47 -4.949 12.517 -6.802 1.00 0.00 C ATOM 693 CG2 VAL A 47 -5.663 11.124 -8.779 1.00 0.00 C ATOM 0 H VAL A 47 -7.379 9.448 -7.363 1.00 0.00 H new ATOM 0 HA VAL A 47 -4.608 9.744 -6.760 1.00 0.00 H new ATOM 0 HB VAL A 47 -6.885 11.675 -7.119 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -5.149 13.411 -7.393 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -5.152 12.723 -5.751 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -3.904 12.230 -6.920 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -5.848 12.047 -9.329 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.643 10.788 -8.967 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -6.365 10.358 -9.109 1.00 0.00 H new ATOM 703 N VAL A 48 -4.418 10.097 -4.373 1.00 0.00 N ATOM 704 CA VAL A 48 -4.253 10.285 -2.942 1.00 0.00 C ATOM 705 C VAL A 48 -2.951 11.045 -2.677 1.00 0.00 C ATOM 706 O VAL A 48 -2.097 11.144 -3.556 1.00 0.00 O ATOM 707 CB VAL A 48 -4.310 8.933 -2.227 1.00 0.00 C ATOM 708 CG1 VAL A 48 -5.050 7.896 -3.075 1.00 0.00 C ATOM 709 CG2 VAL A 48 -2.907 8.445 -1.863 1.00 0.00 C ATOM 0 H VAL A 48 -3.584 9.768 -4.859 1.00 0.00 H new ATOM 0 HA VAL A 48 -5.068 10.887 -2.540 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.867 9.067 -1.300 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -5.077 6.944 -2.544 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -6.069 8.237 -3.260 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.533 7.767 -4.026 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.977 7.483 -1.356 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.313 8.335 -2.770 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.430 9.169 -1.203 1.00 0.00 H new ATOM 719 N GLN A 49 -2.842 11.563 -1.463 1.00 0.00 N ATOM 720 CA GLN A 49 -1.660 12.312 -1.072 1.00 0.00 C ATOM 721 C GLN A 49 -0.880 11.548 0.001 1.00 0.00 C ATOM 722 O GLN A 49 -1.408 11.267 1.075 1.00 0.00 O ATOM 723 CB GLN A 49 -2.034 13.713 -0.585 1.00 0.00 C ATOM 724 CG GLN A 49 -2.517 14.586 -1.746 1.00 0.00 C ATOM 725 CD GLN A 49 -2.944 15.968 -1.251 1.00 0.00 C ATOM 726 OE1 GLN A 49 -2.130 16.830 -0.959 1.00 0.00 O ATOM 727 NE2 GLN A 49 -4.261 16.133 -1.173 1.00 0.00 N ATOM 0 H GLN A 49 -3.553 11.479 -0.737 1.00 0.00 H new ATOM 0 HA GLN A 49 -1.020 12.427 -1.947 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -2.816 13.642 0.171 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -1.171 14.179 -0.109 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -1.721 14.690 -2.483 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -3.354 14.100 -2.247 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.887 15.371 -1.433 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.646 17.022 -0.853 1.00 0.00 H new ATOM 736 N LEU A 50 0.365 11.237 -0.328 1.00 0.00 N ATOM 737 CA LEU A 50 1.224 10.512 0.594 1.00 0.00 C ATOM 738 C LEU A 50 1.786 11.486 1.632 1.00 0.00 C ATOM 739 O LEU A 50 2.410 12.485 1.277 1.00 0.00 O ATOM 740 CB LEU A 50 2.300 9.739 -0.170 1.00 0.00 C ATOM 741 CG LEU A 50 2.868 8.506 0.535 1.00 0.00 C ATOM 742 CD1 LEU A 50 3.788 8.909 1.688 1.00 0.00 C ATOM 743 CD2 LEU A 50 1.746 7.572 0.995 1.00 0.00 C ATOM 0 H LEU A 50 0.800 11.474 -1.220 1.00 0.00 H new ATOM 0 HA LEU A 50 0.651 9.761 1.138 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.884 9.426 -1.127 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.123 10.420 -0.388 1.00 0.00 H new ATOM 0 HG LEU A 50 3.475 7.952 -0.181 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.178 8.014 2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.616 9.503 1.302 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.226 9.498 2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.177 6.703 1.493 1.00 0.00 H new ATOM 0 HD22 LEU A 50 1.093 8.102 1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.168 7.245 0.131 1.00 0.00 H new ATOM 755 N TYR A 51 1.548 11.160 2.894 1.00 0.00 N ATOM 756 CA TYR A 51 2.023 11.993 3.985 1.00 0.00 C ATOM 757 C TYR A 51 2.862 11.178 4.971 1.00 0.00 C ATOM 758 O TYR A 51 2.693 9.965 5.083 1.00 0.00 O ATOM 759 CB TYR A 51 0.771 12.504 4.702 1.00 0.00 C ATOM 760 CG TYR A 51 0.081 13.671 3.992 1.00 0.00 C ATOM 761 CD1 TYR A 51 0.609 14.942 4.082 1.00 0.00 C ATOM 762 CD2 TYR A 51 -1.070 13.451 3.263 1.00 0.00 C ATOM 763 CE1 TYR A 51 -0.041 16.041 3.413 1.00 0.00 C ATOM 764 CE2 TYR A 51 -1.719 14.549 2.594 1.00 0.00 C ATOM 765 CZ TYR A 51 -1.172 15.789 2.703 1.00 0.00 C ATOM 766 OH TYR A 51 -1.786 16.827 2.072 1.00 0.00 O ATOM 0 H TYR A 51 1.032 10.330 3.185 1.00 0.00 H new ATOM 0 HA TYR A 51 2.648 12.802 3.606 1.00 0.00 H new ATOM 0 HB2 TYR A 51 0.062 11.683 4.803 1.00 0.00 H new ATOM 0 HB3 TYR A 51 1.044 12.815 5.710 1.00 0.00 H new ATOM 0 HD1 TYR A 51 1.509 15.114 4.654 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -1.484 12.456 3.194 1.00 0.00 H new ATOM 0 HE1 TYR A 51 0.361 17.041 3.475 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -2.619 14.391 2.019 1.00 0.00 H new ATOM 0 HH TYR A 51 -1.805 16.658 1.107 1.00 0.00 H new ATOM 776 N ALA A 52 3.751 11.877 5.661 1.00 0.00 N ATOM 777 CA ALA A 52 4.619 11.234 6.634 1.00 0.00 C ATOM 778 C ALA A 52 4.469 11.936 7.985 1.00 0.00 C ATOM 779 O ALA A 52 4.614 13.153 8.076 1.00 0.00 O ATOM 780 CB ALA A 52 6.060 11.253 6.123 1.00 0.00 C ATOM 0 H ALA A 52 3.889 12.883 5.566 1.00 0.00 H new ATOM 0 HA ALA A 52 4.336 10.190 6.772 1.00 0.00 H new ATOM 0 HB1 ALA A 52 6.711 10.771 6.852 1.00 0.00 H new ATOM 0 HB2 ALA A 52 6.117 10.717 5.176 1.00 0.00 H new ATOM 0 HB3 ALA A 52 6.380 12.284 5.976 1.00 0.00 H new ATOM 786 N ALA A 53 4.182 11.136 9.002 1.00 0.00 N ATOM 787 CA ALA A 53 4.012 11.664 10.344 1.00 0.00 C ATOM 788 C ALA A 53 5.375 12.082 10.900 1.00 0.00 C ATOM 789 O ALA A 53 6.045 11.296 11.567 1.00 0.00 O ATOM 790 CB ALA A 53 3.322 10.617 11.221 1.00 0.00 C ATOM 0 H ALA A 53 4.063 10.126 8.923 1.00 0.00 H new ATOM 0 HA ALA A 53 3.376 12.549 10.330 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.194 11.013 12.228 1.00 0.00 H new ATOM 0 HB2 ALA A 53 2.346 10.375 10.800 1.00 0.00 H new ATOM 0 HB3 ALA A 53 3.933 9.715 11.260 1.00 0.00 H new ATOM 796 N ASP A 54 5.744 13.320 10.603 1.00 0.00 N ATOM 797 CA ASP A 54 7.014 13.853 11.065 1.00 0.00 C ATOM 798 C ASP A 54 7.033 13.863 12.595 1.00 0.00 C ATOM 799 O ASP A 54 6.024 13.567 13.233 1.00 0.00 O ATOM 800 CB ASP A 54 7.217 15.290 10.580 1.00 0.00 C ATOM 801 CG ASP A 54 8.577 15.569 9.934 1.00 0.00 C ATOM 802 OD1 ASP A 54 9.585 15.114 10.517 1.00 0.00 O ATOM 803 OD2 ASP A 54 8.577 16.231 8.874 1.00 0.00 O ATOM 0 H ASP A 54 5.186 13.969 10.048 1.00 0.00 H new ATOM 0 HA ASP A 54 7.809 13.222 10.667 1.00 0.00 H new ATOM 0 HB2 ASP A 54 6.434 15.529 9.860 1.00 0.00 H new ATOM 0 HB3 ASP A 54 7.088 15.965 11.426 1.00 0.00 H new ATOM 808 N ARG A 55 8.191 14.207 13.138 1.00 0.00 N ATOM 809 CA ARG A 55 8.354 14.261 14.581 1.00 0.00 C ATOM 810 C ARG A 55 7.246 15.106 15.210 1.00 0.00 C ATOM 811 O ARG A 55 6.571 15.867 14.518 1.00 0.00 O ATOM 812 CB ARG A 55 9.713 14.851 14.960 1.00 0.00 C ATOM 813 CG ARG A 55 10.826 13.813 14.798 1.00 0.00 C ATOM 814 CD ARG A 55 12.205 14.478 14.832 1.00 0.00 C ATOM 815 NE ARG A 55 12.899 14.137 16.094 1.00 0.00 N ATOM 816 CZ ARG A 55 14.002 14.758 16.535 1.00 0.00 C ATOM 817 NH1 ARG A 55 14.540 15.756 15.820 1.00 0.00 N ATOM 818 NH2 ARG A 55 14.565 14.382 17.691 1.00 0.00 N ATOM 0 H ARG A 55 9.026 14.451 12.605 1.00 0.00 H new ATOM 0 HA ARG A 55 8.295 13.240 14.959 1.00 0.00 H new ATOM 0 HB2 ARG A 55 9.925 15.717 14.333 1.00 0.00 H new ATOM 0 HB3 ARG A 55 9.686 15.203 15.991 1.00 0.00 H new ATOM 0 HG2 ARG A 55 10.756 13.072 15.594 1.00 0.00 H new ATOM 0 HG3 ARG A 55 10.698 13.281 13.855 1.00 0.00 H new ATOM 0 HD2 ARG A 55 12.799 14.147 13.980 1.00 0.00 H new ATOM 0 HD3 ARG A 55 12.099 15.559 14.746 1.00 0.00 H new ATOM 0 HE ARG A 55 12.514 13.383 16.663 1.00 0.00 H new ATOM 0 HH11 ARG A 55 14.110 16.043 14.941 1.00 0.00 H new ATOM 0 HH12 ARG A 55 15.379 16.229 16.155 1.00 0.00 H new ATOM 0 HH21 ARG A 55 14.154 13.623 18.235 1.00 0.00 H new ATOM 0 HH22 ARG A 55 15.404 14.854 18.027 1.00 0.00 H new ATOM 832 N ASN A 56 7.090 14.945 16.516 1.00 0.00 N ATOM 833 CA ASN A 56 6.075 15.684 17.247 1.00 0.00 C ATOM 834 C ASN A 56 4.690 15.272 16.743 1.00 0.00 C ATOM 835 O ASN A 56 4.011 14.465 17.376 1.00 0.00 O ATOM 836 CB ASN A 56 6.228 17.191 17.030 1.00 0.00 C ATOM 837 CG ASN A 56 6.792 17.870 18.279 1.00 0.00 C ATOM 838 OD1 ASN A 56 7.122 17.235 19.267 1.00 0.00 O ATOM 839 ND2 ASN A 56 6.885 19.193 18.181 1.00 0.00 N ATOM 0 H ASN A 56 7.651 14.313 17.087 1.00 0.00 H new ATOM 0 HA ASN A 56 6.191 15.459 18.307 1.00 0.00 H new ATOM 0 HB2 ASN A 56 6.888 17.375 16.182 1.00 0.00 H new ATOM 0 HB3 ASN A 56 5.260 17.626 16.781 1.00 0.00 H new ATOM 0 HD21 ASN A 56 7.250 19.738 18.962 1.00 0.00 H new ATOM 0 HD22 ASN A 56 6.591 19.663 17.325 1.00 0.00 H new ATOM 846 N CYS A 57 4.312 15.846 15.610 1.00 0.00 N ATOM 847 CA CYS A 57 3.021 15.548 15.014 1.00 0.00 C ATOM 848 C CYS A 57 2.742 16.589 13.928 1.00 0.00 C ATOM 849 O CYS A 57 2.004 17.547 14.155 1.00 0.00 O ATOM 850 CB CYS A 57 1.909 15.509 16.065 1.00 0.00 C ATOM 851 SG CYS A 57 2.101 16.905 17.233 1.00 0.00 S ATOM 0 H CYS A 57 4.878 16.516 15.089 1.00 0.00 H new ATOM 0 HA CYS A 57 3.044 14.554 14.567 1.00 0.00 H new ATOM 0 HB2 CYS A 57 0.935 15.563 15.578 1.00 0.00 H new ATOM 0 HB3 CYS A 57 1.943 14.564 16.607 1.00 0.00 H new ATOM 0 HG CYS A 57 1.151 16.863 18.119 1.00 0.00 H new ATOM 857 N MET A 58 3.346 16.365 12.770 1.00 0.00 N ATOM 858 CA MET A 58 3.172 17.272 11.648 1.00 0.00 C ATOM 859 C MET A 58 3.373 16.543 10.318 1.00 0.00 C ATOM 860 O MET A 58 4.477 16.527 9.774 1.00 0.00 O ATOM 861 CB MET A 58 4.179 18.420 11.758 1.00 0.00 C ATOM 862 CG MET A 58 3.629 19.548 12.633 1.00 0.00 C ATOM 863 SD MET A 58 2.161 20.238 11.888 1.00 0.00 S ATOM 864 CE MET A 58 2.885 21.059 10.478 1.00 0.00 C ATOM 0 H MET A 58 3.956 15.569 12.585 1.00 0.00 H new ATOM 0 HA MET A 58 2.155 17.664 11.676 1.00 0.00 H new ATOM 0 HB2 MET A 58 5.113 18.050 12.180 1.00 0.00 H new ATOM 0 HB3 MET A 58 4.408 18.804 10.764 1.00 0.00 H new ATOM 0 HG2 MET A 58 3.397 19.168 13.628 1.00 0.00 H new ATOM 0 HG3 MET A 58 4.384 20.325 12.756 1.00 0.00 H new ATOM 0 HE1 MET A 58 2.213 21.843 10.129 1.00 0.00 H new ATOM 0 HE2 MET A 58 3.840 21.500 10.764 1.00 0.00 H new ATOM 0 HE3 MET A 58 3.045 20.336 9.678 1.00 0.00 H new ATOM 874 N TRP A 59 2.290 15.955 9.833 1.00 0.00 N ATOM 875 CA TRP A 59 2.332 15.225 8.577 1.00 0.00 C ATOM 876 C TRP A 59 3.203 16.018 7.599 1.00 0.00 C ATOM 877 O TRP A 59 3.171 17.248 7.590 1.00 0.00 O ATOM 878 CB TRP A 59 0.922 14.965 8.045 1.00 0.00 C ATOM 879 CG TRP A 59 -0.037 14.383 9.085 1.00 0.00 C ATOM 880 CD1 TRP A 59 -0.889 15.042 9.883 1.00 0.00 C ATOM 881 CD2 TRP A 59 -0.210 12.987 9.408 1.00 0.00 C ATOM 882 NE1 TRP A 59 -1.595 14.176 10.694 1.00 0.00 N ATOM 883 CE2 TRP A 59 -1.169 12.887 10.396 1.00 0.00 C ATOM 884 CE3 TRP A 59 0.424 11.846 8.885 1.00 