USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 732 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 7 ASN : amide:sc= 1.75 K(o=3.9,f=-5.2!) USER MOD Set 1.2: A 9 HIS : no HE2:sc= 0.769 K(o=3.9,f=-2!) USER MOD Set 1.3: A 79 GLN : amide:sc= 1.39 K(o=3.9,f=-5.2) USER MOD Set 2.1: A 63 GLN : amide:sc= 0.903 K(o=2,f=0.55) USER MOD Set 2.2: A 65 GLN : amide:sc= 1.05 K(o=2,f=0.55) USER MOD Set 3.1: A 1 MET CE :methyl 176:sc= -0.501 (180deg=-0.547) USER MOD Set 3.2: A 15 MET CE :methyl -156:sc= -0.462 (180deg=-1.48!) USER MOD Single : A 1 MET N :NH3+ 175:sc= 0.856 (180deg=0.73) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -175:sc= 1.29 (180deg=1.18) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -19:sc= 0.0704 USER MOD Single : A 17 TYR OH : rot 102:sc= 0.0796 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 1.97 K(o=2,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= -0.0359 USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 HIS : no HE2:sc= -0.013 X(o=-0.013,f=-0.1) USER MOD Single : A 69 LYS NZ :NH3+ -178:sc= 1.17 (180deg=1.16) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.719 USER MOD Single : A 77 LYS NZ :NH3+ -168:sc= 1.31 (180deg=1.13) USER MOD Single : A 81 SER OG : rot 180:sc= 0.19 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.939 0.834 -3.361 1.00 0.00 N ATOM 2 CA MET A 1 5.355 -0.248 -4.216 1.00 0.00 C ATOM 3 C MET A 1 4.141 0.275 -5.010 1.00 0.00 C ATOM 4 O MET A 1 3.843 1.468 -4.964 1.00 0.00 O ATOM 5 CB MET A 1 5.074 -1.553 -3.417 1.00 0.00 C ATOM 6 CG MET A 1 3.854 -1.544 -2.483 1.00 0.00 C ATOM 7 SD MET A 1 3.776 -2.959 -1.345 1.00 0.00 S ATOM 8 CE MET A 1 3.382 -4.276 -2.516 1.00 0.00 C ATOM 0 H1 MET A 1 6.700 0.439 -2.773 1.00 0.00 H new ATOM 0 H2 MET A 1 6.325 1.586 -3.968 1.00 0.00 H new ATOM 0 H3 MET A 1 5.198 1.230 -2.748 1.00 0.00 H new ATOM 0 HA MET A 1 6.104 -0.537 -4.954 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.950 -2.368 -4.130 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.957 -1.783 -2.821 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.864 -0.623 -1.900 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.947 -1.528 -3.088 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.367 -5.233 -1.995 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.404 -4.088 -2.959 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.137 -4.302 -3.302 1.00 0.00 H new ATOM 20 N GLU A 2 3.448 -0.590 -5.759 1.00 0.00 N ATOM 21 CA GLU A 2 2.434 -0.217 -6.743 1.00 0.00 C ATOM 22 C GLU A 2 1.215 -1.104 -6.489 1.00 0.00 C ATOM 23 O GLU A 2 1.387 -2.314 -6.407 1.00 0.00 O ATOM 24 CB GLU A 2 3.060 -0.448 -8.138 1.00 0.00 C ATOM 25 CG GLU A 2 3.527 0.854 -8.800 1.00 0.00 C ATOM 26 CD GLU A 2 2.346 1.736 -9.250 1.00 0.00 C ATOM 27 OE1 GLU A 2 1.843 1.549 -10.384 1.00 0.00 O ATOM 28 OE2 GLU A 2 1.922 2.632 -8.480 1.00 0.00 O ATOM 0 H GLU A 2 3.584 -1.599 -5.693 1.00 0.00 H new ATOM 0 HA GLU A 2 2.116 0.823 -6.677 1.00 0.00 H new ATOM 0 HB2 GLU A 2 3.907 -1.127 -8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 2 2.330 -0.937 -8.783 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.149 1.412 -8.100 1.00 0.00 H new ATOM 0 HG3 GLU A 2 4.151 0.618 -9.662 1.00 0.00 H new ATOM 35 N ILE A 3 0.012 -0.543 -6.337 1.00 0.00 N ATOM 36 CA ILE A 3 -1.217 -1.264 -5.973 1.00 0.00 C ATOM 37 C ILE A 3 -2.270 -0.989 -7.063 1.00 0.00 C ATOM 38 O ILE A 3 -2.263 0.088 -7.666 1.00 0.00 O ATOM 39 CB ILE A 3 -1.726 -0.809 -4.583 1.00 0.00 C ATOM 40 CG1 ILE A 3 -0.651 -0.859 -3.478 1.00 0.00 C ATOM 41 CG2 ILE A 3 -2.959 -1.618 -4.119 1.00 0.00 C ATOM 42 CD1 ILE A 3 -0.031 -2.228 -3.185 1.00 0.00 C ATOM 0 H ILE A 3 -0.141 0.457 -6.467 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.021 -2.334 -5.909 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.006 0.234 -4.729 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.151 -0.174 -3.752 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.093 -0.481 -2.556 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.280 -1.263 -3.140 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -3.770 -1.488 -4.835 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.698 -2.674 -4.054 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.709 -2.130 -2.391 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.811 -2.921 -2.871 1.00 0.00 H new ATOM 0 HD13 ILE A 3 0.452 -2.609 -4.085 1.00 0.00 H new ATOM 54 N GLU A 4 -3.199 -1.923 -7.294 1.00 0.00 N ATOM 55 CA GLU A 4 -4.276 -1.769 -8.272 1.00 0.00 C ATOM 56 C GLU A 4 -5.539 -2.516 -7.816 1.00 0.00 C ATOM 57 O GLU A 4 -5.493 -3.701 -7.490 1.00 0.00 O ATOM 58 CB GLU A 4 -3.783 -2.300 -9.629 1.00 0.00 C ATOM 59 CG GLU A 4 -4.788 -2.057 -10.761 1.00 0.00 C ATOM 60 CD GLU A 4 -4.219 -2.339 -12.168 1.00 0.00 C ATOM 61 OE1 GLU A 4 -3.094 -1.888 -12.492 1.00 0.00 O ATOM 62 OE2 GLU A 4 -4.916 -2.990 -12.982 1.00 0.00 O ATOM 0 H GLU A 4 -3.223 -2.816 -6.801 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.540 -0.716 -8.366 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -2.837 -1.821 -9.880 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.587 -3.369 -9.546 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.663 -2.687 -10.600 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.128 -1.022 -10.717 1.00 0.00 H new ATOM 69 N ARG A 5 -6.690 -1.838 -7.835 1.00 0.00 N ATOM 70 CA ARG A 5 -8.004 -2.439 -7.598 1.00 0.00 C ATOM 71 C ARG A 5 -8.537 -2.933 -8.946 1.00 0.00 C ATOM 72 O ARG A 5 -8.850 -2.110 -9.806 1.00 0.00 O ATOM 73 CB ARG A 5 -8.897 -1.367 -6.938 1.00 0.00 C ATOM 74 CG ARG A 5 -10.393 -1.706 -6.830 1.00 0.00 C ATOM 75 CD ARG A 5 -10.737 -3.029 -6.139 1.00 0.00 C ATOM 76 NE ARG A 5 -10.378 -3.053 -4.716 1.00 0.00 N ATOM 77 CZ ARG A 5 -10.614 -4.059 -3.869 1.00 0.00 C ATOM 78 NH1 ARG A 5 -11.135 -5.224 -4.246 1.00 0.00 N ATOM 79 NH2 ARG A 5 -10.316 -3.886 -2.598 1.00 0.00 N ATOM 0 H ARG A 5 -6.734 -0.836 -8.019 1.00 0.00 H new ATOM 0 HA ARG A 5 -7.972 -3.296 -6.925 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -8.516 -1.173 -5.935 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -8.795 -0.440 -7.503 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -10.889 -0.899 -6.292 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -10.814 -1.725 -7.835 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -11.806 -3.216 -6.240 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -10.222 -3.842 -6.650 1.00 0.00 H new ATOM 0 HE ARG A 5 -9.907 -2.230 -4.341 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -11.375 -5.383 -5.225 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -11.294 -5.958 -3.556 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -9.916 -3.002 -2.284 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -10.485 -4.636 -1.928 1.00 0.00 H new ATOM 93 N ILE A 6 -8.630 -4.255 -9.154 1.00 0.00 N ATOM 94 CA ILE A 6 -9.167 -4.812 -10.393 1.00 0.00 C ATOM 95 C ILE A 6 -10.685 -4.635 -10.386 1.00 0.00 C ATOM 96 O ILE A 6 -11.251 -4.005 -11.281 1.00 0.00 O ATOM 97 CB ILE A 6 -8.783 -6.301 -10.509 1.00 0.00 C ATOM 98 CG1 ILE A 6 -7.279 -6.528 -10.293 1.00 0.00 C ATOM 99 CG2 ILE A 6 -9.231 -6.923 -11.843 1.00 0.00 C ATOM 100 CD1 ILE A 6 -6.344 -5.664 -11.141 1.00 0.00 C ATOM 0 H ILE A 6 -8.337 -4.956 -8.474 1.00 0.00 H new ATOM 0 HA ILE A 6 -8.749 -4.292 -11.255 1.00 0.00 H new ATOM 0 HB ILE A 6 -9.322 -6.809 -9.709 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -7.052 -6.351 -9.242 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -7.057 -7.576 -10.495 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -8.936 -7.972 -11.873 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -10.315 -6.848 -11.934 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.760 -6.390 -12.669 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.308 -5.909 -10.905 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -6.531 -5.855 -12.198 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -6.526 -4.611 -10.925 1.00 0.00 H new ATOM 112 N ASN A 7 -11.334 -5.197 -9.361 1.00 0.00 N ATOM 113 CA ASN A 7 -12.786 -5.202 -9.171 1.00 0.00 C ATOM 114 C ASN A 7 -13.088 -5.420 -7.687 1.00 0.00 C ATOM 115 O ASN A 7 -12.165 -5.483 -6.876 1.00 0.00 O ATOM 116 CB ASN A 7 -13.464 -6.265 -10.077 1.00 0.00 C ATOM 117 CG ASN A 7 -13.403 -7.719 -9.596 1.00 0.00 C ATOM 118 OD1 ASN A 7 -12.703 -8.060 -8.649 1.00 0.00 O ATOM 119 ND2 ASN A 7 -14.152 -8.607 -10.222 1.00 0.00 N ATOM 0 H ASN A 7 -10.840 -5.681 -8.611 1.00 0.00 H new ATOM 0 HA ASN A 7 -13.203 -4.241 -9.471 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -14.512 -5.990 -10.198 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -13.005 -6.214 -11.064 