USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 730 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 112 THR OG1 : rot 63:sc= 0.848 USER MOD Set 1.2: A 116 ASN : amide:sc= -0.259 X(o=0.59,f=0.52) USER MOD Set 2.1: A 92 ASN : amide:sc= 1.13 K(o=2.3,f=-0.79) USER MOD Set 2.2: A 95 SER OG : rot -58:sc= 1.22 USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= 0.634 K(o=0.63,f=-0.21) USER MOD Single : A 65 LYS NZ :NH3+ -177:sc= 0.549 (180deg=0.544) USER MOD Single : A 75 ASN : amide:sc= 0.411 K(o=0.41,f=-5.1!) USER MOD Single : A 77 TYR OH : rot 130:sc= -0.0272 USER MOD Single : A 78 TYR OH : rot -94:sc= 1.11 USER MOD Single : A 81 ASN : amide:sc= -0.525 K(o=-0.53,f=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.0654 X(o=-0.065,f=-0.05) USER MOD Single : A 90 HIS : no HE2:sc= -1.32 K(o=-1.3,f=-9.5!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0.67 K(o=0.67,f=-0.021) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.278 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 76:sc= 0.238 USER MOD Single : A 110 ASN : amide:sc= 0.999 K(o=1,f=0) USER MOD Single : A 113 GLN : amide:sc= -0.165 X(o=-0.16,f=-0.036) USER MOD Single : A 117 GLN : amide:sc= -0.525 K(o=-0.53,f=-2.7!) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 122 LYS NZ :NH3+ 166:sc= 1.26 (180deg=1.22) USER MOD Single : A 125 ASN : amide:sc= -0.263 K(o=-0.26,f=-0.84) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 HIS : no HD1:sc= -0.856 K(o=-0.86,f=-0.3) USER MOD Single : A 129 GLN : amide:sc= -0.42 K(o=-0.42,f=-4.2!) USER MOD Single : A 130 GLN : amide:sc= 0.0545 X(o=0.055,f=0) USER MOD Single : A 137 GLN : amide:sc=-0.00772 K(o=-0.0077,f=-1.9) USER MOD Single : A 141 SER OG : rot -16:sc= -0.207 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 HIS : no HD1:sc= -0.064 X(o=-0.064,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 52 -1.125 -15.333 -3.648 1.00 0.00 N ATOM 2 CA ALA A 52 -1.263 -14.041 -4.290 1.00 0.00 C ATOM 3 C ALA A 52 -0.510 -12.961 -3.522 1.00 0.00 C ATOM 4 O ALA A 52 -0.475 -11.823 -3.968 1.00 0.00 O ATOM 5 CB ALA A 52 -2.742 -13.675 -4.383 1.00 0.00 C ATOM 0 HA ALA A 52 -0.834 -14.105 -5.290 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -2.847 -12.703 -4.866 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -3.267 -14.430 -4.968 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -3.169 -13.630 -3.381 1.00 0.00 H new ATOM 11 N GLU A 53 0.094 -13.288 -2.382 1.00 0.00 N ATOM 12 CA GLU A 53 0.864 -12.351 -1.572 1.00 0.00 C ATOM 13 C GLU A 53 2.342 -12.399 -1.943 1.00 0.00 C ATOM 14 O GLU A 53 3.127 -11.580 -1.467 1.00 0.00 O ATOM 15 CB GLU A 53 0.665 -12.669 -0.078 1.00 0.00 C ATOM 16 CG GLU A 53 -0.831 -12.818 0.237 1.00 0.00 C ATOM 17 CD GLU A 53 -1.254 -12.682 1.703 1.00 0.00 C ATOM 18 OE1 GLU A 53 -0.433 -12.729 2.648 1.00 0.00 O ATOM 19 OE2 GLU A 53 -2.489 -12.613 1.918 1.00 0.00 O ATOM 0 H GLU A 53 0.061 -14.229 -1.989 1.00 0.00 H new ATOM 0 HA GLU A 53 0.506 -11.341 -1.768 1.00 0.00 H new ATOM 0 HB2 GLU A 53 1.192 -13.588 0.179 1.00 0.00 H new ATOM 0 HB3 GLU A 53 1.095 -11.874 0.531 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.374 -12.071 -0.342 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.156 -13.796 -0.119 1.00 0.00 H new ATOM 26 N ASN A 54 2.734 -13.330 -2.820 1.00 0.00 N ATOM 27 CA ASN A 54 4.104 -13.388 -3.340 1.00 0.00 C ATOM 28 C ASN A 54 4.471 -12.143 -4.152 1.00 0.00 C ATOM 29 O ASN A 54 5.652 -11.877 -4.364 1.00 0.00 O ATOM 30 CB ASN A 54 4.283 -14.625 -4.232 1.00 0.00 C ATOM 31 CG ASN A 54 5.232 -15.636 -3.622 1.00 0.00 C ATOM 32 OD1 ASN A 54 6.432 -15.601 -3.877 1.00 0.00 O ATOM 33 ND2 ASN A 54 4.723 -16.565 -2.831 1.00 0.00 N ATOM 0 H ASN A 54 2.118 -14.056 -3.186 1.00 0.00 H new ATOM 0 HA ASN A 54 4.765 -13.442 -2.475 1.00 0.00 H new ATOM 0 HB2 ASN A 54 3.313 -15.094 -4.399 1.00 0.00 H new ATOM 0 HB3 ASN A 54 4.660 -14.317 -5.207 1.00 0.00 H new ATOM 0 HD21 ASN A 54 5.331 -17.273 -2.418 1.00 0.00 H new ATOM 0 HD22 ASN A 54 3.722 -16.574 -2.633 1.00 0.00 H new ATOM 40 N ARG A 55 3.483 -11.402 -4.662 1.00 0.00 N ATOM 41 CA ARG A 55 3.714 -10.243 -5.523 1.00 0.00 C ATOM 42 C ARG A 55 4.148 -9.029 -4.689 1.00 0.00 C ATOM 43 O ARG A 55 3.957 -9.009 -3.477 1.00 0.00 O ATOM 44 CB ARG A 55 2.493 -9.931 -6.423 1.00 0.00 C ATOM 45 CG ARG A 55 1.251 -10.798 -6.286 1.00 0.00 C ATOM 46 CD ARG A 55 0.209 -10.521 -7.363 1.00 0.00 C ATOM 47 NE ARG A 55 -1.167 -10.384 -6.869 1.00 0.00 N ATOM 48 CZ ARG A 55 -2.147 -11.282 -6.986 1.00 0.00 C ATOM 49 NH1 ARG A 55 -1.912 -12.507 -7.436 1.00 0.00 N ATOM 50 NH2 ARG A 55 -3.385 -10.928 -6.657 1.00 0.00 N ATOM 0 H ARG A 55 2.496 -11.592 -4.487 1.00 0.00 H new ATOM 0 HA ARG A 55 4.531 -10.489 -6.201 1.00 0.00 H new ATOM 0 HB2 ARG A 55 2.199 -8.898 -6.236 1.00 0.00 H new ATOM 0 HB3 ARG A 55 2.823 -9.986 -7.460 1.00 0.00 H new ATOM 0 HG2 ARG A 55 1.541 -11.848 -6.330 1.00 0.00 H new ATOM 0 HG3 ARG A 55 0.805 -10.632 -5.305 1.00 0.00 H new ATOM 0 HD2 ARG A 55 0.484 -9.606 -7.888 1.00 0.00 H new ATOM 0 HD3 ARG A 55 0.239 -11.329 -8.094 1.00 0.00 H new ATOM 0 HE ARG A 55 -1.397 -9.515 -6.388 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -0.966 -12.780 -7.701 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -2.677 -13.176 -7.517 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -3.573 -9.983 -6.322 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -4.147 -11.601 -6.740 1.00 0.00 H new ATOM 64 N PRO A 56 4.682 -7.982 -5.335 1.00 0.00 N ATOM 65 CA PRO A 56 5.113 -6.734 -4.719 1.00 0.00 C ATOM 66 C PRO A 56 3.912 -5.937 -4.219 1.00 0.00 C ATOM 67 O PRO A 56 3.447 -6.082 -3.094 1.00 0.00 O ATOM 68 CB PRO A 56 5.996 -6.080 -5.788 1.00 0.00 C ATOM 69 CG PRO A 56 5.433 -6.586 -7.116 1.00 0.00 C ATOM 70 CD PRO A 56 4.914 -7.969 -6.766 1.00 0.00 C ATOM 0 HA PRO A 56 5.698 -6.841 -3.805 1.00 0.00 H new ATOM 0 HB2 PRO A 56 5.952 -4.993 -5.727 1.00 0.00 H new ATOM 0 HB3 PRO A 56 7.041 -6.364 -5.667 1.00 0.00 H new ATOM 0 HG2 PRO A 56 4.638 -5.940 -7.489 1.00 0.00 H new ATOM 0 HG3 PRO A 56 6.200 -6.627 -7.889 1.00 0.00 H new ATOM 0 HD2 PRO A 56 3.993 -8.185 -7.308 1.00 0.00 H new ATOM 0 HD3 PRO A 56 5.637 -8.735 -7.047 1.00 0.00 H new ATOM 78 N GLY A 57 3.365 -5.135 -5.113 1.00 0.00 N ATOM 79 CA GLY A 57 2.074 -4.453 -5.043 1.00 0.00 C ATOM 80 C GLY A 57 0.883 -5.414 -5.040 1.00 0.00 C ATOM 81 O GLY A 57 -0.159 -5.087 -5.599 1.00 0.00 O ATOM 0 H GLY A 57 3.850 -4.922 -5.985 1.00 0.00 H new ATOM 0 HA2 GLY A 57 2.042 -3.842 -4.141 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.983 -3.774 -5.891 1.00 0.00 H new ATOM 85 N ALA A 58 1.032 -6.613 -4.487 1.00 0.00 N ATOM 86 CA ALA A 58 -0.032 -7.555 -4.247 1.00 0.00 C ATOM 87 C ALA A 58 -1.162 -6.922 -3.426 1.00 0.00 C ATOM 88 O ALA A 58 -0.899 -6.215 -2.450 1.00 0.00 O ATOM 89 CB ALA A 58 0.610 -8.708 -3.498 1.00 0.00 C ATOM 0 H ALA A 58 1.942 -6.961 -4.184 1.00 0.00 H new ATOM 0 HA ALA A 58 -0.491 -7.886 -5.179 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -0.143 -9.465 -3.281 1.00 0.00 H new ATOM 0 HB2 ALA A 58 1.399 -9.145 -4.110 1.00 0.00 H new ATOM 0 HB3 ALA A 58 1.037 -8.343 -2.564 1.00 0.00 H new ATOM 95 N PHE A 59 -2.402 -7.186 -3.829 1.00 0.00 N ATOM 96 CA PHE A 59 -3.623 -6.765 -3.167 1.00 0.00 C ATOM 97 C PHE A 59 -3.919 -7.756 -2.035 1.00 0.00 C ATOM 98 O PHE A 59 -4.026 -8.951 -2.305 1.00 0.00 O ATOM 99 CB PHE A 59 -4.787 -6.747 -4.190 1.00 0.00 C ATOM 100 CG PHE A 59 -4.944 -5.514 -5.084 1.00 0.00 C ATOM 101 CD1 PHE A 59 -4.007 -4.460 -5.063 1.00 0.00 C ATOM 102 CD2 PHE A 59 -6.104 -5.371 -5.880 1.00 0.00 C ATOM 103 CE1 PHE A 59 -4.273 -3.264 -5.744 1.00 0.00 C ATOM 104 CE2 PHE A 59 -6.338 -4.185 -6.610 1.00 0.00 C ATOM 105 CZ PHE A 59 -5.423 -3.122 -6.525 1.00 0.00 C ATOM 0 H PHE A 59 -2.587 -7.729 -4.672 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.511 -5.761 -2.757 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -4.675 -7.616 -4.838 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -5.718 -6.879 -3.638 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.081 -4.575 -4.520 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -6.820 -6.178 -5.930 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -3.579 -2.440 -5.664 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -7.217 -4.095 -7.231 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.607 -2.202 -7.059 1.00 0.00 H new ATOM 115 N ILE A 60 -4.058 -7.288 -0.789 1.00 0.00 N ATOM 116 CA ILE A 60 -4.450 -8.144 0.342 1.00 0.00 C ATOM 117 C ILE A 60 -5.947 -8.520 0.240 1.00 0.00 C ATOM 118 O ILE A 60 -6.324 -9.657 0.511 1.00 0.00 O ATOM 119 CB ILE A 60 -4.080 -7.438 1.678 1.00 0.00 C ATOM 120 CG1 ILE A 60 -2.547 -7.312 1.812 1.00 0.00 C ATOM 121 CG2 ILE A 60 -4.598 -8.200 2.900 1.00 0.00 C ATOM 122 CD1 ILE A 60 -2.024 -6.656 3.094 1.00 0.00 C ATOM 0 H ILE A 60 -3.904 -6.312 -0.535 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.900 -9.085 0.313 1.00 0.00 H new ATOM 0 HB ILE A 60 -4.551 -6.455 1.648 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -2.115 -8.310 1.739 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -2.176 -6.741 0.961 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -4.314 -7.668 3.808 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.684 -8.276 2.848 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.165 -9.200 2.916 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.935 -6.626 3.069 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -2.413 -5.641 3.168 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -2.351 -7.234 3.958 1.00 0.00 H new ATOM 134 N LYS A 61 -6.797 -7.562 -0.161 1.00 0.00 N ATOM 135 CA LYS A 61 -8.263 -7.674 -0.299 1.00 0.00 C ATOM 136 C LYS A 61 -8.936 -8.595 0.727 1.00 0.00 C ATOM 137 O LYS A 61 -9.550 -9.591 0.360 1.00 0.00 O ATOM 138 CB LYS A 61 -8.701 -7.927 -1.765 1.00 0.00 C ATOM 139 CG LYS A 61 -7.875 -8.879 -2.633 1.00 0.00 C ATOM 140 CD LYS A 61 -8.237 -10.346 -2.399 1.00 0.00 C ATOM 141 CE LYS A 61 -7.658 -11.268 -3.474 1.00 0.00 C ATOM 142 NZ LYS A 61 -7.424 -12.626 -2.943 1.00 0.00 N ATOM 0 H LYS A 61 -6.463 -6.632 -0.413 1.00 0.00 H new ATOM 0 HA LYS A 61 -8.652 -6.690 -0.037 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -9.723 -8.306 -1.742 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.730 -6.962 -2.271 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -8.028 -8.633 -3.684 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.816 -8.731 -2.422 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.869 -10.657 -1.421 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -9.322 -10.451 -2.380 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -8.343 -11.319 -4.321 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.721 -10.854 -3.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -7.031 -13.229 -3.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -6.752 -12.578 -2.