0.00 C ATOM 885 CZ2 TRP A 59 -1.579 11.666 10.945 1.00 0.00 C ATOM 886 CZ3 TRP A 59 0.002 10.634 9.444 1.00 0.00 C ATOM 887 CH2 TRP A 59 -0.962 10.517 10.439 1.00 0.00 C ATOM 0 H TRP A 59 1.377 15.969 10.287 1.00 0.00 H new ATOM 0 HA TRP A 59 2.775 14.239 8.719 1.00 0.00 H new ATOM 0 HB2 TRP A 59 0.509 15.900 7.668 1.00 0.00 H new ATOM 0 HB3 TRP A 59 0.984 14.280 7.199 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -1.008 16.115 9.891 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -2.300 14.435 11.385 1.00 0.00 H new ATOM 0 HE3 TRP A 59 1.177 11.900 8.113 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -2.332 11.614 11.718 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 0.457 9.726 9.077 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -1.233 9.543 10.820 1.00 0.00 H new ATOM 898 N SER A 60 3.960 15.281 6.799 1.00 0.00 N ATOM 899 CA SER A 60 4.838 15.900 5.821 1.00 0.00 C ATOM 900 C SER A 60 4.679 15.208 4.465 1.00 0.00 C ATOM 901 O SER A 60 4.836 13.993 4.363 1.00 0.00 O ATOM 902 CB SER A 60 6.297 15.846 6.277 1.00 0.00 C ATOM 903 OG SER A 60 7.101 16.813 5.608 1.00 0.00 O ATOM 0 H SER A 60 3.983 14.261 6.808 1.00 0.00 H new ATOM 0 HA SER A 60 4.556 16.948 5.723 1.00 0.00 H new ATOM 0 HB2 SER A 60 6.347 16.014 7.353 1.00 0.00 H new ATOM 0 HB3 SER A 60 6.698 14.850 6.091 1.00 0.00 H new ATOM 0 HG SER A 60 8.025 16.748 5.928 1.00 0.00 H new ATOM 909 N LYS A 61 4.371 16.012 3.458 1.00 0.00 N ATOM 910 CA LYS A 61 4.190 15.493 2.114 1.00 0.00 C ATOM 911 C LYS A 61 5.461 14.761 1.680 1.00 0.00 C ATOM 912 O LYS A 61 6.566 15.283 1.830 1.00 0.00 O ATOM 913 CB LYS A 61 3.768 16.611 1.160 1.00 0.00 C ATOM 914 CG LYS A 61 2.412 17.193 1.562 1.00 0.00 C ATOM 915 CD LYS A 61 1.391 17.037 0.433 1.00 0.00 C ATOM 916 CE LYS A 61 1.099 18.384 -0.232 1.00 0.00 C ATOM 917 NZ LYS A 61 2.159 18.720 -1.209 1.00 0.00 N ATOM 0 H LYS A 61 4.242 17.020 3.547 1.00 0.00 H new ATOM 0 HA LYS A 61 3.379 14.765 2.093 1.00 0.00 H new ATOM 0 HB2 LYS A 61 4.521 17.399 1.162 1.00 0.00 H new ATOM 0 HB3 LYS A 61 3.714 16.224 0.142 1.00 0.00 H new ATOM 0 HG2 LYS A 61 2.048 16.690 2.458 1.00 0.00 H new ATOM 0 HG3 LYS A 61 2.525 18.248 1.812 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.769 16.335 -0.310 1.00 0.00 H new ATOM 0 HD3 LYS A 61 0.467 16.615 0.829 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.132 18.347 -0.734 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.034 19.164 0.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 1.946 19.637 -1.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.076 18.776 -0.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.201 17.984 -1.942 1.00 0.00 H new ATOM 931 N LYS A 62 5.265 13.563 1.149 1.00 0.00 N ATOM 932 CA LYS A 62 6.382 12.754 0.691 1.00 0.00 C ATOM 933 C LYS A 62 6.331 12.638 -0.834 1.00 0.00 C ATOM 934 O LYS A 62 7.362 12.710 -1.500 1.00 0.00 O ATOM 935 CB LYS A 62 6.396 11.404 1.410 1.00 0.00 C ATOM 936 CG LYS A 62 7.564 11.319 2.394 1.00 0.00 C ATOM 937 CD LYS A 62 7.819 9.872 2.820 1.00 0.00 C ATOM 938 CE LYS A 62 9.001 9.785 3.788 1.00 0.00 C ATOM 939 NZ LYS A 62 9.799 8.567 3.522 1.00 0.00 N ATOM 0 H LYS A 62 4.348 13.133 1.026 1.00 0.00 H new ATOM 0 HA LYS A 62 7.328 13.233 0.943 1.00 0.00 H new ATOM 0 HB2 LYS A 62 5.456 11.262 1.943 1.00 0.00 H new ATOM 0 HB3 LYS A 62 6.473 10.599 0.679 1.00 0.00 H new ATOM 0 HG2 LYS A 62 8.462 11.730 1.934 1.00 0.00 H new ATOM 0 HG3 LYS A 62 7.349 11.928 3.272 1.00 0.00 H new ATOM 0 HD2 LYS A 62 6.925 9.466 3.294 1.00 0.00 H new ATOM 0 HD3 LYS A 62 8.019 9.260 1.940 1.00 0.00 H new ATOM 0 HE2 LYS A 62 9.630 10.669 3.684 1.00 0.00 H new ATOM 0 HE3 LYS A 62 8.637 9.772 4.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 10.597 8.523 4.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 9.200 7.726 3.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 10.162 8.595 2.548 1.00 0.00 H new ATOM 953 N CYS A 63 5.120 12.459 -1.342 1.00 0.00 N ATOM 954 CA CYS A 63 4.921 12.333 -2.775 1.00 0.00 C ATOM 955 C CYS A 63 3.436 12.066 -3.032 1.00 0.00 C ATOM 956 O CYS A 63 2.887 11.078 -2.549 1.00 0.00 O ATOM 957 CB CYS A 63 5.809 11.241 -3.376 1.00 0.00 C ATOM 958 SG CYS A 63 7.093 11.994 -4.440 1.00 0.00 S ATOM 0 H CYS A 63 4.267 12.398 -0.786 1.00 0.00 H new ATOM 0 HA CYS A 63 5.214 13.260 -3.268 1.00 0.00 H new ATOM 0 HB2 CYS A 63 6.278 10.663 -2.580 1.00 0.00 H new ATOM 0 HB3 CYS A 63 5.203 10.548 -3.959 1.00 0.00 H new ATOM 0 HG CYS A 63 7.907 12.695 -3.708 1.00 0.00 H new ATOM 964 N SER A 64 2.830 12.964 -3.795 1.00 0.00 N ATOM 965 CA SER A 64 1.420 12.838 -4.122 1.00 0.00 C ATOM 966 C SER A 64 1.249 12.618 -5.626 1.00 0.00 C ATOM 967 O SER A 64 2.159 12.901 -6.405 1.00 0.00 O ATOM 968 CB SER A 64 0.638 14.074 -3.674 1.00 0.00 C ATOM 969 OG SER A 64 1.496 15.175 -3.391 1.00 0.00 O ATOM 0 H SER A 64 3.290 13.782 -4.196 1.00 0.00 H new ATOM 0 HA SER A 64 1.021 11.976 -3.588 1.00 0.00 H new ATOM 0 HB2 SER A 64 -0.070 14.357 -4.453 1.00 0.00 H new ATOM 0 HB3 SER A 64 0.055 13.832 -2.786 1.00 0.00 H new ATOM 0 HG SER A 64 0.959 15.945 -3.110 1.00 0.00 H new ATOM 975 N GLY A 65 0.078 12.116 -5.990 1.00 0.00 N ATOM 976 CA GLY A 65 -0.222 11.856 -7.387 1.00 0.00 C ATOM 977 C GLY A 65 -1.335 10.813 -7.524 1.00 0.00 C ATOM 978 O GLY A 65 -2.214 10.724 -6.669 1.00 0.00 O ATOM 0 H GLY A 65 -0.674 11.883 -5.341 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -0.524 12.782 -7.876 1.00 0.00 H new ATOM 0 HA3 GLY A 65 0.675 11.505 -7.896 1.00 0.00 H new ATOM 982 N VAL A 66 -1.260 10.053 -8.606 1.00 0.00 N ATOM 983 CA VAL A 66 -2.249 9.021 -8.865 1.00 0.00 C ATOM 984 C VAL A 66 -1.749 7.688 -8.304 1.00 0.00 C ATOM 985 O VAL A 66 -0.614 7.290 -8.560 1.00 0.00 O ATOM 986 CB VAL A 66 -2.563 8.960 -10.362 1.00 0.00 C ATOM 987 CG1 VAL A 66 -1.302 8.653 -11.173 1.00 0.00 C ATOM 988 CG2 VAL A 66 -3.663 7.938 -10.650 1.00 0.00 C ATOM 0 H VAL A 66 -0.530 10.131 -9.314 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.186 9.255 -8.359 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.929 9.940 -10.669 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.552 8.615 -12.233 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.561 9.434 -11.002 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.894 7.691 -10.862 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.867 7.915 -11.721 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.338 6.951 -10.321 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.570 8.219 -10.114 1.00 0.00 H new ATOM 998 N ALA A 67 -2.621 7.036 -7.549 1.00 0.00 N ATOM 999 CA ALA A 67 -2.282 5.756 -6.951 1.00 0.00 C ATOM 1000 C ALA A 67 -3.261 4.689 -7.448 1.00 0.00 C ATOM 1001 O ALA A 67 -4.440 4.972 -7.654 1.00 0.00 O ATOM 1002 CB ALA A 67 -2.289 5.887 -5.427 1.00 0.00 C ATOM 0 H ALA A 67 -3.561 7.370 -7.338 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.280 5.448 -7.248 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -2.035 4.927 -4.978 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.557 6.635 -5.123 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.280 6.193 -5.093 1.00 0.00 H new ATOM 1008 N CYS A 68 -2.735 3.486 -7.626 1.00 0.00 N ATOM 1009 CA CYS A 68 -3.546 2.377 -8.095 1.00 0.00 C ATOM 1010 C CYS A 68 -3.170 1.132 -7.290 1.00 0.00 C ATOM 1011 O CYS A 68 -1.996 0.908 -6.999 1.00 0.00 O ATOM 1012 CB CYS A 68 -3.385 2.153 -9.601 1.00 0.00 C ATOM 1013 SG CYS A 68 -4.933 1.477 -10.303 1.00 0.00 S ATOM 0 H CYS A 68 -1.756 3.256 -7.454 1.00 0.00 H new ATOM 0 HA CYS A 68 -4.601 2.605 -7.939 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -3.134 3.093 -10.092 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -2.560 1.465 -9.788 1.00 0.00 H new ATOM 0 HG CYS A 68 -4.863 1.491 -11.601 1.00 0.00 H new ATOM 1019 N LEU A 69 -4.188 0.354 -6.953 1.00 0.00 N ATOM 1020 CA LEU A 69 -3.978 -0.863 -6.187 1.00 0.00 C ATOM 1021 C LEU A 69 -3.833 -2.047 -7.147 1.00 0.00 C ATOM 1022 O LEU A 69 -4.792 -2.426 -7.818 1.00 0.00 O ATOM 1023 CB LEU A 69 -5.090 -1.043 -5.152 1.00 0.00 C ATOM 1024 CG LEU A 69 -4.634 -1.239 -3.705 1.00 0.00 C ATOM 1025 CD1 LEU A 69 -5.487 -0.408 -2.744 1.00 0.00 C ATOM 1026 CD2 LEU A 69 -4.626 -2.722 -3.328 1.00 0.00 C ATOM 0 H LEU A 69 -5.160 0.543 -7.196 1.00 0.00 H new ATOM 0 HA LEU A 69 -3.051 -0.799 -5.617 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.741 -0.170 -5.192 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -5.693 -1.904 -5.442 1.00 0.00 H new ATOM 0 HG LEU A 69 -3.609 -0.880 -3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -5.142 -0.566 -1.722 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.398 0.648 -2.998 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.530 -0.714 -2.826 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.298 -2.833 -2.294 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.631 -3.130 -3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -3.943 -3.261 -3.985 1.00 0.00 H new ATOM 1038 N VAL A 70 -2.629 -2.596 -7.181 1.00 0.00 N ATOM 1039 CA VAL A 70 -2.347 -3.727 -8.047 1.00 0.00 C ATOM 1040 C VAL A 70 -2.208 -4.992 -7.198 1.00 0.00 C ATOM 1041 O VAL A 70 -1.698 -4.940 -6.080 1.00 0.00 O ATOM 1042 CB VAL A 70 -1.108 -3.440 -8.898 1.00 0.00 C ATOM 1043 CG1 VAL A 70 -0.745 -4.648 -9.764 1.00 0.00 C ATOM 1044 CG2 VAL A 70 -1.311 -2.190 -9.757 1.00 0.00 C ATOM 0 H VAL A 70 -1.837 -2.279 -6.622 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.171 -3.890 -8.742 1.00 0.00 H new ATOM 0 HB VAL A 70 -0.274 -3.250 -8.222 1.00 0.00 H new ATOM 0 HG11 VAL A 70 0.139 -4.417 -10.359 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -0.538 -5.505 -9.124 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -1.577 -4.883 -10.427 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -0.416 -2.008 -10.352 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -2.163 -2.339 -10.420 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -1.498 -1.332 -9.112 1.00 0.00 H new ATOM 1054 N LYS A 71 -2.670 -6.099 -7.761 1.00 0.00 N ATOM 1055 CA LYS A 71 -2.604 -7.374 -7.069 1.00 0.00 C ATOM 1056 C LYS A 71 -1.939 -8.410 -7.979 1.00 0.00 C ATOM 1057 O LYS A 71 -2.286 -8.521 -9.154 1.00 0.00 O ATOM 1058 CB LYS A 71 -3.992 -7.790 -6.577 1.00 0.00 C ATOM 1059 CG LYS A 71 -4.112 -9.314 -6.498 1.00 0.00 C ATOM 1060 CD LYS A 71 -5.514 -9.729 -6.045 1.00 0.00 C ATOM 1061 CE LYS A 71 -5.858 -11.133 -6.548 1.00 0.00 C ATOM 1062 NZ LYS A 71 -7.197 -11.542 -6.065 1.00 0.00 N ATOM 0 H LYS A 71 -3.092 -6.139 -8.689 1.00 0.00 H new ATOM 0 HA LYS A 71 -1.986 -7.290 -6.175 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -4.179 -7.356 -5.595 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -4.754 -7.396 -7.250 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -3.896 -9.751 -7.473 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -3.370 -9.706 -5.802 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -5.571 -9.704 -4.957 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.248 -9.015 -6.419 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -5.837 -11.151 -7.638 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -5.107 -11.844 -6.