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -14.150 -9.581 -9.918 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.733 -8.320 -11.009 1.00 0.00 H new ATOM 126 N GLU A 8 -14.357 -5.580 -7.311 1.00 0.00 N ATOM 127 CA GLU A 8 -14.818 -5.681 -5.920 1.00 0.00 C ATOM 128 C GLU A 8 -14.153 -6.809 -5.102 1.00 0.00 C ATOM 129 O GLU A 8 -14.211 -6.796 -3.873 1.00 0.00 O ATOM 130 CB GLU A 8 -16.347 -5.827 -5.957 1.00 0.00 C ATOM 131 CG GLU A 8 -17.006 -5.706 -4.578 1.00 0.00 C ATOM 132 CD GLU A 8 -18.490 -5.308 -4.690 1.00 0.00 C ATOM 133 OE1 GLU A 8 -19.356 -6.199 -4.868 1.00 0.00 O ATOM 134 OE2 GLU A 8 -18.805 -4.095 -4.588 1.00 0.00 O ATOM 0 H GLU A 8 -15.119 -5.645 -7.985 1.00 0.00 H new ATOM 0 HA GLU A 8 -14.518 -4.776 -5.392 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -16.761 -5.065 -6.617 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -16.601 -6.795 -6.389 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -16.923 -6.656 -4.050 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -16.474 -4.963 -3.984 1.00 0.00 H new ATOM 141 N HIS A 9 -13.478 -7.760 -5.756 1.00 0.00 N ATOM 142 CA HIS A 9 -12.924 -8.964 -5.139 1.00 0.00 C ATOM 143 C HIS A 9 -11.410 -9.036 -5.347 1.00 0.00 C ATOM 144 O HIS A 9 -10.676 -9.289 -4.393 1.00 0.00 O ATOM 145 CB HIS A 9 -13.607 -10.191 -5.761 1.00 0.00 C ATOM 146 CG HIS A 9 -15.117 -10.148 -5.737 1.00 0.00 C ATOM 147 ND1 HIS A 9 -15.939 -10.274 -6.834 1.00 0.00 N ATOM 148 CD2 HIS A 9 -15.929 -9.937 -4.651 1.00 0.00 C ATOM 149 CE1 HIS A 9 -17.213 -10.150 -6.421 1.00 0.00 C ATOM 150 NE2 HIS A 9 -17.260 -9.947 -5.090 1.00 0.00 N ATOM 0 H HIS A 9 -13.298 -7.709 -6.759 1.00 0.00 H new ATOM 0 HA HIS A 9 -13.109 -8.939 -4.065 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -13.276 -10.290 -6.795 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -13.273 -11.084 -5.232 1.00 0.00 H new ATOM 0 HD1 HIS A 9 -15.634 -10.434 -7.794 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -15.599 -9.789 -3.633 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -18.077 -10.205 -7.066 1.00 0.00 H new ATOM 158 N THR A 10 -10.937 -8.799 -6.566 1.00 0.00 N ATOM 159 CA THR A 10 -9.544 -8.977 -6.935 1.00 0.00 C ATOM 160 C THR A 10 -8.806 -7.648 -6.806 1.00 0.00 C ATOM 161 O THR A 10 -9.301 -6.585 -7.196 1.00 0.00 O ATOM 162 CB THR A 10 -9.481 -9.574 -8.356 1.00 0.00 C ATOM 163 OG1 THR A 10 -10.191 -10.806 -8.345 1.00 0.00 O ATOM 164 CG2 THR A 10 -8.060 -9.863 -8.847 1.00 0.00 C ATOM 0 H THR A 10 -11.523 -8.473 -7.335 1.00 0.00 H new ATOM 0 HA THR A 10 -9.043 -9.675 -6.264 1.00 0.00 H new ATOM 0 HB THR A 10 -9.911 -8.833 -9.030 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.167 -11.205 -9.240 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.101 -10.281 -9.853 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.485 -8.937 -8.861 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.582 -10.577 -8.177 1.00 0.00 H new ATOM 172 N VAL A 11 -7.563 -7.724 -6.346 1.00 0.00 N ATOM 173 CA VAL A 11 -6.594 -6.641 -6.418 1.00 0.00 C ATOM 174 C VAL A 11 -5.351 -7.208 -7.100 1.00 0.00 C ATOM 175 O VAL A 11 -5.179 -8.426 -7.183 1.00 0.00 O ATOM 176 CB VAL A 11 -6.321 -6.042 -5.018 1.00 0.00 C ATOM 177 CG1 VAL A 11 -7.584 -5.384 -4.452 1.00 0.00 C ATOM 178 CG2 VAL A 11 -5.808 -7.062 -3.991 1.00 0.00 C ATOM 0 H VAL A 11 -7.193 -8.564 -5.901 1.00 0.00 H new ATOM 0 HA VAL A 11 -6.968 -5.801 -7.003 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.532 -5.306 -5.176 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.368 -4.970 -3.467 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -7.908 -4.585 -5.119 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.375 -6.129 -4.367 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -5.641 -6.564 -3.036 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -6.547 -7.853 -3.863 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -4.871 -7.494 -4.344 1.00 0.00 H new ATOM 188 N LYS A 12 -4.461 -6.349 -7.576 1.00 0.00 N ATOM 189 CA LYS A 12 -3.095 -6.750 -7.862 1.00 0.00 C ATOM 190 C LYS A 12 -2.140 -5.712 -7.298 1.00 0.00 C ATOM 191 O LYS A 12 -2.562 -4.630 -6.898 1.00 0.00 O ATOM 192 CB LYS A 12 -2.903 -7.060 -9.356 1.00 0.00 C ATOM 193 CG LYS A 12 -2.726 -5.892 -10.311 1.00 0.00 C ATOM 194 CD LYS A 12 -2.435 -6.442 -11.719 1.00 0.00 C ATOM 195 CE LYS A 12 -2.213 -5.261 -12.656 1.00 0.00 C ATOM 196 NZ LYS A 12 -1.604 -5.658 -13.953 1.00 0.00 N ATOM 0 H LYS A 12 -4.663 -5.369 -7.772 1.00 0.00 H new ATOM 0 HA LYS A 12 -2.863 -7.690 -7.362 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -2.030 -7.706 -9.453 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.765 -7.637 -9.691 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -3.625 -5.276 -10.325 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -1.908 -5.253 -9.979 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -1.554 -7.084 -11.702 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.268 -7.053 -12.068 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -3.167 -4.769 -12.844 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -1.569 -4.531 -12.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.398 -4.807 -14.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -0.721 -6.179 -13.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.266 -6.266 -14.476 1.00 0.00 H new ATOM 210 N PHE A 13 -0.860 -6.035 -7.278 1.00 0.00 N ATOM 211 CA PHE A 13 0.197 -5.114 -6.926 1.00 0.00 C ATOM 212 C PHE A 13 1.435 -5.463 -7.732 1.00 0.00 C ATOM 213 O PHE A 13 1.528 -6.544 -8.319 1.00 0.00 O ATOM 214 CB PHE A 13 0.453 -5.139 -5.415 1.00 0.00 C ATOM 215 CG PHE A 13 0.862 -6.441 -4.786 1.00 0.00 C ATOM 216 CD1 PHE A 13 -0.129 -7.324 -4.333 1.00 0.00 C ATOM 217 CD2 PHE A 13 2.214 -6.667 -4.478 1.00 0.00 C ATOM 218 CE1 PHE A 13 0.228 -8.413 -3.524 1.00 0.00 C ATOM 219 CE2 PHE A 13 2.568 -7.732 -3.638 1.00 0.00 C ATOM 220 CZ PHE A 13 1.567 -8.586 -3.137 1.00 0.00 C ATOM 0 H PHE A 13 -0.522 -6.968 -7.512 1.00 0.00 H new ATOM 0 HA PHE A 13 -0.094 -4.092 -7.170 1.00 0.00 H new ATOM 0 HB2 PHE A 13 1.229 -4.405 -5.197 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -0.456 -4.800 -4.918 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -1.162 -7.166 -4.606 1.00 0.00 H new ATOM 0 HD2 PHE A 13 2.978 -6.022 -4.887 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -0.525 -9.116 -3.200 1.00 0.00 H new ATOM 0 HE2 PHE A 13 3.603 -7.897 -3.377 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.830 -9.378 -2.452 1.00 0.00 H new ATOM 230 N TYR A 14 2.406 -4.564 -7.729 1.00 0.00 N ATOM 231 CA TYR A 14 3.720 -4.778 -8.269 1.00 0.00 C ATOM 232 C TYR A 14 4.701 -4.278 -7.219 1.00 0.00 C ATOM 233 O TYR A 14 4.434 -3.310 -6.500 1.00 0.00 O ATOM 234 CB TYR A 14 3.837 -4.073 -9.619 1.00 0.00 C ATOM 235 CG TYR A 14 5.267 -4.019 -10.091 1.00 0.00 C ATOM 236 CD1 TYR A 14 5.845 -5.143 -10.696 1.00 0.00 C ATOM 237 CD2 TYR A 14 6.045 -2.890 -9.786 1.00 0.00 C ATOM 238 CE1 TYR A 14 7.204 -5.145 -11.039 1.00 0.00 C ATOM 239 CE2 TYR A 14 7.420 -2.888 -10.102 1.00 0.00 C ATOM 240 CZ TYR A 14 8.002 -4.013 -10.743 1.00 0.00 C ATOM 241 OH TYR A 14 9.325 -4.020 -11.071 1.00 0.00 O ATOM 0 H TYR A 14 2.286 -3.632 -7.333 1.00 0.00 H new ATOM 0 HA TYR A 14 3.936 -5.827 -8.472 1.00 0.00 H new ATOM 0 HB2 TYR A 14 3.228 -4.595 -10.357 1.00 0.00 H new ATOM 0 HB3 TYR A 14 3.441 -3.061 -9.538 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.239 -6.014 -10.899 1.00 0.00 H new ATOM 0 HD2 TYR A 14 5.594 -2.030 -9.313 1.00 0.00 H new ATOM 0 HE1 TYR A 14 7.640 -6.005 -11.526 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.030 -2.031 -9.856 1.00 0.00 H new ATOM 0 HH TYR A 14 9.733 -3.170 -10.803 1.00 0.00 H new ATOM 251 N MET A 15 5.823 -4.974 -7.097 1.00 0.00 N ATOM 252 CA MET A 15 6.774 -4.811 -6.021 1.00 0.00 C ATOM 253 C MET A 15 8.155 -4.956 -6.630 1.00 0.00 C ATOM 254 O MET A 15 8.526 -6.035 -7.090 1.00 0.00 O ATOM 255 CB MET A 15 6.504 -5.912 -4.993 1.00 0.00 C ATOM 256 CG MET A 15 7.230 -5.678 -3.692 1.00 0.00 C ATOM 257 SD MET A 15 6.744 -6.874 -2.425 1.00 0.00 S ATOM 258 CE MET A 15 6.753 -5.809 -0.963 1.00 0.00 C ATOM 0 H MET A 15 6.100 -5.689 -7.769 1.00 0.00 H new ATOM 0 HA MET A 15 6.694 -3.843 -5.526 1.00 0.00 H new ATOM 0 HB2 MET A 15 5.433 -5.971 -4.802 1.00 0.00 H new ATOM 0 HB3 MET A 15 6.808 -6.874 -5.407 1.00 0.00 H new ATOM 0 HG2 MET A 15 8.305 -5.743 -3.859 1.00 0.00 H new ATOM 0 HG3 MET A 15 7.023 -4.668 -3.337 1.00 0.00 H new ATOM 0 HE1 MET A 15 6.900 -6.417 -0.071 1.00 0.00 H new ATOM 0 HE2 MET A 15 7.563 -5.084 -1.046 1.00 0.00 H new ATOM 0 HE3 MET A 15 5.801 -5.282 -0.891 1.00 0.00 H new ATOM 268 N SER A 16 8.915 -3.871 -6.663 1.00 0.00 N ATOM 269 CA SER A 16 10.288 -3.926 -7.135 1.00 0.00 C ATOM 270 C SER A 16 11.121 -4.672 -6.091 1.00 0.00 C ATOM 271 O SER A 16 10.778 -4.676 -4.905 1.00 0.00 O ATOM 272 CB SER A 16 10.816 -2.509 -7.378 1.00 0.00 C ATOM 273 OG SER A 16 9.859 -1.703 -8.049 1.00 0.00 O ATOM 0 H SER A 16 8.604 -2.945 -6.369 1.00 0.00 H new ATOM 0 HA SER A 16 10.350 -4.458 -8.084 1.00 0.00 H new ATOM 0 HB2 SER A 16 11.076 -2.049 -6.425 1.00 0.00 H new ATOM 0 HB3 SER A 16 11.731 -2.557 -7.969 1.00 0.00 H new ATOM 0 HG SER A 16 9.199 -2.278 -8.490 1.00 0.00 H new ATOM 279 N TYR A 17 12.245 -5.261 -6.489 1.00 0.00 N ATOM 280 CA TYR A 17 13.133 -5.939 -5.547 1.00 0.00 C ATOM 281 C TYR A 17 13.563 -5.022 -4.407 1.00 0.00 C ATOM 282 O TYR A 17 13.528 -5.433 -3.252 1.00 0.00 O ATOM 283 CB TYR A 17 14.342 -6.534 -6.271 1.00 0.00 C ATOM 284 CG TYR A 17 14.021 -7.586 -7.316 1.00 0.00 C ATOM 285 CD1 TYR A 17 12.921 -8.458 -7.168 1.00 0.00 C ATOM 286 CD2 TYR A 17 14.863 -7.710 -8.434 1.00 0.00 C ATOM 287 CE1 TYR A 17 12.677 -9.450 -8.131 1.00 0.00 C ATOM 288 CE2 TYR A 17 14.626 -8.706 -9.399 1.00 0.00 C ATOM 289 CZ TYR A 17 13.532 -9.591 -9.247 1.00 0.00 C ATOM 290 OH TYR A 17 13.299 -10.590 -10.143 1.00 0.00 O ATOM 0 H TYR A 17 12.563 -5.283 -7.458 1.00 0.00 H new ATOM 0 HA TYR A 17 12.570 -6.758 -5.099 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.891 -5.724 -6.752 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.008 -6.974 -5.529 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.267 -8.362 -6.314 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.698 -7.036 -8.553 1.00 0.00 H new ATOM 0 HE1 TYR A 17 11.830 -10.110 -8.018 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.278 -8.795 -10.255 1.00 0.00 H new ATOM 0 HH TYR A 17 12.866 -10.220 -10.940 1.00 0.00 H new ATOM 300 N GLY A 18 13.864 -3.755 -4.679 1.00 0.00 N ATOM 301 CA GLY A 18 14.305 -2.865 -3.619 1.00 0.00 C ATOM 302 C GLY A 18 13.171 -2.366 -2.721 1.00 0.00 C ATOM 303 O GLY A 18 13.454 -1.897 -1.623 1.00 0.00 O ATOM 0 H GLY A 18 13.811 -3.332 -5.606 1.00 0.00 H new ATOM 0 HA2 GLY A 18 15.041 -3.383 -3.005 1.00 0.00 H new ATOM 0 HA3 GLY A 18 14.808 -2.007 -4.064 1.00 0.00 H new ATOM 307 N ASP A 19 11.895 -2.539 -3.098 1.00 0.00 N ATOM 308 CA ASP A 19 10.775 -2.357 -2.160 1.00 0.00 C ATOM 309 C ASP A 19 10.844 -3.436 -1.074 1.00 0.00 C ATOM 310 O ASP A 19 10.470 -3.196 0.076 1.00 0.00 O ATOM 311 CB ASP A 19 9.410 -2.438 -2.877 1.00 0.00 C ATOM 312 CG ASP A 19 8.731 -1.078 -3.041 1.00 0.00 C ATOM 313 OD1 ASP A 19 8.122 -0.585 -2.064 1.00 0.00 O ATOM 314 OD2 ASP A 19 8.696 -0.546 -4.172 1.00 0.00 O ATOM 0 H ASP A 19 11.613 -2.804 -4.042 1.00 0.00 H new ATOM 0 HA ASP A 19 10.863 -1.365 -1.717 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.550 -2.887 -3.860 1.00 0.00 H new ATOM 0 HB3 ASP A 19 8.751 -3.100 -2.315 1.00 0.00 H new ATOM 319 N ILE A 20 11.308 -4.634 -1.434 1.00 0.00 N ATOM 320 CA ILE A 20 11.449 -5.773 -0.532 1.00 0.00 C ATOM 321 C ILE A 20 12.716 -5.551 0.314 1.00 0.00 C ATOM 322 O ILE A 20 12.667 -5.746 1.531 1.00 0.00 O ATOM 323 CB ILE A 20 11.418 -7.081 -1.377 1.00 0.00 C ATOM 324 CG1 ILE A 20 10.029 -7.225 -2.038 1.00 0.00 C ATOM 325 CG2 ILE A 20 11.714 -8.336 -0.553 1.00 0.00 C ATOM 326 CD1 ILE A 20 10.013 -7.997 -3.363 1.00 0.00 C ATOM 0 H ILE A 20 11.604 -4.842 -2.388 1.00 0.00 H new ATOM 0 HA ILE A 20 10.628 -5.871 0.178 1.00 0.00 H new ATOM 0 HB ILE A 20 12.205 -6.997 -2.127 1.00 0.00 H new ATOM 0 HG12 ILE A 20 9.361 -7.725 -1.337 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.622 -6.229 -2.211 1.00 0.00 H new ATOM 0 HG21 ILE A 20 11.677 -9.213 -1.200 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.706 -8.254 -0.109 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.970 -8.436 0.237 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.993 -8.043 -3.745 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.650 -7.489 -4.088 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.385 -9.009 -3.199 1.00 0.00 H new ATOM 338 N GLU A 21 13.805 -5.056 -0.293 1.00 0.00 N ATOM 339 CA GLU A 21 15.027 -4.707 0.435 1.00 0.00 C ATOM 340 C GLU A 21 14.769 -3.612 1.479 1.00 0.00 C ATOM 341 O GLU A 21 15.356 -3.643 2.560 1.00 0.00 O ATOM 342 CB GLU A 21 16.134 -4.189 -0.504 1.00 0.00 C ATOM 343 CG GLU A 21 16.574 -5.124 -1.637 1.00 0.00 C ATOM 344 CD GLU A 21 17.859 -4.617 -2.320 1.00 0.00 C ATOM 345 OE1 GLU A 21 17.769 -3.814 -3.280 1.00 0.00 O ATOM 346 OE2 GLU A 21 18.971 -5.027 -1.905 1.00 0.00 O ATOM 0 H GLU A 21 13.860 -4.888 -1.298 1.00 0.00 H new ATOM 0 HA GLU A 21 15.350 -5.629 0.919 1.00 0.00 H new ATOM 0 HB2 GLU A 21 15.792 -3.254 -0.949 1.00 0.00 H new ATOM 0 HB3 GLU A 21 17.010 -3.953 0.101 1.00 0.00 H new ATOM 0 HG2 GLU A 21 16.742 -6.125 -1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 21 15.776 -5.204 -2.375 1.00 0.00 H new ATOM 353 N ASP A 22 13.904 -2.637 1.173 1.00 0.00 N ATOM 354 CA ASP A 22 13.616 -1.498 2.052 1.00 0.00 C ATOM 355 C ASP A 22 12.957 -1.955 3.347 1.00 0.00 C ATOM 356 O ASP A 22 13.313 -1.524 4.446 1.00 0.00 O ATOM 357 CB ASP A 22 12.658 -0.529 1.365 1.00 0.00 C ATOM 358 CG ASP A 22 12.383 0.694 2.256 1.00 0.00 C ATOM 359 OD1 ASP A 22 13.291 1.547 2.410 1.00 0.00 O ATOM 360 OD2 ASP A 22 11.255 0.814 2.792 1.00 0.00 O ATOM 0 H ASP A 22 13.379 -2.617 0.299 1.00 0.00 H new ATOM 0 HA ASP A 22 14.567 -1.012 2.271 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.082 -0.204 0.415 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.721 -1.037 1.138 1.00 0.00 H new ATOM 365 N ARG A 23 12.018 -2.891 3.187 1.00 0.00 N ATOM 366 CA ARG A 23 11.343 -3.575 4.285 1.00 0.00 C ATOM 367 C ARG A 23 12.293 -4.530 5.017 1.00 0.00 C ATOM 368 O ARG A 23 11.921 -5.070 6.060 1.00 0.00 O ATOM 369 CB ARG A 23 10.104 -4.298 3.731 1.00 0.00 C ATOM 370 CG ARG A 23 9.041 -3.322 3.221 1.00 0.00 C ATOM 371 CD ARG A 23 8.016 -4.024 2.321 1.00 0.00 C ATOM 372 NE ARG A 23 6.917 -3.107 1.994 1.00 0.00 N ATOM 373 CZ ARG A 23 6.933 -2.113 1.101 1.00 0.00 C ATOM 374 NH1 ARG A 23 7.996 -1.892 0.335 1.00 0.00 N ATOM 375 NH2 ARG A 23 5.870 -1.330 0.988 1.00 0.00 N ATOM 0 H ARG A 23 11.701 -3.199 2.268 1.00 0.00 H new ATOM 0 HA ARG A 23 11.020 -2.845 5.027 1.00 0.00 H new ATOM 0 HB2 ARG A 23 10.405 -4.960 2.919 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.673 -4.926 4.511 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.530 -2.865 4.068 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.522 -2.516 2.666 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.499 -4.366 1.405 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.624 -4.908 2.824 1.00 0.00 H new ATOM 0 HE ARG A 23 6.045 -3.244 2.505 1.00 0.00 H new ATOM 0 HH11 ARG A 23 8.820 -2.487 0.423 1.00 0.00 H new ATOM 0 HH12 ARG A 23 7.988 -1.128 -0.341 1.00 0.00 H new ATOM 0 HH21 ARG A 23 5.054 -1.490 1.578 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.868 -0.567 0.311 1.00 0.00 H new ATOM 389 N GLY A 24 13.503 -4.746 4.498 1.00 0.00 N ATOM 390 CA GLY A 24 14.513 -5.605 5.094 1.00 0.00 C ATOM 391 C GLY A 24 14.239 -7.092 4.871 1.00 0.00 C ATOM 392 O GLY A 24 14.876 -7.929 5.512 1.00 0.00 O ATOM 0 H GLY A 24 13.810 -4.313 3.627 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.488 -5.354 4.676 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.565 -5.407 6.165 1.00 0.00 H new ATOM 396 N PHE A 25 13.307 -7.427 3.972 1.00 0.00 N ATOM 397 CA PHE A 25 13.158 -8.779 3.443 1.00 0.00 C ATOM 398 C PHE A 25 14.166 -8.934 2.286 1.00 0.00 C ATOM 399 O PHE A 25 15.000 -8.056 2.042 1.00 0.00 O ATOM 400 CB PHE A 25 11.689 -9.019 3.028 1.00 0.00 C ATOM 401 CG PHE A 25 10.679 -8.939 4.166 1.00 0.00 C ATOM 402 CD1 PHE A 25 10.331 -7.678 4.679 1.00 0.00 C ATOM 403 CD2 PHE A 25 10.087 -10.088 4.728 1.00 0.00 C ATOM 404 CE1 PHE A 25 9.468 -7.552 5.778 1.00 0.00 C ATOM 405 CE2 PHE A 25 9.226 -9.963 5.830 1.00 0.00 C ATOM 406 CZ PHE A 25 8.917 -8.700 6.365 1.00 0.00 C ATOM 0 H PHE A 25 12.634 -6.762 3.592 1.00 0.00 H new ATOM 0 HA PHE A 25 13.380 -9.542 4.189 1.00 0.00 H new ATOM 0 HB2 PHE A 25 11.417 -8.286 2.268 1.00 0.00 H new ATOM 0 HB3 PHE A 25 11.614 -10.002 2.564 1.00 0.00 H new ATOM 0 HD1 PHE A 25 10.736 -6.789 4.219 1.00 0.00 H new ATOM 0 HD2 PHE A 25 10.295 -11.063 4.312 1.00 0.00 H new ATOM 0 HE1 PHE A 25 9.229 -6.575 6.170 1.00 0.00 H new ATOM 0 HE2 PHE A 25 8.795 -10.849 6.273 1.00 0.00 H new ATOM 0 HZ PHE A 25 8.262 -8.615 7.219 1.00 0.00 H new ATOM 416 N ASP A 26 14.092 -10.040 1.543 1.00 0.00 N ATOM 417 CA ASP A 26 14.890 -10.256 0.334 1.00 0.00 C ATOM 418 C ASP A 26 13.995 -10.918 -0.695 1.00 0.00 C ATOM 419 O ASP A 26 13.109 -11.683 -0.312 1.00 0.00 O ATOM 420 CB ASP A 26 16.084 -11.169 0.621 1.00 0.00 C ATOM 421 CG ASP A 26 17.206 -10.927 -0.395 1.00 