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -8.323 -13.028 -2.610 1.00 0.00 H new ATOM 156 N GLN A 62 -8.897 -8.217 2.009 1.00 0.00 N ATOM 157 CA GLN A 62 -9.549 -8.974 3.081 1.00 0.00 C ATOM 158 C GLN A 62 -11.081 -8.952 2.998 1.00 0.00 C ATOM 159 O GLN A 62 -11.727 -9.759 3.669 1.00 0.00 O ATOM 160 CB GLN A 62 -9.073 -8.486 4.462 1.00 0.00 C ATOM 161 CG GLN A 62 -7.549 -8.594 4.566 1.00 0.00 C ATOM 162 CD GLN A 62 -6.995 -8.753 5.975 1.00 0.00 C ATOM 163 OE1 GLN A 62 -7.377 -9.644 6.725 1.00 0.00 O ATOM 164 NE2 GLN A 62 -6.066 -7.904 6.369 1.00 0.00 N ATOM 0 H GLN A 62 -8.413 -7.379 2.332 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.249 -10.013 2.945 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -9.383 -7.453 4.617 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -9.541 -9.080 5.247 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -7.221 -9.444 3.968 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.108 -7.702 4.120 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.752 -7.164 5.741 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.662 -7.987 7.302 1.00 0.00 H new ATOM 173 N GLY A 63 -11.669 -8.071 2.186 1.00 0.00 N ATOM 174 CA GLY A 63 -13.096 -8.001 1.910 1.00 0.00 C ATOM 175 C GLY A 63 -13.825 -7.114 2.912 1.00 0.00 C ATOM 176 O GLY A 63 -14.900 -7.498 3.377 1.00 0.00 O ATOM 0 H GLY A 63 -11.137 -7.360 1.685 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -13.253 -7.615 0.903 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.521 -9.004 1.937 1.00 0.00 H new ATOM 180 N ARG A 64 -13.257 -5.953 3.267 1.00 0.00 N ATOM 181 CA ARG A 64 -13.753 -5.113 4.366 1.00 0.00 C ATOM 182 C ARG A 64 -14.129 -3.700 3.936 1.00 0.00 C ATOM 183 O ARG A 64 -13.849 -3.285 2.809 1.00 0.00 O ATOM 184 CB ARG A 64 -12.779 -5.081 5.548 1.00 0.00 C ATOM 185 CG ARG A 64 -11.446 -4.492 5.118 1.00 0.00 C ATOM 186 CD ARG A 64 -10.531 -4.295 6.320 1.00 0.00 C ATOM 187 NE ARG A 64 -10.002 -5.565 6.830 1.00 0.00 N ATOM 188 CZ ARG A 64 -8.854 -5.709 7.501 1.00 0.00 C ATOM 189 NH1 ARG A 64 -8.037 -4.687 7.710 1.00 0.00 N ATOM 190 NH2 ARG A 64 -8.517 -6.897 7.969 1.00 0.00 N ATOM 0 H ARG A 64 -12.437 -5.569 2.798 1.00 0.00 H new ATOM 0 HA ARG A 64 -14.676 -5.591 4.694 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -13.201 -4.488 6.360 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -12.631 -6.090 5.933 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -10.967 -5.152 4.395 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -11.609 -3.537 4.618 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.702 -3.645 6.040 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -11.080 -3.788 7.113 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.554 -6.406 6.659 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.277 -3.761 7.356 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.168 -4.826 8.225 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -9.131 -7.698 7.818 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.643 -7.014 8.482 1.00 0.00 H new ATOM 204 N LYS A 65 -14.699 -2.933 4.865 1.00 0.00 N ATOM 205 CA LYS A 65 -14.821 -1.483 4.787 1.00 0.00 C ATOM 206 C LYS A 65 -13.790 -0.865 5.733 1.00 0.00 C ATOM 207 O LYS A 65 -13.547 -1.401 6.815 1.00 0.00 O ATOM 208 CB LYS A 65 -16.259 -1.079 5.174 1.00 0.00 C ATOM 209 CG LYS A 65 -16.855 -0.098 4.156 1.00 0.00 C ATOM 210 CD LYS A 65 -18.291 0.329 4.473 1.00 0.00 C ATOM 211 CE LYS A 65 -19.301 -0.821 4.575 1.00 0.00 C ATOM 212 NZ LYS A 65 -20.339 -0.524 5.571 1.00 0.00 N ATOM 0 H LYS A 65 -15.101 -3.319 5.719 1.00 0.00 H new ATOM 0 HA LYS A 65 -14.630 -1.122 3.776 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.885 -1.969 5.234 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -16.257 -0.623 6.164 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.224 0.790 4.109 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.833 -0.557 3.168 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -18.292 0.878 5.415 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -18.627 1.021 3.701 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -19.763 -0.991 3.603 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.784 -1.741 4.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.980 -1.338 5.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.893 -0.335 6.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -20.880 0.312 5.270 1.00 0.00 H new ATOM 226 N LEU A 66 -13.169 0.239 5.324 1.00 0.00 N ATOM 227 CA LEU A 66 -12.399 1.160 6.136 1.00 0.00 C ATOM 228 C LEU A 66 -13.108 2.515 6.068 1.00 0.00 C ATOM 229 O LEU A 66 -14.199 2.637 5.501 1.00 0.00 O ATOM 230 CB LEU A 66 -10.972 1.354 5.587 1.00 0.00 C ATOM 231 CG LEU A 66 -10.141 0.181 5.084 1.00 0.00 C ATOM 232 CD1 LEU A 66 -9.792 -0.828 6.171 1.00 0.00 C ATOM 233 CD2 LEU A 66 -10.718 -0.487 3.852 1.00 0.00 C ATOM 0 H LEU A 66 -13.197 0.528 4.346 1.00 0.00 H new ATOM 0 HA LEU A 66 -12.327 0.764 7.149 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.044 2.065 4.764 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.393 1.836 6.375 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.198 0.631 4.772 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -9.200 -1.636 5.741 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.218 -0.334 6.955 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -10.709 -1.237 6.596 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -10.074 -1.313 3.551 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.714 -0.867 4.077 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.781 0.238 3.041 1.00 0.00 H new ATOM 245 N ASP A 67 -12.413 3.553 6.515 1.00 0.00 N ATOM 246 CA ASP A 67 -12.830 4.952 6.509 1.00 0.00 C ATOM 247 C ASP A 67 -11.834 5.720 5.641 1.00 0.00 C ATOM 248 O ASP A 67 -10.716 5.999 6.082 1.00 0.00 O ATOM 249 CB ASP A 67 -12.866 5.472 7.950 1.00 0.00 C ATOM 250 CG ASP A 67 -13.646 6.767 8.096 1.00 0.00 C ATOM 251 OD1 ASP A 67 -14.809 6.793 7.639 1.00 0.00 O ATOM 252 OD2 ASP A 67 -13.131 7.669 8.796 1.00 0.00 O ATOM 0 H ASP A 67 -11.483 3.434 6.917 1.00 0.00 H new ATOM 0 HA ASP A 67 -13.831 5.079 6.097 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -13.310 4.712 8.593 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -11.845 5.628 8.299 1.00 0.00 H new ATOM 257 N ILE A 68 -12.181 5.937 4.374 1.00 0.00 N ATOM 258 CA ILE A 68 -11.365 6.565 3.339 1.00 0.00 C ATOM 259 C ILE A 68 -12.308 7.561 2.656 1.00 0.00 C ATOM 260 O ILE A 68 -13.478 7.251 2.414 1.00 0.00 O ATOM 261 CB ILE A 68 -10.775 5.526 2.338 1.00 0.00 C ATOM 262 CG1 ILE A 68 -10.325 4.196 3.004 1.00 0.00 C ATOM 263 CG2 ILE A 68 -9.651 6.171 1.499 1.00 0.00 C ATOM 264 CD1 ILE A 68 -9.628 3.171 2.105 1.00 0.00 C ATOM 0 H ILE A 68 -13.098 5.661 4.021 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.487 7.058 3.757 1.00 0.00 H new ATOM 0 HB ILE A 68 -11.586 5.236 1.669 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.652 4.439 3.826 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -11.204 3.722 3.441 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -9.248 5.435 0.804 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -10.053 7.016 0.940 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -8.857 6.519 2.160 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -9.366 2.291 2.692 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -10.298 2.881 1.296 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -8.722 3.610 1.686 1.00 0.00 H new ATOM 276 N ASP A 69 -11.842 8.777 2.402 1.00 0.00 N ATOM 277 CA ASP A 69 -12.617 9.909 1.924 1.00 0.00 C ATOM 278 C ASP A 69 -12.485 10.020 0.405 1.00 0.00 C ATOM 279 O ASP A 69 -11.723 10.836 -0.118 1.00 0.00 O ATOM 280 CB ASP A 69 -12.159 11.171 2.679 1.00 0.00 C ATOM 281 CG ASP A 69 -10.681 11.534 2.502 1.00 0.00 C ATOM 282 OD1 ASP A 69 -9.811 10.655 2.698 1.00 0.00 O ATOM 283 OD2 ASP A 69 -10.391 12.688 2.109 1.00 0.00 O ATOM 0 H ASP A 69 -10.858 9.010 2.532 1.00 0.00 H new ATOM 0 HA ASP A 69 -13.680 9.778 2.126 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -12.766 12.014 2.348 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -12.358 11.032 3.742 1.00 0.00 H new ATOM 288 N PHE A 70 -13.201 9.183 -0.347 1.00 0.00 N ATOM 289 CA PHE A 70 -13.152 9.187 -1.803 1.00 0.00 C ATOM 290 C PHE A 70 -13.909 10.364 -2.408 1.00 0.00 C ATOM 291 O PHE A 70 -13.681 10.650 -3.587 1.00 0.00 O ATOM 292 CB PHE A 70 -13.738 7.893 -2.372 1.00 0.00 C ATOM 293 CG PHE A 70 -13.053 6.635 -1.901 1.00 0.00 C ATOM 294 CD1 PHE A 70 -11.761 6.337 -2.366 1.00 0.00 C ATOM 295 CD2 PHE A 70 -13.686 5.783 -0.978 1.00 0.00 C ATOM 296 CE1 PHE A 70 -11.089 5.201 -1.893 1.00 0.00 C ATOM 297 CE2 PHE A 70 -13.026 4.633 -0.525 1.00 0.00 C ATOM 298 CZ PHE A 70 -11.724 4.354 -0.970 1.00 0.00 C ATOM 0 H PHE A 70 -13.832 8.482 0.041 1.00 0.00 H new ATOM 0 HA PHE A 70 -12.099 9.275 -2.069 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -14.793 7.839 -2.104 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -13.687 7.934 -3.460 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -11.285 6.984 -3.088 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -14.678 6.015 -0.619 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -10.089 4.979 -2.236 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -13.518 3.963 0.165 1.00 0.00 H new ATOM 0 HZ PHE A 70 -11.207 3.481 -0.600 1.00 0.00 H new ATOM 308 N GLY A 71 -14.828 11.006 -1.676 1.00 0.00 N ATOM 309 CA GLY A 71 -15.584 12.154 -2.169 1.00 0.00 C ATOM 310 C GLY A 71 -17.072 11.840 -2.186 1.00 0.00 C ATOM 311 O GLY A 71 -17.670 11.674 -1.120 1.00 0.00 O ATOM 0 H GLY A 71 -15.066 10.739 -0.721 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -15.396 13.021 -1.536 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -15.249 12.414 -3.173 1.00 0.00 H new ATOM 315 N ALA A 72 -17.660 11.717 -3.378 1.00 0.00 N ATOM 316 CA ALA A 72 -19.069 11.436 -3.585 1.00 0.00 C ATOM 317 C ALA A 72 -19.299 10.146 -4.367 1.00 0.00 C ATOM 318 O ALA A 72 -19.782 9.175 -3.779 1.00 0.00 O ATOM 319 CB ALA A 72 -19.723 12.619 -4.300 1.00 0.00 C ATOM 0 H ALA A 72 -17.144 11.815 -4.252 1.00 0.00 H new ATOM 0 HA ALA A 72 -19.527 11.294 -2.606 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -20.781 12.410 -4.456 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -19.617 13.516 -3.691 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -19.238 12.775 -5.263 1.00 0.00 H new ATOM 325 N GLU A 73 -19.040 10.160 -5.685 1.00 0.00 N ATOM 326 CA GLU A 73 -19.478 9.109 -6.602 1.00 0.00 C ATOM 327 C GLU A 73 -18.883 7.762 -6.204 1.00 0.00 C ATOM 328 O GLU A 73 -19.624 6.787 -6.051 1.00 0.00 O ATOM 329 CB GLU A 73 -19.264 9.460 -8.094 1.00 0.00 C ATOM 330 CG GLU A 73 -17.878 9.979 -8.518 1.00 0.00 C ATOM 331 CD GLU A 73 -17.670 9.985 -10.038 1.00 0.00 C ATOM 332 OE1 GLU A 73 -18.215 10.895 -10.708 1.00 0.00 O ATOM 333 OE2 GLU A 73 -16.942 9.128 -10.587 1.00 0.00 O ATOM 0 H GLU A 73 -18.517 10.908 -6.141 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.560 9.027 -6.503 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -19.482 8.569 -8.682 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -20.002 10.213 -8.370 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -17.745 10.991 -8.136 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -17.109 9.360 -8.056 1.00 0.00 H new ATOM 340 N GLY A 74 -17.571 7.729 -5.985 1.00 0.00 N ATOM 341 CA GLY A 74 -16.819 6.560 -5.588 1.00 0.00 C ATOM 342 C GLY A 74 -17.032 6.237 -4.122 1.00 0.00 C ATOM 343 O GLY A 74 -17.112 5.070 -3.766 1.00 0.00 O ATOM 0 H GLY A 74 -16.985 8.557 -6.086 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -17.120 5.708 -6.197 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -15.758 6.727 -5.775 1.00 0.00 H new ATOM 347 N ASN A 75 -17.171 7.258 -3.283 1.00 0.00 N ATOM 348 CA ASN A 75 -17.390 7.124 -1.849 1.00 0.00 C ATOM 349 C ASN A 75 -18.617 6.265 -1.545 1.00 0.00 C ATOM 350 O ASN A 75 -18.521 5.208 -0.928 1.00 0.00 O ATOM 351 CB ASN A 75 -17.486 8.538 -1.279 1.00 0.00 C ATOM 352 CG ASN A 75 -16.977 8.613 0.142 1.00 0.00 C ATOM 353 OD1 ASN A 75 -15.783 8.509 0.379 1.00 0.00 O ATOM 354 ND2 ASN A 75 -17.845 8.869 1.085 1.00 0.00 N ATOM 0 H ASN A 75 -17.133 8.229 -3.592 1.00 0.00 H new ATOM 0 HA