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -7.416 -12.497 -6.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.205 -11.544 -5.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.912 -10.873 -6.416 1.00 0.00 H new ATOM 1076 N ASP A 72 -0.996 -9.140 -7.402 1.00 0.00 N ATOM 1077 CA ASP A 72 -0.280 -10.161 -8.146 1.00 0.00 C ATOM 1078 C ASP A 72 -1.169 -11.398 -8.291 1.00 0.00 C ATOM 1079 O ASP A 72 -1.412 -12.111 -7.318 1.00 0.00 O ATOM 1080 CB ASP A 72 0.996 -10.581 -7.416 1.00 0.00 C ATOM 1081 CG ASP A 72 1.967 -9.440 -7.102 1.00 0.00 C ATOM 1082 OD1 ASP A 72 1.666 -8.684 -6.154 1.00 0.00 O ATOM 1083 OD2 ASP A 72 2.988 -9.352 -7.817 1.00 0.00 O ATOM 0 H ASP A 72 -0.711 -9.044 -6.427 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.019 -9.747 -9.120 1.00 0.00 H new ATOM 0 HB2 ASP A 72 0.718 -11.069 -6.482 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.515 -11.324 -8.022 1.00 0.00 H new ATOM 1157 N SER A 77 0.235 -11.761 -3.607 1.00 0.00 N ATOM 1158 CA SER A 77 0.483 -10.556 -2.833 1.00 0.00 C ATOM 1159 C SER A 77 -0.016 -9.330 -3.599 1.00 0.00 C ATOM 1160 O SER A 77 -0.257 -9.400 -4.804 1.00 0.00 O ATOM 1161 CB SER A 77 1.970 -10.408 -2.507 1.00 0.00 C ATOM 1162 OG SER A 77 2.211 -9.350 -1.583 1.00 0.00 O ATOM 0 HA SER A 77 -0.062 -10.636 -1.892 1.00 0.00 H new ATOM 0 HB2 SER A 77 2.345 -11.344 -2.093 1.00 0.00 H new ATOM 0 HB3 SER A 77 2.526 -10.221 -3.426 1.00 0.00 H new ATOM 0 HG SER A 77 3.172 -9.289 -1.399 1.00 0.00 H new ATOM 1168 N TYR A 78 -0.157 -8.232 -2.870 1.00 0.00 N ATOM 1169 CA TYR A 78 -0.624 -6.993 -3.465 1.00 0.00 C ATOM 1170 C TYR A 78 0.458 -5.912 -3.399 1.00 0.00 C ATOM 1171 O TYR A 78 1.365 -5.986 -2.572 1.00 0.00 O ATOM 1172 CB TYR A 78 -1.824 -6.548 -2.628 1.00 0.00 C ATOM 1173 CG TYR A 78 -2.889 -7.630 -2.442 1.00 0.00 C ATOM 1174 CD1 TYR A 78 -2.983 -8.668 -3.347 1.00 0.00 C ATOM 1175 CD2 TYR A 78 -3.757 -7.569 -1.371 1.00 0.00 C ATOM 1176 CE1 TYR A 78 -3.985 -9.687 -3.173 1.00 0.00 C ATOM 1177 CE2 TYR A 78 -4.759 -8.588 -1.196 1.00 0.00 C ATOM 1178 CZ TYR A 78 -4.823 -9.597 -2.106 1.00 0.00 C ATOM 1179 OH TYR A 78 -5.771 -10.560 -1.942 1.00 0.00 O ATOM 0 H TYR A 78 0.045 -8.176 -1.872 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.880 -7.144 -4.514 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -1.471 -6.228 -1.648 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.282 -5.680 -3.101 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -2.305 -8.716 -4.186 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -3.685 -6.756 -0.663 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -4.069 -10.504 -3.874 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -5.444 -8.552 -0.362 1.00 0.00 H new ATOM 0 HH TYR A 78 -6.297 -10.368 -1.138 1.00 0.00 H new ATOM 1189 N PHE A 79 0.325 -4.932 -4.281 1.00 0.00 N ATOM 1190 CA PHE A 79 1.279 -3.837 -4.334 1.00 0.00 C ATOM 1191 C PHE A 79 0.566 -2.496 -4.521 1.00 0.00 C ATOM 1192 O PHE A 79 -0.311 -2.370 -5.374 1.00 0.00 O ATOM 1193 CB PHE A 79 2.186 -4.092 -5.540 1.00 0.00 C ATOM 1194 CG PHE A 79 3.141 -5.274 -5.361 1.00 0.00 C ATOM 1195 CD1 PHE A 79 3.755 -5.477 -4.165 1.00 0.00 C ATOM 1196 CD2 PHE A 79 3.376 -6.121 -6.398 1.00 0.00 C ATOM 1197 CE1 PHE A 79 4.642 -6.574 -3.999 1.00 0.00 C ATOM 1198 CE2 PHE A 79 4.263 -7.218 -6.233 1.00 0.00 C ATOM 1199 CZ PHE A 79 4.877 -7.421 -5.037 1.00 0.00 C ATOM 0 H PHE A 79 -0.429 -4.873 -4.965 1.00 0.00 H new ATOM 0 HA PHE A 79 1.844 -3.790 -3.403 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.565 -4.270 -6.418 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.770 -3.193 -5.739 1.00 0.00 H new ATOM 0 HD1 PHE A 79 3.568 -4.804 -3.341 1.00 0.00 H new ATOM 0 HD2 PHE A 79 2.888 -5.960 -7.348 1.00 0.00 H new ATOM 0 HE1 PHE A 79 5.130 -6.735 -3.049 1.00 0.00 H new ATOM 0 HE2 PHE A 79 4.450 -7.891 -7.057 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.552 -8.255 -4.911 1.00 0.00 H new ATOM 1209 N LEU A 80 0.969 -1.530 -3.709 1.00 0.00 N ATOM 1210 CA LEU A 80 0.380 -0.204 -3.775 1.00 0.00 C ATOM 1211 C LEU A 80 1.478 0.824 -4.052 1.00 0.00 C ATOM 1212 O LEU A 80 2.442 0.928 -3.296 1.00 0.00 O ATOM 1213 CB LEU A 80 -0.429 0.086 -2.508 1.00 0.00 C ATOM 1214 CG LEU A 80 -1.294 1.348 -2.539 1.00 0.00 C ATOM 1215 CD1 LEU A 80 -1.931 1.542 -3.916 1.00 0.00 C ATOM 1216 CD2 LEU A 80 -2.339 1.323 -1.422 1.00 0.00 C ATOM 0 H LEU A 80 1.696 -1.639 -3.002 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.330 -0.143 -4.600 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -1.075 -0.769 -2.310 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.263 0.164 -1.669 1.00 0.00 H new ATOM 0 HG LEU A 80 -0.650 2.209 -2.358 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -2.540 2.446 -3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.148 1.636 -4.669 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -2.559 0.682 -4.151 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.941 2.231 -1.466 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -2.984 0.454 -1.547 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -1.838 1.267 -0.456 1.00 0.00 H new ATOM 1228 N ARG A 81 1.295 1.560 -5.139 1.00 0.00 N ATOM 1229 CA ARG A 81 2.259 2.576 -5.525 1.00 0.00 C ATOM 1230 C ARG A 81 1.537 3.823 -6.041 1.00 0.00 C ATOM 1231 O ARG A 81 0.371 3.754 -6.429 1.00 0.00 O ATOM 1232 CB ARG A 81 3.202 2.056 -6.612 1.00 0.00 C ATOM 1233 CG ARG A 81 2.560 0.907 -7.392 1.00 0.00 C ATOM 1234 CD ARG A 81 3.203 0.754 -8.771 1.00 0.00 C ATOM 1235 NE ARG A 81 4.498 0.048 -8.651 1.00 0.00 N ATOM 1236 CZ ARG A 81 5.266 -0.296 -9.694 1.00 0.00 C ATOM 1237 NH1 ARG A 81 4.873 -0.002 -10.941 1.00 0.00 N ATOM 1238 NH2 ARG A 81 6.426 -0.935 -9.490 1.00 0.00 N ATOM 0 H ARG A 81 0.494 1.473 -5.764 1.00 0.00 H new ATOM 0 HA ARG A 81 2.845 2.830 -4.642 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.457 2.866 -7.295 1.00 0.00 H new ATOM 0 HB3 ARG A 81 4.133 1.717 -6.159 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.667 -0.022 -6.832 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.491 1.091 -7.503 1.00 0.00 H new ATOM 0 HD2 ARG A 81 2.537 0.199 -9.432 1.00 0.00 H new ATOM 0 HD3 ARG A 81 3.355 1.735 -9.221 1.00 0.00 H new ATOM 0 HE ARG A 81 4.827 -0.192 -7.716 1.00 0.00 H new ATOM 0 HH11 ARG A 81 3.989 0.484 -11.096 1.00 0.00 H new ATOM 0 HH12 ARG A 81 5.457 -0.264 -11.735 1.00 0.00 H new ATOM 0 HH21 ARG A 81 6.724 -1.160 -8.541 1.00 0.00 H new ATOM 0 HH22 ARG A 81 7.010 -1.197 -10.284 1.00 0.00 H new ATOM 1252 N ILE A 82 2.259 4.934 -6.029 1.00 0.00 N ATOM 1253 CA ILE A 82 1.702 6.193 -6.491 1.00 0.00 C ATOM 1254 C ILE A 82 2.493 6.681 -7.706 1.00 0.00 C ATOM 1255 O ILE A 82 3.706 6.493 -7.777 1.00 0.00 O ATOM 1256 CB ILE A 82 1.647 7.207 -5.345 1.00 0.00 C ATOM 1257 CG1 ILE A 82 0.488 6.898 -4.396 1.00 0.00 C ATOM 1258 CG2 ILE A 82 1.583 8.638 -5.881 1.00 0.00 C ATOM 1259 CD1 ILE A 82 0.991 6.685 -2.967 1.00 0.00 C ATOM 0 H ILE A 82 3.225 4.988 -5.706 1.00 0.00 H new ATOM 0 HA ILE A 82 0.670 6.057 -6.816 1.00 0.00 H new ATOM 0 HB ILE A 82 2.568 7.121 -4.768 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -0.230 7.718 -4.414 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -0.038 6.006 -4.737 1.00 0.00 H new ATOM 0 HG21 ILE A 82 1.545 9.338 -5.046 1.00 0.00 H new ATOM 0 HG22 ILE A 82 2.468 8.841 -6.484 1.00 0.00 H new ATOM 0 HG23 ILE A 82 0.690 8.757 -6.495 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.147 6.467 -2.313 1.00 0.00 H new ATOM 0 HD12 ILE A 82 1.690 5.849 -2.948 1.00 0.00 H new ATOM 0 HD13 ILE A 82 1.495 7.587 -2.620 1.00 0.00 H new ATOM 1271 N PHE A 83 1.773 7.299 -8.631 1.00 0.00 N ATOM 1272 CA PHE A 83 2.394 7.816 -9.839 1.00 0.00 C ATOM 1273 C PHE A 83 2.167 9.323 -9.970 1.00 0.00 C ATOM 1274 O PHE A 83 1.141 9.841 -9.531 1.00 0.00 O ATOM 1275 CB PHE A 83 1.728 7.108 -11.021 1.00 0.00 C ATOM 1276 CG PHE A 83 0.928 5.864 -10.630 1.00 0.00 C ATOM 1277 CD1 PHE A 83 1.468 4.943 -9.789 1.00 0.00 C ATOM 1278 CD2 PHE A 83 -0.327 5.680 -11.124 1.00 0.00 C ATOM 1279 CE1 PHE A 83 0.726 3.789 -9.426 1.00 0.00 C ATOM 1280 CE2 PHE A 83 -1.070 4.525 -10.761 1.00 0.00 C ATOM 1281 CZ PHE A 83 -0.529 3.604 -9.920 1.00 0.00 C ATOM 0 H PHE A 83 0.767 7.453 -8.568 1.00 0.00 H new ATOM 0 HA PHE A 83 3.469 7.639 -9.810 1.00 0.00 H new ATOM 0 HB2 PHE A 83 1.064 7.811 -11.525 1.00 0.00 H new ATOM 0 HB3 PHE A 83 2.496 6.823 -11.740 1.00 0.00 H new ATOM 0 HD1 PHE A 83 2.463 5.090 -9.396 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -0.758 6.412 -11.792 1.00 0.00 H new ATOM 0 HE1 PHE A 83 1.157 3.058 -8.758 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -2.065 4.378 -11.153 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.094 2.726 -9.644 1.00 0.00 H new ATOM 1291 N ASP A 84 3.142 9.986 -10.578 1.00 0.00 N ATOM 1292 CA ASP A 84 3.062 11.423 -10.772 1.00 0.00 C ATOM 1293 C ASP A 84 2.060 11.727 -11.888 1.00 0.00 C ATOM 1294 O ASP A 84 1.866 10.914 -12.791 1.00 0.00 O ATOM 1295 CB ASP A 84 4.417 12.000 -11.183 1.00 0.00 C ATOM 1296 CG ASP A 84 4.682 13.429 -10.708 1.00 0.00 C ATOM 1297 OD1 ASP A 84 3.692 14.185 -10.600 1.00 0.00 O ATOM 1298 OD2 ASP A 84 5.870 13.736 -10.466 1.00 0.00 O ATOM 0 H ASP A 84 3.991 9.553 -10.942 1.00 0.00 H new ATOM 0 HA ASP A 84 2.750 11.874 -9.830 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.203 11.353 -10.795 1.00 0.00 H new ATOM 0 HB3 ASP A 84 4.491 11.975 -12.270 1.00 0.00 H new ATOM 1303 N ILE A 85 1.451 12.900 -11.789 1.00 0.00 N ATOM 1304 CA ILE A 85 0.475 13.321 -12.779 1.00 0.00 C ATOM 1305 C ILE A 85 1.163 14.202 -13.825 1.00 0.00 C ATOM 1306 O ILE A 85 0.579 14.509 -14.864 1.00 0.00 O ATOM 1307 CB ILE A 85 -0.721 13.993 -12.101 1.00 0.00 C ATOM 1308 CG1 ILE A 85 -1.717 14.516 -13.138 1.00 0.00 C ATOM 1309 CG2 ILE A 85 -0.260 15.094 -11.143 1.00 0.00 C ATOM 1310 CD1 ILE A 85 -3.052 14.876 -12.483 1.00 0.00 C ATOM 0 H ILE A 85 1.615 13.571 -11.039 1.00 0.00 H new ATOM 0 HA ILE A 85 0.070 12.457 -13.305 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.241 13.243 -11.505 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.303 15.394 -13.635 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -1.877 13.760 -13.907 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.129 15.556 -10.674 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.381 14.662 -10.374 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.297 15.849 -11.698 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -3.742 15.245 -13.242 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -3.475 13.991 -12.008 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -2.892 15.649 -11.732 1.00 0.00 H new ATOM 1322 N LYS A 86 2.393 14.581 -13.515 1.00 0.00 N ATOM 1323 CA LYS A 86 3.167 15.420 -14.415 1.00 0.00 C ATOM 1324 C LYS A 86 4.332 14.608 -14.987 1.00 0.00 C ATOM 1325 O LYS A 86 4.634 14.701 -16.175 1.00 0.00 O ATOM 1326 CB LYS A 86 3.601 16.705 -13.709 1.00 0.00 C ATOM 1327 CG LYS A 86 2.722 17.886 -14.128 1.00 0.00 C ATOM 1328 CD LYS A 86 3.434 19.216 -13.877 1.00 0.00 C ATOM 1329 CE LYS A 86 2.978 19.842 -12.559 1.00 0.00 C ATOM 1330 NZ LYS A 86 4.100 20.552 -11.906 1.00 0.00 N ATOM 0 H LYS A 86 2.874 14.323 -12.653 1.00 0.00 H new ATOM 0 HA LYS A 86 2.556 15.739 -15.259 1.00 0.00 H new ATOM 0 HB2 LYS A 86 3.542 16.568 -12.629 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.643 16.920 -13.947 1.00 0.00 H new ATOM 0 HG2 LYS A 86 2.469 17.799 -15.185 1.00 0.00 H new ATOM 0 HG3 LYS A 86 1.784 17.861 -13.573 1.00 0.00 H new ATOM 0 HD2 LYS A 86 4.512 19.057 -13.854 1.00 0.00 H new ATOM 0 HD3 LYS A 86 3.231 19.902 -14.699 1.00 0.00 H new ATOM 0 HE2 LYS A 86 2.159 20.537 -12.744 1.00 0.00 H new ATOM 0 HE3 LYS A 86 2.595 19.067 -11.