0.00 C ATOM 422 OD1 ASP A 26 17.116 -11.478 -1.515 1.00 0.00 O ATOM 423 OD2 ASP A 26 18.166 -10.184 -0.076 1.00 0.00 O ATOM 0 H ASP A 26 13.471 -10.818 1.765 1.00 0.00 H new ATOM 0 HA ASP A 26 15.273 -9.301 -0.026 1.00 0.00 H new ATOM 0 HB2 ASP A 26 16.454 -10.986 1.630 1.00 0.00 H new ATOM 0 HB3 ASP A 26 15.769 -12.212 0.581 1.00 0.00 H new ATOM 428 N ARG A 27 14.209 -10.654 -1.984 1.00 0.00 N ATOM 429 CA ARG A 27 13.351 -11.201 -3.034 1.00 0.00 C ATOM 430 C ARG A 27 13.311 -12.728 -3.005 1.00 0.00 C ATOM 431 O ARG A 27 12.289 -13.299 -3.372 1.00 0.00 O ATOM 432 CB ARG A 27 13.771 -10.658 -4.415 1.00 0.00 C ATOM 433 CG ARG A 27 15.122 -11.206 -4.921 1.00 0.00 C ATOM 434 CD ARG A 27 15.561 -10.527 -6.221 1.00 0.00 C ATOM 435 NE ARG A 27 16.838 -11.086 -6.706 1.00 0.00 N ATOM 436 CZ ARG A 27 17.014 -11.959 -7.711 1.00 0.00 C ATOM 437 NH1 ARG A 27 15.977 -12.427 -8.407 1.00 0.00 N ATOM 438 NH2 ARG A 27 18.243 -12.372 -8.012 1.00 0.00 N ATOM 0 H ARG A 27 14.969 -10.065 -2.326 1.00 0.00 H new ATOM 0 HA ARG A 27 12.332 -10.867 -2.840 1.00 0.00 H new ATOM 0 HB2 ARG A 27 12.996 -10.903 -5.141 1.00 0.00 H new ATOM 0 HB3 ARG A 27 13.828 -9.571 -4.364 1.00 0.00 H new ATOM 0 HG2 ARG A 27 15.884 -11.055 -4.157 1.00 0.00 H new ATOM 0 HG3 ARG A 27 15.041 -12.281 -5.082 1.00 0.00 H new ATOM 0 HD2 ARG A 27 14.791 -10.657 -6.981 1.00 0.00 H new ATOM 0 HD3 ARG A 27 15.669 -9.455 -6.057 1.00 0.00 H new ATOM 0 HE ARG A 27 17.681 -10.774 -6.224 1.00 0.00 H new ATOM 0 HH11 ARG A 27 15.031 -12.122 -8.179 1.00 0.00 H new ATOM 0 HH12 ARG A 27 16.130 -13.090 -9.167 1.00 0.00 H new ATOM 0 HH21 ARG A 27 19.042 -12.026 -7.481 1.00 0.00 H new ATOM 0 HH22 ARG A 27 18.386 -13.035 -8.774 1.00 0.00 H new ATOM 452 N GLU A 28 14.396 -13.383 -2.582 1.00 0.00 N ATOM 453 CA GLU A 28 14.403 -14.830 -2.412 1.00 0.00 C ATOM 454 C GLU A 28 13.807 -15.182 -1.050 1.00 0.00 C ATOM 455 O GLU A 28 12.954 -16.057 -0.970 1.00 0.00 O ATOM 456 CB GLU A 28 15.825 -15.387 -2.549 1.00 0.00 C ATOM 457 CG GLU A 28 16.372 -15.224 -3.971 1.00 0.00 C ATOM 458 CD GLU A 28 17.707 -15.973 -4.153 1.00 0.00 C ATOM 459 OE1 GLU A 28 18.780 -15.405 -3.835 1.00 0.00 O ATOM 460 OE2 GLU A 28 17.697 -17.133 -4.636 1.00 0.00 O ATOM 0 H GLU A 28 15.280 -12.929 -2.352 1.00 0.00 H new ATOM 0 HA GLU A 28 13.796 -15.286 -3.194 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.484 -14.876 -1.847 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.828 -16.443 -2.278 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.642 -15.600 -4.688 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.515 -14.165 -4.188 1.00 0.00 H new ATOM 467 N GLU A 29 14.214 -14.491 0.018 1.00 0.00 N ATOM 468 CA GLU A 29 13.831 -14.817 1.395 1.00 0.00 C ATOM 469 C GLU A 29 12.319 -14.850 1.587 1.00 0.00 C ATOM 470 O GLU A 29 11.816 -15.708 2.311 1.00 0.00 O ATOM 471 CB GLU A 29 14.456 -13.796 2.355 1.00 0.00 C ATOM 472 CG GLU A 29 15.961 -13.985 2.543 1.00 0.00 C ATOM 473 CD GLU A 29 16.297 -14.987 3.663 1.00 0.00 C ATOM 474 OE1 GLU A 29 16.058 -16.206 3.491 1.00 0.00 O ATOM 475 OE2 GLU A 29 16.798 -14.558 4.731 1.00 0.00 O ATOM 0 H GLU A 29 14.827 -13.679 -0.050 1.00 0.00 H new ATOM 0 HA GLU A 29 14.205 -15.818 1.612 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.267 -12.791 1.978 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.964 -13.871 3.325 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.400 -14.331 1.607 1.00 0.00 H new ATOM 0 HG3 GLU A 29 16.418 -13.023 2.772 1.00 0.00 H new ATOM 482 N ILE A 30 11.615 -13.952 0.902 1.00 0.00 N ATOM 483 CA ILE A 30 10.152 -13.939 0.809 1.00 0.00 C ATOM 484 C ILE A 30 9.623 -15.351 0.515 1.00 0.00 C ATOM 485 O ILE A 30 8.719 -15.821 1.204 1.00 0.00 O ATOM 486 CB ILE A 30 9.713 -12.927 -0.271 1.00 0.00 C ATOM 487 CG1 ILE A 30 9.982 -11.479 0.191 1.00 0.00 C ATOM 488 CG2 ILE A 30 8.249 -13.081 -0.724 1.00 0.00 C ATOM 489 CD1 ILE A 30 8.879 -10.794 1.021 1.00 0.00 C ATOM 0 H ILE A 30 12.055 -13.193 0.382 1.00 0.00 H new ATOM 0 HA ILE A 30 9.727 -13.625 1.762 1.00 0.00 H new ATOM 0 HB ILE A 30 10.323 -13.154 -1.145 1.00 0.00 H new ATOM 0 HG12 ILE A 30 10.900 -11.476 0.779 1.00 0.00 H new ATOM 0 HG13 ILE A 30 10.168 -10.870 -0.694 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.022 -12.332 -1.483 1.00 0.00 H new ATOM 0 HG22 ILE A 30 8.100 -14.077 -1.141 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.587 -12.943 0.131 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.194 -9.783 1.280 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.959 -10.749 0.438 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.703 -11.364 1.933 1.00 0.00 H new ATOM 501 N TRP A 31 10.185 -16.039 -0.477 1.00 0.00 N ATOM 502 CA TRP A 31 9.722 -17.354 -0.917 1.00 0.00 C ATOM 503 C TRP A 31 10.213 -18.512 -0.040 1.00 0.00 C ATOM 504 O TRP A 31 9.679 -19.617 -0.161 1.00 0.00 O ATOM 505 CB TRP A 31 10.128 -17.586 -2.377 1.00 0.00 C ATOM 506 CG TRP A 31 9.715 -16.477 -3.295 1.00 0.00 C ATOM 507 CD1 TRP A 31 10.545 -15.764 -4.085 1.00 0.00 C ATOM 508 CD2 TRP A 31 8.403 -15.850 -3.422 1.00 0.00 C ATOM 509 NE1 TRP A 31 9.853 -14.711 -4.649 1.00 0.00 N ATOM 510 CE2 TRP A 31 8.549 -14.664 -4.199 1.00 0.00 C ATOM 511 CE3 TRP A 31 7.114 -16.125 -2.912 1.00 0.00 C ATOM 512 CZ2 TRP A 31 7.502 -13.744 -4.363 1.00 0.00 C ATOM 513 CZ3 TRP A 31 6.037 -15.246 -3.130 1.00 0.00 C ATOM 514 CH2 TRP A 31 6.234 -14.044 -3.833 1.00 0.00 C ATOM 0 H TRP A 31 10.986 -15.694 -1.005 1.00 0.00 H new ATOM 0 HA TRP A 31 8.636 -17.346 -0.821 1.00 0.00 H new ATOM 0 HB2 TRP A 31 11.210 -17.707 -2.430 1.00 0.00 H new ATOM 0 HB3 TRP A 31 9.685 -18.519 -2.725 1.00 0.00 H new ATOM 0 HD1 TRP A 31 11.589 -15.983 -4.250 1.00 0.00 H new ATOM 0 HE1 TRP A 31 10.255 -14.051 -5.315 1.00 0.00 H new ATOM 0 HE3 TRP A 31 6.952 -17.029 -2.343 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 7.668 -12.816 -4.890 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 5.055 -15.495 -2.756 1.00 0.00 H new ATOM 0 HH2 TRP A 31 5.414 -13.353 -3.966 1.00 0.00 H new ATOM 525 N TYR A 32 11.197 -18.289 0.840 1.00 0.00 N ATOM 526 CA TYR A 32 11.937 -19.362 1.512 1.00 0.00 C ATOM 527 C TYR A 32 11.846 -19.277 3.044 1.00 0.00 C ATOM 528 O TYR A 32 12.543 -20.013 3.746 1.00 0.00 O ATOM 529 CB TYR A 32 13.384 -19.385 0.984 1.00 0.00 C ATOM 530 CG TYR A 32 13.494 -19.628 -0.512 1.00 0.00 C ATOM 531 CD1 TYR A 32 12.887 -20.759 -1.092 1.00 0.00 C ATOM 532 CD2 TYR A 32 14.187 -18.717 -1.331 1.00 0.00 C ATOM 533 CE1 TYR A 32 12.939 -20.953 -2.481 1.00 0.00 C ATOM 534 CE2 TYR A 32 14.212 -18.884 -2.725 1.00 0.00 C ATOM 535 CZ TYR A 32 13.592 -20.012 -3.311 1.00 0.00 C ATOM 536 OH TYR A 32 13.612 -20.205 -4.663 1.00 0.00 O ATOM 0 H TYR A 32 11.503 -17.353 1.107 1.00 0.00 H new ATOM 0 HA TYR A 32 11.472 -20.318 1.270 1.00 0.00 H new ATOM 0 HB2 TYR A 32 13.862 -18.435 1.223 1.00 0.00 H new ATOM 0 HB3 TYR A 32 13.939 -20.162 1.509 1.00 0.00 H new ATOM 0 HD1 TYR A 32 12.380 -21.479 -0.466 1.00 0.00 H new ATOM 0 HD2 TYR A 32 14.704 -17.882 -0.883 1.00 0.00 H new ATOM 0 HE1 TYR A 32 12.478 -21.826 -2.919 1.00 0.00 H new ATOM 0 HE2 TYR A 32 14.704 -18.152 -3.349 1.00 0.00 H new ATOM 0 HH TYR A 32 14.098 -19.470 -5.091 1.00 0.00 H new ATOM 546 N ASN A 33 10.964 -18.424 3.573 1.00 0.00 N ATOM 547 CA ASN A 33 10.692 -18.258 4.993 1.00 0.00 C ATOM 548 C ASN A 33 9.173 -18.242 5.136 1.00 0.00 C ATOM 549 O ASN A 33 8.535 -17.234 4.838 1.00 0.00 O ATOM 550 CB ASN A 33 11.307 -16.945 5.477 1.00 0.00 C ATOM 551 CG ASN A 33 12.822 -16.999 5.525 1.00 0.00 C ATOM 552 OD1 ASN A 33 13.431 -17.420 6.507 1.00 0.00 O ATOM 553 ND2 ASN A 33 13.447 -16.567 4.448 1.00 0.00 N ATOM 0 H ASN A 33 10.398 -17.805 2.992 1.00 0.00 H new ATOM 0 HA ASN A 33 11.123 -19.060 5.593 1.00 0.00 H new ATOM 0 HB2 ASN A 33 10.996 -16.136 4.816 1.00 0.00 H new ATOM 0 HB3 ASN A 33 10.923 -16.711 6.470 1.00 0.00 H new ATOM 0 HD21 ASN A 33 14.466 -16.576 4.412 1.00 0.00 H new ATOM 0 HD22 ASN A 33 12.911 -16.224 3.651 1.00 0.00 H new ATOM 560 N ARG A 34 8.595 -19.384 5.519 1.00 0.00 N ATOM 561 CA ARG A 34 7.160 -19.704 5.415 1.00 0.00 C ATOM 562 C ARG A 34 6.208 -18.764 6.147 1.00 0.00 C ATOM 563 O ARG A 34 4.995 -18.823 5.941 1.00 0.00 O ATOM 564 CB ARG A 34 6.954 -21.140 5.881 1.00 0.00 C ATOM 565 CG ARG A 34 6.974 -21.351 7.403 1.00 0.00 C ATOM 566 CD ARG A 34 6.780 -22.844 7.652 1.00 0.00 C ATOM 567 NE ARG A 34 6.767 -23.166 9.093 1.00 0.00 N ATOM 568 CZ ARG A 34 6.564 -24.381 9.626 1.00 0.00 C ATOM 569 NH1 ARG A 34 6.348 -25.438 8.844 1.00 0.00 N ATOM 570 NH2 ARG A 34 6.579 -24.535 10.947 1.00 0.00 N ATOM 0 H ARG A 34 9.134 -20.147 5.928 1.00 0.00 H new ATOM 0 HA ARG A 34 6.898 -19.570 4.366 1.00 0.00 H new ATOM 0 HB2 ARG A 34 5.999 -21.495 5.495 