ASN A 75 -16.563 6.597 -1.372 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -16.912 9.221 -1.906 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -18.523 8.872 -1.310 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -17.531 8.987 2.048 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -18.836 8.950 0.858 1.00 0.00 H new ATOM 361 N ARG A 76 -19.774 6.673 -2.070 1.00 0.00 N ATOM 362 CA ARG A 76 -20.983 5.843 -2.126 1.00 0.00 C ATOM 363 C ARG A 76 -20.725 4.468 -2.738 1.00 0.00 C ATOM 364 O ARG A 76 -21.245 3.485 -2.216 1.00 0.00 O ATOM 365 CB ARG A 76 -22.071 6.562 -2.933 1.00 0.00 C ATOM 366 CG ARG A 76 -22.968 7.427 -2.050 1.00 0.00 C ATOM 367 CD ARG A 76 -24.081 6.624 -1.369 1.00 0.00 C ATOM 368 NE ARG A 76 -25.285 6.506 -2.217 1.00 0.00 N ATOM 369 CZ ARG A 76 -26.545 6.649 -1.789 1.00 0.00 C ATOM 370 NH1 ARG A 76 -26.810 6.710 -0.489 1.00 0.00 N ATOM 371 NH2 ARG A 76 -27.542 6.787 -2.652 1.00 0.00 N ATOM 0 H ARG A 76 -19.901 7.601 -2.474 1.00 0.00 H new ATOM 0 HA ARG A 76 -21.311 5.688 -1.098 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -21.603 7.186 -3.695 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -22.681 5.825 -3.455 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -22.359 7.914 -1.288 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -23.414 8.216 -2.655 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -23.711 5.628 -1.126 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -24.348 7.103 -0.427 1.00 0.00 H new ATOM 0 HE ARG A 76 -25.145 6.299 -3.206 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -26.051 6.648 0.190 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -27.772 6.819 -0.169 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -27.353 6.785 -3.654 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -28.498 6.895 -2.314 1.00 0.00 H new ATOM 385 N TYR A 77 -19.983 4.384 -3.843 1.00 0.00 N ATOM 386 CA TYR A 77 -19.671 3.098 -4.460 1.00 0.00 C ATOM 387 C TYR A 77 -18.901 2.172 -3.513 1.00 0.00 C ATOM 388 O TYR A 77 -19.077 0.957 -3.589 1.00 0.00 O ATOM 389 CB TYR A 77 -18.883 3.308 -5.757 1.00 0.00 C ATOM 390 CG TYR A 77 -19.456 2.584 -6.951 1.00 0.00 C ATOM 391 CD1 TYR A 77 -20.729 2.945 -7.429 1.00 0.00 C ATOM 392 CD2 TYR A 77 -18.671 1.661 -7.667 1.00 0.00 C ATOM 393 CE1 TYR A 77 -21.242 2.347 -8.588 1.00 0.00 C ATOM 394 CE2 TYR A 77 -19.138 1.147 -8.887 1.00 0.00 C ATOM 395 CZ TYR A 77 -20.460 1.416 -9.299 1.00 0.00 C ATOM 396 OH TYR A 77 -20.957 0.860 -10.433 1.00 0.00 O ATOM 0 H TYR A 77 -19.588 5.191 -4.327 1.00 0.00 H new ATOM 0 HA TYR A 77 -20.619 2.610 -4.689 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -18.844 4.375 -5.977 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -17.856 2.977 -5.603 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -21.312 3.685 -6.901 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -17.712 1.349 -7.279 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -22.233 2.599 -8.935 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -18.488 0.548 -9.508 1.00 0.00 H new ATOM 0 HH TYR A 77 -20.297 0.940 -11.153 1.00 0.00 H new ATOM 406 N TYR A 78 -18.064 2.709 -2.619 1.00 0.00 N ATOM 407 CA TYR A 78 -17.400 1.898 -1.618 1.00 0.00 C ATOM 408 C TYR A 78 -18.471 1.329 -0.704 1.00 0.00 C ATOM 409 O TYR A 78 -18.623 0.119 -0.690 1.00 0.00 O ATOM 410 CB TYR A 78 -16.310 2.656 -0.847 1.00 0.00 C ATOM 411 CG TYR A 78 -15.291 1.733 -0.193 1.00 0.00 C ATOM 412 CD1 TYR A 78 -14.621 0.762 -0.964 1.00 0.00 C ATOM 413 CD2 TYR A 78 -15.007 1.839 1.185 1.00 0.00 C ATOM 414 CE1 TYR A 78 -13.773 -0.169 -0.344 1.00 0.00 C ATOM 415 CE2 TYR A 78 -14.085 0.965 1.795 1.00 0.00 C ATOM 416 CZ TYR A 78 -13.529 -0.089 1.040 1.00 0.00 C ATOM 417 OH TYR A 78 -12.770 -1.036 1.647 1.00 0.00 O ATOM 0 H TYR A 78 -17.837 3.702 -2.576 1.00 0.00 H new ATOM 0 HA TYR A 78 -16.860 1.089 -2.111 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -15.794 3.332 -1.529 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -16.778 3.273 -0.080 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -14.760 0.734 -2.035 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -15.500 2.596 1.777 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.307 -0.948 -0.930 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -13.807 1.101 2.830 1.00 0.00 H new ATOM 0 HH TYR A 78 -13.350 -1.739 2.006 1.00 0.00 H new ATOM 427 N GLU A 79 -19.284 2.156 -0.041 1.00 0.00 N ATOM 428 CA GLU A 79 -20.382 1.709 0.828 1.00 0.00 C ATOM 429 C GLU A 79 -21.283 0.660 0.174 1.00 0.00 C ATOM 430 O GLU A 79 -21.793 -0.243 0.845 1.00 0.00 O ATOM 431 CB GLU A 79 -21.237 2.915 1.225 1.00 0.00 C ATOM 432 CG GLU A 79 -20.675 3.646 2.439 1.00 0.00 C ATOM 433 CD GLU A 79 -21.079 2.973 3.761 1.00 0.00 C ATOM 434 OE1 GLU A 79 -21.027 1.726 3.874 1.00 0.00 O ATOM 435 OE2 GLU A 79 -21.617 3.645 4.672 1.00 0.00 O ATOM 0 H GLU A 79 -19.199 3.171 -0.092 1.00 0.00 H new ATOM 0 HA GLU A 79 -19.922 1.243 1.699 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -21.300 3.606 0.384 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -22.252 2.583 1.441 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -19.588 3.681 2.369 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -21.028 4.677 2.436 1.00 0.00 H new ATOM 442 N ALA A 80 -21.462 0.759 -1.140 1.00 0.00 N ATOM 443 CA ALA A 80 -22.182 -0.239 -1.915 1.00 0.00 C ATOM 444 C ALA A 80 -21.522 -1.620 -1.952 1.00 0.00 C ATOM 445 O ALA A 80 -22.203 -2.623 -1.727 1.00 0.00 O ATOM 446 CB ALA A 80 -22.437 0.256 -3.347 1.00 0.00 C ATOM 0 H ALA A 80 -21.109 1.538 -1.697 1.00 0.00 H new ATOM 0 HA ALA A 80 -23.127 -0.371 -1.389 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -22.977 -0.509 -3.906 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -23.031 1.170 -3.316 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -21.485 0.459 -3.837 1.00 0.00 H new ATOM 452 N ASN A 81 -20.247 -1.704 -2.333 1.00 0.00 N ATOM 453 CA ASN A 81 -19.608 -2.962 -2.729 1.00 0.00 C ATOM 454 C ASN A 81 -18.119 -2.972 -2.353 1.00 0.00 C ATOM 455 O ASN A 81 -17.265 -3.474 -3.082 1.00 0.00 O ATOM 456 CB ASN A 81 -19.901 -3.280 -4.214 1.00 0.00 C ATOM 457 CG ASN A 81 -19.683 -2.109 -5.159 1.00 0.00 C ATOM 458 OD1 ASN A 81 -20.600 -1.651 -5.835 1.00 0.00 O ATOM 459 ND2 ASN A 81 -18.479 -1.583 -5.192 1.00 0.00 N ATOM 0 H ASN A 81 -19.624 -0.897 -2.376 1.00 0.00 H new ATOM 0 HA ASN A 81 -20.046 -3.784 -2.163 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -19.266 -4.108 -4.528 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -20.933 -3.617 -4.304 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -18.291 -0.777 -5.788 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -17.733 -1.981 -4.621 1.00 0.00 H new ATOM 466 N TYR A 82 -17.810 -2.439 -1.174 1.00 0.00 N ATOM 467 CA TYR A 82 -16.502 -2.302 -0.531 1.00 0.00 C ATOM 468 C TYR A 82 -15.705 -3.602 -0.449 1.00 0.00 C ATOM 469 O TYR A 82 -14.476 -3.576 -0.464 1.00 0.00 O ATOM 470 CB TYR A 82 -16.711 -1.768 0.896 1.00 0.00 C ATOM 471 CG TYR A 82 -17.811 -2.498 1.654 1.00 0.00 C ATOM 472 CD1 TYR A 82 -17.503 -3.664 2.378 1.00 0.00 C ATOM 473 CD2 TYR A 82 -19.152 -2.070 1.561 1.00 0.00 C ATOM 474 CE1 TYR A 82 -18.529 -4.451 2.926 1.00 0.00 C ATOM 475 CE2 TYR A 82 -20.177 -2.838 2.130 1.00 0.00 C ATOM 476 CZ TYR A 82 -19.876 -4.049 2.787 1.00 0.00 C ATOM 477 OH TYR A 82 -20.879 -4.842 3.246 1.00 0.00 O ATOM 0 H TYR A 82 -18.545 -2.051 -0.582 1.00 0.00 H new ATOM 0 HA TYR A 82 -15.922 -1.619 -1.151 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -15.777 -1.856 1.450 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -16.954 -0.707 0.848 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -16.472 -3.956 2.513 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -19.389 -1.148 1.050 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -18.288 -5.362 3.453 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -21.201 -2.501 2.065 1.00 0.00 H new ATOM 0 HH TYR A 82 -21.742 -4.413 3.070 1.00 0.00 H new ATOM 487 N TRP A 83 -16.386 -4.744 -0.386 1.00 0.00 N ATOM 488 CA TRP A 83 -15.759 -6.053 -0.308 1.00 0.00 C ATOM 489 C TRP A 83 -14.922 -6.381 -1.553 1.00 0.00 C ATOM 490 O TRP A 83 -14.065 -7.257 -1.492 1.00 0.00 O ATOM 491 CB TRP A 83 -16.844 -7.101 -0.035 1.00 0.00 C ATOM 492 CG TRP A 83 -17.921 -7.255 -1.069 1.00 0.00 C ATOM 493 CD1 TRP A 83 -19.003 -6.457 -1.218 1.00 0.00 C ATOM 494 CD2 TRP A 83 -18.056 -8.290 -2.086 1.00 0.00 C ATOM 495 NE1 TRP A 83 -19.794 -6.926 -2.243 1.00 0.00 N ATOM 496 CE2 TRP A 83 -19.258 -8.059 -2.816 1.00 0.00 C ATOM 497 CE3 TRP A 83 -17.253 -9.375 -2.494 1.00 0.00 C ATOM 498 CZ2 TRP A 83 -19.658 -8.885 -3.876 1.00 0.00 C ATOM 499 CZ3 TRP A 83 -17.634 -10.204 -3.566 1.00 0.00 C ATOM 500 CH2 TRP A 83 -18.837 -9.960 -4.253 1.00 0.00 C ATOM 0 H TRP A 83 -17.405 -4.782 -0.388 1.00 0.00 H new ATOM 0 HA TRP A 83 -15.046 -6.057 0.516 1.00 0.00 H new ATOM 0 HB2 TRP A 83 -16.356 -8.068 0.092 1.00 0.00 H new ATOM 0 HB3 TRP A 83 -17.319 -6.856 0.915 1.00 0.00 H new ATOM 0 HD1 TRP A 83 -19.215 -5.582 -0.622 1.00 0.00 H new ATOM 0 HE1 TRP A 83 -20.667 -6.490 -2.541 1.00 0.00 H new ATOM 0 HE3 TRP A 83 -16.328 -9.574 -1.974 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 -20.586 -8.697 -4.396 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 -17.002 -11.028 -3.861 1.00 0.00 H new ATOM 0 HH2 TRP A 83 -19.130 -10.601 -5.072 1.00 0.00 H new ATOM 511 N GLN A 84 -15.116 -5.668 -2.664 1.00 0.00 N ATOM 512 CA GLN A 84 -14.514 -5.940 -3.965 1.00 0.00 C ATOM 513 C GLN A 84 -13.212 -5.147 -4.167 1.00 0.00 C ATOM 514 O GLN A 84 -12.922 -4.710 -5.280 1.00 0.00 O ATOM 515 CB GLN A 84 -15.563 -5.662 -5.054 1.00 0.00 C ATOM 516 CG GLN A 84 -16.779 -6.600 -4.948 1.00 0.00 C ATOM 517 CD GLN A 84 -16.741 -7.748 -5.960 1.00 0.00 C ATOM 518 OE1 GLN A 84 -15.718 -8.418 -6.123 1.00 0.00 O ATOM 519 NE2 GLN A 84 -17.833 -8.040 -6.643 1.00 0.00 N ATOM 0 H GLN A 84 -15.724 -4.850 -2.679 1.00 0.00 H new ATOM 0 HA GLN A 84 -14.219 -6.988 -4.027 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -15.897 -4.627 -4.977 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -15.103 -5.776 -6.036 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -16.825 -7.013 -3.940 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -17.691 -6.022 -5.097 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -18.680 -7.488 -6.510 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -17.829 -8.818 -7.303 1.00 0.00 H new ATOM 528 N PHE A 85 -12.450 -4.876 -3.103 1.00 0.00 N ATOM 529 CA PHE A 85 -11.294 -3.978 -3.136 1.00 0.00 C ATOM 530 C PHE A 85 -10.159 -4.504 -2.248 1.00 0.00 C ATOM 531 O PHE A 85 -10.432 -5.278 -1.326 1.00 0.00 O ATOM 532 CB PHE A 85 -11.744 -2.600 -2.637 1.00 0.00 C ATOM 533 CG PHE A 85 -12.698 -1.864 -3.563 1.00 0.00 C ATOM 534 CD1 PHE A 85 -14.084 -2.089 -3.477 1.00 0.00 C ATOM 535 CD2 PHE A 85 -12.207 -0.949 -4.513 1.00 0.00 C ATOM 536 CE1 PHE A 85 -14.973 -1.365 -4.284 1.00 0.00 C ATOM 537 CE2 PHE A 85 -13.096 -0.253 -5.349 1.00 0.00 C ATOM 538 CZ PHE A 85 -14.483 -0.435 -5.215 1.00 0.00 C ATOM 0 H PHE A 85 -12.622 -5.280 -2.182 1.00 0.00 H new ATOM 0 HA PHE A 85 -10.916 -3.915 -4.156 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -12.224 -2.720 -1.666 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -10.861 -1.980 -2.481 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -14.466 -2.825 -2.785 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -11.144 -0.781 -4.600 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -16.037 -1.523 -4.189 