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 3.772 20.971 -11.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 4.870 19.880 -11.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 4.447 21.304 -12.534 1.00 0.00 H new ATOM 1344 N ASP A 87 4.954 13.831 -14.113 1.00 0.00 N ATOM 1345 CA ASP A 87 6.078 13.004 -14.516 1.00 0.00 C ATOM 1346 C ASP A 87 5.563 11.642 -14.988 1.00 0.00 C ATOM 1347 O ASP A 87 6.304 10.869 -15.591 1.00 0.00 O ATOM 1348 CB ASP A 87 7.035 12.767 -13.346 1.00 0.00 C ATOM 1349 CG ASP A 87 8.305 13.618 -13.367 1.00 0.00 C ATOM 1350 OD1 ASP A 87 8.221 14.750 -13.889 1.00 0.00 O ATOM 1351 OD2 ASP A 87 9.332 13.118 -12.858 1.00 0.00 O ATOM 0 H ASP A 87 4.701 13.757 -13.128 1.00 0.00 H new ATOM 0 HA ASP A 87 6.607 13.522 -15.316 1.00 0.00 H new ATOM 0 HB2 ASP A 87 6.502 12.960 -12.415 1.00 0.00 H new ATOM 0 HB3 ASP A 87 7.321 11.715 -13.337 1.00 0.00 H new ATOM 1356 N GLY A 88 4.294 11.392 -14.694 1.00 0.00 N ATOM 1357 CA GLY A 88 3.671 10.138 -15.081 1.00 0.00 C ATOM 1358 C GLY A 88 4.551 8.947 -14.699 1.00 0.00 C ATOM 1359 O GLY A 88 4.525 7.913 -15.364 1.00 0.00 O ATOM 0 H GLY A 88 3.682 12.036 -14.193 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.699 10.046 -14.597 1.00 0.00 H new ATOM 0 HA3 GLY A 88 3.493 10.133 -16.156 1.00 0.00 H new ATOM 1363 N LYS A 89 5.312 9.132 -13.629 1.00 0.00 N ATOM 1364 CA LYS A 89 6.199 8.085 -13.151 1.00 0.00 C ATOM 1365 C LYS A 89 5.850 7.750 -11.700 1.00 0.00 C ATOM 1366 O LYS A 89 5.016 8.417 -11.088 1.00 0.00 O ATOM 1367 CB LYS A 89 7.660 8.488 -13.356 1.00 0.00 C ATOM 1368 CG LYS A 89 8.144 8.106 -14.756 1.00 0.00 C ATOM 1369 CD LYS A 89 9.610 8.493 -14.954 1.00 0.00 C ATOM 1370 CE LYS A 89 9.997 8.437 -16.433 1.00 0.00 C ATOM 1371 NZ LYS A 89 10.958 7.338 -16.678 1.00 0.00 N ATOM 0 H LYS A 89 5.332 9.991 -13.080 1.00 0.00 H new ATOM 0 HA LYS A 89 6.060 7.172 -13.730 1.00 0.00 H new ATOM 0 HB2 LYS A 89 7.768 9.563 -13.211 1.00 0.00 H new ATOM 0 HB3 LYS A 89 8.284 8.001 -12.606 1.00 0.00 H new ATOM 0 HG2 LYS A 89 8.024 7.033 -14.906 1.00 0.00 H new ATOM 0 HG3 LYS A 89 7.529 8.603 -15.506 1.00 0.00 H new ATOM 0 HD2 LYS A 89 9.780 9.498 -14.568 1.00 0.00 H new ATOM 0 HD3 LYS A 89 10.248 7.820 -14.382 1.00 0.00 H new ATOM 0 HE2 LYS A 89 9.105 8.291 -17.043 1.00 0.00 H new ATOM 0 HE3 LYS A 89 10.438 9.387 -16.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 11.209 7.315 -17.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 11.816 7.494 -16.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 10.525 6.432 -16.409 1.00 0.00 H new ATOM 1385 N LEU A 90 6.506 6.717 -11.190 1.00 0.00 N ATOM 1386 CA LEU A 90 6.276 6.286 -9.822 1.00 0.00 C ATOM 1387 C LEU A 90 6.883 7.309 -8.861 1.00 0.00 C ATOM 1388 O LEU A 90 8.043 7.693 -9.008 1.00 0.00 O ATOM 1389 CB LEU A 90 6.796 4.862 -9.615 1.00 0.00 C ATOM 1390 CG LEU A 90 6.871 4.381 -8.164 1.00 0.00 C ATOM 1391 CD1 LEU A 90 6.658 2.868 -8.077 1.00 0.00 C ATOM 1392 CD2 LEU A 90 8.184 4.814 -7.510 1.00 0.00 C ATOM 0 H LEU A 90 7.197 6.166 -11.700 1.00 0.00 H new ATOM 0 HA LEU A 90 5.208 6.244 -9.610 1.00 0.00 H new ATOM 0 HB2 LEU A 90 6.155 4.178 -10.171 1.00 0.00 H new ATOM 0 HB3 LEU A 90 7.792 4.793 -10.052 1.00 0.00 H new ATOM 0 HG LEU A 90 6.063 4.853 -7.605 1.00 0.00 H new ATOM 0 HD11 LEU A 90 6.716 2.552 -7.036 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.677 2.615 -8.479 1.00 0.00 H new ATOM 0 HD13 LEU A 90 7.429 2.358 -8.655 1.00 0.00 H new ATOM 0 HD21 LEU A 90 8.212 4.459 -6.480 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.023 4.390 -8.062 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.255 5.902 -7.521 1.00 0.00 H new ATOM 1404 N LEU A 91 6.073 7.722 -7.896 1.00 0.00 N ATOM 1405 CA LEU A 91 6.516 8.692 -6.910 1.00 0.00 C ATOM 1406 C LEU A 91 6.600 8.019 -5.539 1.00 0.00 C ATOM 1407 O LEU A 91 7.190 8.567 -4.610 1.00 0.00 O ATOM 1408 CB LEU A 91 5.616 9.930 -6.934 1.00 0.00 C ATOM 1409 CG LEU A 91 6.014 11.031 -7.919 1.00 0.00 C ATOM 1410 CD1 LEU A 91 5.132 12.269 -7.744 1.00 0.00 C ATOM 1411 CD2 LEU A 91 7.503 11.365 -7.795 1.00 0.00 C ATOM 0 H LEU A 91 5.112 7.402 -7.777 1.00 0.00 H new ATOM 0 HA LEU A 91 7.517 9.049 -7.151 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.600 9.611 -7.167 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.594 10.358 -5.932 1.00 0.00 H new ATOM 0 HG LEU A 91 5.850 10.660 -8.931 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.436 13.036 -8.456 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.090 12.002 -7.921 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.240 12.652 -6.729 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.760 12.150 -8.506 1.00 0.00 H new ATOM 0 HD22 LEU A 91 7.716 11.708 -6.783 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.095 10.475 -8.008 1.00 0.00 H new ATOM 1423 N TRP A 92 6.000 6.841 -5.457 1.00 0.00 N ATOM 1424 CA TRP A 92 6.000 6.086 -4.215 1.00 0.00 C ATOM 1425 C TRP A 92 5.629 4.639 -4.541 1.00 0.00 C ATOM 1426 O TRP A 92 4.830 4.387 -5.442 1.00 0.00 O ATOM 1427 CB TRP A 92 5.064 6.726 -3.186 1.00 0.00 C ATOM 1428 CG TRP A 92 5.112 6.066 -1.807 1.00 0.00 C ATOM 1429 CD1 TRP A 92 6.051 6.199 -0.861 1.00 0.00 C ATOM 1430 CD2 TRP A 92 4.137 5.157 -1.255 1.00 0.00 C ATOM 1431 NE1 TRP A 92 5.753 5.446 0.258 1.00 0.00 N ATOM 1432 CE2 TRP A 92 4.552 4.792 0.010 1.00 0.00 C ATOM 1433 CE3 TRP A 92 2.943 4.658 -1.805 1.00 0.00 C ATOM 1434 CZ2 TRP A 92 3.833 3.915 0.830 1.00 0.00 C ATOM 1435 CZ3 TRP A 92 2.235 3.782 -0.972 1.00 0.00 C ATOM 1436 CH2 TRP A 92 2.641 3.406 0.303 1.00 0.00 C ATOM 0 H TRP A 92 5.510 6.390 -6.230 1.00 0.00 H new ATOM 0 HA TRP A 92 6.989 6.096 -3.757 1.00 0.00 H new ATOM 0 HB2 TRP A 92 5.321 7.780 -3.082 1.00 0.00 H new ATOM 0 HB3 TRP A 92 4.042 6.683 -3.563 1.00 0.00 H new ATOM 0 HD1 TRP A 92 6.931 6.817 -0.961 1.00 0.00 H new ATOM 0 HE1 TRP A 92 6.311 5.382 1.109 1.00 0.00 H new ATOM 0 HE3 TRP A 92 2.599 4.929 -2.792 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 4.180 3.646 1.817 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 1.309 3.370 -1.347 1.00 0.00 H new ATOM 0 HH2 TRP A 92 2.039 2.724 0.885 1.00 0.00 H new ATOM 1447 N GLU A 93 6.228 3.725 -3.792 1.00 0.00 N ATOM 1448 CA GLU A 93 5.971 2.308 -3.990 1.00 0.00 C ATOM 1449 C GLU A 93 5.979 1.575 -2.648 1.00 0.00 C ATOM 1450 O GLU A 93 6.895 1.751 -1.845 1.00 0.00 O ATOM 1451 CB GLU A 93 6.989 1.696 -4.955 1.00 0.00 C ATOM 1452 CG GLU A 93 8.307 1.392 -4.242 1.00 0.00 C ATOM 1453 CD GLU A 93 9.347 0.843 -5.221 1.00 0.00 C ATOM 1454 OE1 GLU A 93 9.743 1.616 -6.120 1.00 0.00 O ATOM 1455 OE2 GLU A 93 9.721 -0.337 -5.049 1.00 0.00 O ATOM 0 H GLU A 93 6.891 3.938 -3.047 1.00 0.00 H new ATOM 0 HA GLU A 93 4.983 2.197 -4.437 1.00 0.00 H new ATOM 0 HB2 GLU A 93 6.584 0.779 -5.384 1.00 0.00 H new ATOM 0 HB3 GLU A 93 7.169 2.382 -5.782 1.00 0.00 H new ATOM 0 HG2 GLU A 93 8.688 2.299 -3.772 1.00 0.00 H new ATOM 0 HG3 GLU A 93 8.135 0.668 -3.445 1.00 0.00 H new ATOM 1462 N GLN A 94 4.949 0.766 -2.445 1.00 0.00 N ATOM 1463 CA GLN A 94 4.825 0.005 -1.214 1.00 0.00 C ATOM 1464 C GLN A 94 4.605 -1.476 -1.526 1.00 0.00 C ATOM 1465 O GLN A 94 3.803 -1.820 -2.392 1.00 0.00 O ATOM 1466 CB GLN A 94 3.697 0.555 -0.340 1.00 0.00 C ATOM 1467 CG GLN A 94 4.196 0.861 1.074 1.00 0.00 C ATOM 1468 CD GLN A 94 4.861 -0.366 1.698 1.00 0.00 C ATOM 1469 OE1 GLN A 94 6.073 -0.461 1.805 1.00 0.00 O ATOM 1470 NE2 GLN A 94 4.004 -1.299 2.103 1.00 0.00 N ATOM 0 H GLN A 94 4.192 0.621 -3.113 1.00 0.00 H new ATOM 0 HA GLN A 94 5.755 0.104 -0.654 1.00 0.00 H new ATOM 0 HB2 GLN A 94 3.292 1.461 -0.790 1.00 0.00 H new ATOM 0 HB3 GLN A 94 2.883 -0.168 -0.293 1.00 0.00 H new ATOM 0 HG2 GLN A 94 4.906 1.687 1.042 1.00 0.00 H new ATOM 0 HG3 GLN A 94 3.361 1.183 1.696 1.00 0.00 H new ATOM 0 HE21 GLN A 94 3.001 -1.157 1.984 1.00 0.00 H new ATOM 0 HE22 GLN A 94 4.350 -2.157 2.533 1.00 0.00 H new ATOM 1479 N GLU A 95 5.332 -2.315 -0.802 1.00 0.00 N ATOM 1480 CA GLU A 95 5.227 -3.751 -0.991 1.00 0.00 C ATOM 1481 C GLU A 95 4.397 -4.375 0.133 1.00 0.00 C ATOM 1482 O GLU A 95 4.948 -4.869 1.116 1.00 0.00 O ATOM 1483 CB GLU A 95 6.612 -4.398 -1.072 1.00 0.00 C ATOM 1484 CG GLU A 95 7.024 -4.629 -2.527 1.00 0.00 C ATOM 1485 CD GLU A 95 8.489 -4.243 -2.750 1.00 0.00 C ATOM 1486 OE1 GLU A 95 8.720 -3.059 -3.077 1.00 0.00 O ATOM 1487 OE2 GLU A 95 9.343 -5.141 -2.589 1.00 0.00 O ATOM 0 H GLU A 95 5.996 -2.027 -0.083 1.00 0.00 H new ATOM 0 HA GLU A 95 4.720 -3.936 -1.938 1.00 0.00 H new ATOM 0 HB2 GLU A 95 7.345 -3.759 -0.580 1.00 0.00 H new ATOM 0 HB3 GLU A 95 6.606 -5.348 -0.537 1.00 0.00 H new ATOM 0 HG2 GLU A 95 6.876 -5.677 -2.789 1.00 0.00 H new ATOM 0 HG3 GLU A 95 6.385 -4.043 -3.187 1.00 0.00 H new ATOM 1494 N LEU A 96 3.085 -4.332 -0.049 1.00 0.00 N ATOM 1495 CA LEU A 96 2.174 -4.886 0.937 1.00 0.00 C ATOM 1496 C LEU A 96 2.755 -6.190 1.485 1.00 0.00 C ATOM 1497 O LEU A 96 3.532 -6.862 0.808 1.00 0.00 O ATOM 1498 CB LEU A 96 0.771 -5.038 0.345 1.00 0.00 C ATOM 1499 CG LEU A 96 0.192 -3.796 -0.335 1.00 0.00 C ATOM 1500 CD1 LEU A 96 -1.286 -3.996 -0.676 1.00 0.00 C ATOM 1501 CD2 LEU A 96 0.419 -2.547 0.521 1.00 0.00 C ATOM 0 H LEU A 96 2.632 -3.922 -0.865 1.00 0.00 H new ATOM 0 HA LEU A 96 2.066 -4.205 1.781 1.00 0.00 H new ATOM 0 HB2 LEU A 96 0.791 -5.850 -0.382 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.093 -5.341 1.143 1.00 0.00 H new ATOM 0 HG LEU A 96 0.721 -3.643 -1.276 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.673 -3.098 -1.158 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.392 -4.845 -1.351 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.848 -4.187 0.238 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -0.002 -1.678 0.015 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.068 -2.675 1.488 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.488 -2.397 0.670 1.00 0.00 H new ATOM 1513 N TYR A 97 2.355 -6.511 2.707 1.00 0.00 N ATOM 1514 CA TYR A 97 2.826 -7.724 3.354 1.00 0.00 C ATOM 1515 C TYR A 97 1.658 -8.644 3.714 1.00 0.00 C ATOM 