1.00 0.00 H new ATOM 0 HB3 ARG A 34 7.729 -21.763 5.435 1.00 0.00 H new ATOM 0 HG2 ARG A 34 7.918 -21.009 7.827 1.00 0.00 H new ATOM 0 HG3 ARG A 34 6.183 -20.775 7.882 1.00 0.00 H new ATOM 0 HD2 ARG A 34 5.843 -23.169 7.199 1.00 0.00 H new ATOM 0 HD3 ARG A 34 7.580 -23.400 7.163 1.00 0.00 H new ATOM 0 HE ARG A 34 6.927 -22.395 9.742 1.00 0.00 H new ATOM 0 HH11 ARG A 34 6.336 -25.328 7.830 1.00 0.00 H new ATOM 0 HH12 ARG A 34 6.195 -26.357 9.259 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.744 -23.731 11.552 1.00 0.00 H new ATOM 0 HH22 ARG A 34 6.425 -25.457 11.355 1.00 0.00 H new ATOM 584 N GLU A 35 6.755 -17.963 7.049 1.00 0.00 N ATOM 585 CA GLU A 35 6.045 -16.978 7.839 1.00 0.00 C ATOM 586 C GLU A 35 6.429 -15.548 7.441 1.00 0.00 C ATOM 587 O GLU A 35 5.582 -14.657 7.502 1.00 0.00 O ATOM 588 CB GLU A 35 6.277 -17.250 9.336 1.00 0.00 C ATOM 589 CG GLU A 35 7.699 -17.027 9.882 1.00 0.00 C ATOM 590 CD GLU A 35 8.720 -18.056 9.357 1.00 0.00 C ATOM 591 OE1 GLU A 35 9.277 -17.832 8.255 1.00 0.00 O ATOM 592 OE2 GLU A 35 8.949 -19.087 10.034 1.00 0.00 O ATOM 0 H GLU A 35 7.753 -17.986 7.257 1.00 0.00 H new ATOM 0 HA GLU A 35 4.978 -17.069 7.638 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.595 -16.617 9.904 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.996 -18.284 9.539 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.032 -16.025 9.612 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.674 -17.072 10.971 1.00 0.00 H new ATOM 599 N ARG A 36 7.665 -15.313 6.984 1.00 0.00 N ATOM 600 CA ARG A 36 8.086 -13.994 6.527 1.00 0.00 C ATOM 601 C ARG A 36 7.574 -13.697 5.120 1.00 0.00 C ATOM 602 O ARG A 36 7.558 -12.540 4.703 1.00 0.00 O ATOM 603 CB ARG A 36 9.602 -13.845 6.611 1.00 0.00 C ATOM 604 CG ARG A 36 10.179 -13.929 8.037 1.00 0.00 C ATOM 605 CD ARG A 36 9.374 -13.157 9.099 1.00 0.00 C ATOM 606 NE ARG A 36 10.015 -13.213 10.426 1.00 0.00 N ATOM 607 CZ ARG A 36 9.443 -12.856 11.584 1.00 0.00 C ATOM 608 NH1 ARG A 36 8.192 -12.402 11.626 1.00 0.00 N ATOM 609 NH2 ARG A 36 10.139 -12.959 12.714 1.00 0.00 N ATOM 0 H ARG A 36 8.391 -16.027 6.923 1.00 0.00 H new ATOM 0 HA ARG A 36 7.641 -13.256 7.194 1.00 0.00 H new ATOM 0 HB2 ARG A 36 10.064 -14.621 6.000 1.00 0.00 H new ATOM 0 HB3 ARG A 36 9.884 -12.886 6.175 1.00 0.00 H new ATOM 0 HG2 ARG A 36 10.234 -14.977 8.332 1.00 0.00 H new ATOM 0 HG3 ARG A 36 11.200 -13.547 8.025 1.00 0.00 H new ATOM 0 HD2 ARG A 36 9.270 -12.117 8.790 1.00 0.00 H new ATOM 0 HD3 ARG A 36 8.368 -13.572 9.164 1.00 0.00 H new ATOM 0 HE ARG A 36 10.976 -13.553 10.466 1.00 0.00 H new ATOM 0 HH11 ARG A 36 7.650 -12.321 10.766 1.00 0.00 H new ATOM 0 HH12 ARG A 36 7.776 -12.136 12.518 1.00 0.00 H new ATOM 0 HH21 ARG A 36 11.098 -13.307 12.693 1.00 0.00 H new ATOM 0 HH22 ARG A 36 9.714 -12.690 13.601 1.00 0.00 H new ATOM 623 N SER A 37 7.131 -14.723 4.402 1.00 0.00 N ATOM 624 CA SER A 37 6.328 -14.588 3.208 1.00 0.00 C ATOM 625 C SER A 37 5.103 -13.722 3.512 1.00 0.00 C ATOM 626 O SER A 37 4.939 -12.645 2.939 1.00 0.00 O ATOM 627 CB SER A 37 5.934 -16.005 2.752 1.00 0.00 C ATOM 628 OG SER A 37 5.424 -16.758 3.843 1.00 0.00 O ATOM 0 H SER A 37 7.329 -15.693 4.646 1.00 0.00 H new ATOM 0 HA SER A 37 6.879 -14.095 2.407 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.184 -15.944 1.963 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.802 -16.511 2.328 1.00 0.00 H new ATOM 0 HG SER A 37 5.178 -17.655 3.535 1.00 0.00 H new ATOM 634 N GLU A 38 4.273 -14.184 4.449 1.00 0.00 N ATOM 635 CA GLU A 38 2.923 -13.717 4.692 1.00 0.00 C ATOM 636 C GLU A 38 2.871 -12.220 5.017 1.00 0.00 C ATOM 637 O GLU A 38 1.888 -11.562 4.682 1.00 0.00 O ATOM 638 CB GLU A 38 2.314 -14.579 5.812 1.00 0.00 C ATOM 639 CG GLU A 38 0.832 -14.836 5.537 1.00 0.00 C ATOM 640 CD GLU A 38 0.192 -15.714 6.629 1.00 0.00 C ATOM 641 OE1 GLU A 38 0.212 -16.962 6.490 1.00 0.00 O ATOM 642 OE2 GLU A 38 -0.359 -15.168 7.615 1.00 0.00 O ATOM 0 H GLU A 38 4.546 -14.932 5.087 1.00 0.00 H new ATOM 0 HA GLU A 38 2.332 -13.828 3.783 1.00 0.00 H new ATOM 0 HB2 GLU A 38 2.848 -15.527 5.882 1.00 0.00 H new ATOM 0 HB3 GLU A 38 2.431 -14.076 6.772 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.303 -13.885 5.479 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.721 -15.322 4.568 1.00 0.00 H new ATOM 649 N GLU A 39 3.930 -11.665 5.612 1.00 0.00 N ATOM 650 CA GLU A 39 4.012 -10.274 6.028 1.00 0.00 C ATOM 651 C GLU A 39 3.775 -9.325 4.852 1.00 0.00 C ATOM 652 O GLU A 39 3.128 -8.288 5.010 1.00 0.00 O ATOM 653 CB GLU A 39 5.397 -9.975 6.635 1.00 0.00 C ATOM 654 CG GLU A 39 6.081 -11.092 7.428 1.00 0.00 C ATOM 655 CD GLU A 39 5.484 -11.421 8.814 1.00 0.00 C ATOM 656 OE1 GLU A 39 4.267 -11.222 9.046 1.00 0.00 O ATOM 657 OE2 GLU A 39 6.266 -11.867 9.688 1.00 0.00 O ATOM 0 H GLU A 39 4.777 -12.193 5.821 1.00 0.00 H new ATOM 0 HA GLU A 39 3.235 -10.113 6.775 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.063 -9.683 5.823 1.00 0.00 H new ATOM 0 HB3 GLU A 39 5.296 -9.111 7.291 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.062 -11.999 6.824 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.128 -10.822 7.563 1.00 0.00 H new ATOM 664 N LEU A 40 4.292 -9.688 3.671 1.00 0.00 N ATOM 665 CA LEU A 40 4.098 -8.918 2.450 1.00 0.00 C ATOM 666 C LEU A 40 2.600 -8.813 2.157 1.00 0.00 C ATOM 667 O LEU A 40 2.040 -7.719 2.056 1.00 0.00 O ATOM 668 CB LEU A 40 4.922 -9.557 1.315 1.00 0.00 C ATOM 669 CG LEU A 40 4.742 -9.036 -0.131 1.00 0.00 C ATOM 670 CD1 LEU A 40 4.028 -10.077 -0.985 1.00 0.00 C ATOM 671 CD2 LEU A 40 4.059 -7.669 -0.289 1.00 0.00 C ATOM 0 H LEU A 40 4.857 -10.527 3.542 1.00 0.00 H new ATOM 0 HA LEU A 40 4.462 -7.896 2.555 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.975 -9.451 1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.701 -10.624 1.310 1.00 0.00 H new ATOM 0 HG LEU A 40 5.762 -8.870 -0.478 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.909 -9.696 -1.999 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.617 -10.994 -1.009 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.047 -10.287 -0.559 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.992 -7.416 -1.347 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.057 -7.711 0.138 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.643 -6.909 0.230 1.00 0.00 H new ATOM 683 N PHE A 41 1.941 -9.961 2.069 1.00 0.00 N ATOM 684 CA PHE A 41 0.538 -10.081 1.708 1.00 0.00 C ATOM 685 C PHE A 41 -0.348 -9.387 2.747 1.00 0.00 C ATOM 686 O PHE A 41 -1.343 -8.751 2.392 1.00 0.00 O ATOM 687 CB PHE A 41 0.191 -11.569 1.562 1.00 0.00 C ATOM 688 CG PHE A 41 1.133 -12.267 0.601 1.00 0.00 C ATOM 689 CD1 PHE A 41 0.850 -12.299 -0.776 1.00 0.00 C ATOM 690 CD2 PHE A 41 2.365 -12.757 1.069 1.00 0.00 C ATOM 691 CE1 PHE A 41 1.787 -12.844 -1.672 1.00 0.00 C ATOM 692 CE2 PHE A 41 3.296 -13.313 0.175 1.00 0.00 C ATOM 693 CZ PHE A 41 3.003 -13.363 -1.196 1.00 0.00 C ATOM 0 H PHE A 41 2.384 -10.861 2.253 1.00 0.00 H new ATOM 0 HA PHE A 41 0.354 -9.584 0.755 1.00 0.00 H new ATOM 0 HB2 PHE A 41 0.240 -12.053 2.538 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -0.834 -11.672 1.207 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -0.086 -11.906 -1.145 1.00 0.00 H new ATOM 0 HD2 PHE A 41 2.597 -12.706 2.122 1.00 0.00 H new ATOM 0 HE1 PHE A 41 1.571 -12.864 -2.730 1.00 0.00 H new ATOM 0 HE2 PHE A 41 4.235 -13.701 0.543 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.711 -13.800 -1.885 1.00 0.00 H new ATOM 703 N TRP A 42 0.035 -9.455 4.021 1.00 0.00 N ATOM 704 CA TRP A 42 -0.627 -8.707 5.069 1.00 0.00 C ATOM 705 C TRP A 42 -0.484 -7.199 4.874 1.00 0.00 C ATOM 706 O TRP A 42 -1.461 -6.496 5.122 1.00 0.00 O ATOM 707 CB TRP A 42 -0.115 -9.164 6.439 1.00 0.00 C ATOM 708 CG TRP A 42 -0.826 -10.383 6.938 1.00 0.00 C ATOM 709 CD1 TRP A 42 -0.291 -11.615 7.088 1.00 0.00 C ATOM 710 CD2 TRP A 42 -2.242 -10.528 7.277 1.00 0.00 C ATOM 711 NE1 TRP A 42 -1.260 -12.500 7.508 1.00 0.00 N ATOM 712 CE2 TRP A 42 -2.493 -11.892 7.618 1.00 0.00 C ATOM 713 CE3 TRP A 42 -3.348 -9.649 7.298 1.00 0.00 C ATOM 714 CZ2 TRP A 42 -3.778 -12.360 7.944 1.00 0.00 C ATOM 715 CZ3 TRP A 42 -4.640 -10.107 7.623 1.00 0.00 C ATOM 716 CH2 TRP A 42 -4.857 -11.460 7.939 1.00 0.00 C ATOM 0 H TRP A 42 0.811 -10.031 4.347 1.00 0.00 H new ATOM 0 HA TRP A 42 -1.696 -8.915 5.018 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.953 -9.371 6.374 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -0.239 -8.355 7.158 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.743 -11.868 6.906 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -1.087 -13.484 7.712 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -3.200 -8.606 7.060 