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.712 0.424 -6.097 1.00 0.00 H new ATOM 0 HZ PHE A 85 -15.168 0.137 -5.824 1.00 0.00 H new ATOM 548 N PRO A 86 -8.895 -4.078 -2.459 1.00 0.00 N ATOM 549 CA PRO A 86 -7.798 -4.393 -1.559 1.00 0.00 C ATOM 550 C PRO A 86 -8.057 -3.757 -0.194 1.00 0.00 C ATOM 551 O PRO A 86 -8.604 -2.661 -0.103 1.00 0.00 O ATOM 552 CB PRO A 86 -6.521 -3.867 -2.208 1.00 0.00 C ATOM 553 CG PRO A 86 -7.010 -2.755 -3.121 1.00 0.00 C ATOM 554 CD PRO A 86 -8.422 -3.200 -3.513 1.00 0.00 C ATOM 0 HA PRO A 86 -7.702 -5.466 -1.393 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.818 -3.493 -1.463 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -6.006 -4.647 -2.768 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -7.021 -1.793 -2.609 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -6.368 -2.644 -3.995 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -9.081 -2.339 -3.623 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -8.411 -3.718 -4.472 1.00 0.00 H new ATOM 562 N ASP A 87 -7.660 -4.456 0.861 1.00 0.00 N ATOM 563 CA ASP A 87 -7.590 -3.944 2.228 1.00 0.00 C ATOM 564 C ASP A 87 -6.295 -3.163 2.423 1.00 0.00 C ATOM 565 O ASP A 87 -6.288 -2.058 2.958 1.00 0.00 O ATOM 566 CB ASP A 87 -7.603 -5.145 3.176 1.00 0.00 C ATOM 567 CG ASP A 87 -7.024 -4.792 4.543 1.00 0.00 C ATOM 568 OD1 ASP A 87 -7.567 -3.880 5.193 1.00 0.00 O ATOM 569 OD2 ASP A 87 -6.056 -5.468 4.955 1.00 0.00 O ATOM 0 H ASP A 87 -7.367 -5.430 0.788 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.433 -3.282 2.428 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -8.626 -5.503 3.295 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.029 -5.961 2.737 1.00 0.00 H new ATOM 574 N GLY A 88 -5.201 -3.757 1.955 1.00 0.00 N ATOM 575 CA GLY A 88 -3.842 -3.347 2.213 1.00 0.00 C ATOM 576 C GLY A 88 -2.964 -3.709 1.025 1.00 0.00 C ATOM 577 O GLY A 88 -3.382 -4.480 0.145 1.00 0.00 O ATOM 0 H GLY A 88 -5.252 -4.580 1.355 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -3.804 -2.272 2.392 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -3.470 -3.834 3.114 1.00 0.00 H new ATOM 581 N ILE A 89 -1.757 -3.148 1.008 1.00 0.00 N ATOM 582 CA ILE A 89 -0.682 -3.483 0.081 1.00 0.00 C ATOM 583 C ILE A 89 0.550 -3.825 0.910 1.00 0.00 C ATOM 584 O ILE A 89 1.000 -3.010 1.713 1.00 0.00 O ATOM 585 CB ILE A 89 -0.377 -2.319 -0.886 1.00 0.00 C ATOM 586 CG1 ILE A 89 -1.603 -1.863 -1.689 1.00 0.00 C ATOM 587 CG2 ILE A 89 0.770 -2.683 -1.847 1.00 0.00 C ATOM 588 CD1 ILE A 89 -2.151 -2.880 -2.692 1.00 0.00 C ATOM 0 H ILE A 89 -1.492 -2.417 1.668 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.982 -4.330 -0.536 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.073 -1.482 -0.257 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.398 -1.605 -0.989 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.344 -0.951 -2.228 1.00 0.00 H new ATOM 0 HG21 ILE A 89 0.963 -1.845 -2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.670 -2.904 -1.273 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.490 -3.558 -2.433 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -3.015 -2.457 -3.204 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -1.379 -3.123 -3.422 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.450 -3.786 -2.165 1.00 0.00 H new ATOM 600 N HIS A 90 1.093 -5.014 0.657 1.00 0.00 N ATOM 601 CA HIS A 90 2.330 -5.545 1.203 1.00 0.00 C ATOM 602 C HIS A 90 3.501 -4.633 0.775 1.00 0.00 C ATOM 603 O HIS A 90 3.867 -3.714 1.507 1.00 0.00 O ATOM 604 CB HIS A 90 2.493 -7.020 0.756 1.00 0.00 C ATOM 605 CG HIS A 90 1.234 -7.861 0.633 1.00 0.00 C ATOM 606 ND1 HIS A 90 0.232 -7.727 -0.315 1.00 0.00 N ATOM 607 CD2 HIS A 90 1.002 -9.037 1.294 1.00 0.00 C ATOM 608 CE1 HIS A 90 -0.563 -8.806 -0.233 1.00 0.00 C ATOM 609 NE2 HIS A 90 -0.137 -9.621 0.734 1.00 0.00 N ATOM 0 H HIS A 90 0.646 -5.674 0.021 1.00 0.00 H new ATOM 0 HA HIS A 90 2.316 -5.550 2.293 1.00 0.00 H new ATOM 0 HB2 HIS A 90 2.996 -7.024 -0.211 1.00 0.00 H new ATOM 0 HB3 HIS A 90 3.159 -7.514 1.464 1.00 0.00 H new ATOM 0 HD1 HIS A 90 0.118 -6.946 -0.961 1.00 0.00 H new ATOM 0 HD2 HIS A 90 1.593 -9.441 2.103 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -1.424 -8.988 -0.860 1.00 0.00 H new ATOM 617 N TYR A 91 4.000 -4.808 -0.457 1.00 0.00 N ATOM 618 CA TYR A 91 5.070 -4.056 -1.114 1.00 0.00 C ATOM 619 C TYR A 91 6.351 -3.902 -0.263 1.00 0.00 C ATOM 620 O TYR A 91 6.537 -4.550 0.771 1.00 0.00 O ATOM 621 CB TYR A 91 4.488 -2.747 -1.689 1.00 0.00 C ATOM 622 CG TYR A 91 5.391 -1.980 -2.638 1.00 0.00 C ATOM 623 CD1 TYR A 91 5.837 -2.588 -3.826 1.00 0.00 C ATOM 624 CD2 TYR A 91 5.850 -0.694 -2.294 1.00 0.00 C ATOM 625 CE1 TYR A 91 6.747 -1.924 -4.666 1.00 0.00 C ATOM 626 CE2 TYR A 91 6.757 -0.021 -3.133 1.00 0.00 C ATOM 627 CZ TYR A 91 7.213 -0.631 -4.322 1.00 0.00 C ATOM 628 OH TYR A 91 8.105 0.022 -5.117 1.00 0.00 O ATOM 0 H TYR A 91 3.633 -5.539 -1.066 1.00 0.00 H new ATOM 0 HA TYR A 91 5.445 -4.638 -1.956 1.00 0.00 H new ATOM 0 HB2 TYR A 91 3.561 -2.983 -2.212 1.00 0.00 H new ATOM 0 HB3 TYR A 91 4.227 -2.092 -0.858 1.00 0.00 H new ATOM 0 HD1 TYR A 91 5.478 -3.571 -4.094 1.00 0.00 H new ATOM 0 HD2 TYR A 91 5.505 -0.224 -1.385 1.00 0.00 H new ATOM 0 HE1 TYR A 91 7.091 -2.399 -5.573 1.00 0.00 H new ATOM 0 HE2 TYR A 91 7.106 0.966 -2.867 1.00 0.00 H new ATOM 0 HH TYR A 91 8.312 0.897 -4.727 1.00 0.00 H new ATOM 638 N ASN A 92 7.310 -3.123 -0.772 1.00 0.00 N ATOM 639 CA ASN A 92 8.546 -2.797 -0.080 1.00 0.00 C ATOM 640 C ASN A 92 8.253 -1.733 0.973 1.00 0.00 C ATOM 641 O ASN A 92 7.493 -0.802 0.702 1.00 0.00 O ATOM 642 CB ASN A 92 9.576 -2.256 -1.075 1.00 0.00 C ATOM 643 CG ASN A 92 10.884 -1.970 -0.359 1.00 0.00 C ATOM 644 OD1 ASN A 92 11.232 -0.823 -0.118 1.00 0.00 O ATOM 645 ND2 ASN A 92 11.628 -3.001 0.007 1.00 0.00 N ATOM 0 H ASN A 92 7.241 -2.696 -1.696 1.00 0.00 H new ATOM 0 HA ASN A 92 8.947 -3.694 0.393 1.00 0.00 H new ATOM 0 HB2 ASN A 92 9.739 -2.980 -1.873 1.00 0.00 H new ATOM 0 HB3 ASN A 92 9.200 -1.346 -1.542 1.00 0.00 H new ATOM 0 HD21 ASN A 92 12.508 -2.846 0.499 1.00 0.00 H new ATOM 0 HD22 ASN A 92 11.322 -3.951 -0.203 1.00 0.00 H new ATOM 652 N GLY A 93 8.886 -1.834 2.140 1.00 0.00 N ATOM 653 CA GLY A 93 8.671 -0.936 3.263 1.00 0.00 C ATOM 654 C GLY A 93 9.531 0.315 3.189 1.00 0.00 C ATOM 655 O GLY A 93 10.066 0.717 4.227 1.00 0.00 O ATOM 0 H GLY A 93 9.577 -2.560 2.331 1.00 0.00 H new ATOM 0 HA2 GLY A 93 7.620 -0.648 3.296 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.886 -1.465 4.192 1.00 0.00 H new ATOM 659 N CYS A 94 9.660 0.924 2.002 1.00 0.00 N ATOM 660 CA CYS A 94 10.441 2.121 1.697 1.00 0.00 C ATOM 661 C CYS A 94 11.914 1.730 1.528 1.00 0.00 C ATOM 662 O CYS A 94 12.422 0.931 2.313 1.00 0.00 O ATOM 663 CB CYS A 94 10.251 3.175 2.801 1.00 0.00 C ATOM 664 SG CYS A 94 10.020 4.884 2.299 1.00 0.00 S ATOM 0 H CYS A 94 9.186 0.564 1.174 1.00 0.00 H new ATOM 0 HA CYS A 94 10.095 2.565 0.764 1.00 0.00 H new ATOM 0 HB2 CYS A 94 9.388 2.882 3.398 1.00 0.00 H new ATOM 0 HB3 CYS A 94 11.121 3.133 3.457 1.00 0.00 H new ATOM 669 N SER A 95 12.615 2.283 0.533 1.00 0.00 N ATOM 670 CA SER A 95 14.068 2.175 0.394 1.00 0.00 C ATOM 671 C SER A 95 14.540 3.146 -0.694 1.00 0.00 C ATOM 672 O SER A 95 14.460 2.846 -1.885 1.00 0.00 O ATOM 673 CB SER A 95 14.506 0.724 0.136 1.00 0.00 C ATOM 674 OG SER A 95 13.673 0.009 -0.766 1.00 0.00 O ATOM 0 H SER A 95 12.179 2.828 -0.211 1.00 0.00 H new ATOM 0 HA SER A 95 14.547 2.458 1.331 1.00 0.00 H new ATOM 0 HB2 SER A 95 15.523 0.729 -0.255 1.00 0.00 H new ATOM 0 HB3 SER A 95 14.532 0.191 1.087 1.00 0.00 H new ATOM 0 HG SER A 95 12.756 -0.007 -0.421 1.00 0.00 H new ATOM 680 N GLU A 96 14.910 4.366 -0.300 1.00 0.00 N ATOM 681 CA GLU A 96 15.317 5.478 -1.145 1.00 0.00 C ATOM 682 C GLU A 96 15.936 6.580 -0.285 1.00 0.00 C ATOM 683 O GLU A 96 16.692 7.412 -0.783 1.00 0.00 O ATOM 684 CB GLU A 96 14.060 5.985 -1.839 1.00 0.00 C ATOM 685 CG GLU A 96 14.302 7.069 -2.876 1.00 0.00 C ATOM 686 CD GLU A 96 14.859 6.505 -4.188 1.00 0.00 C ATOM 687 OE1 GLU A 96 14.031 6.110 -5.038 1.00 0.00 O ATOM 688 OE2 GLU A 96 16.094 6.475 -4.381 1.00 0.00 O ATOM 0 H GLU A 96 14.933 4.615 0.689 1.00 0.00 H new ATOM 0 HA GLU A 96 16.063 5.170 -1.877 1.00 0.00 H new ATOM 0 HB2 GLU A 96 13.563 5.143 -2.322 1.00 0.00 H new ATOM 0 HB3 GLU A 96 13.374 6.370 -1.084 1.00 0.00 H new ATOM 0 HG2 GLU A 96 13.367 7.593 -3.076 1.00 0.00 H new ATOM 0 HG3 GLU A 96 14.999 7.804 -2.474 1.00 0.00 H new ATOM 695 N ALA A 97 15.591 6.610 1.007 1.00 0.00 N ATOM 696 CA ALA A 97 16.191 7.402 2.067 1.00 0.00 C ATOM 697 C ALA A 97 15.722 8.855 2.015 1.00 0.00 C ATOM 698 O ALA A 97 16.101 9.643 2.877 1.00 0.00 O ATOM 699 CB ALA A 97 17.713 7.239 2.030 1.00 0.00 C ATOM 0 H ALA A 97 14.825 6.034 1.357 1.00 0.00 H new ATOM 0 HA ALA A 97 15.854 7.034 3.036 1.00 0.00 H new ATOM 0 HB1 ALA A 97 18.162 7.834 2.826 1.00 0.00 H new ATOM 0 HB2 ALA A 97 17.970 6.189 2.172 1.00 0.00 H new ATOM 0 HB3 ALA A 97 18.092 7.578 1.066 1.00 0.00 H new ATOM 705 N ASN A 98 14.896 9.197 1.015 1.00 0.00 N ATOM 706 CA ASN A 98 14.470 10.591 0.782 1.00 0.00 C ATOM 707 C ASN A 98 13.164 10.772 -0.007 1.00 0.00 C ATOM 708 O ASN A 98 12.947 11.810 -0.637 1.00 0.00 O ATOM 709 CB ASN A 98 15.615 11.402 0.137 1.00 0.00 C ATOM 710 CG ASN A 98 15.789 11.196 -1.361 1.00 0.00 C ATOM 711 OD1 ASN A 98 15.599 12.116 -2.146 1.00 0.00 O ATOM 712 ND2 ASN A 98 16.212 10.025 -1.803 1.00 0.00 N ATOM 0 H ASN A 98 14.507 8.527 0.351 1.00 0.00 H new ATOM 0 HA ASN A 98 14.239 10.978 1.775 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.439 12.461 0.324 1.00 0.00 H new ATOM 0 HB3 ASN A 98 16.549 11.141 0.635 1.00 0.00 H new ATOM 0 HD21 ASN A 98 16.381 9.887 -2.799 1.00 0.00 H new ATOM 0 HD22 ASN A 98 16.370 9.259 -1.148 1.00 0.00 H new ATOM 719 N VAL A 99 12.309 9.756 -0.024 1.00 0.00 N ATOM 720 CA VAL A 99 11.174 9.653 -0.932 1.00 0.00 C ATOM 721 C VAL A 99 9.988 10.512 -0.454 1.00 0.00 C ATOM 722 O VAL A 99 10.082 11.213 0.554 1.00 0.00 O ATOM 723 CB VAL A 99 10.909 8.147 -1.107 1.00 0.00 C ATOM 724 CG1 VAL A 99 10.292 7.500 0.128 1.00 0.00 C ATOM 725 CG2 VAL A 99 10.162 7.765 -2.377 1.00 0.00 C ATOM 0 H VAL A 99 12.389 8.961 0.610 1.00 0.00 H new ATOM 0 HA VAL A 99 11.370 10.074 -1.918 1.00 0.00 H new ATOM 0 HB VAL A 99 11.908 7.728 -1.230 1.00 0.00 H new ATOM 0 HG11 VAL A 99 10.130 6.439 -0.060 1.00 0.00 H new ATOM 0 HG12 VAL A 99 10.966 7.620 0.976 1.00 0.00 H new ATOM 0 HG13 VAL A 99 9.339 7.979 0.352 1.00 0.00 H new ATOM 0 HG21 VAL A 99 10.025 6.684 -2.407 1.00 0.00 H new ATOM 0 HG22 VAL A 99 9.188 8.255 -2.388 1.00 0.00 H new ATOM 0 HG23 VAL A 99 10.737 8.082 -3.247 1.00 0.00 H new ATOM 735 N THR A 100 8.881 10.483 -1.194 1.00 0.00 N ATOM 736 CA THR A 100 7.691 11.298 -0.980 1.00 0.00 C ATOM 737 C THR A 100 6.427 10.464 -1.182 1.00 0.00 C ATOM 738 O THR A 100 6.461 9.369 -1.755 1.00 0.00 O ATOM 739 CB THR A 100 7.702 12.478 -1.975 1.00 0.00 C ATOM 740 OG1 THR A 100 7.783 11.992 -3.303 1.00 0.00 O ATOM 741 CG2 THR A 100 8.860 13.452 -1.757 1.00 0.00 C ATOM 0 H THR A 100 8.787 9.860 -1.997 1.00 0.00 H new ATOM 0 HA THR A 100 7.696 11.675 0.043 1.00 0.00 H new ATOM 0 HB THR A 100 6.772 13.020 -1.802 1.00 0.00 H new ATOM 0 HG1 THR A 100 7.788 12.747 -3.928 1.00 0.00 H new ATOM 0 HG21 THR A 100 8.803 14.255 -2.492 1.00 0.00 H new ATOM 0 HG22 THR A 100 8.797 13.873 -0.754 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.806 12.923 -1.870 1.00 0.00 H new ATOM 749 N LYS A 101 5.284 11.032 -0.787 1.00 0.00 N ATOM 750 CA LYS A 101 3.960 10.499 -1.062 1.00 0.00 C ATOM 751 C LYS A 101 3.592 10.518 -2.542 1.00 0.00 C ATOM 752 O LYS A 101 2.535 9.985 -2.888 1.00 0.00 O ATOM 753 CB LYS A 101 2.918 11.292 -0.254 1.00 0.00 C ATOM 754 CG LYS A 101 2.248 10.359 0.752 1.00 0.00 C ATOM 755 CD LYS A 101 1.104 11.075 1.474 1.00 0.00 C ATOM 756 CE LYS A 101 -0.161 11.022 0.604 1.00 0.00 C ATOM 757 NZ LYS A 101 -1.229 11.878 1.162 1.00 0.00 N ATOM 0 H LYS A 101 5.261 11.900 -0.252 1.00 0.00 H new ATOM 0 HA LYS A 101 3.969 9.451 -0.762 1.00 0.00 H new ATOM 0 HB2 LYS A 101 3.397 12.122 0.265 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.172 11.722 -0.922 1.00 0.00 H new ATOM 0 HG2 LYS A 101 1.865 9.477 0.239 1.00 0.00 H new ATOM 0 HG3 LYS A 101 2.982 10.011 1.479 1.00 0.00 H new ATOM 0 HD2 LYS A 101 0.916 10.603 2.438 1.00 0.00 H new ATOM 0 HD3 LYS A 101 1.378 12.111 1.675 1.00 0.00 H new ATOM 0 HE2 LYS A 101 0.077 11.347 -0.409 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.515 9.993 0.