1516 O TYR A 97 0.510 -8.203 3.769 1.00 0.00 O ATOM 1517 CB TYR A 97 3.519 -7.273 4.642 1.00 0.00 C ATOM 1518 CG TYR A 97 2.899 -6.028 5.280 1.00 0.00 C ATOM 1519 CD1 TYR A 97 3.185 -4.777 4.771 1.00 0.00 C ATOM 1520 CD2 TYR A 97 2.053 -6.156 6.362 1.00 0.00 C ATOM 1521 CE1 TYR A 97 2.601 -3.606 5.371 1.00 0.00 C ATOM 1522 CE2 TYR A 97 1.470 -4.985 6.962 1.00 0.00 C ATOM 1523 CZ TYR A 97 1.772 -3.767 6.437 1.00 0.00 C ATOM 1524 OH TYR A 97 1.221 -2.660 7.003 1.00 0.00 O ATOM 0 H TYR A 97 1.710 -5.952 3.266 1.00 0.00 H new ATOM 0 HA TYR A 97 3.492 -8.278 2.692 1.00 0.00 H new ATOM 0 HB2 TYR A 97 3.491 -8.090 5.363 1.00 0.00 H new ATOM 0 HB3 TYR A 97 4.569 -7.074 4.427 1.00 0.00 H new ATOM 0 HD1 TYR A 97 3.846 -4.677 3.923 1.00 0.00 H new ATOM 0 HD2 TYR A 97 1.828 -7.135 6.759 1.00 0.00 H new ATOM 0 HE1 TYR A 97 2.816 -2.621 4.983 1.00 0.00 H new ATOM 0 HE2 TYR A 97 0.807 -5.071 7.810 1.00 0.00 H new ATOM 0 HH TYR A 97 0.650 -2.926 7.754 1.00 0.00 H new ATOM 1534 N ASN A 98 1.989 -9.905 3.948 1.00 0.00 N ATOM 1535 CA ASN A 98 0.981 -10.890 4.301 1.00 0.00 C ATOM 1536 C ASN A 98 0.104 -10.336 5.425 1.00 0.00 C ATOM 1537 O ASN A 98 0.580 -9.589 6.277 1.00 0.00 O ATOM 1538 CB ASN A 98 1.627 -12.185 4.799 1.00 0.00 C ATOM 1539 CG ASN A 98 0.842 -13.408 4.319 1.00 0.00 C ATOM 1540 OD1 ASN A 98 -0.307 -13.619 4.670 1.00 0.00 O ATOM 1541 ND2 ASN A 98 1.526 -14.202 3.499 1.00 0.00 N ATOM 0 H ASN A 98 2.941 -10.267 3.900 1.00 0.00 H new ATOM 0 HA ASN A 98 0.390 -11.101 3.410 1.00 0.00 H new ATOM 0 HB2 ASN A 98 2.655 -12.244 4.441 1.00 0.00 H new ATOM 0 HB3 ASN A 98 1.669 -12.180 5.888 1.00 0.00 H new ATOM 0 HD21 ASN A 98 1.091 -15.045 3.125 1.00 0.00 H new ATOM 0 HD22 ASN A 98 2.486 -13.967 3.245 1.00 0.00 H new ATOM 1548 N ASN A 99 -1.162 -10.727 5.391 1.00 0.00 N ATOM 1549 CA ASN A 99 -2.110 -10.278 6.397 1.00 0.00 C ATOM 1550 C ASN A 99 -2.078 -8.750 6.478 1.00 0.00 C ATOM 1551 O ASN A 99 -1.780 -8.187 7.531 1.00 0.00 O ATOM 1552 CB ASN A 99 -1.752 -10.832 7.778 1.00 0.00 C ATOM 1553 CG ASN A 99 -2.460 -12.164 8.035 1.00 0.00 C ATOM 1554 OD1 ASN A 99 -1.895 -13.236 7.885 1.00 0.00 O ATOM 1555 ND2 ASN A 99 -3.723 -12.038 8.428 1.00 0.00 N ATOM 0 H ASN A 99 -1.553 -11.349 4.683 1.00 0.00 H new ATOM 0 HA ASN A 99 -3.099 -10.635 6.110 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.673 -10.970 7.850 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.033 -10.112 8.547 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -4.281 -12.869 8.624 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -4.134 -11.111 8.533 1.00 0.00 H new ATOM 1562 N PHE A 100 -2.388 -8.124 5.353 1.00 0.00 N ATOM 1563 CA PHE A 100 -2.399 -6.673 5.283 1.00 0.00 C ATOM 1564 C PHE A 100 -3.769 -6.115 5.673 1.00 0.00 C ATOM 1565 O PHE A 100 -4.800 -6.656 5.275 1.00 0.00 O ATOM 1566 CB PHE A 100 -2.100 -6.293 3.832 1.00 0.00 C ATOM 1567 CG PHE A 100 -1.949 -4.787 3.601 1.00 0.00 C ATOM 1568 CD1 PHE A 100 -0.816 -4.149 4.000 1.00 0.00 C ATOM 1569 CD2 PHE A 100 -2.947 -4.089 2.997 1.00 0.00 C ATOM 1570 CE1 PHE A 100 -0.676 -2.753 3.786 1.00 0.00 C ATOM 1571 CE2 PHE A 100 -2.806 -2.692 2.783 1.00 0.00 C ATOM 1572 CZ PHE A 100 -1.674 -2.053 3.182 1.00 0.00 C ATOM 0 H PHE A 100 -2.634 -8.595 4.482 1.00 0.00 H new ATOM 0 HA PHE A 100 -1.661 -6.262 5.971 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -1.183 -6.792 3.518 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -2.901 -6.669 3.196 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -0.023 -4.704 4.479 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -3.846 -4.596 2.680 1.00 0.00 H new ATOM 0 HE1 PHE A 100 0.223 -2.246 4.103 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -3.598 -2.137 2.303 1.00 0.00 H new ATOM 0 HZ PHE A 100 -1.567 -0.991 3.020 1.00 0.00 H new ATOM 1582 N VAL A 101 -3.737 -5.039 6.445 1.00 0.00 N ATOM 1583 CA VAL A 101 -4.964 -4.401 6.892 1.00 0.00 C ATOM 1584 C VAL A 101 -4.941 -2.924 6.494 1.00 0.00 C ATOM 1585 O VAL A 101 -3.874 -2.355 6.270 1.00 0.00 O ATOM 1586 CB VAL A 101 -5.145 -4.612 8.397 1.00 0.00 C ATOM 1587 CG1 VAL A 101 -6.283 -3.746 8.939 1.00 0.00 C ATOM 1588 CG2 VAL A 101 -5.378 -6.089 8.720 1.00 0.00 C ATOM 0 H VAL A 101 -2.880 -4.592 6.773 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.829 -4.854 6.407 1.00 0.00 H new ATOM 0 HB VAL A 101 -4.224 -4.303 8.891 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -6.390 -3.915 10.010 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -6.058 -2.695 8.758 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -7.213 -4.010 8.435 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -5.503 -6.211 9.796 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.276 -6.436 8.208 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -4.521 -6.674 8.386 1.00 0.00 H new ATOM 1598 N TYR A 102 -6.131 -2.346 6.417 1.00 0.00 N ATOM 1599 CA TYR A 102 -6.260 -0.947 6.049 1.00 0.00 C ATOM 1600 C TYR A 102 -6.925 -0.145 7.169 1.00 0.00 C ATOM 1601 O TYR A 102 -8.058 -0.431 7.555 1.00 0.00 O ATOM 1602 CB TYR A 102 -7.162 -0.917 4.813 1.00 0.00 C ATOM 1603 CG TYR A 102 -6.702 0.061 3.731 1.00 0.00 C ATOM 1604 CD1 TYR A 102 -5.926 1.150 4.070 1.00 0.00 C ATOM 1605 CD2 TYR A 102 -7.063 -0.145 2.415 1.00 0.00 C ATOM 1606 CE1 TYR A 102 -5.493 2.072 3.051 1.00 0.00 C ATOM 1607 CE2 TYR A 102 -6.630 0.775 1.396 1.00 0.00 C ATOM 1608 CZ TYR A 102 -5.866 1.838 1.764 1.00 0.00 C ATOM 1609 OH TYR A 102 -5.457 2.708 0.802 1.00 0.00 O ATOM 0 H TYR A 102 -7.014 -2.821 6.603 1.00 0.00 H new ATOM 0 HA TYR A 102 -5.280 -0.508 5.863 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -7.210 -1.919 4.386 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -8.174 -0.653 5.121 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -5.643 1.312 5.100 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.671 -0.997 2.149 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -4.886 2.929 3.303 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -6.906 0.624 0.363 1.00 0.00 H new ATOM 0 HH TYR A 102 -5.891 2.484 -0.048 1.00 0.00 H new ATOM 1619 N ASN A 103 -6.193 0.844 7.661 1.00 0.00 N ATOM 1620 CA ASN A 103 -6.697 1.689 8.730 1.00 0.00 C ATOM 1621 C ASN A 103 -7.430 2.887 8.123 1.00 0.00 C ATOM 1622 O ASN A 103 -6.904 3.556 7.234 1.00 0.00 O ATOM 1623 CB ASN A 103 -5.555 2.222 9.596 1.00 0.00 C ATOM 1624 CG ASN A 103 -4.681 1.079 10.116 1.00 0.00 C ATOM 1625 OD1 ASN A 103 -3.776 0.602 9.452 1.00 0.00 O ATOM 1626 ND2 ASN A 103 -5.003 0.666 11.339 1.00 0.00 N ATOM 0 H ASN A 103 -5.254 1.079 7.339 1.00 0.00 H new ATOM 0 HA ASN A 103 -7.367 1.090 9.347 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -4.946 2.915 9.015 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -5.963 2.784 10.436 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -4.480 -0.094 11.775 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -5.773 1.109 11.841 1.00 0.00 H new ATOM 1633 N SER A 104 -8.632 3.123 8.628 1.00 0.00 N ATOM 1634 CA SER A 104 -9.442 4.229 8.148 1.00 0.00 C ATOM 1635 C SER A 104 -10.323 4.763 9.279 1.00 0.00 C ATOM 1636 O SER A 104 -11.548 4.696 9.201 1.00 0.00 O ATOM 1637 CB SER A 104 -10.306 3.803 6.959 1.00 0.00 C ATOM 1638 OG SER A 104 -11.354 2.921 7.350 1.00 0.00 O ATOM 0 H SER A 104 -9.064 2.566 9.365 1.00 0.00 H new ATOM 0 HA SER A 104 -8.773 5.022 7.812 1.00 0.00 H new ATOM 0 HB2 SER A 104 -10.734 4.687 6.486 1.00 0.00 H new ATOM 0 HB3 SER A 104 -9.680 3.314 6.213 1.00 0.00 H new ATOM 0 HG SER A 104 -11.876 3.332 8.071 1.00 0.00 H new ATOM 1644 N PRO A 105 -9.646 5.297 10.331 1.00 0.00 N ATOM 1645 CA PRO A 105 -10.354 5.842 11.478 1.00 0.00 C ATOM 1646 C PRO A 105 -10.974 7.200 11.144 1.00 0.00 C ATOM 1647 O PRO A 105 -11.639 7.806 11.982 1.00 0.00 O ATOM 1648 CB PRO A 105 -9.312 5.920 12.582 1.00 0.00 C ATOM 1649 CG PRO A 105 -7.962 5.856 11.887 1.00 0.00 C ATOM 1650 CD PRO A 105 -8.194 5.394 10.458 1.00 0.00 C ATOM 0 HA PRO A 105 -11.196 5.223 11.786 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -9.415 6.844 13.151 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -9.428 5.097 13.287 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.480 6.834 11.898 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -7.297 5.167 12.408 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -7.780 6.103 9.741 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -7.715 4.433 10.270 1.00 0.00 H new ATOM 1658 N ARG A 106 -10.733 7.639 9.916 1.00 0.00 N ATOM 1659 CA ARG A 106 -11.259 8.914 9.461 1.00 0.00 C ATOM 1660 C ARG A 106 -12.281 8.699 8.344 1.00 0.00 C ATOM 1661 O ARG A 106 -12.595 7.561 7.996 1.00 0.00 O ATOM 1662 CB ARG A 106 -10.139 9.822 8.950 1.00 0.00 C ATOM 1663 CG ARG A 106 -9.701 10.814 10.028 1.00 0.00 C ATOM 1664 CD ARG A 106 -10.785 11.866 10.277 1.00 0.00 C ATOM 1665 NE ARG A 106 -11.400 11.653 11.606 1.00 0.00 N ATOM 1666 CZ ARG A 106 -12.014 12.611 12.312 1.00 0.00 C ATOM 1667 NH1 ARG A 106 -12.099 13.855 11.821 1.00 0.00 N ATOM 1668 NH2 ARG A 106 -12.545 12.327 13.509 1.00 0.00 N ATOM 0 H ARG A 106 -10.181 7.134 9.223 1.00 0.00 H new ATOM 0 HA ARG A 106 -11.741 9.395 10.312 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -9.287 9.216 8.641 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -10.480 10.365 8.069 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -9.488 10.280 10.954 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -8.777 11.304 9.723 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -10.353 12.865 10.223 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -11.547 11.806 9.500 1.00 0.00 H new ATOM 0 HE ARG A 106 -11.353 10.717 12.010 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -11.696 14.072 10.909 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -12.567 14.585 12.359 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -12.482 11.380 13.883 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -13.012 13.058 14.046 1.00 0.00 H new ATOM 1682 N GLY A 107 -12.775 9.808 7.814 1.00 0.00 N ATOM 1683 CA GLY A 107 -13.755 9.755 6.743 1.00 0.00 C ATOM 1684 C GLY A 107 -13.125 9.236 5.448 1.00 0.00 C ATOM 1685 O GLY A 107 -13.617 8.277 4.855 1.00 0.00 O ATOM 0 H GLY A 107 -12.514 10.750 8.107 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.582 9.108 7.034 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -14.171 10.749 6.576 1.00 0.00 H new ATOM 1689 N TYR A 108 -12.047 9.895 5.047 1.00 0.00 N ATOM 1690 CA TYR A 108 -11.346 9.513 3.834 1.00 0.00 C ATOM 1691 C TYR A 108 -9.833 9.681 4.000 1.00 0.00 C ATOM 1692 O TYR A 108 -9.168 10.240 3.128 1.00 0.00 O ATOM 1693 CB TYR A 108 -11.837 10.468 2.744 1.00 0.00 C ATOM 1694 CG TYR A 108 -11.801 11.943 3.148 1.00 0.00 C ATOM 1695 CD1 TYR A 108 -12.736 12.441 4.031 1.00 0.00 C ATOM 1696 CD2 TYR A 108 -10.830 12.777 2.629 1.00 0.00 C ATOM 1697 CE1 TYR A 108 -12.702 13.830 4.410 1.00 0.00 C ATOM 1698 CE2 TYR A 108 -10.796 14.165 3.008 1.00 0.00 C ATOM 1699 CZ TYR A 108 -11.733 