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.071 11.823 0.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.471 11.552 2.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.897 12.863 1.206 1.00 0.00 H new ATOM 771 N GLU A 102 4.384 11.134 -3.418 1.00 0.00 N ATOM 772 CA GLU A 102 4.353 10.793 -4.826 1.00 0.00 C ATOM 773 C GLU A 102 5.244 9.572 -4.989 1.00 0.00 C ATOM 774 O GLU A 102 4.714 8.467 -5.032 1.00 0.00 O ATOM 775 CB GLU A 102 4.775 11.977 -5.712 1.00 0.00 C ATOM 776 CG GLU A 102 3.605 12.837 -6.212 1.00 0.00 C ATOM 777 CD GLU A 102 2.606 12.099 -7.119 1.00 0.00 C ATOM 778 OE1 GLU A 102 1.802 11.283 -6.616 1.00 0.00 O ATOM 779 OE2 GLU A 102 2.528 12.396 -8.333 1.00 0.00 O ATOM 0 H GLU A 102 5.049 11.867 -3.173 1.00 0.00 H new ATOM 0 HA GLU A 102 3.341 10.561 -5.157 1.00 0.00 H new ATOM 0 HB2 GLU A 102 5.462 12.610 -5.150 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.324 11.595 -6.572 1.00 0.00 H new ATOM 0 HG2 GLU A 102 3.068 13.233 -5.350 1.00 0.00 H new ATOM 0 HG3 GLU A 102 4.007 13.691 -6.757 1.00 0.00 H new ATOM 786 N ALA A 103 6.567 9.757 -5.026 1.00 0.00 N ATOM 787 CA ALA A 103 7.528 8.791 -5.540 1.00 0.00 C ATOM 788 C ALA A 103 7.288 7.361 -5.052 1.00 0.00 C ATOM 789 O ALA A 103 7.228 6.444 -5.872 1.00 0.00 O ATOM 790 CB ALA A 103 8.943 9.268 -5.204 1.00 0.00 C ATOM 0 H ALA A 103 7.007 10.612 -4.687 1.00 0.00 H new ATOM 0 HA ALA A 103 7.397 8.742 -6.621 1.00 0.00 H new ATOM 0 HB1 ALA A 103 9.669 8.550 -5.585 1.00 0.00 H new ATOM 0 HB2 ALA A 103 9.118 10.240 -5.664 1.00 0.00 H new ATOM 0 HB3 ALA A 103 9.051 9.354 -4.123 1.00 0.00 H new ATOM 796 N PHE A 104 7.145 7.162 -3.742 1.00 0.00 N ATOM 797 CA PHE A 104 6.987 5.835 -3.161 1.00 0.00 C ATOM 798 C PHE A 104 5.613 5.245 -3.520 1.00 0.00 C ATOM 799 O PHE A 104 5.535 4.096 -3.952 1.00 0.00 O ATOM 800 CB PHE A 104 7.257 5.896 -1.644 1.00 0.00 C ATOM 801 CG PHE A 104 6.416 4.934 -0.844 1.00 0.00 C ATOM 802 CD1 PHE A 104 6.792 3.584 -0.723 1.00 0.00 C ATOM 803 CD2 PHE A 104 5.181 5.373 -0.341 1.00 0.00 C ATOM 804 CE1 PHE A 104 5.920 2.667 -0.113 1.00 0.00 C ATOM 805 CE2 PHE A 104 4.282 4.441 0.188 1.00 0.00 C ATOM 806 CZ PHE A 104 4.653 3.090 0.323 1.00 0.00 C ATOM 0 H PHE A 104 7.136 7.917 -3.057 1.00 0.00 H new ATOM 0 HA PHE A 104 7.723 5.152 -3.585 1.00 0.00 H new ATOM 0 HB2 PHE A 104 8.310 5.684 -1.462 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.071 6.910 -1.290 1.00 0.00 H new ATOM 0 HD1 PHE A 104 7.749 3.253 -1.098 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.927 6.422 -0.362 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.223 1.639 0.021 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.297 4.760 0.495 1.00 0.00 H new ATOM 0 HZ PHE A 104 3.966 2.381 0.760 1.00 0.00 H new ATOM 816 N VAL A 105 4.525 6.012 -3.378 1.00 0.00 N ATOM 817 CA VAL A 105 3.177 5.524 -3.672 1.00 0.00 C ATOM 818 C VAL A 105 3.096 5.207 -5.177 1.00 0.00 C ATOM 819 O VAL A 105 2.644 4.130 -5.563 1.00 0.00 O ATOM 820 CB VAL A 105 2.114 6.538 -3.187 1.00 0.00 C ATOM 821 CG1 VAL A 105 0.687 6.050 -3.480 1.00 0.00 C ATOM 822 CG2 VAL A 105 2.205 6.871 -1.687 1.00 0.00 C ATOM 0 H VAL A 105 4.556 6.980 -3.059 1.00 0.00 H new ATOM 0 HA VAL A 105 2.964 4.604 -3.128 1.00 0.00 H new ATOM 0 HB VAL A 105 2.333 7.445 -3.751 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.031 6.789 -3.125 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.563 5.911 -4.554 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.515 5.102 -2.970 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.427 7.588 -1.426 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.070 5.960 -1.103 1.00 0.00 H new ATOM 0 HG23 VAL A 105 3.183 7.301 -1.468 1.00 0.00 H new ATOM 832 N THR A 106 3.610 6.087 -6.038 1.00 0.00 N ATOM 833 CA THR A 106 3.838 5.844 -7.450 1.00 0.00 C ATOM 834 C THR A 106 4.572 4.507 -7.658 1.00 0.00 C ATOM 835 O THR A 106 4.114 3.679 -8.451 1.00 0.00 O ATOM 836 CB THR A 106 4.631 7.031 -8.026 1.00 0.00 C ATOM 837 OG1 THR A 106 3.940 8.263 -7.909 1.00 0.00 O ATOM 838 CG2 THR A 106 4.951 6.782 -9.491 1.00 0.00 C ATOM 0 H THR A 106 3.888 7.026 -5.751 1.00 0.00 H new ATOM 0 HA THR A 106 2.888 5.764 -7.978 1.00 0.00 H new ATOM 0 HB THR A 106 5.547 7.107 -7.440 1.00 0.00 H new ATOM 0 HG1 THR A 106 3.984 8.576 -6.981 1.00 0.00 H new ATOM 0 HG21 THR A 106 5.512 7.627 -9.890 1.00 0.00 H new ATOM 0 HG22 THR A 106 5.547 5.874 -9.584 1.00 0.00 H new ATOM 0 HG23 THR A 106 4.023 6.666 -10.051 1.00 0.00 H new ATOM 846 N GLY A 107 5.698 4.274 -6.977 1.00 0.00 N ATOM 847 CA GLY A 107 6.466 3.041 -7.090 1.00 0.00 C ATOM 848 C GLY A 107 5.618 1.823 -6.735 1.00 0.00 C ATOM 849 O GLY A 107 5.688 0.797 -7.422 1.00 0.00 O ATOM 0 H GLY A 107 6.102 4.947 -6.326 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.845 2.939 -8.107 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.332 3.088 -6.430 1.00 0.00 H new ATOM 853 N CYS A 108 4.767 1.938 -5.715 1.00 0.00 N ATOM 854 CA CYS A 108 3.878 0.851 -5.317 1.00 0.00 C ATOM 855 C CYS A 108 2.850 0.585 -6.421 1.00 0.00 C ATOM 856 O CYS A 108 2.470 -0.559 -6.663 1.00 0.00 O ATOM 857 CB CYS A 108 3.210 1.108 -3.954 1.00 0.00 C ATOM 858 SG CYS A 108 1.489 1.694 -3.992 1.00 0.00 S ATOM 0 H CYS A 108 4.676 2.780 -5.147 1.00 0.00 H new ATOM 0 HA CYS A 108 4.481 -0.047 -5.186 1.00 0.00 H new ATOM 0 HB2 CYS A 108 3.243 0.183 -3.378 1.00 0.00 H new ATOM 0 HB3 CYS A 108 3.808 1.841 -3.414 1.00 0.00 H new ATOM 863 N ILE A 109 2.410 1.621 -7.131 1.00 0.00 N ATOM 864 CA ILE A 109 1.423 1.539 -8.200 1.00 0.00 C ATOM 865 C ILE A 109 2.028 0.976 -9.481 1.00 0.00 C ATOM 866 O ILE A 109 1.365 0.218 -10.192 1.00 0.00 O ATOM 867 CB ILE A 109 0.775 2.926 -8.344 1.00 0.00 C ATOM 868 CG1 ILE A 109 -0.365 2.974 -7.308 1.00 0.00 C ATOM 869 CG2 ILE A 109 0.292 3.297 -9.751 1.00 0.00 C ATOM 870 CD1 ILE A 109 -0.581 4.390 -6.804 1.00 0.00 C ATOM 0 H ILE A 109 2.743 2.572 -6.971 1.00 0.00 H new ATOM 0 HA ILE A 109 0.634 0.827 -7.958 1.00 0.00 H new ATOM 0 HB ILE A 109 1.537 3.683 -8.161 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -1.285 2.599 -7.756 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -0.128 2.318 -6.470 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -0.147 4.295 -9.734 1.00 0.00 H new ATOM 0 HG22 ILE A 109 1.136 3.284 -10.441 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -0.457 2.577 -10.080 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.391 4.397 -6.074 1.00 0.00 H new ATOM 0 HD12 ILE A 109 0.334 4.753 -6.335 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -0.841 5.038 -7.641 1.00 0.00 H new ATOM 882 N ASN A 110 3.298 1.269 -9.749 1.00 0.00 N ATOM 883 CA ASN A 110 4.068 0.571 -10.797 1.00 0.00 C ATOM 884 C ASN A 110 4.112 -0.928 -10.515 1.00 0.00 C ATOM 885 O ASN A 110 4.207 -1.748 -11.423 1.00 0.00 O ATOM 886 CB ASN A 110 5.524 1.062 -10.907 1.00 0.00 C ATOM 887 CG ASN A 110 5.681 2.379 -11.643 1.00 0.00 C ATOM 888 OD1 ASN A 110 6.234 2.429 -12.734 1.00 0.00 O ATOM 889 ND2 ASN A 110 5.239 3.461 -11.036 1.00 0.00 N ATOM 0 H ASN A 110 3.826 1.989 -9.256 1.00 0.00 H new ATOM 0 HA ASN A 110 3.554 0.788 -11.733 1.00 0.00 H new ATOM 0 HB2 ASN A 110 5.937 1.168 -9.904 1.00 0.00 H new ATOM 0 HB3 ASN A 110 6.115 0.301 -11.417 1.00 0.00 H new ATOM 0 HD21 ASN A 110 5.353 4.375 -11.475 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.782 3.385 -10.127 1.00 0.00 H new ATOM 896 N ALA A 111 4.096 -1.314 -9.242 1.00 0.00 N ATOM 897 CA ALA A 111 4.095 -2.703 -8.834 1.00 0.00 C ATOM 898 C ALA A 111 2.682 -3.291 -8.914 1.00 0.00 C ATOM 899 O ALA A 111 2.486 -4.378 -9.454 1.00 0.00 O ATOM 900 CB ALA A 111 4.706 -2.761 -7.436 1.00 0.00 C ATOM 0 H ALA A 111 4.083 -0.658 -8.461 1.00 0.00 H new ATOM 0 HA ALA A 111 4.694 -3.321 -9.503 1.00 0.00 H new ATOM 0 HB1 ALA A 111 4.724 -3.794 -7.089 1.00 0.00 H new ATOM 0 HB2 ALA A 111 5.723 -2.371 -7.467 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.107 -2.159 -6.752 1.00 0.00 H new ATOM 906 N THR A 112 1.682 -2.588 -8.387 1.00 0.00 N ATOM 907 CA THR A 112 0.337 -3.119 -8.288 1.00 0.00 C ATOM 908 C THR A 112 -0.334 -3.202 -9.665 1.00 0.00 C ATOM 909 O THR A 112 -1.171 -4.080 -9.863 1.00 0.00 O ATOM 910 CB THR A 112 -0.485 -2.301 -7.283 1.00 0.00 C ATOM 911 OG1 THR A 112 -1.457 -3.119 -6.699 1.00 0.00 O ATOM 912 CG2 THR A 112 -1.223 -1.140 -7.943 1.00 0.00 C ATOM 0 H THR A 112 1.786 -1.642 -8.021 1.00 0.00 H new ATOM 0 HA THR A 112 0.392 -4.141 -7.912 1.00 0.00 H new ATOM 0 HB THR A 112 0.220 -1.910 -6.549 1.00 0.00 H new ATOM 0 HG1 THR A 112 -1.020 -3.840 -6.199 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.789 -0.593 -7.189 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.502 -0.470 -8.412 1.00 0.00 H new ATOM 0 HG23 THR A 112 -1.905 -1.526 -8.700 1.00 0.00 H new ATOM 920 N GLN A 113 -0.001 -2.319 -10.621 1.00 0.00 N ATOM 921 CA GLN A 113 -0.626 -2.390 -11.940 1.00 0.00 C ATOM 922 C GLN A 113 -0.340 -3.755 -12.557 1.00 0.00 C ATOM 923 O GLN A 113 -1.263 -4.463 -12.957 1.00 0.00 O ATOM 924 CB GLN A 113 -0.212 -1.214 -12.837 1.00 0.00 C ATOM 925 CG GLN A 113 1.265 -1.066 -13.211 1.00 0.00 C ATOM 926 CD GLN A 113 1.485 0.303 -13.850 1.00 0.00 C ATOM 927 OE1 GLN A 113 1.558 0.443 -15.066 1.00 0.00 O ATOM 928 NE2 GLN A 113 1.497 1.359 -13.049 1.00 0.00 N ATOM 0 H GLN A 113 0.680 -1.568 -10.505 1.00 0.00 H new ATOM 0 HA GLN A 113 -1.706 -2.291 -11.835 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -0.783 -1.286 -13.763 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -0.523 -0.294 -12.342 1.00 0.00 H new ATOM 0 HG2 GLN A 113 1.890 -1.171 -12.324 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.558 -1.855 -13.903 1.00 0.00 H new ATOM 0 HE21 GLN A 113 1.436 1.233 -12.039 1.00 0.00 H new ATOM 0 HE22 GLN A 113 1.567 2.297 -13.443 1.00 0.00 H new ATOM 937 N ALA A 114 0.926 -4.176 -12.502 1.00 0.00 N ATOM 938 CA ALA A 114 1.356 -5.490 -12.939 1.00 0.00 C ATOM 939 C ALA A 114 0.685 -6.589 -12.116 1.00 0.00 C ATOM 940 O ALA A 114 0.340 -7.634 -12.669 1.00 0.00 O ATOM 941 CB ALA A 114 2.870 -5.564 -12.809 1.00 0.00 C ATOM 0 H ALA A 114 1.687 -3.598 -12.146 1.00 0.00 H new ATOM 0 HA ALA A 114 1.065 -5.645 -13.978 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.215 -6.546 -13.133 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.327 -4.795 -13.432 1.00 0.00 H new ATOM 0 HB3 ALA A 114 3.154 -5.404 -11.769 1.00 0.00 H new ATOM 947 N ALA A 115 0.467 -6.349 -10.814 1.00 0.00 N ATOM 948 CA ALA A 115 -0.149 -7.325 -9.920 1.00 0.00 C ATOM 949 C ALA A 115 -1.614 -7.596 -10.296 1.00 0.00 C ATOM 950 O ALA A 115 -2.189 -8.580 -9.830 1.00 0.00 O ATOM 951 CB ALA A 115 -0.035 -6.824 -8.466 1.00 0.00 C ATOM 0 H ALA A 115 0.715 -5.471 -10.357 1.00 0.00 H new ATOM 0 HA ALA A 115 0.381 -8.272 -10.019 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.494 -7.549 -7.794 1.00 0.00 H new ATOM 0 HB2 ALA A 115 1.016 -6.701 -8.205 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -0.547 -5.866 -8.370 1.00 0.00 H new ATOM 957 N ASN A 116 -2.242 -6.721 -11.092 1.00 0.00 N ATOM 958 CA ASN A 116 -3.690 -6.659 -11.262 1.00 0.00 C ATOM 959 C ASN A 116 -4.034 -6.238 -12.693 1.00 0.00 C ATOM 960 O ASN A 116 -4.998 -5.498 -12.925 1.00 0.00 O ATOM 961 CB ASN A 116 -4.235 -5.636 -10.257 1.00 0.00 C ATOM 962 CG ASN A 116 -3.964 -5.998 -8.806 1.00 0.00 C ATOM 963 OD1 ASN A 116 -4.270 -7.091 -8.345 1.00 0.00 O ATOM 964 ND2 ASN A 116 -3.294 -5.117 -8.093 1.00 0.00 N ATOM 0 H ASN A 116 -1.743 -6.024 -11.645 1.00 0.00 H new ATOM 0 HA ASN A 116 -4.138 -7.637 -11.085 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -3.793 -4.662 -10.468 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -5.311 -5.536 -10.402 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -3.019 -5.338 -7.136 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -3.050 -4.213 -8.498 1.00 0.00 H new ATOM 971 N GLN A 117 -3.281 -6.728 -13.680 1.00 0.00 N ATOM 972 CA GLN A 117 -3.485 -6.338 -15.073 1.00 0.00 C ATOM 973 C GLN A 117 -4.823 -6.828 -15.614 1.00 0.00 C ATOM 974 O GLN A 117 -5.402 -6.190 -16.490 1.00 0.00 O ATOM 975 CB GLN A 117 -2.379 -6.886 -15.958 1.00 0.00 C ATOM 976 CG GLN A 117 -1.058 -6.174 -15.712 1.00 0.00 C ATOM 977 CD GLN A 117 -1.035 -4.691 -16.134 1.00 0.00 C ATOM 978 OE1 GLN A 117 -2.039 -4.077 -16.484 1.00 0.00 O ATOM 979 NE2 GLN A 117 0.115 -4.053 -16.075 1.00 0.00 N ATOM 0 H GLN A 117 -2.524 -7.397 -13.538 1.00 0.00 H new ATOM 0 HA GLN A 117 -3.473 -5.248 -15.091 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -2.258 -7.953 -15.771 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -2.662 -6.776 -17.005 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.818 -6.239 -14.651 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -0.271 -6.703 -16.250 1.00 0.00 H new ATOM 0 HE21 GLN A 117 0.959 -4.548 -15.786 1.00 0.00 H new ATOM 0 HE22 GLN A 117 0.162 -3.064 -16.318 1.00 0.00 H new ATOM 988 N GLY A 118 -5.320 -7.916 -15.044 1.00 0.00 N ATOM 989 CA GLY A 118 -6.643 -8.469 -15.287 1.00 0.00 C ATOM 990 C GLY A 118 -7.676 -8.020 -14.256 1.00 0.00 C ATOM 991 O GLY A 118 -8.657 -8.738 -14.054 1.00 0.00 O ATOM 0 H GLY A 118 -4.786 -8.462 -14.368 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -6.978 -8.173 -16.281 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.582 -9.557 -15.282 1.00 0.00 H new ATOM 995 N GLU A 119 -7.460 -6.903 -13.546 1.00 0.00 N ATOM 996 CA GLU A 119 -8.326 -6.475 -12.469 1.00 0.00 C ATOM 997 C GLU A 119 -8.675 -4.980 -12.552 1.00 0.00 C ATOM 998 O GLU A 119 -9.864 -4.695 -12.660 1.00 0.00 O ATOM 999 CB GLU A 119 -7.731 -7.030 -11.177 1.00 0.00 C ATOM 1000 CG GLU A 119 -8.220 -6.336 -9.925 1.00 0.00 C ATOM 1001 CD GLU A 119 -8.141 -7.283 -8.723 1.00 0.00 C ATOM 1002 OE1 GLU A 119 -7.086 -7.920 -8.502 1.00 0.00 O ATOM 1003 OE2 GLU A 119 -9.187 -7.445 -8.048 1.00 0.00 O ATOM 0 H GLU A 119 -6.672 -6.277 -13.714 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.332 -6.889 -12.532 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.968 -8.092 -11.107 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -6.645 -6.948 -11.225 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.618 -5.447 -9.736 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -9.248 -6.001 -10.065 1.00 0.00 H new ATOM 1010 N PHE A 120 -7.732 -4.027 -12.646 1.00 0.00 N ATOM 1011 CA PHE A 120 -8.089 -2.624 -12.982 1.00 0.00 C ATOM 1012 C PHE A 120 -8.769 -2.445 -14.361 1.00 0.00 C ATOM 1013 O PHE A 120 -9.148 -1.327 -14.728 1.00 0.00 O ATOM 1014 CB PHE A 120 -6.870 -1.693 -12.933 1.00 0.00 C ATOM 1015 CG PHE A 120 -6.237 -1.514 -11.580 1.00 0.00 C ATOM 1016 CD1 PHE A 120 -5.217 -2.383 -11.165 1.00 0.00 C ATOM 1017 CD2 PHE A 120 -6.595 -0.412 -10.788 1.00 0.00 C ATOM 1018 CE1 PHE A 120 -4.517 -2.112 -9.976 1.00 0.00 C ATOM 1019 CE2 PHE A 120 -5.899 -0.149 -9.602 1.00 0.00 C ATOM 1020 CZ PHE A 120 -4.857 -0.995 -9.200 1.00 0.00 C ATOM 0 H PHE A 120 -6.736 -4.189 -12.499 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.813 -2.354 -12.213 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.115 -2.078 -13.618 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -7.169 -0.713 -13.306 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -4.971 -3.254 -11.754 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -7.406 0.232 -11.093 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -3.717 -2.765 -9.660 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -6.165 0.705 -8.997 1.00 0.00 H new ATOM 0 HZ PHE A 120 -4.314 -0.786 -8.290 1.00 0.00 H new ATOM 1030 N GLN A 121 -8.898 -3.506 -15.162 1.00 0.00 N ATOM 1031 CA GLN A 121 -9.556 -3.491 -16.464 1.00 0.00 C ATOM 1032 C GLN A 121 -10.855 -4.301 -16.447 1.00 0.00 C ATOM 1033 O GLN A 121 -11.528 -4.360 -17.481 1.00 0.00 O ATOM 1034 CB GLN A 121 -8.560 -3.955 -17.546 1.00 0.00 C ATOM 1035 CG GLN A 121 -7.572 -2.823 -17.860 1.00 0.00 C ATOM 1036 CD GLN A 121 -6.421 -3.216 -18.779 1.00 0.00 C ATOM 1037 OE1 GLN A 121 -6.404 -4.272 -19.410 1.00 0.00 O ATOM 1038 NE2 GLN A 121 -5.404 -2.376 -18.839 1.00 0.00 N ATOM 0 H GLN A 121 -8.535 -4.426 -14.911 1.00 0.00 H new ATOM 0 HA GLN A 121 -9.857 -2.472 -16.709 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -8.020 -4.837 -17.202 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -9.098 -4.242 -18.450 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -8.119 -1.999 -18.318 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -7.159 -2.450 -16.923 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -5.431 -1.504 -18.311 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -4.591 -2.599 -19.414 1.00 0.00 H new ATOM 1047 N LYS A 122 -11.263 -4.869 -15.301 1.00 0.00 N ATOM 1048 CA LYS A 122 -12.502 -5.632 -15.218 1.00 0.00 C ATOM 1049 C LYS A 122 -13.672 -4.710 -15.558 1.00 0.00 C ATOM 1050 O LYS A 122 -13.650 -3.527 -15.198 1.00 0.00 O ATOM 1051 CB LYS A 122 -12.716 -6.206 -13.811 1.00 0.00 C ATOM 1052 CG LYS A 122 -12.113 -7.592 -13.588 1.00 0.00 C ATOM 1053 CD LYS A 122 -12.364 -8.030 -12.138 1.00 0.00 C ATOM 1054 CE LYS A 122 -12.486 -9.553 -12.009 1.00 0.00 C ATOM 1055 NZ LYS A 122 -13.415 -9.938 -10.923 1.00 0.00 N ATOM 0 H LYS A 122 -10.747 -4.810 -14.423 1.00 0.00 H new ATOM 0 HA LYS A 122 -12.441 -6.463 -15.921 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.287 -5.517 -13.083 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.787 -6.254 -13.612 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -12.557 -8.309 -14.278 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -11.043 -7.572 -13.794 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.548 -7.677 -11.507 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -13.277 -7.561 -11.771 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -12.836 -9.971 -12.953 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -11.503 -9.982 -11.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -13.657 -10.945 -11.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -12.960 -9.773 -10.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -14.281 -9.367 -10.988 1.00 0.00 H new ATOM 1069 N PRO A 123 -14.724 -5.238 -16.189 1.00 0.00 N ATOM 1070 CA PRO A 123 -15.945 -4.502 -16.466 1.00 0.00 C ATOM 1071 C PRO A 123 -16.956 -4.609 -15.314 1.00 0.00 C ATOM 1072 O PRO A 123 -18.098 -4.181 -15.486 1.00 0.00 O ATOM 1073 CB PRO A 123 -16.490 -5.188 -17.719 1.00 0.00 C ATOM 1074 CG PRO A 123 -16.181 -6.646 -17.409 1.00 0.00 C ATOM 1075 CD PRO A 123 -14.811 -6.579 -16.742 1.00 0.00 C ATOM 0 HA PRO A 123 -15.764 -3.435 -16.592 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -17.557 -5.012 -17.854 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -15.993 -4.845 -18.626 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -16.929 -7.084 -16.749 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -16.159 -7.254 -18.314 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -14.715 -7.334 -15.962 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -14.013 -6.761 -17.462 1.00 0.00 H new ATOM 1083 N ASP A 124 -16.583 -5.239 -14.192 1.00 0.00 N ATOM 1084 CA ASP A 124 -17.478 -5.622 -13.096 1.00 0.00 C ATOM 1085 C ASP A 124 -18.238 -4.405 -12.576 1.00 0.00 C ATOM 1086 O ASP A 124 -19.422 -4.517 -12.248 1.00 0.00 O ATOM 1087 CB ASP A 124 -16.718 -6.311 -11.937 1.00 0.00 C ATOM 1088 CG ASP A 124 -16.218 -7.734 -12.216 1.00 0.00 C ATOM 1089 OD1 ASP A 124 -16.306 -8.221 -13.368 1.00 0.00 O ATOM 1090 OD2 ASP A 124 -15.724 -8.404 -11.278 1.00 0.00 O ATOM 0 H ASP A 124 -15.614 -5.505 -14.018 1.00 0.00 H new ATOM 0 HA ASP A 124 -18.188 -6.344 -13.498 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -15.862 -5.691 -11.671 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -17.373 -6.341 -11.066 1.00 0.00 H new ATOM 1095 N ASN A 125 -17.594 -3.231 -12.545 1.00 0.00 N ATOM 1096 CA ASN A 125 -18.217 -1.952 -12.310 1.00 0.00 C ATOM 1097 C ASN A 125 -17.288 -0.885 -12.903 1.00 0.00 C ATOM 1098 O ASN A 125 -16.105 -1.125 -13.139 1.00 0.00 O ATOM 1099 CB ASN A 125 -18.412 -1.640 -10.813 1.00 0.00 C ATOM 1100 CG ASN A 125 -18.592 -2.780 -9.819 1.00 0.00 C ATOM 1101 OD1 ASN A 125 -17.724 -3.631 -9.649 1.00 0.00 O ATOM 1102 ND2 ASN A 125 -19.648 -2.744 -9.025 1.00 0.00 N ATOM 0 H ASN A 125 -16.587 -3.159 -12.690 1.00 0.00 H new ATOM 0 HA ASN A 125 -19.206 -1.964 -12.768 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -17.550 -1.058 -10.487 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -19.285 -0.993 -10.727 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -19.742 -3.424 -8.270 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -20.369 -2.036 -9.167 1.00 0.00 H new ATOM 1109 N LYS A 126 -17.797 0.335 -13.056 1.00 0.00 N ATOM 1110 CA LYS A 126 -17.020 1.532 -13.414 1.00 0.00 C ATOM 1111 C LYS A 126 -16.322 2.132 -12.209 1.00 0.00 C ATOM 1112 O LYS A 126 -15.097 2.172 -12.193 1.00 0.00 O ATOM 1113 CB LYS A 126 -17.909 2.586 -14.089 1.00 0.00 C ATOM 1114 CG LYS A 126 -17.383 4.044 -14.138 1.00 0.00 C ATOM 1115 CD LYS A 126 -15.910 4.252 -14.555 1.00 0.00 C ATOM 1116 CE LYS A 126 -15.766 4.780 -15.984 1.00 0.00 C ATOM 1117 NZ LYS A 126 -14.921 3.913 -16.836 1.00 0.00 N ATOM 0 H LYS A 126 -18.790 0.530 -12.932 1.00 0.00 H new ATOM 0 HA LYS A 126 -16.255 1.214 -14.122 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -18.096 2.262 -15.113 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -18.871 2.593 -13.576 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -18.012 4.606 -14.828 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -17.520 4.485 -13.151 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -15.437 4.951 -13.865 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -15.375 3.306 -14.467 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -16.755 4.870 -16.434 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -15.337 5.781 -15.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -14.859 4.319 -17.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -13.968 3.846 -16.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -15.342 2.964 -16.890 1.00 0.00 H new ATOM 1131 N LEU A 127 -17.076 2.689 -11.250 1.00 0.00 N ATOM 1132 CA LEU A 127 -16.522 3.547 -10.190 1.00 0.00 C ATOM 1133 C LEU A 127 -15.480 2.774 -9.376 1.00 0.00 C ATOM 1134 O LEU A 127 -14.609 3.415 -8.801 1.00 0.00 O ATOM 1135 CB LEU A 127 -17.616 4.097 -9.248 1.00 0.00 C ATOM 1136 CG LEU A 127 -17.854 5.607 -9.131 1.00 0.00 C ATOM 1137 CD1 LEU A 127 -16.581 6.423 -8.940 1.00 0.00 C ATOM 1138 CD2 LEU A 127 -18.672 6.175 -10.287 1.00 0.00 C ATOM 0 H LEU A 127 -18.086 2.558 -11.187 1.00 0.00 H new ATOM 0 HA LEU A 127 -16.051 4.399 -10.680 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.560 3.645 -9.553 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -17.394 3.728 -8.247 1.00 0.00 H new ATOM 0 HG LEU A 127 -18.440 5.707 -8.217 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -16.834 7.481 -8.866 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -16.079 6.105 -8.026 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.918 6.267 -9.791 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -18.806 7.247 -10.146 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -18.149 5.995 -11.226 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -19.647 5.689 -10.316 1.00 0.00 H new ATOM 1150 N HIS A 128 -15.532 1.433 -9.401 1.00 0.00 N ATOM 1151 CA HIS A 128 -14.452 0.504 -9.090 1.00 0.00 C ATOM 1152 C HIS A 128 -13.098 1.126 -9.410 1.00 0.00 C ATOM 1153 O HIS A 128 -12.282 1.227 -8.515 1.00 0.00 O ATOM 1154 CB HIS A 128 -14.672 -0.834 -9.832 1.00 0.00 C ATOM 1155 CG HIS A 128 -13.493 -1.383 -10.590 1.00 0.00 C ATOM 1156 ND1 HIS A 128 -12.503 -2.213 -10.120 1.00 0.00 N ATOM 1157 CD2 HIS A 128 -13.216 -1.093 -11.894 1.00 0.00 C ATOM 1158 CE1 HIS A 128 -11.644 -2.427 -11.132 1.00 0.00 C ATOM 1159 NE2 HIS A 128 -12.040 -1.766 -12.235 1.00 0.00 N ATOM 0 H HIS A 128 -16.390 0.944 -9.657 1.00 0.00 H new ATOM 0 HA HIS A 128 -14.458 0.291 -8.021 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -14.987 -1.581 -9.103 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -15.497 -0.704 -10.532 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -13.800 -0.459 -12.544 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -10.760 -3.043 -11.068 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -11.573 -1.758 -13.142 1.00 0.00 H new ATOM 1167 N GLN A 129 -12.872 1.579 -10.641 1.00 0.00 N ATOM 1168 CA GLN A 129 -11.610 2.093 -11.139 1.00 0.00 C ATOM 1169 C GLN A 129 -11.185 3.315 -10.328 1.00 0.00 C ATOM 1170 O GLN A 129 -10.088 3.382 -9.774 1.00 0.00 O ATOM 1171 CB GLN A 129 -11.809 2.416 -12.628 1.00 0.00 C ATOM 1172 CG GLN A 129 -10.628 3.105 -13.296 1.00 0.00 C ATOM 1173 CD GLN A 129 -9.356 2.268 -13.366 1.00 0.00 C ATOM 1174 OE1 GLN A 129 -8.893 1.704 -12.390 1.00 0.00 O ATOM 1175 NE2 GLN A 129 -8.736 2.212 -14.525 1.00 0.00 N ATOM 0 H GLN A 129 -13.605 1.596 -11.350 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.808 1.363 -11.034 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -12.020 1.489 -13.161 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -12.689 3.051 -12.733 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -10.916 3.388 -14.308 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -10.410 4.027 -12.757 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -9.130 2.687 -15.337 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -7.862 1.694 -14.611 1.00 0.00 H new ATOM 1184 N GLN A 130 -12.076 4.304 -10.288 1.00 0.00 N ATOM 1185 CA GLN A 130 -11.831 5.585 -9.651 1.00 0.00 C ATOM 1186 C GLN A 130 -11.561 5.399 -8.153 1.00 0.00 C ATOM 1187 O GLN A 130 -10.571 5.925 -7.644 1.00 0.00 O ATOM 1188 CB GLN A 130 -13.003 6.521 -9.952 1.00 0.00 C ATOM 1189 CG GLN A 130 -12.930 6.989 -11.416 1.00 0.00 C ATOM 1190 CD GLN A 130 -12.914 8.509 -11.556 1.00 0.00 C ATOM 1191 OE1 GLN A 130 -11.845 9.108 -11.635 1.00 0.00 O ATOM 1192 NE2 GLN A 130 -14.057 9.169 -11.629 1.00 0.00 N ATOM 0 H GLN A 130 -13.003 4.231 -10.707 1.00 0.00 H new ATOM 0 HA GLN A 130 -10.932 6.050 -10.055 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -13.947 6.007 -9.771 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -12.975 7.381 -9.283 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -12.033 6.578 -11.879 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -13.783 6.588 -11.963 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -14.942 8.666 -11.563 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -14.054 10.182 -11.752 1.00 0.00 H new ATOM 1201 N VAL A 131 -12.399 4.618 -7.466 1.00 0.00 N ATOM 1202 CA VAL A 131 -12.188 4.228 -6.079 1.00 0.00 C ATOM 1203 C VAL A 131 -10.855 3.501 -5.970 1.00 0.00 C ATOM 1204 O VAL A 131 -10.006 3.944 -5.219 1.00 0.00 O ATOM 1205 CB VAL A 131 -13.361 3.372 -5.561 1.00 0.00 C ATOM 1206 CG1 VAL A 131 -13.141 2.850 -4.133 1.00 0.00 C ATOM 1207 CG2 VAL A 131 -14.650 4.190 -5.536 1.00 0.00 C ATOM 0 H VAL A 131 -13.255 4.236 -7.869 1.00 0.00 H new ATOM 0 HA VAL A 131 -12.153 5.115 -5.447 1.00 0.00 H new ATOM 0 HB VAL A 131 -13.428 2.527 -6.247 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -14.001 2.255 -3.827 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -12.244 2.231 -4.106 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -13.021 3.693 -3.452 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -15.467 3.570 -5.168 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -14.522 5.050 -4.879 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -14.882 4.535 -6.544 1.00 0.00 H new ATOM 1217 N LEU A 132 -10.657 2.408 -6.703 1.00 0.00 N ATOM 1218 CA LEU A 132 -9.559 1.471 -6.536 1.00 0.00 C ATOM 1219 C LEU A 132 -8.222 2.172 -6.671 1.00 0.00 C ATOM 1220 O LEU A 132 -7.385 1.979 -5.793 1.00 0.00 O ATOM 1221 CB LEU A 132 -9.687 0.290 -7.515 1.00 0.00 C ATOM 1222 CG LEU A 132 -8.571 -0.748 -7.448 1.00 0.00 C ATOM 1223 CD1 LEU A 132 -8.416 -1.289 -6.032 1.00 0.00 C ATOM 1224 CD2 LEU A 132 -8.908 -1.853 -8.464 1.00 0.00 C ATOM 0 H LEU A 132 -11.287 2.144 -7.461 1.00 0.00 H new ATOM 0 HA LEU A 132 -9.611 1.062 -5.527 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -10.637 -0.212 -7.328 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -9.730 0.686 -8.530 1.00 0.00 H new ATOM 0 HG LEU A 132 -7.609 -0.303 -7.703 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.614 -2.027 -6.010 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -8.174 -0.470 -5.354 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -9.349 -1.757 -5.717 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -8.129 -2.615 -8.444 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -9.865 -2.305 -8.205 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -8.968 -1.422 -9.463 1.00 0.00 H new ATOM 1236 N TRP A 133 -8.015 2.993 -7.707 1.00 0.00 N ATOM 1237 CA TRP A 133 -6.767 3.738 -7.827 1.00 0.00 C ATOM 1238 C TRP A 133 -6.546 4.653 -6.622 1.00 0.00 C ATOM 1239 O TRP A 133 -5.431 4.714 -6.111 1.00 0.00 O ATOM 1240 CB TRP A 133 -6.677 4.521 -9.144 1.00 0.00 C ATOM 1241 CG TRP A 133 -6.132 3.760 -10.316 1.00 0.00 C ATOM 1242 CD1 TRP A 133 -6.701 3.698 -11.539 1.00 0.00 C ATOM 1243 CD2 TRP A 133 -4.932 2.924 -10.401 1.00 0.00 C ATOM 1244 NE1 TRP A 133 -5.957 2.875 -12.361 1.00 0.00 N ATOM 1245 CE2 TRP A 133 -4.880 2.339 -11.702 1.00 0.00 C ATOM 1246 CE3 TRP A 133 -3.917 2.538 -9.496 1.00 0.00 C ATOM 1247 CZ2 TRP A 133 -3.919 1.385 -12.069 1.00 0.00 C ATOM 1248 CZ3 TRP A 133 -2.960 1.568 -9.846 1.00 0.00 C ATOM 1249 CH2 TRP A 133 -2.975 0.976 -11.117 1.00 0.00 C ATOM 0 H TRP A 133 -8.685 3.154 -8.459 1.00 0.00 H new ATOM 0 HA TRP A 133 -5.963 3.002 -7.842 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -7.673 4.882 -9.400 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -6.052 5.399 -8.982 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -7.603 4.215 -11.831 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -6.181 2.688 -13.338 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -3.875 2.996 -8.519 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -3.907 0.973 -13.067 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -2.207 1.277 -9.129 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -2.259 0.205 -11.362 1.00 0.00 H new ATOM 1260 N ARG A 134 -7.578 5.345 -6.129 1.00 0.00 N ATOM 1261 CA ARG A 134 -7.429 6.165 -4.929 1.00 0.00 C ATOM 1262 C ARG A 134 -7.152 5.303 -3.697 1.00 0.00 C ATOM 1263 O ARG A 134 -6.325 5.655 -2.864 1.00 0.00 O ATOM 1264 CB ARG A 134 -8.676 7.041 -4.728 1.00 0.00 C ATOM 1265 CG ARG A 134 -8.603 7.900 -3.458 1.00 0.00 C ATOM 1266 CD ARG A 134 -7.312 8.716 -3.435 1.00 0.00 C ATOM 1267 NE ARG A 134 -7.283 9.659 -2.329 1.00 0.00 N ATOM 1268 CZ ARG A 134 -6.442 10.687 -2.239 1.00 0.00 C ATOM 1269 NH1 ARG A 134 -5.436 10.813 -3.102 1.00 0.00 N ATOM 1270 NH2 ARG A 134 -6.601 11.589 -1.288 1.00 0.00 N ATOM 0 H ARG A 134 -8.512 5.353 -6.538 1.00 0.00 H new ATOM 0 HA ARG A 134 -6.567 6.819 -5.065 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.801 7.691 -5.594 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -9.558 6.403 -4.679 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -9.463 8.568 -3.414 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -8.651 7.261 -2.577 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -6.459 8.042 -3.359 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -7.208 9.257 -4.376 1.00 0.00 H new ATOM 0 HE ARG A 134 -7.952 9.524 -1.571 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -5.306 10.119 -3.838 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -4.796 11.603 -3.027 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -7.368 11.498 -0.622 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -5.956 12.377 -1.219 1.00 0.00 H new ATOM 1284 N LEU A 135 -7.849 4.184 -3.578 1.00 0.00 N ATOM 1285 CA LEU A 135 -7.784 3.275 -2.456 1.00 0.00 C ATOM 1286 C LEU A 135 -6.340 2.793 -2.335 1.00 0.00 C ATOM 1287 O LEU A 135 -5.731 2.948 -1.282 1.00 0.00 O ATOM 1288 CB LEU A 135 -8.844 2.175 -2.677 1.00 0.00 C ATOM 1289 CG LEU A 135 -9.283 1.450 -1.403 1.00 0.00 C ATOM 1290 CD1 LEU A 135 -10.709 0.903 -1.542 1.00 0.00 C ATOM 1291 CD2 LEU A 135 -8.379 0.274 -1.093 1.00 0.00 C ATOM 0 H LEU A 135 -8.504 3.875 -4.296 1.00 0.00 H new ATOM 0 HA LEU A 135 -8.028 3.731 -1.497 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -9.721 2.622 -3.146 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -8.447 1.441 -3.379 1.00 0.00 H new ATOM 0 HG LEU A 135 -9.231 2.186 -0.600 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.994 0.393 -0.622 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.398 1.727 -1.729 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.750 0.200 -2.374 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.721 -0.217 -0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -8.408 -0.435 -1.920 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -7.357 0.627 -0.954 1.00 0.00 H new ATOM 1303 N VAL A 136 -5.751 2.290 -3.421 1.00 0.00 N ATOM 1304 CA VAL A 136 -4.375 1.812 -3.407 1.00 0.00 C ATOM 1305 C VAL A 136 -3.352 2.922 -3.130 1.00 0.00 C ATOM 1306 O VAL A 136 -2.336 2.647 -2.490 1.00 0.00 O ATOM 1307 CB VAL A 136 -4.122 0.935 -4.643 1.00 0.00 C ATOM 1308 CG1 VAL A 136 -4.180 1.589 -6.013 1.00 0.00 C ATOM 1309 CG2 VAL A 136 -2.789 0.213 -4.568 1.00 0.00 C ATOM 0 H VAL A 136 -6.213 2.204 -4.326 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.221 1.160 -2.547 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.981 0.267 -4.582 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -3.981 0.842 -6.781 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -5.170 2.016 -6.171 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -3.431 2.378 -6.071 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -2.653 -0.395 -5.463 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -1.983 