14.623 3.880 1.00 0.00 C ATOM 1700 OH TYR A 108 -11.701 15.935 4.239 1.00 0.00 O ATOM 0 H TYR A 108 -11.643 10.691 5.541 1.00 0.00 H new ATOM 0 HA TYR A 108 -11.539 8.468 3.591 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -11.225 10.331 1.852 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -12.859 10.201 2.474 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -13.494 11.789 4.439 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -10.096 12.388 1.939 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -13.429 14.232 5.099 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -10.043 14.828 2.609 1.00 0.00 H new ATOM 0 HH TYR A 108 -10.956 16.380 3.785 1.00 0.00 H new ATOM 1710 N PHE A 109 -9.334 9.187 5.122 1.00 0.00 N ATOM 1711 CA PHE A 109 -7.914 9.276 5.413 1.00 0.00 C ATOM 1712 C PHE A 109 -7.406 7.989 6.068 1.00 0.00 C ATOM 1713 O PHE A 109 -7.662 7.746 7.247 1.00 0.00 O ATOM 1714 CB PHE A 109 -7.728 10.438 6.390 1.00 0.00 C ATOM 1715 CG PHE A 109 -6.286 10.939 6.495 1.00 0.00 C ATOM 1716 CD1 PHE A 109 -5.413 10.326 7.337 1.00 0.00 C ATOM 1717 CD2 PHE A 109 -5.879 11.998 5.745 1.00 0.00 C ATOM 1718 CE1 PHE A 109 -4.074 10.791 7.433 1.00 0.00 C ATOM 1719 CE2 PHE A 109 -4.540 12.464 5.841 1.00 0.00 C ATOM 1720 CZ PHE A 109 -3.666 11.850 6.683 1.00 0.00 C ATOM 0 H PHE A 109 -9.888 8.723 5.842 1.00 0.00 H new ATOM 0 HA PHE A 109 -7.355 9.428 4.490 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -8.367 11.265 6.081 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -8.066 10.126 7.378 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -5.737 9.486 7.933 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -6.574 12.485 5.076 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -3.380 10.304 8.102 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -4.217 13.305 5.246 1.00 0.00 H new ATOM 0 HZ PHE A 109 -2.648 12.203 6.756 1.00 0.00 H new ATOM 1730 N HIS A 110 -6.698 7.199 5.276 1.00 0.00 N ATOM 1731 CA HIS A 110 -6.153 5.944 5.764 1.00 0.00 C ATOM 1732 C HIS A 110 -4.680 6.132 6.134 1.00 0.00 C ATOM 1733 O HIS A 110 -3.939 6.808 5.420 1.00 0.00 O ATOM 1734 CB HIS A 110 -6.369 4.824 4.745 1.00 0.00 C ATOM 1735 CG HIS A 110 -7.775 4.757 4.195 1.00 0.00 C ATOM 1736 ND1 HIS A 110 -8.096 4.063 3.042 1.00 0.00 N ATOM 1737 CD2 HIS A 110 -8.938 5.304 4.653 1.00 0.00 C ATOM 1738 CE1 HIS A 110 -9.397 4.194 2.824 1.00 0.00 C ATOM 1739 NE2 HIS A 110 -9.916 4.963 3.823 1.00 0.00 N ATOM 0 H HIS A 110 -6.489 7.403 4.299 1.00 0.00 H new ATOM 0 HA HIS A 110 -6.683 5.642 6.667 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -5.672 4.960 3.918 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -6.127 3.870 5.212 1.00 0.00 H new ATOM 0 HD1 HIS A 110 -7.443 3.540 2.459 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -9.045 5.911 5.540 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -9.949 3.767 2.000 1.00 0.00 H new ATOM 1747 N THR A 111 -4.298 5.523 7.246 1.00 0.00 N ATOM 1748 CA THR A 111 -2.928 5.615 7.718 1.00 0.00 C ATOM 1749 C THR A 111 -2.303 4.223 7.819 1.00 0.00 C ATOM 1750 O THR A 111 -3.012 3.232 7.991 1.00 0.00 O ATOM 1751 CB THR A 111 -2.935 6.375 9.047 1.00 0.00 C ATOM 1752 OG1 THR A 111 -3.945 5.724 9.813 1.00 0.00 O ATOM 1753 CG2 THR A 111 -3.446 7.809 8.899 1.00 0.00 C ATOM 0 H THR A 111 -4.915 4.963 7.835 1.00 0.00 H new ATOM 0 HA THR A 111 -2.305 6.166 7.014 1.00 0.00 H new ATOM 0 HB THR A 111 -1.927 6.390 9.462 1.00 0.00 H new ATOM 0 HG1 THR A 111 -4.016 6.152 10.692 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.430 8.303 9.871 1.00 0.00 H new ATOM 0 HG22 THR A 111 -2.806 8.353 8.205 1.00 0.00 H new ATOM 0 HG23 THR A 111 -4.466 7.794 8.516 1.00 0.00 H new ATOM 1761 N PHE A 112 -0.984 4.192 7.706 1.00 0.00 N ATOM 1762 CA PHE A 112 -0.255 2.936 7.781 1.00 0.00 C ATOM 1763 C PHE A 112 1.231 3.180 8.056 1.00 0.00 C ATOM 1764 O PHE A 112 1.679 4.325 8.096 1.00 0.00 O ATOM 1765 CB PHE A 112 -0.404 2.251 6.422 1.00 0.00 C ATOM 1766 CG PHE A 112 0.363 2.937 5.291 1.00 0.00 C ATOM 1767 CD1 PHE A 112 -0.078 4.123 4.792 1.00 0.00 C ATOM 1768 CD2 PHE A 112 1.486 2.361 4.784 1.00 0.00 C ATOM 1769 CE1 PHE A 112 0.634 4.761 3.741 1.00 0.00 C ATOM 1770 CE2 PHE A 112 2.198 2.998 3.733 1.00 0.00 C ATOM 1771 CZ PHE A 112 1.757 4.184 3.234 1.00 0.00 C ATOM 0 H PHE A 112 -0.400 5.016 7.563 1.00 0.00 H new ATOM 0 HA PHE A 112 -0.651 2.324 8.591 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -0.060 1.220 6.507 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -1.461 2.214 6.160 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -0.970 4.580 5.195 1.00 0.00 H new ATOM 0 HD2 PHE A 112 1.836 1.419 5.181 1.00 0.00 H new ATOM 0 HE1 PHE A 112 0.284 5.703 3.345 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.090 2.541 3.330 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.299 4.668 2.435 1.00 0.00 H new ATOM 1781 N ALA A 113 1.953 2.085 8.239 1.00 0.00 N ATOM 1782 CA ALA A 113 3.379 2.165 8.508 1.00 0.00 C ATOM 1783 C ALA A 113 4.137 2.296 7.186 1.00 0.00 C ATOM 1784 O ALA A 113 3.815 1.616 6.212 1.00 0.00 O ATOM 1785 CB ALA A 113 3.816 0.939 9.312 1.00 0.00 C ATOM 0 H ALA A 113 1.578 1.137 8.206 1.00 0.00 H new ATOM 0 HA ALA A 113 3.608 3.046 9.107 1.00 0.00 H new ATOM 0 HB1 ALA A 113 4.885 0.999 9.514 1.00 0.00 H new ATOM 0 HB2 ALA A 113 3.270 0.909 10.255 1.00 0.00 H new ATOM 0 HB3 ALA A 113 3.604 0.035 8.741 1.00 0.00 H new ATOM 1791 N GLY A 114 5.129 3.173 7.193 1.00 0.00 N ATOM 1792 CA GLY A 114 5.936 3.401 6.006 1.00 0.00 C ATOM 1793 C GLY A 114 7.218 2.567 6.045 1.00 0.00 C ATOM 1794 O GLY A 114 7.347 1.660 6.867 1.00 0.00 O ATOM 0 H GLY A 114 5.393 3.735 8.002 1.00 0.00 H new ATOM 0 HA2 GLY A 114 5.360 3.147 5.116 1.00 0.00 H new ATOM 0 HA3 GLY A 114 6.188 4.459 5.931 1.00 0.00 H new ATOM 1798 N ASP A 115 8.133 2.905 5.149 1.00 0.00 N ATOM 1799 CA ASP A 115 9.400 2.199 5.072 1.00 0.00 C ATOM 1800 C ASP A 115 9.962 2.010 6.483 1.00 0.00 C ATOM 1801 O ASP A 115 10.054 0.886 6.973 1.00 0.00 O ATOM 1802 CB ASP A 115 10.424 2.993 4.257 1.00 0.00 C ATOM 1803 CG ASP A 115 9.848 3.765 3.069 1.00 0.00 C ATOM 1804 OD1 ASP A 115 9.797 3.165 1.974 1.00 0.00 O ATOM 1805 OD2 ASP A 115 9.470 4.937 3.284 1.00 0.00 O ATOM 0 H ASP A 115 8.022 3.658 4.470 1.00 0.00 H new ATOM 0 HA ASP A 115 9.221 1.238 4.589 1.00 0.00 H new ATOM 0 HB2 ASP A 115 10.925 3.698 4.920 1.00 0.00 H new ATOM 0 HB3 ASP A 115 11.185 2.305 3.889 1.00 0.00 H new ATOM 1810 N THR A 116 10.322 3.129 7.096 1.00 0.00 N ATOM 1811 CA THR A 116 10.872 3.101 8.440 1.00 0.00 C ATOM 1812 C THR A 116 10.086 4.040 9.357 1.00 0.00 C ATOM 1813 O THR A 116 10.294 4.048 10.569 1.00 0.00 O ATOM 1814 CB THR A 116 12.360 3.444 8.350 1.00 0.00 C ATOM 1815 OG1 THR A 116 12.377 4.824 7.998 1.00 0.00 O ATOM 1816 CG2 THR A 116 13.051 2.750 7.173 1.00 0.00 C ATOM 0 H THR A 116 10.243 4.060 6.686 1.00 0.00 H new ATOM 0 HA THR A 116 10.779 2.110 8.885 1.00 0.00 H new ATOM 0 HB THR A 116 12.855 3.161 9.279 1.00 0.00 H new ATOM 0 HG1 THR A 116 13.305 5.130 7.920 1.00 0.00 H new ATOM 0 HG21 THR A 116 14.105 3.027 7.155 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.962 1.669 7.285 1.00 0.00 H new ATOM 0 HG23 THR A 116 12.579 3.059 6.240 1.00 0.00 H new ATOM 1824 N CYS A 117 9.199 4.810 8.743 1.00 0.00 N ATOM 1825 CA CYS A 117 8.382 5.751 9.488 1.00 0.00 C ATOM 1826 C CYS A 117 6.920 5.538 9.091 1.00 0.00 C ATOM 1827 O CYS A 117 6.636 4.972 8.036 1.00 0.00 O ATOM 1828 CB CYS A 117 8.830 7.196 9.260 1.00 0.00 C ATOM 1829 SG CYS A 117 8.982 8.067 10.861 1.00 0.00 S ATOM 0 H CYS A 117 9.029 4.801 7.737 1.00 0.00 H new ATOM 0 HA CYS A 117 8.498 5.569 10.556 1.00 0.00 H new ATOM 0 HB2 CYS A 117 9.786 7.210 8.737 1.00 0.00 H new ATOM 0 HB3 CYS A 117 8.111 7.712 8.623 1.00 0.00 H new ATOM 0 HG CYS A 117 9.365 9.292 10.654 1.00 0.00 H new ATOM 1835 N GLN A 118 6.031 6.002 9.957 1.00 0.00 N ATOM 1836 CA GLN A 118 4.606 5.868 9.709 1.00 0.00 C ATOM 1837 C GLN A 118 4.129 6.960 8.750 1.00 0.00 C ATOM 1838 O GLN A 118 4.321 8.147 9.010 1.00 0.00 O ATOM 1839 CB GLN A 118 3.816 5.906 11.019 1.00 0.00 C ATOM 1840 CG GLN A 118 2.309 5.952 10.750 1.00 0.00 C ATOM 1841 CD GLN A 118 1.614 4.713 11.318 1.00 0.00 C ATOM 1842 OE1 GLN A 118 1.948 3.582 11.004 1.00 0.00 O ATOM 1843 NE2 GLN A 118 0.629 4.988 12.169 1.00 0.00 N ATOM 0 H GLN A 118 6.270 6.471 10.831 1.00 0.00 H new ATOM 0 HA GLN A 118 4.428 4.899 9.243 1.00 0.00 H new ATOM 0 HB2 GLN A 118 4.055 5.027 11.618 1.00 0.00 H new ATOM 0 HB3 GLN A 118 4.112 6.779 11.601 1.00 0.00 H new ATOM 0 HG2 GLN A 118 1.883 6.850 11.198 1.00 0.00 H new ATOM 0 HG3 GLN A 118 2.129 6.015 9.677 1.00 0.00 H new ATOM 0 HE21 GLN A 118 0.401 5.958 12.389 1.00 0.00 H new ATOM 0 HE22 GLN A 118 0.102 4.229 12.602 1.00 0.00 H new ATOM 1852 N VAL A 119 3.516 6.521 7.660 1.00 0.00 N ATOM 1853 CA VAL A 119 3.011 7.447 6.661 1.00 0.00 C ATOM 1854 C VAL A 119 1.492 7.296 6.554 1.00 0.00 C ATOM 1855 O VAL A 119 0.947 6.236 6.858 1.00 0.00 O ATOM 1856 CB VAL A 119 3.729 7.222 5.328 1.00 0.00 C ATOM 1857 CG1 VAL A 119 5.195 7.654 5.416 1.00 0.00 C ATOM 1858 CG2 VAL A 119 3.614 5.763 4.882 1.00 0.00 C ATOM 0 H VAL A 119 3.358 5.536 7.447 1.00 0.00 H new ATOM 0 HA VAL A 119 3.216 8.476 6.956 1.00 0.00 H new ATOM 0 HB VAL A 119 3.241 7.841 4.576 1.00 0.00 H new ATOM 0 HG11 VAL A 119 5.683 7.484 4.456 1.00 0.00 H new ATOM 0 HG12 VAL A 119 5.248 8.713 5.667 1.00 0.00 H new ATOM 0 HG13 VAL A 119 5.700 7.073 6.188 1.00 0.00 H new ATOM 0 HG21 VAL A 119 4.133 5.631 3.932 1.00 0.00 H new ATOM 0 HG22 VAL A 119 4.064 5.116 5.635 1.00 0.00 H new ATOM 0 HG23 VAL A 119 2.563 5.501 4.761 1.00 0.00 H new ATOM 1868 N ALA A 120 0.851 8.371 6.121 1.00 0.00 N ATOM 1869 CA ALA A 120 -0.594 8.372 5.969 1.00 0.00 C ATOM 1870 C ALA A 120 -0.953 8.784 4.540 1.00 0.00 C ATOM 1871 O ALA A 120 -0.200 9.510 3.892 1.00 0.00 O ATOM 1872 CB ALA A 120 -1.216 9.297 7.016 1.00 0.00 C ATOM 0 H ALA A 120 1.306 9.249 5.870 1.00 0.00 H new ATOM 0 HA ALA A 120 -0.998 7.373 6.135 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -2.300 9.298 6.902 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -0.956 8.944 8.014 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -0.836 10.309 6.879 1.00 0.00 H new ATOM 1878 N LEU A 121 -2.103 8.302 4.090 1.00 0.00 N ATOM 1879 CA LEU A 121 -2.570 8.612 2.751 1.00 0.00 C ATOM 1880 C LEU A 121 -3.910 9.345 2.839 1.00 0.00 C ATOM 1881 O LEU A 121 -4.742 9.025 3.687 1.00 0.00 O ATOM 1882 CB LEU A 121 -2.619 7.344 1.894 1.00 0.00 C ATOM 1883 CG LEU A 121 -3.545 6.234 2.392 1.00 0.00 C ATOM 1884 CD1 LEU A 121 -4.511 5.791 1.290 1.00 0.00 C ATOM 1885 CD2 LEU A 121 -2.742 5.060 2.956 1.00 0.00 C ATOM 0 H LEU A 121 -2.724 7.699 4.630 1.00 0.00 H new ATOM 0 HA LEU A 121 -1.872 9.282 2.250 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -2.927 7.622 0.886 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -1.609 6.941 1.819 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.147 6.633 