0.943 -4.500 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -2.772 -0.429 -3.687 1.00 0.00 H new ATOM 1319 N GLN A 137 -3.643 4.172 -3.510 1.00 0.00 N ATOM 1320 CA GLN A 137 -2.821 5.314 -3.099 1.00 0.00 C ATOM 1321 C GLN A 137 -2.755 5.401 -1.564 1.00 0.00 C ATOM 1322 O GLN A 137 -1.652 5.386 -1.012 1.00 0.00 O ATOM 1323 CB GLN A 137 -3.297 6.648 -3.710 1.00 0.00 C ATOM 1324 CG GLN A 137 -3.129 6.760 -5.236 1.00 0.00 C ATOM 1325 CD GLN A 137 -4.135 7.725 -5.880 1.00 0.00 C ATOM 1326 OE1 GLN A 137 -4.609 8.694 -5.281 1.00 0.00 O ATOM 1327 NE2 GLN A 137 -4.498 7.495 -7.132 1.00 0.00 N ATOM 0 H GLN A 137 -4.439 4.417 -4.099 1.00 0.00 H new ATOM 0 HA GLN A 137 -1.818 5.141 -3.489 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -4.350 6.788 -3.464 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -2.748 7.463 -3.238 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -2.117 7.095 -5.461 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -3.244 5.772 -5.682 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -4.112 6.697 -7.636 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -5.163 8.116 -7.592 1.00 0.00 H new ATOM 1336 N GLU A 138 -3.899 5.482 -0.868 1.00 0.00 N ATOM 1337 CA GLU A 138 -3.898 5.606 0.594 1.00 0.00 C ATOM 1338 C GLU A 138 -3.304 4.359 1.246 1.00 0.00 C ATOM 1339 O GLU A 138 -2.553 4.489 2.207 1.00 0.00 O ATOM 1340 CB GLU A 138 -5.298 5.884 1.172 1.00 0.00 C ATOM 1341 CG GLU A 138 -5.296 6.203 2.682 1.00 0.00 C ATOM 1342 CD GLU A 138 -4.378 7.354 3.141 1.00 0.00 C ATOM 1343 OE1 GLU A 138 -4.119 8.316 2.379 1.00 0.00 O ATOM 1344 OE2 GLU A 138 -3.983 7.371 4.332 1.00 0.00 O ATOM 0 H GLU A 138 -4.827 5.464 -1.291 1.00 0.00 H new ATOM 0 HA GLU A 138 -3.274 6.469 0.827 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -5.743 6.721 0.634 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -5.933 5.016 0.994 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -6.317 6.440 2.982 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -5.007 5.301 3.221 1.00 0.00 H new ATOM 1351 N LEU A 139 -3.603 3.163 0.728 1.00 0.00 N ATOM 1352 CA LEU A 139 -3.106 1.902 1.278 1.00 0.00 C ATOM 1353 C LEU A 139 -1.589 1.886 1.365 1.00 0.00 C ATOM 1354 O LEU A 139 -1.062 1.477 2.398 1.00 0.00 O ATOM 1355 CB LEU A 139 -3.552 0.715 0.419 1.00 0.00 C ATOM 1356 CG LEU A 139 -4.831 0.001 0.870 1.00 0.00 C ATOM 1357 CD1 LEU A 139 -5.974 0.894 1.344 1.00 0.00 C ATOM 1358 CD2 LEU A 139 -5.290 -0.944 -0.247 1.00 0.00 C ATOM 0 H LEU A 139 -4.201 3.044 -0.090 1.00 0.00 H new ATOM 0 HA LEU A 139 -3.525 1.815 2.281 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -3.697 1.066 -0.603 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -2.742 -0.014 0.394 1.00 0.00 H new ATOM 0 HG LEU A 139 -4.560 -0.549 1.771 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.822 0.275 1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -5.644 1.484 2.199 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -6.273 1.561 0.536 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -6.200 -1.458 0.062 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -5.488 -0.369 -1.152 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -4.509 -1.678 -0.447 1.00 0.00 H new ATOM 1370 N CYS A 140 -0.901 2.259 0.283 1.00 0.00 N ATOM 1371 CA CYS A 140 0.550 2.329 0.295 1.00 0.00 C ATOM 1372 C CYS A 140 1.003 3.486 1.176 1.00 0.00 C ATOM 1373 O CYS A 140 1.903 3.312 1.995 1.00 0.00 O ATOM 1374 CB CYS A 140 1.090 2.499 -1.123 1.00 0.00 C ATOM 1375 SG CYS A 140 0.712 1.113 -2.215 1.00 0.00 S ATOM 0 H CYS A 140 -1.330 2.515 -0.606 1.00 0.00 H new ATOM 0 HA CYS A 140 0.944 1.397 0.701 1.00 0.00 H new ATOM 0 HB2 CYS A 140 0.677 3.412 -1.553 1.00 0.00 H new ATOM 0 HB3 CYS A 140 2.171 2.629 -1.077 1.00 0.00 H new ATOM 1380 N SER A 141 0.403 4.668 0.990 1.00 0.00 N ATOM 1381 CA SER A 141 0.758 5.885 1.703 1.00 0.00 C ATOM 1382 C SER A 141 0.793 5.642 3.204 1.00 0.00 C ATOM 1383 O SER A 141 1.805 5.957 3.824 1.00 0.00 O ATOM 1384 CB SER A 141 -0.249 6.986 1.353 1.00 0.00 C ATOM 1385 OG SER A 141 0.057 8.223 1.964 1.00 0.00 O ATOM 0 H SER A 141 -0.358 4.800 0.324 1.00 0.00 H new ATOM 0 HA SER A 141 1.756 6.201 1.398 1.00 0.00 H new ATOM 0 HB2 SER A 141 -0.276 7.117 0.271 1.00 0.00 H new ATOM 0 HB3 SER A 141 -1.246 6.671 1.660 1.00 0.00 H new ATOM 0 HG SER A 141 0.694 8.078 2.694 1.00 0.00 H new ATOM 1391 N LEU A 142 -0.326 5.153 3.740 1.00 0.00 N ATOM 1392 CA LEU A 142 -0.732 5.070 5.127 1.00 0.00 C ATOM 1393 C LEU A 142 0.064 6.026 6.005 1.00 0.00 C ATOM 1394 O LEU A 142 1.032 5.647 6.664 1.00 0.00 O ATOM 1395 CB LEU A 142 -0.742 3.596 5.566 1.00 0.00 C ATOM 1396 CG LEU A 142 -2.054 3.200 6.260 1.00 0.00 C ATOM 1397 CD1 LEU A 142 -2.247 3.976 7.572 1.00 0.00 C ATOM 1398 CD2 LEU A 142 -3.281 3.331 5.334 1.00 0.00 C ATOM 0 H LEU A 142 -1.047 4.762 3.134 1.00 0.00 H new ATOM 0 HA LEU A 142 -1.756 5.421 5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -0.589 2.959 4.695 1.00 0.00 H new ATOM 0 HB3 LEU A 142 0.093 3.416 6.243 1.00 0.00 H new ATOM 0 HG LEU A 142 -1.971 2.142 6.507 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -3.184 3.673 8.039 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -1.419 3.761 8.247 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -2.275 5.045 7.362 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -4.180 3.038 5.877 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -3.378 4.365 5.003 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -3.154 2.683 4.467 1.00 0.00 H new ATOM 1410 N LYS A 143 -0.341 7.298 5.947 1.00 0.00 N ATOM 1411 CA LYS A 143 0.417 8.450 6.414 1.00 0.00 C ATOM 1412 C LYS A 143 1.633 8.603 5.498 1.00 0.00 C ATOM 1413 O LYS A 143 1.454 8.953 4.327 1.00 0.00 O ATOM 1414 CB LYS A 143 0.708 8.368 7.935 1.00 0.00 C ATOM 1415 CG LYS A 143 -0.568 8.100 8.748 1.00 0.00 C ATOM 1416 CD LYS A 143 -0.294 7.680 10.187 1.00 0.00 C ATOM 1417 CE LYS A 143 -1.671 7.481 10.831 1.00 0.00 C ATOM 1418 NZ LYS A 143 -1.596 7.057 12.241 1.00 0.00 N ATOM 0 H LYS A 143 -1.246 7.558 5.555 1.00 0.00 H new ATOM 0 HA LYS A 143 -0.156 9.374 6.338 1.00 0.00 H new ATOM 0 HB2 LYS A 143 1.432 7.576 8.124 1.00 0.00 H new ATOM 0 HB3 LYS A 143 1.162 9.301 8.269 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -1.183 9.000 8.751 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -1.147 7.320 8.254 1.00 0.00 H new ATOM 0 HD2 LYS A 143 0.291 6.761 10.222 1.00 0.00 H new ATOM 0 HD3 LYS A 143 0.279 8.442 10.715 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -2.233 8.413 10.768 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -2.226 6.735 10.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -2.557 6.939 12.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -1.086 6.153 12.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -1.092 7.779 12.794 1.00 0.00 H new ATOM 1432 N HIS A 144 2.834 8.345 6.001 1.00 0.00 N ATOM 1433 CA HIS A 144 4.113 8.449 5.309 1.00 0.00 C ATOM 1434 C HIS A 144 4.950 7.235 5.723 1.00 0.00 C ATOM 1435 O HIS A 144 4.552 6.513 6.643 1.00 0.00 O ATOM 1436 CB HIS A 144 4.818 9.756 5.723 1.00 0.00 C ATOM 1437 CG HIS A 144 5.238 9.748 7.172 1.00 0.00 C ATOM 1438 ND1 HIS A 144 4.404 9.836 8.263 1.00 0.00 N ATOM 1439 CD2 HIS A 144 6.488 9.430 7.630 1.00 0.00 C ATOM 1440 CE1 HIS A 144 5.132 9.533 9.345 1.00 0.00 C ATOM 1441 NE2 HIS A 144 6.415 9.300 9.018 1.00 0.00 N ATOM 0 H HIS A 144 2.948 8.037 6.967 1.00 0.00 H new ATOM 0 HA HIS A 144 3.978 8.466 4.228 1.00 0.00 H new ATOM 0 HB2 HIS A 144 5.695 9.908 5.094 1.00 0.00 H new ATOM 0 HB3 HIS A 144 4.149 10.598 5.546 1.00 0.00 H new ATOM 0 HD2 HIS A 144 7.374 9.302 7.025 1.00 0.00 H new ATOM 0 HE1 HIS A 144 4.740 9.482 10.350 1.00 0.00 H new ATOM 0 HE2 HIS A 144 7.179 9.074 9.654 1.00 0.00 H new ATOM 1449 N CYS A 145 6.124 7.028 5.110 1.00 0.00 N ATOM 1450 CA CYS A 145 6.991 5.933 5.528 1.00 0.00 C ATOM 1451 C CYS A 145 7.721 6.343 6.814 1.00 0.00 C ATOM 1452 O CYS A 145 7.206 6.110 7.909 1.00 0.00 O ATOM 1453 CB CYS A 145 7.815 5.332 4.360 1.00 0.00 C ATOM 1454 SG CYS A 145 9.570 5.737 4.086 1.00 0.00 S ATOM 0 H CYS A 145 6.484 7.593 4.341 1.00 0.00 H new ATOM 0 HA CYS A 145 6.415 5.052 5.810 1.00 0.00 H new ATOM 0 HB2 CYS A 145 7.758 4.248 4.464 1.00 0.00 H new ATOM 0 HB3 CYS A 145 7.289 5.592 3.442 1.00 0.00 H new ATOM 1459 N GLU A 146 8.891 6.982 6.718 1.00 0.00 N ATOM 1460 CA GLU A 146 9.807 7.106 7.846 1.00 0.00 C ATOM 1461 C GLU A 146 10.737 8.311 7.707 1.00 0.00 C ATOM 1462 O GLU A 146 10.640 9.220 8.525 1.00 0.00 O ATOM 1463 CB GLU A 146 10.598 5.795 8.013 1.00 0.00 C ATOM 1464 CG GLU A 146 9.955 4.866 9.062 1.00 0.00 C ATOM 1465 CD GLU A 146 10.639 3.506 9.198 1.00 0.00 C ATOM 1466 OE1 GLU A 146 10.812 2.796 8.183 1.00 0.00 O ATOM 1467 OE2 GLU A 146 10.968 3.123 10.341 1.00 0.00 O ATOM 0 H GLU A 146 9.224 7.423 5.861 1.00 0.00 H new ATOM 0 HA GLU A 146 9.219 7.282 8.747 1.00 0.00 H new ATOM 0 HB2 GLU A 146 10.651 5.279 7.055 1.00 0.00 H new ATOM 0 HB3 GLU A 146 11.622 6.024 8.309 1.00 0.00 H new ATOM 0 HG2 GLU A 146 9.969 5.366 10.031 1.00 0.00 H new ATOM 0 HG3 GLU A 146 8.909 4.709 8.799 1.00 0.00 H new ATOM 1474 N PHE A 147 11.648 8.344 6.723 1.00 0.00 N ATOM 1475 CA PHE A 147 12.691 9.386 6.636 1.00 0.00 C ATOM 1476 C PHE A 147 12.084 10.800 6.624 1.00 0.00 C ATOM 1477 O PHE A 147 12.568 11.742 7.257 1.00 0.00 O ATOM 1478 CB PHE A 147 13.544 9.182 5.366 1.00 0.00 C ATOM 1479 CG PHE A 147 13.821 7.743 4.979 1.00 0.00 C ATOM 1480 CD1 PHE A 147 14.682 6.961 5.767 1.00 0.00 C ATOM 1481 CD2 PHE A 147 13.181 7.172 3.858 1.00 0.00 C ATOM 1482 CE1 PHE A 147 14.884 5.610 5.448 1.00 0.00 C ATOM 1483 CE2 PHE A 147 13.390 5.818 3.539 1.00 0.00 C ATOM 1484 CZ PHE A 147 14.240 5.037 4.338 1.00 0.00 C ATOM 0 H PHE A 147 11.686 7.657 5.970 1.00 0.00 H new ATOM 0 HA PHE A 147 13.320 9.293 7.521 1.00 0.00 H new ATOM 0 HB2 PHE A 147 13.042 9.672 4.532 1.00 0.00 H new ATOM 0 HB3 PHE A 147 14.498 9.690 5.507 1.00 0.00 H new ATOM 0 HD1 PHE A 147 15.187 7.399 6.616 1.00 0.00 H new ATOM 0 HD2 PHE A 147 12.529 7.776 3.244 1.00 0.00 H new ATOM 0 HE1 PHE A 147 15.539 5.006 6.059 1.00 0.00 H new ATOM 0 HE2 PHE A 147 12.898 5.381 2.683 1.00 0.00 H new ATOM 0 HZ PHE A 147 14.399 3.996 4.100 1.00 0.00 H new ATOM 1494 N TRP A 148 10.989 10.917 5.883 1.00 0.00 N ATOM 1495 CA TRP A 148 10.229 12.104 5.553 1.00 0.00 C ATOM 1496 C TRP A 148 9.039 12.263 6.508 1.00 0.00 C ATOM 1497 O TRP A 148 7.947 12.650 6.101 1.00 0.00 O ATOM 1498 CB TRP A 148 9.819 11.960 4.076 1.00 0.00 C ATOM 1499 CG TRP A 148 9.252 10.636 3.625 1.00 0.00 C ATOM 1500 CD1 TRP A 148 9.928 9.464 3.543 1.00 0.00 C ATOM 1501 CD2 TRP A 148 7.913 10.343 3.120 1.00 0.00 C ATOM 1502 NE1 TRP A 148 9.126 8.508 2.972 1.00 0.00 N ATOM 1503 CE2 TRP A 148 7.874 8.984 2.695 1.00 0.00 C ATOM 1504 CE3 TRP A 148 6.717 11.073 2.992 1.00 0.00 C ATOM 1505 CZ2 TRP A 148 6.733 8.380 2.156 1.00 0.00 C ATOM 1506 CZ3 TRP A 148 5.555 10.481 2.465 1.00 0.00 C ATOM 1507 CH2 TRP A 148 5.563 9.139 2.044 1.00 0.00 C ATOM 0 H TRP A 148 10.572 10.090 5.455 1.00 0.00 H new ATOM 0 HA TRP A 148 10.812 13.017 5.676 1.00 0.00 H new ATOM 0 HB2 TRP A 148 9.081 12.732 3.857 1.00 0.00 H new ATOM 0 HB3 TRP A 148 10.695 12.174 3.464 1.00 0.00 H new ATOM 0 HD1 TRP A 148 10.943 9.307 3.876 1.00 0.00 H new ATOM 0 HE1 TRP A 148 9.428 7.554 2.777 1.00 0.00 H new ATOM 0 HE3 TRP A 148 6.691 12.107 3.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 6.755 7.350 1.833 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 4.648 11.062 2.383 1.00 0.00 H new ATOM 0 HH2 TRP A 148 4.667 8.695 1.635 1.00 0.00 H new