3.208 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -5.159 5.001 1.670 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -5.119 6.639 0.977 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -3.944 5.417 0.438 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.425 4.285 3.303 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -2.097 4.653 2.177 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -2.131 5.405 3.790 1.00 0.00 H new ATOM 1897 N ASN A 122 -4.077 10.315 1.952 1.00 0.00 N ATOM 1898 CA ASN A 122 -5.301 11.097 1.919 1.00 0.00 C ATOM 1899 C ASN A 122 -5.803 11.191 0.477 1.00 0.00 C ATOM 1900 O ASN A 122 -5.094 11.683 -0.399 1.00 0.00 O ATOM 1901 CB ASN A 122 -5.061 12.519 2.431 1.00 0.00 C ATOM 1902 CG ASN A 122 -6.316 13.379 2.269 1.00 0.00 C ATOM 1903 OD1 ASN A 122 -7.042 13.646 3.212 1.00 0.00 O ATOM 1904 ND2 ASN A 122 -6.529 13.796 1.025 1.00 0.00 N ATOM 0 H ASN A 122 -3.385 10.577 1.250 1.00 0.00 H new ATOM 0 HA ASN A 122 -6.033 10.603 2.558 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -4.771 12.487 3.481 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -4.233 12.971 1.885 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -7.341 14.376 0.814 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -5.881 13.536 0.282 1.00 0.00 H new ATOM 1911 N PHE A 123 -7.022 10.712 0.277 1.00 0.00 N ATOM 1912 CA PHE A 123 -7.627 10.737 -1.045 1.00 0.00 C ATOM 1913 C PHE A 123 -8.148 12.135 -1.384 1.00 0.00 C ATOM 1914 O PHE A 123 -8.369 12.952 -0.491 1.00 0.00 O ATOM 1915 CB PHE A 123 -8.804 9.760 -1.016 1.00 0.00 C ATOM 1916 CG PHE A 123 -8.437 8.358 -0.523 1.00 0.00 C ATOM 1917 CD1 PHE A 123 -7.983 7.426 -1.402 1.00 0.00 C ATOM 1918 CD2 PHE A 123 -8.566 8.045 0.794 1.00 0.00 C ATOM 1919 CE1 PHE A 123 -7.643 6.125 -0.945 1.00 0.00 C ATOM 1920 CE2 PHE A 123 -8.226 6.744 1.251 1.00 0.00 C ATOM 1921 CZ PHE A 123 -7.771 5.812 0.372 1.00 0.00 C ATOM 0 H PHE A 123 -7.607 10.305 1.007 1.00 0.00 H new ATOM 0 HA PHE A 123 -6.888 10.462 -1.798 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -9.585 10.167 -0.374 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -9.224 9.683 -2.019 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -7.881 7.675 -2.448 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.927 8.786 1.492 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -7.283 5.384 -1.644 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -8.329 6.495 2.297 1.00 0.00 H new ATOM 0 HZ PHE A 123 -7.511 4.823 0.720 1.00 0.00 H new ATOM 1931 N ALA A 124 -8.330 12.367 -2.676 1.00 0.00 N ATOM 1932 CA ALA A 124 -8.821 13.651 -3.143 1.00 0.00 C ATOM 1933 C ALA A 124 -10.343 13.695 -2.996 1.00 0.00 C ATOM 1934 O ALA A 124 -10.935 14.773 -2.947 1.00 0.00 O ATOM 1935 CB ALA A 124 -8.369 13.875 -4.588 1.00 0.00 C ATOM 0 H ALA A 124 -8.146 11.687 -3.413 1.00 0.00 H new ATOM 0 HA ALA A 124 -8.408 14.461 -2.542 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -8.737 14.839 -4.939 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -7.280 13.864 -4.634 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -8.767 13.082 -5.221 1.00 0.00 H new ATOM 1941 N ASN A 125 -10.934 12.511 -2.928 1.00 0.00 N ATOM 1942 CA ASN A 125 -12.376 12.401 -2.787 1.00 0.00 C ATOM 1943 C ASN A 125 -12.700 11.395 -1.681 1.00 0.00 C ATOM 1944 O ASN A 125 -11.886 10.528 -1.367 1.00 0.00 O ATOM 1945 CB ASN A 125 -13.020 11.903 -4.083 1.00 0.00 C ATOM 1946 CG ASN A 125 -13.846 13.008 -4.744 1.00 0.00 C ATOM 1947 OD1 ASN A 125 -15.053 13.095 -4.588 1.00 0.00 O ATOM 1948 ND2 ASN A 125 -13.131 13.846 -5.490 1.00 0.00 N ATOM 0 H ASN A 125 -10.440 11.619 -2.968 1.00 0.00 H new ATOM 0 HA ASN A 125 -12.768 13.389 -2.546 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -12.246 11.562 -4.770 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -13.658 11.045 -3.870 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -13.591 14.618 -5.973 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -12.123 13.717 -5.579 1.00 0.00 H new ATOM 1955 N GLU A 126 -13.891 11.544 -1.121 1.00 0.00 N ATOM 1956 CA GLU A 126 -14.333 10.658 -0.056 1.00 0.00 C ATOM 1957 C GLU A 126 -14.738 9.299 -0.629 1.00 0.00 C ATOM 1958 O GLU A 126 -14.294 8.260 -0.145 1.00 0.00 O ATOM 1959 CB GLU A 126 -15.483 11.284 0.735 1.00 0.00 C ATOM 1960 CG GLU A 126 -15.778 10.479 2.003 1.00 0.00 C ATOM 1961 CD GLU A 126 -16.446 11.354 3.065 1.00 0.00 C ATOM 1962 OE1 GLU A 126 -15.735 12.225 3.613 1.00 0.00 O ATOM 1963 OE2 GLU A 126 -17.653 11.135 3.305 1.00 0.00 O ATOM 0 H GLU A 126 -14.564 12.264 -1.384 1.00 0.00 H new ATOM 0 HA GLU A 126 -13.502 10.506 0.632 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -15.229 12.310 1.002 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -16.376 11.328 0.112 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -16.426 9.637 1.761 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -14.851 10.065 2.399 1.00 0.00 H new ATOM 1970 N GLU A 127 -15.577 9.351 -1.654 1.00 0.00 N ATOM 1971 CA GLU A 127 -16.046 8.137 -2.299 1.00 0.00 C ATOM 1972 C GLU A 127 -14.860 7.281 -2.748 1.00 0.00 C ATOM 1973 O GLU A 127 -14.813 6.084 -2.470 1.00 0.00 O ATOM 1974 CB GLU A 127 -16.966 8.462 -3.478 1.00 0.00 C ATOM 1975 CG GLU A 127 -18.380 7.935 -3.232 1.00 0.00 C ATOM 1976 CD GLU A 127 -19.316 8.318 -4.381 1.00 0.00 C ATOM 1977 OE1 GLU A 127 -18.994 7.934 -5.526 1.00 0.00 O ATOM 1978 OE2 GLU A 127 -20.331 8.986 -4.088 1.00 0.00 O ATOM 0 H GLU A 127 -15.944 10.215 -2.053 1.00 0.00 H new ATOM 0 HA GLU A 127 -16.627 7.566 -1.575 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -16.998 9.541 -3.632 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -16.563 8.021 -4.390 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -18.354 6.851 -3.125 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -18.764 8.338 -2.295 1.00 0.00 H new ATOM 1985 N GLU A 128 -13.931 7.930 -3.436 1.00 0.00 N ATOM 1986 CA GLU A 128 -12.747 7.243 -3.926 1.00 0.00 C ATOM 1987 C GLU A 128 -12.027 6.538 -2.775 1.00 0.00 C ATOM 1988 O GLU A 128 -11.402 5.497 -2.973 1.00 0.00 O ATOM 1989 CB GLU A 128 -11.811 8.214 -4.648 1.00 0.00 C ATOM 1990 CG GLU A 128 -11.900 8.035 -6.165 1.00 0.00 C ATOM 1991 CD GLU A 128 -10.592 8.447 -6.843 1.00 0.00 C ATOM 1992 OE1 GLU A 128 -9.837 9.211 -6.203 1.00 0.00 O ATOM 1993 OE2 GLU A 128 -10.377 7.991 -7.987 1.00 0.00 O ATOM 0 H GLU A 128 -13.974 8.923 -3.665 1.00 0.00 H new ATOM 0 HA GLU A 128 -13.060 6.488 -4.647 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -12.070 9.239 -4.383 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -10.785 8.049 -4.318 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -12.123 6.994 -6.400 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -12.722 8.634 -6.558 1.00 0.00 H new ATOM 2000 N ALA A 129 -12.138 7.134 -1.597 1.00 0.00 N ATOM 2001 CA ALA A 129 -11.504 6.578 -0.414 1.00 0.00 C ATOM 2002 C ALA A 129 -12.358 5.425 0.122 1.00 0.00 C ATOM 2003 O ALA A 129 -11.826 4.429 0.609 1.00 0.00 O ATOM 2004 CB ALA A 129 -11.301 7.682 0.624 1.00 0.00 C ATOM 0 H ALA A 129 -12.658 7.997 -1.437 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.521 6.176 -0.659 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.825 7.264 1.511 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -10.666 8.463 0.205 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -12.267 8.107 0.896 1.00 0.00 H new ATOM 2010 N LYS A 130 -13.667 5.600 0.012 1.00 0.00 N ATOM 2011 CA LYS A 130 -14.598 4.587 0.479 1.00 0.00 C ATOM 2012 C LYS A 130 -14.494 3.352 -0.419 1.00 0.00 C ATOM 2013 O LYS A 130 -14.440 2.225 0.073 1.00 0.00 O ATOM 2014 CB LYS A 130 -16.013 5.161 0.570 1.00 0.00 C ATOM 2015 CG LYS A 130 -16.893 4.307 1.484 1.00 0.00 C ATOM 2016 CD LYS A 130 -18.343 4.796 1.461 1.00 0.00 C ATOM 2017 CE LYS A 130 -19.301 3.692 1.912 1.00 0.00 C ATOM 2018 NZ LYS A 130 -20.034 4.105 3.130 1.00 0.00 N ATOM 0 H LYS A 130 -14.104 6.427 -0.393 1.00 0.00 H new ATOM 0 HA LYS A 130 -14.340 4.271 1.490 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -15.971 6.182 0.949 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -16.455 5.209 -0.425 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -16.851 3.265 1.166 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -16.509 4.344 2.503 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -18.449 5.663 2.113 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -18.605 5.121 0.454 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -20.008 3.468 1.114 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -18.743 2.777 2.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -20.680 3.344 3.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -19.356 4.296 3.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -20.582 4.966 2.930 1.00 0.00 H new ATOM 2032 N LYS A 131 -14.466 3.605 -1.719 1.00 0.00 N ATOM 2033 CA LYS A 131 -14.369 2.527 -2.689 1.00 0.00 C ATOM 2034 C LYS A 131 -13.006 1.846 -2.552 1.00 0.00 C ATOM 2035 O LYS A 131 -12.868 0.661 -2.854 1.00 0.00 O ATOM 2036 CB LYS A 131 -14.657 3.048 -4.098 1.00 0.00 C ATOM 2037 CG LYS A 131 -13.641 4.116 -4.507 1.00 0.00 C ATOM 2038 CD LYS A 131 -12.441 3.488 -5.218 1.00 0.00 C ATOM 2039 CE LYS A 131 -12.269 4.069 -6.622 1.00 0.00 C ATOM 2040 NZ LYS A 131 -10.845 4.373 -6.887 1.00 0.00 N ATOM 0 H LYS A 131 -14.509 4.540 -2.123 1.00 0.00 H new ATOM 0 HA LYS A 131 -15.127 1.768 -2.493 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -14.627 2.222 -4.808 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -15.663 3.465 -4.137 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -14.118 4.844 -5.164 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -13.302 4.658 -3.624 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -11.537 3.663 -4.635 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -12.576 2.408 -5.282 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -12.640 3.361 -7.363 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -12.865 4.976 -6.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -10.738 5.388 -7.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -10.276 4.122 -6.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -10.519 3.823 -7.707 1.00 0.00 H new ATOM 2054 N PHE A 132 -12.035 2.623 -2.096 1.00 0.00 N ATOM 2055 CA PHE A 132 -10.688 2.107 -1.916 1.00 0.00 C ATOM 2056 C PHE A 132 -10.656 1.018 -0.843 1.00 0.00 C ATOM 2057 O PHE A 132 -10.226 -0.104 -1.105 1.00 0.00 O ATOM 2058 CB PHE A 132 -9.818 3.281 -1.460 1.00 0.00 C ATOM 2059 CG PHE A 132 -8.468 3.369 -2.175 1.00 0.00 C ATOM 2060 CD1 PHE A 132 -8.378 3.982 -3.386 1.00 0.00 C ATOM 2061 CD2 PHE A 132 -7.358 2.834 -1.599 1.00 0.00 C ATOM 2062 CE1 PHE A 132 -7.125 4.064 -4.049 1.00 0.00 C ATOM 2063 CE2 PHE A 132 -6.104 2.917 -2.262 1.00 0.00 C ATOM 2064 CZ PHE A 132 -6.015 3.530 -3.474 1.00 0.00 C ATOM 0 H PHE A 132 -12.153 3.605 -1.846 1.00 0.00 H new ATOM 0 HA PHE A 132 -10.329 1.671 -2.848 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -10.365 4.210 -1.622 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -9.645 3.196 -0.387 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -9.260 4.406 -3.843 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -7.430 2.346 -0.638 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -7.054 4.551 -5.010 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -5.222 2.494 -1.804 1.00 0.00 H new ATOM 0 HZ PHE A 132 -5.062 3.592 -3.979 1.00 0.00 H new ATOM 2074 N ARG A 133 -11.117 1.388 0.344 1.00 0.00 N ATOM 2075 CA ARG A 133 -11.147 0.456 1.457 1.00 0.00 C ATOM 2076 C ARG A 133 -12.092 -0.708 1.151 1.00 0.00 C ATOM 2077 O ARG A 133 -11.892 -1.820 1.639 1.00 0.00 O ATOM 2078 CB ARG A 133 -11.602 1.148 2.743 1.00 0.00 C ATOM 2079 CG ARG A 133 -10.925 0.532 3.969 1.00 0.00 C ATOM 2080 CD ARG A 133 -11.863 0.542 5.177 1.00 0.00 C ATOM 2081 NE ARG A 133 -11.943 -0.812 5.768 1.00 0.00 N ATOM 2082 CZ ARG A 133 -12.841 -1.176 6.695 1.00 0.00 C ATOM 2083 NH1 ARG A 133 -13.739 -0.288 7.142 1.00 0.00 N ATOM 2084 NH2 ARG A 133 -12.839 -2.428 7.174 1.00 0.00 N ATOM 0 H ARG A 133 -11.472 2.320 0.558 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.134 0.078 1.599 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -11.368 2.211 2.690 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -12.684 1.065 2.841 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -10.624 -0.492 3.746 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.017 1.087 4.205 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.503 1.252 5.922 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -12.856 0.875 4.874 1.00 0.00 H new ATOM 0 HE ARG A 133 -11.273 -1.513 5.450 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -13.739 0.665 6.777 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -14.422 -0.564 7.847 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -12.155 -3.103 6.833 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -13.522 -2.705 7.879 1.00 0.00 H new ATOM 2098 N LYS A 134 -13.101 -0.412 0.346 1.00 0.00 N ATOM 2099 CA LYS A 134 -14.078 -1.420 -0.031 1.00 0.00 C ATOM 2100 C LYS A 134 -13.412 -2.454 -0.941 1.00 0.00 C ATOM 2101 O LYS A 134 -13.668 -3.651 -0.818 1.00 0.00 O ATOM 2102 CB LYS A 134 -15.315 -0.763 -0.648 1.00 0.00 C ATOM 2103 CG LYS A 134 -16.599 -1.389 -0.102 1.00 0.00 C ATOM 2104 CD LYS A 134 -17.528 -1.816 -1.240 1.00 0.00 C ATOM 2105 CE LYS A 134 -18.284 -0.614 -1.811 1.00 0.00 C ATOM 2106 NZ LYS A 134 -19.503 -0.345 -1.016 1.00 0.00 N ATOM 0 H LYS A 134 -13.264 0.511 -0.056 1.00 0.00 H new ATOM 0 HA LYS A 134 -14.435 -1.953 0.850 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -15.308 0.306 -0.434 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -15.286 -0.871 -1.732 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -16.353 -2.253 0.515 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -17.111 -0.674 0.542 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -16.947 -2.293 -2.029 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -18.239 -2.557 -0.875 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -17.639 0.264 -1.807 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -18.555 -0.806 -2.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -20.005 0.473 -1.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -20.125 -1.178 -1.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -19.237 -0.141 -0.031 1.00 0.00 H new ATOM 2120 N ALA A 135 -12.571 -1.954 -1.834 1.00 0.00 N ATOM 2121 CA ALA A 135 -11.866 -2.820 -2.764 1.00 0.00 C ATOM 2122 C ALA A 135 -10.906 -3.723 -1.986 1.00 0.00 C ATOM 2123 O ALA A 135 -10.918 -4.942 -2.156 1.00 0.00 O ATOM 2124 CB ALA A 135 -11.146 -1.968 -3.811 1.00 0.00 C ATOM 0 H ALA A 135 -12.362 -0.961 -1.933 1.00 0.00 H new ATOM 0 HA ALA A 135 -12.567 -3.464 -3.295 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -10.617 -2.618 -4.508 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -11.875 -1.368 -4.356 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -10.432 -1.310 -3.316 1.00 0.00 H new ATOM 2130 N VAL A 136 -10.096 -3.090 -1.150 1.00 0.00 N ATOM 2131 CA VAL A 136 -9.131 -3.821 -0.346 1.00 0.00 C ATOM 2132 C VAL A 136 -9.856 -4.904 0.454 1.00 0.00 C ATOM 2133 O VAL A 136 -9.556 -6.089 0.318 1.00 0.00 O ATOM 2134 CB VAL A 136 -8.344 -2.851 0.536 1.00 0.00 C ATOM 2135 CG1 VAL A 136 -7.529 -3.605 1.589 1.00 0.00 C ATOM 2136 CG2 VAL A 136 -7.445 -1.946 -0.309 1.00 0.00 C ATOM 0 H VAL A 136 -10.088 -2.079 -1.012 1.00 0.00 H new ATOM 0 HA VAL A 136 -8.403 -4.322 -0.984 1.00 0.00 H new ATOM 0 HB VAL A 136 -9.061 -2.217 1.058 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.979 -2.892 2.203 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -8.200 -4.186 2.221 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.826 -4.275 1.094 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -6.897 -1.266 0.343 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -6.739 -2.557 -0.871 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -8.058 -1.369 -1.002 1.00 0.00 H new ATOM 2146 N THR A 137 -10.799 -4.459 1.272 1.00 0.00 N ATOM 2147 CA THR A 137 -11.570 -5.374 2.096 1.00 0.00 C ATOM 2148 C THR A 137 -12.117 -6.524 1.246 1.00 0.00 C ATOM 2149 O THR A 137 -11.972 -7.691 1.606 1.00 0.00 O ATOM 2150 CB THR A 137 -12.661 -4.569 2.804 1.00 0.00 C ATOM 2151 OG1 THR A 137 -13.344 -3.904 1.745 1.00 0.00 O ATOM 2152 CG2 THR A 137 -12.091 -3.433 3.654 1.00 0.00 C ATOM 0 H THR A 137 -11.047 -3.476 1.382 1.00 0.00 H new ATOM 0 HA THR A 137 -10.946 -5.842 2.858 1.00 0.00 H new ATOM 0 HB THR A 137 -13.251 -5.233 3.436 1.00 0.00 H new ATOM 0 HG1 THR A 137 -12.906 -3.047 1.561 1.00 0.00 H new ATOM 0 HG21 THR A 137 -12.907 -2.893 4.135 1.00 0.00 H new ATOM 0 HG22 THR A 137 -11.430 -3.845 4.416 1.00 0.00 H new ATOM 0 HG23 THR A 137 -11.529 -2.749 3.018 1.00 0.00 H new ATOM 2160 N ASP A 138 -12.735 -6.152 0.134 1.00 0.00 N ATOM 2161 CA ASP A 138 -13.304 -7.137 -0.770 1.00 0.00 C ATOM 2162 C ASP A 138 -12.232 -8.161 -1.144 1.00 0.00 C ATOM 2163 O ASP A 138 -12.499 -9.360 -1.181 1.00 0.00 O ATOM 2164 CB ASP A 138 -13.800 -6.479 -2.059 1.00 0.00 C ATOM 2165 CG ASP A 138 -15.321 -6.467 -2.236 1.00 0.00 C ATOM 2166 OD1 ASP A 138 -15.950 -7.454 -1.800 1.00 0.00 O ATOM 2167 OD2 ASP A 138 -15.817 -5.470 -2.803 1.00 0.00 O ATOM 0 H ASP A 138 -12.854 -5.183 -0.161 1.00 0.00 H new ATOM 0 HA ASP A 138 -14.142 -7.615 -0.263 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -13.438 -5.451 -2.087 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -13.355 -6.997 -2.908 1.00 0.00 H new ATOM 2172 N LEU A 139 -11.039 -7.649 -1.412 1.00 0.00 N ATOM 2173 CA LEU A 139 -9.923 -8.504 -1.782 1.00 0.00 C ATOM 2174 C LEU A 139 -9.501 -9.337 -0.570 1.00 0.00 C ATOM 2175 O LEU A 139 -9.246 -10.533 -0.692 1.00 0.00 O ATOM 2176 CB LEU A 139 -8.788 -7.673 -2.384 1.00 0.00 C ATOM 2177 CG LEU A 139 -8.603 -7.789 -3.898 1.00 0.00 C ATOM 2178 CD1 LEU A 139 -9.639 -6.946 -4.643 1.00 0.00 C ATOM 2179 CD2 LEU A 139 -7.172 -7.429 -4.304 1.00 0.00 C ATOM 0 H LEU A 139 -10.821 -6.653 -1.380 1.00 0.00 H new ATOM 0 HA LEU A 139 -10.221 -9.205 -2.562 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -8.961 -6.625 -2.138 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -7.855 -7.964 -1.901 1.00 0.00 H new ATOM 0 HG LEU A 139 -8.768 -8.828 -4.184 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -9.485 -7.046 -5.717 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -10.641 -7.290 -4.386 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -9.530 -5.900 -4.357 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.067 -7.519 -5.385 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -6.955 -6.404 -4.003 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -6.473 -8.107 -3.814 1.00 0.00 H new ATOM 2191 N LEU A 140 -9.439 -8.669 0.573 1.00 0.00 N ATOM 2192 CA LEU A 140 -9.052 -9.333 1.807 1.00 0.00 C ATOM 2193 C LEU A 140 -10.074 -10.422 2.139 1.00 0.00 C ATOM 2194 O LEU A 140 -9.712 -11.491 2.627 1.00 0.00 O ATOM 2195 CB LEU A 140 -8.859 -8.309 2.928 1.00 0.00 C ATOM 2196 CG LEU A 140 -7.418 -7.860 3.185 1.00 0.00 C ATOM 2197 CD1 LEU A 140 -7.085 -6.603 2.380 1.00 0.00 C ATOM 2198 CD2 LEU A 140 -7.163 -7.669 4.681 1.00 0.00 C ATOM 0 H LEU A 140 -9.650 -7.676 0.671 1.00 0.00 H new ATOM 0 HA LEU A 140 -8.088 -9.827 1.687 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -9.457 -7.428 2.696 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -9.257 -8.730 3.851 1.00 0.00 H new ATOM 0 HG LEU A 140 -6.747 -8.648 2.843 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.056 -6.305 2.580 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.202 -6.810 1.316 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.759 -5.797 2.669 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.132 -7.350 4.837 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -7.841 -6.910 5.072 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -7.334 -8.611 5.202 1.00 0.00 H new ATOM 2210 N GLY A 141 -11.332 -10.113 1.859 1.00 0.00 N ATOM 2211 CA GLY A 141 -12.409 -11.052 2.121 1.00 0.00 C ATOM 2212 C GLY A 141 -12.314 -12.268 1.197 1.00 0.00 C ATOM 2213 O GLY A 141 -12.399 -13.407 1.653 1.00 0.00 O ATOM 0 H GLY A 141 -11.629 -9.226 1.453 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -12.368 -11.377 3.161 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.370 -10.557 1.979 1.00 0.00 H new ATOM 2217 N ARG A 142 -12.140 -11.983 -0.086 1.00 0.00 N ATOM 2218 CA ARG A 142 -12.033 -13.039 -1.078 1.00 0.00 C ATOM 2219 C ARG A 142 -10.847 -13.952 -0.757 1.00 0.00 C ATOM 2220 O ARG A 142 -10.958 -15.173 -0.846 1.00 0.00 O ATOM 2221 CB ARG A 142 -11.855 -12.459 -2.483 1.00 0.00 C ATOM 2222 CG ARG A 142 -12.722 -13.205 -3.499 1.00 0.00 C ATOM 2223 CD ARG A 142 -13.587 -12.231 -4.302 1.00 0.00 C ATOM 2224 NE ARG A 142 -12.879 -11.825 -5.537 1.00 0.00 N ATOM 2225 CZ ARG A 142 -13.437 -11.110 -6.522 1.00 0.00 C ATOM 2226 NH1 ARG A 142 -14.714 -10.717 -6.424 1.00 0.00 N ATOM 2227 NH2 ARG A 142 -12.719 -10.788 -7.607 1.00 0.00 N ATOM 0 H ARG A 142 -12.071 -11.037 -0.461 1.00 0.00 H new ATOM 0 HA ARG A 142 -12.958 -13.615 -1.049 1.00 0.00 H new ATOM 0 HB2 ARG A 142 -12.120 -11.402 -2.480 1.00 0.00 H new ATOM 0 HB3 ARG A 142 -10.807 -12.524 -2.777 1.00 0.00 H new ATOM 0 HG2 ARG A 142 -12.086 -13.775 -4.176 1.00 0.00 H new ATOM 0 HG3 ARG A 142 -13.360 -13.922 -2.982 1.00 0.00 H new ATOM 0 HD2 ARG A 142 -14.538 -12.700 -4.555 1.00 0.00 H new ATOM 0 HD3 ARG A 142 -13.816 -11.353 -3.699 1.00 0.00 H new ATOM 0 HE ARG A 142 -11.905 -12.108 -5.644 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -15.261 -10.962 -5.599 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -15.139 -10.172 -7.174 1.00 0.00 H new ATOM 0 HH21 ARG A 142 -11.747 -11.088 -7.683 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -13.145 -10.243 -8.357 1.00 0.00 H new