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -3.934 -13.399 8.195 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -5.469 -9.415 7.630 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -5.852 -11.807 8.178 1.00 0.00 H new ATOM 727 N GLU A 43 0.659 -6.674 4.422 1.00 0.00 N ATOM 728 CA GLU A 43 0.826 -5.241 4.273 1.00 0.00 C ATOM 729 C GLU A 43 -0.064 -4.729 3.139 1.00 0.00 C ATOM 730 O GLU A 43 -0.752 -3.723 3.309 1.00 0.00 O ATOM 731 CB GLU A 43 2.297 -4.894 4.005 1.00 0.00 C ATOM 732 CG GLU A 43 2.520 -3.384 4.141 1.00 0.00 C ATOM 733 CD GLU A 43 3.882 -2.938 3.590 1.00 0.00 C ATOM 734 OE1 GLU A 43 4.928 -3.525 3.949 1.00 0.00 O ATOM 735 OE2 GLU A 43 3.923 -1.979 2.785 1.00 0.00 O ATOM 0 H GLU A 43 1.475 -7.225 4.156 1.00 0.00 H new ATOM 0 HA GLU A 43 0.528 -4.753 5.201 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.937 -5.428 4.707 1.00 0.00 H new ATOM 0 HB3 GLU A 43 2.579 -5.221 3.004 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.727 -2.854 3.613 1.00 0.00 H new ATOM 0 HG3 GLU A 43 2.447 -3.103 5.191 1.00 0.00 H new ATOM 742 N VAL A 44 -0.090 -5.406 1.987 1.00 0.00 N ATOM 743 CA VAL A 44 -0.916 -4.972 0.880 1.00 0.00 C ATOM 744 C VAL A 44 -2.390 -5.033 1.256 1.00 0.00 C ATOM 745 O VAL A 44 -3.128 -4.085 1.012 1.00 0.00 O ATOM 746 CB VAL A 44 -0.627 -5.785 -0.380 1.00 0.00 C ATOM 747 CG1 VAL A 44 0.777 -5.475 -0.901 1.00 0.00 C ATOM 748 CG2 VAL A 44 -0.710 -7.296 -0.230 1.00 0.00 C ATOM 0 H VAL A 44 0.452 -6.251 1.807 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.668 -3.934 0.658 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.419 -5.481 -1.065 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.969 -6.062 -1.799 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.851 -4.414 -1.138 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.513 -5.729 -0.138 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.486 -7.769 -1.186 1.00 0.00 H new ATOM 0 HG22 VAL A 44 0.011 -7.628 0.517 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.715 -7.576 0.087 1.00 0.00 H new ATOM 758 N MET A 45 -2.831 -6.125 1.869 1.00 0.00 N ATOM 759 CA MET A 45 -4.199 -6.264 2.298 1.00 0.00 C ATOM 760 C MET A 45 -4.534 -5.186 3.334 1.00 0.00 C ATOM 761 O MET A 45 -5.632 -4.640 3.297 1.00 0.00 O ATOM 762 CB MET A 45 -4.409 -7.690 2.806 1.00 0.00 C ATOM 763 CG MET A 45 -5.818 -7.903 3.345 1.00 0.00 C ATOM 764 SD MET A 45 -7.215 -7.408 2.280 1.00 0.00 S ATOM 765 CE MET A 45 -6.831 -8.263 0.723 1.00 0.00 C ATOM 0 H MET A 45 -2.244 -6.932 2.078 1.00 0.00 H new ATOM 0 HA MET A 45 -4.891 -6.109 1.470 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.220 -8.395 1.996 1.00 0.00 H new ATOM 0 HB3 MET A 45 -3.684 -7.905 3.591 1.00 0.00 H new ATOM 0 HG2 MET A 45 -5.932 -8.962 3.578 1.00 0.00 H new ATOM 0 HG3 MET A 45 -5.904 -7.359 4.286 1.00 0.00 H new ATOM 0 HE1 MET A 45 -7.605 -8.045 -0.012 1.00 0.00 H new ATOM 0 HE2 MET A 45 -5.867 -7.920 0.348 1.00 0.00 H new ATOM 0 HE3 MET A 45 -6.790 -9.338 0.899 1.00 0.00 H new ATOM 775 N ASP A 46 -3.604 -4.828 4.221 1.00 0.00 N ATOM 776 CA ASP A 46 -3.809 -3.759 5.191 1.00 0.00 C ATOM 777 C ASP A 46 -3.969 -2.401 4.504 1.00 0.00 C ATOM 778 O ASP A 46 -4.845 -1.615 4.869 1.00 0.00 O ATOM 779 CB ASP A 46 -2.638 -3.681 6.171 1.00 0.00 C ATOM 780 CG ASP A 46 -2.858 -2.529 7.166 1.00 0.00 C ATOM 781 OD1 ASP A 46 -3.721 -2.660 8.065 1.00 0.00 O ATOM 782 OD2 ASP A 46 -2.147 -1.500 7.076 1.00 0.00 O ATOM 0 H ASP A 46 -2.688 -5.273 4.284 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.726 -3.994 5.732 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.541 -4.624 6.710 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -1.707 -3.528 5.626 1.00 0.00 H new ATOM 787 N GLU A 47 -3.156 -2.131 3.484 1.00 0.00 N ATOM 788 CA GLU A 47 -3.240 -0.946 2.660 1.00 0.00 C ATOM 789 C GLU A 47 -4.593 -0.902 1.930 1.00 0.00 C ATOM 790 O GLU A 47 -5.233 0.152 1.875 1.00 0.00 O ATOM 791 CB GLU A 47 -2.016 -0.988 1.735 1.00 0.00 C ATOM 792 CG GLU A 47 -2.147 -0.272 0.402 1.00 0.00 C ATOM 793 CD GLU A 47 -2.403 1.248 0.509 1.00 0.00 C ATOM 794 OE1 GLU A 47 -1.954 1.899 1.484 1.00 0.00 O ATOM 795 OE2 GLU A 47 -3.032 1.814 -0.416 1.00 0.00 O ATOM 0 H GLU A 47 -2.400 -2.757 3.207 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.213 -0.020 3.234 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.169 -0.559 2.271 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -1.773 -2.032 1.539 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -1.235 -0.434 -0.173 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -2.963 -0.726 -0.160 1.00 0.00 H new ATOM 802 N VAL A 48 -5.064 -2.040 1.417 1.00 0.00 N ATOM 803 CA VAL A 48 -6.357 -2.182 0.767 1.00 0.00 C ATOM 804 C VAL A 48 -7.504 -2.149 1.796 1.00 0.00 C ATOM 805 O VAL A 48 -8.644 -1.935 1.390 1.00 0.00 O ATOM 806 CB VAL A 48 -6.333 -3.493 -0.059 1.00 0.00 C ATOM 807 CG1 VAL A 48 -7.646 -3.816 -0.777 1.00 0.00 C ATOM 808 CG2 VAL A 48 -5.293 -3.485 -1.196 1.00 0.00 C ATOM 0 H VAL A 48 -4.536 -2.912 1.446 1.00 0.00 H new ATOM 0 HA VAL A 48 -6.542 -1.343 0.096 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.106 -4.227 0.714 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.538 -4.749 -1.330 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -8.446 -3.919 -0.044 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -7.890 -3.010 -1.469 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.332 -4.434 -1.732 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.514 -2.670 -1.885 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.297 -3.346 -0.777 1.00 0.00 H new ATOM 818 N HIS A 49 -7.259 -2.342 3.100 1.00 0.00 N ATOM 819 CA HIS A 49 -8.292 -2.792 4.029 1.00 0.00 C ATOM 820 C HIS A 49 -9.530 -1.890 4.117 1.00 0.00 C ATOM 821 O HIS A 49 -10.613 -2.395 4.414 1.00 0.00 O ATOM 822 CB HIS A 49 -7.709 -3.030 5.424 1.00 0.00 C ATOM 823 CG HIS A 49 -8.568 -3.909 6.296 1.00 0.00 C ATOM 824 ND1 HIS A 49 -9.066 -3.604 7.542 1.00 0.00 N ATOM 825 CD2 HIS A 49 -8.958 -5.187 6.004 1.00 0.00 C ATOM 826 CE1 HIS A 49 -9.741 -4.678 7.991 1.00 0.00 C ATOM 827 NE2 HIS A 49 -9.706 -5.676 7.085 1.00 0.00 N ATOM 0 H HIS A 49 -6.347 -2.191 3.532 1.00 0.00 H new ATOM 0 HA HIS A 49 -8.649 -3.731 3.607 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.723 -3.484 5.324 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -7.568 -2.069 5.918 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -8.945 -2.721 8.037 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -8.729 -5.727 5.097 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -10.242 -4.733 8.946 1.00 0.00 H new ATOM 835 N GLU A 50 -9.421 -0.586 3.828 1.00 0.00 N ATOM 836 CA GLU A 50 -10.578 0.309 3.803 1.00 0.00 C ATOM 837 C GLU A 50 -11.645 -0.149 2.787 1.00 0.00 C ATOM 838 O GLU A 50 -12.820 0.198 2.928 1.00 0.00 O ATOM 839 CB GLU A 50 -10.138 1.749 3.497 1.00 0.00 C ATOM 840 CG GLU A 50 -9.250 2.344 4.601 1.00 0.00 C ATOM 841 CD GLU A 50 -8.955 3.833 4.341 1.00 0.00 C ATOM 842 OE1 GLU A 50 -7.971 4.149 3.627 1.00 0.00 O ATOM 843 OE2 GLU A 50 -9.701 4.705 4.855 1.00 0.00 O ATOM 0 H GLU A 50 -8.536 -0.129 3.608 1.00 0.00 H new ATOM 0 HA GLU A 50 -11.032 0.275 4.793 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.596 1.766 2.552 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -11.021 2.375 3.369 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -9.743 2.232 5.567 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.313 1.790 4.655 1.00 0.00 H new ATOM 850 N GLU A 51 -11.257 -0.936 1.777 1.00 0.00 N ATOM 851 CA GLU A 51 -12.137 -1.482 0.744 1.00 0.00 C ATOM 852 C GLU A 51 -12.612 -2.907 1.097 1.00 0.00 C ATOM 853 O GLU A 51 -13.350 -3.520 0.324 1.00 0.00 O ATOM 854 CB GLU A 51 -11.393 -1.513 -0.597 1.00 0.00 C ATOM 855 CG GLU A 51 -11.074 -0.113 -1.135 1.00 0.00 C ATOM 856 CD GLU A 51 -10.191 -0.135 -2.401 1.00 0.00 C ATOM 857 OE1 GLU A 51 -9.635 -1.204 -2.755 1.00 0.00 O ATOM 858 OE2 GLU A 51 -10.066 0.926 -3.060 1.00 0.00 O ATOM 0 H GLU A 51 -10.285 -1.219 1.654 1.00 0.00 H new ATOM 0 HA GLU A 51 -13.015 -0.839 0.676 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.464 -2.072 -0.479 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -11.997 -2.049 -1.329 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -12.007 0.404 -1.359 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -10.570 0.462 -0.358 1.00 0.00 H new ATOM 865 N GLU A 52 -12.156 -3.471 2.222 1.00 0.00 N ATOM 866 CA GLU A 52 -12.198 -4.907 2.502 1.00 0.00 C ATOM 867 C GLU A 52 -12.705 -5.216 3.914 1.00 0.00 C ATOM 868 O GLU A 52 -13.127 -6.341 4.165 1.00 0.00 O ATOM 869 CB GLU A 52 -10.799 -5.500 2.317 1.00 0.00 C ATOM 870 CG GLU A 52 -10.337 -5.480 0.854 1.00 0.00 C ATOM 871 CD GLU A 52 -11.064 -6.456 -0.089 1.00 0.00 C ATOM 872 OE1 GLU A 52 -11.645 -7.468 0.369 1.00 0.00 O ATOM 873 OE2 GLU A 52 -11.021 -6.208 -1.318 1.00 0.00 O ATOM 0 H GLU A 52 -11.739 -2.928 2.978 1.00 0.00 H new ATOM 0 HA GLU A 52 -12.901 -5.358 1.801 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.088 -4.941 2.926 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.793 -6.527 2.682 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -10.462 -4.469 0.467 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.270 -5.703 0.826 1.00 0.00 H new ATOM 880 N GLU A 53 -12.725 -4.242 4.827 1.00 0.00 N ATOM 881 CA GLU A 53 -13.151 -4.418 6.216 1.00 0.00 C ATOM 882 C GLU A 53 -14.609 -4.906 6.354 1.00 0.00 C ATOM 883 O GLU A 53 -14.986 -5.426 7.406 1.00 0.00 O ATOM 884 CB GLU A 53 -12.912 -3.118 7.004 1.00 0.00 C ATOM 885 CG GLU A 53 -13.722 -1.916 6.493 1.00 0.00 C ATOM 886 CD GLU A 53 -13.512 -0.685 7.392 1.00 0.00 C ATOM 887 OE1 GLU A 53 -14.248 -0.534 8.400 1.00 0.00 O ATOM 888 OE2 GLU A 53 -12.625 0.154 7.094 1.00 0.00 O ATOM 0 H GLU A 53 -12.438 -3.286 4.615 1.00 0.00 H new ATOM 0 HA GLU A 53 -12.540 -5.214 6.642 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -13.159 -3.290 8.052 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -11.851 -2.871 6.963 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.423 -1.680 5.472 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.781 -2.173 6.464 1.00 0.00 H new ATOM 895 N PHE A 54 -15.412 -4.772 5.291 1.00 0.00 N ATOM 896 CA PHE A 54 -16.807 -5.208 5.214 1.00 0.00 C ATOM 897 C PHE A 54 -16.965 -6.457 4.325 1.00 0.00 C ATOM 898 O PHE A 54 -18.088 -6.908 4.099 1.00 0.00 O ATOM 899 CB PHE A 54 -17.663 -4.027 4.724 1.00 0.00 C ATOM 900 CG PHE A 54 -17.213 -3.414 3.405 1.00 0.00 C ATOM 901 CD1 PHE A 54 -17.609 -3.985 2.182 1.00 0.00 C ATOM 902 CD2 PHE A 54 -16.379 -2.276 3.408 1.00 0.00 C ATOM 903 CE1 PHE A 54 -17.176 -3.423 0.967 1.00 0.00 C ATOM 904 CE2 PHE A 54 -15.946 -1.713 2.192 1.00 0.00 C ATOM 905 CZ PHE A 54 -16.346 -2.288 0.973 1.00 0.00 C ATOM 0 H PHE A 54 -15.091 -4.338 4.426 1.00 0.00 H new ATOM 0 HA PHE A 54 -17.153 -5.507 6.203 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -18.694 -4.364 4.619 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -17.658 -3.251 5.489 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -18.247 -4.857 2.176 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -16.072 -1.836 4.345 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -17.481 -3.864 0.029 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -15.308 -0.842 2.196 1.00 0.00 H new ATOM 0 HZ PHE A 54 -16.015 -1.857 0.040 1.00 0.00 H new ATOM 915 N ALA A 55 -15.861 -7.018 3.816 1.00 0.00 N ATOM 916 CA ALA A 55 -15.835 -8.146 2.885 1.00 0.00 C ATOM 917 C ALA A 55 -14.712 -9.143 3.214 1.00 0.00 C ATOM 918 O ALA A 55 -14.337 -9.958 2.366 1.00 0.00 O ATOM 919 CB ALA A 55 -15.728 -7.607 1.448 1.00 0.00 C ATOM 0 H ALA A 55 -14.927 -6.683 4.052 1.00 0.00 H new ATOM 0 HA ALA A 55 -16.764 -8.708 2.984 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -15.708 -8.441 0.747 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -16.588 -6.973 1.232 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -14.812 -7.025 1.345 1.00 0.00 H new ATOM 925 N VAL A 56 -14.182 -9.104 4.439 1.00 0.00 N ATOM 926 CA VAL A 56 -13.189 -10.046 4.938 1.00 0.00 C ATOM 927 C VAL A 56 -13.939 -11.189 5.634 1.00 0.00 C ATOM 928 O VAL A 56 -14.032 -11.279 6.859 1.00 0.00 O ATOM 929 CB VAL A 56 -12.083 -9.316 5.730 1.00 0.00 C ATOM 930 CG1 VAL A 56 -12.575 -8.444 6.891 1.00 0.00 C ATOM 931 CG2 VAL A 56 -11.039 -10.329 6.215 1.00 0.00 C ATOM 0 H VAL A 56 -14.442 -8.396 5.126 1.00 0.00 H new ATOM 0 HA VAL A 56 -12.612 -10.522 4.145 1.00 0.00 H new ATOM 0 HB VAL A 56 -11.637 -8.610 5.029 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.722 -7.976 7.382 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -13.242 -7.672 6.509 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -13.112 -9.064 7.609 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -10.260 -9.810 6.773 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -11.519 -11.065 6.860 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -10.595 -10.833 5.357 1.00 0.00 H new ATOM 941 N GLU A 57 -14.562 -12.031 4.810 1.00 0.00 N ATOM 942 CA GLU A 57 -15.464 -13.090 5.247 1.00 0.00 C ATOM 943 C GLU A 57 -15.468 -14.237 4.218 1.00 0.00 C ATOM 944 O GLU A 57 -16.485 -14.900 3.994 1.00 0.00 O ATOM 945 CB GLU A 57 -16.850 -12.478 5.514 1.00 0.00 C ATOM 946 CG GLU A 57 -17.405 -11.644 4.344 1.00 0.00 C ATOM 947 CD GLU A 57 -18.940 -11.525 4.402 1.00 0.00 C ATOM 948 OE1 GLU A 57 -19.473 -10.831 5.303 1.00 0.00 O ATOM 949 OE2 GLU A 57 -19.632 -12.114 3.535 1.00 0.00 O ATOM 0 H GLU A 57 -14.449 -11.993 3.797 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.128 -13.537 6.183 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -17.552 -13.280 5.739 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -16.792 -11.847 6.401 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.962 -10.648 4.366 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -17.112 -12.103 3.400 1.00 0.00 H new ATOM 956 N GLY A 58 -14.325 -14.447 3.556 1.00 0.00 N ATOM 957 CA GLY A 58 -14.133 -15.446 2.516 1.00 0.00 C ATOM 958 C GLY A 58 -12.642 -15.700 2.287 1.00 0.00 C ATOM 959 O GLY A 58 -11.800 -15.110 2.978 1.00 0.00 O ATOM 0 H GLY A 58 -13.482 -13.903 3.741 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -14.627 -16.375 2.800 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -14.597 -15.109 1.589 1.00 0.00 H new ATOM 963 N PRO A 59 -12.308 -16.591 1.340 1.00 0.00 N ATOM 964 CA PRO A 59 -10.937 -17.008 1.075 1.00 0.00 C ATOM 965 C PRO A 59 -10.120 -15.900 0.395 1.00 0.00 C ATOM 966 O PRO A 59 -10.659 -14.902 -0.093 1.00 0.00 O ATOM 967 CB PRO A 59 -11.070 -18.251 0.192 1.00 0.00 C ATOM 968 CG PRO A 59 -12.369 -18.002 -0.564 1.00 0.00 C ATOM 969 CD PRO A 59 -13.235 -17.276 0.454 1.00 0.00 C ATOM 0 HA PRO A 59 -10.393 -17.223 1.995 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -10.223 -18.356 -0.486 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -11.118 -19.164 0.786 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -12.205 -17.398 -1.456 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -12.829 -18.935 -0.891 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -13.905 -16.569 -0.035 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -13.860 -17.977 1.007 1.00 0.00 H new ATOM 977 N LEU A 60 -8.808 -16.129 0.302 1.00 0.00 N ATOM 978 CA LEU A 60 -7.854 -15.316 -0.457 1.00 0.00 C ATOM 979 C LEU A 60 -6.940 -16.269 -1.228 1.00 0.00 C ATOM 980 O LEU A 60 -6.763 -17.433 -0.853 1.00 0.00 O ATOM 981 CB LEU A 60 -7.020 -14.406 0.469 1.00 0.00 C ATOM 982 CG LEU A 60 -7.757 -13.163 1.012 1.00 0.00 C ATOM 983 CD1 LEU A 60 -6.863 -12.423 2.013 1.00 0.00 C ATOM 984 CD2 LEU A 60 -8.151 -12.181 -0.100 1.00 0.00 C ATOM 0 H LEU A 60 -8.363 -16.917 0.772 1.00 0.00 H new ATOM 0 HA LEU A 60 -8.396 -14.662 -1.140 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -6.670 -14.999 1.314 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.136 -14.075 -0.075 1.00 0.00 H new ATOM 0 HG LEU A 60 -8.668 -13.522 1.491 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -7.389 -11.547 2.392 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.618 -13.087 2.842 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.945 -12.108 1.517 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -8.666 -11.325 0.336 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -7.255 -11.840 -0.618 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -8.812 -12.680 -0.809 1.00 0.00 H new ATOM 996 N TRP A 61 -6.377 -15.758 -2.318 1.00 0.00 N ATOM 997 CA TRP A 61 -5.767 -16.528 -3.394 1.00 0.00 C ATOM 998 C TRP A 61 -4.671 -15.666 -3.998 1.00 0.00 C ATOM 999 O TRP A 61 -4.838 -14.448 -4.059 1.00 0.00 O ATOM 1000 CB TRP A 61 -6.837 -16.737 -4.464 1.00 0.00 C ATOM 1001 CG TRP A 61 -8.017 -17.585 -4.111 1.00 0.00 C ATOM 1002 CD1 TRP A 61 -9.138 -17.159 -3.492 1.00 0.00 C ATOM 1003 CD2 TRP A 61 -8.228 -18.994 -4.396 1.00 0.00 C ATOM 1004 NE1 TRP A 61 -10.030 -18.209 -3.374 1.00 0.00 N ATOM 1005 CE2 TRP A 61 -9.512 -19.373 -3.906 1.00 0.00 C ATOM 1006 CE3 TRP A 61 -7.456 -19.986 -5.033 1.00 0.00 C ATOM 1007 CZ2 TRP A 61 -10.003 -20.682 -4.032 1.00 0.00 C ATOM 1008 CZ3 TRP A 61 -7.937 -21.303 -5.168 1.00 0.00 C ATOM 1009 CH2 TRP A 61 -9.206 -21.652 -4.667 1.00 0.00 C ATOM 0 H TRP A 61 -6.332 -14.752 -2.482 1.00 0.00 H new ATOM 0 HA TRP A 61 -5.372 -17.479 -3.037 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -7.207 -15.757 -4.765 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -6.356 -17.178 -5.337 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -9.312 -16.152 -3.142 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -10.954 -18.133 -2.948 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.481 -19.733 -5.423 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -10.978 -20.941 -3.647 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -7.329 -22.049 -5.658 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -9.567 -22.664 -4.770 1.00 0.00 H new ATOM 1020 N ILE A 62 -3.583 -16.268 -4.480 1.00 0.00 N ATOM 1021 CA ILE A 62 -2.385 -15.542 -4.890 1.00 0.00 C ATOM 1022 C ILE A 62 -1.951 -16.046 -6.274 1.00 0.00 C ATOM 1023 O ILE A 62 -1.969 -17.251 -6.537 1.00 0.00 O ATOM 1024 CB ILE A 62 -1.243 -15.749 -3.854 1.00 0.00 C ATOM 1025 CG1 ILE A 62 -1.636 -15.744 -2.354 1.00 0.00 C ATOM 1026 CG2 ILE A 62 -0.131 -14.715 -4.087 1.00 0.00 C ATOM 1027 CD1 ILE A 62 -2.189 -14.430 -1.786 1.00 0.00 C ATOM 0 H ILE A 62 -3.510 -17.279 -4.597 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.603 -14.475 -4.941 1.00 0.00 H new ATOM 0 HB ILE A 62 -0.910 -16.770 -4.043 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.382 -16.523 -2.196 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -0.757 -16.022 -1.772 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.665 -14.866 -3.358 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.271 -14.834 -5.093 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.539 -13.710 -3.976 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.424 -14.561 -0.730 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.443 -13.643 -1.897 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.093 -14.152 -2.327 1.00 0.00 H new ATOM 1039 N GLN A 63 -1.489 -15.130 -7.132 1.00 0.00 N ATOM 1040 CA GLN A 63 -0.787 -15.410 -8.381 1.00 0.00 C ATOM 1041 C GLN A 63 0.389 -14.431 -8.457 1.00 0.00 C ATOM 1042 O GLN A 63 0.253 -13.320 -8.973 1.00 0.00 O ATOM 1043 CB GLN A 63 -1.753 -15.288 -9.570 1.00 0.00 C ATOM 1044 CG GLN A 63 -1.073 -15.462 -10.942 1.00 0.00 C ATOM 1045 CD GLN A 63 -2.011 -15.153 -12.110 1.00 0.00 C ATOM 1046 OE1 GLN A 63 -3.158 -15.595 -12.154 1.00 0.00 O ATOM 1047 NE2 GLN A 63 -1.559 -14.370 -13.083 1.00 0.00 N ATOM 0 H GLN A 63 -1.601 -14.130 -6.964 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.404 -16.430 -8.417 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -2.539 -16.036 -9.466 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -2.236 -14.312 -9.535 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.203 -14.808 -10.997 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.709 -16.485 -11.035 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -0.607 -14.005 -13.043 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -2.164 -14.134 -13.870 1.00 0.00 H new ATOM 1056 N VAL A 64 1.535 -14.822 -7.903 1.00 0.00 N ATOM 1057 CA VAL A 64 2.811 -14.141 -8.134 1.00 0.00 C ATOM 1058 C VAL A 64 3.224 -14.338 -9.603 1.00 0.00 C ATOM 1059 O VAL A 64 2.888 -15.362 -10.206 1.00 0.00 O ATOM 1060 CB VAL A 64 3.873 -14.689 -7.151 1.00 0.00 C ATOM 1061 CG1 VAL A 64 4.295 -16.138 -7.442 1.00 0.00 C ATOM 1062 CG2 VAL A 64 5.141 -13.830 -7.128 1.00 0.00 C ATOM 0 H VAL A 64 1.607 -15.624 -7.277 1.00 0.00 H new ATOM 0 HA VAL A 64 2.717 -13.071 -7.951 1.00 0.00 H new ATOM 0 HB VAL A 64 3.375 -14.656 -6.182 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.041 -16.453 -6.713 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.425 -16.791 -7.376 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.719 -16.199 -8.444 1.00 0.00 H new ATOM 0 HG21 VAL A 64 5.856 -14.255 -6.423 1.00 0.00 H new ATOM 0 HG22 VAL A 64 5.583 -13.807 -8.124 1.00 0.00 H new ATOM 0 HG23 VAL A 64 4.888 -12.816 -6.820 1.00 0.00 H new ATOM 1072 N GLN A 65 4.024 -13.427 -10.164 1.00 0.00 N ATOM 1073 CA GLN A 65 4.926 -13.715 -11.259 1.00 0.00 C ATOM 1074 C GLN A 65 6.108 -12.755 -11.129 1.00 0.00 C ATOM 1075 O GLN A 65 5.957 -11.656 -10.598 1.00 0.00 O ATOM 1076 CB GLN A 65 4.231 -13.580 -12.622 1.00 0.00 C ATOM 1077 CG GLN A 65 3.341 -12.345 -12.804 1.00 0.00 C ATOM 1078 CD GLN A 65 1.920 -12.558 -12.293 1.00 0.00 C ATOM 1079 OE1 GLN A 65 1.099 -13.232 -12.911 1.00 0.00 O ATOM 1080 NE2 GLN A 65 1.594 -11.995 -11.148 1.00 0.00 N ATOM 0 H GLN A 65 4.056 -12.455 -9.857 1.00 0.00 H new ATOM 0 HA GLN A 65 5.267 -14.749 -11.207 1.00 0.00 H new ATOM 0 HB2 GLN A 65 4.996 -13.569 -13.398 1.00 0.00 H new ATOM 0 HB3 GLN A 65 3.622 -14.469 -12.787 1.00 0.00 H new ATOM 0 HG2 GLN A 65 3.788 -11.501 -12.279 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.306 -12.081 -13.861 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.280 -11.437 -10.640 1.00 0.00 H new ATOM 0 HE22 GLN A 65 0.655 -12.117 -10.769 1.00 0.00 H new ATOM 1089 N ALA A 66 7.272 -13.167 -11.622 1.00 0.00 N ATOM 1090 CA ALA A 66 8.514 -12.408 -11.499 1.00 0.00 C ATOM 1091 C ALA A 66 8.855 -11.757 -12.845 1.00 0.00 C ATOM 1092 O ALA A 66 8.608 -12.327 -13.912 1.00 0.00 O ATOM 1093 CB ALA A 66 9.641 -13.312 -10.983 1.00 0.00 C ATOM 0 H ALA A 66 7.382 -14.048 -12.124 1.00 0.00 H new ATOM 0 HA ALA A 66 8.389 -11.609 -10.768 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.561 -12.733 -10.896 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.369 -13.710 -10.005 1.00 0.00 H new ATOM 0 HB3 ALA A 66 9.795 -14.136 -11.680 1.00 0.00 H new ATOM 1099 N LEU A 67 9.401 -10.547 -12.766 1.00 0.00 N ATOM 1100 CA LEU A 67 9.675 -9.615 -13.852 1.00 0.00 C ATOM 1101 C LEU A 67 11.137 -9.157 -13.724 1.00 0.00 C ATOM 1102 O LEU A 67 11.878 -9.673 -12.885 1.00 0.00 O ATOM 1103 CB LEU A 67 8.675 -8.433 -13.780 1.00 0.00 C ATOM 1104 CG LEU A 67 7.211 -8.885 -13.963 1.00 0.00 C ATOM 1105 CD1 LEU A 67 6.516 -9.096 -12.632 1.00 0.00 C ATOM 1106 CD2 LEU A 67 6.373 -7.851 -14.705 1.00 0.00 C ATOM 0 H LEU A 67 9.686 -10.163 -11.865 1.00 0.00 H new ATOM 0 HA LEU A 67 9.544 -10.084 -14.827 1.00 0.00 H new ATOM 0 HB2 LEU A 67 8.779 -7.931 -12.818 1.00 0.00 H new ATOM 0 HB3 LEU A 67 8.925 -7.702 -14.549 1.00 0.00 H new ATOM 0 HG LEU A 67 7.277 -9.813 -14.531 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.488 -9.414 -12.805 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.042 -9.863 -12.064 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.518 -8.163 -12.069 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.351 -8.217 -14.808 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.369 -6.916 -14.145 1.00 0.00 H new ATOM 0 HD23 LEU A 67 6.798 -7.680 -15.694 1.00 0.00 H new ATOM 1118 N ASP A 68 11.581 -8.226 -14.576 1.00 0.00 N ATOM 1119 CA ASP A 68 13.014 -7.964 -14.760 1.00 0.00 C ATOM 1120 C ASP A 68 13.733 -7.521 -13.481 1.00 0.00 C ATOM 1121 O ASP A 68 14.867 -7.946 -13.255 1.00 0.00 O ATOM 1122 CB ASP A 68 13.253 -6.949 -15.884 1.00 0.00 C ATOM 1123 CG ASP A 68 14.754 -6.891 -16.232 1.00 0.00 C ATOM 1124 OD1 ASP A 68 15.272 -7.861 -16.832 1.00 0.00 O ATOM 1125 OD2 ASP A 68 15.425 -5.880 -15.919 1.00 0.00 O ATOM 0 H ASP A 68 10.971 -7.642 -15.148 1.00 0.00 H new ATOM 0 HA ASP A 68 13.450 -8.923 -15.041 1.00 0.00 H new ATOM 0 HB2 ASP A 68 12.677 -7.229 -16.766 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.904 -5.963 -15.575 1.00 0.00 H new ATOM 1130 N LYS A 69 13.083 -6.698 -12.636 1.00 0.00 N ATOM 1131 CA LYS A 69 13.639 -6.194 -11.364 1.00 0.00 C ATOM 1132 C LYS A 69 12.567 -6.118 -10.264 1.00 0.00 C ATOM 1133 O LYS A 69 12.635 -5.265 -9.373 1.00 0.00 O ATOM 1134 CB LYS A 69 14.332 -4.835 -11.549 1.00 0.00 C ATOM 1135 CG LYS A 69 15.520 -4.829 -12.517 1.00 0.00 C ATOM 1136 CD LYS A 69 16.732 -5.629 -12.005 1.00 0.00 C ATOM 1137 CE LYS A 69 17.884 -5.627 -13.020 1.00 0.00 C ATOM 1138 NZ LYS A 69 17.583 -6.434 -14.233 1.00 0.00 N ATOM 0 H LYS A 69 12.139 -6.358 -12.821 1.00 0.00 H new ATOM 0 HA LYS A 69 14.393 -6.912 -11.041 1.00 0.00 H new ATOM 0 HB2 LYS A 69 13.594 -4.115 -11.902 1.00 0.00 H new ATOM 0 HB3 LYS A 69 14.677 -4.487 -10.575 1.00 0.00 H new ATOM 0 HG2 LYS A 69 15.201 -5.241 -13.474 1.00 0.00 H new ATOM 0 HG3 LYS A 69 15.825 -3.799 -12.699 1.00 0.00 H new ATOM 0 HD2 LYS A 69 17.077 -5.204 -11.062 1.00 0.00 H new ATOM 0 HD3 LYS A 69 16.430 -6.656 -11.800 1.00 0.00 H new ATOM 0 HE2 LYS A 69 18.100 -4.600 -13.316 1.00 0.00 H new ATOM 0 HE3 LYS A 69 18.783 -6.017 -12.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 18.406 -6.426 -14.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 17.370 -7.413 -13.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 16.762 -6.028 -14.725 1.00 0.00 H new ATOM 1152 N GLY A 70 11.547 -6.963 -10.328 1.00 0.00 N ATOM 1153 CA GLY A 70 10.431 -6.929 -9.395 1.00 0.00 C ATOM 1154 C GLY A 70 9.470 -8.072 -9.660 1.00 0.00 C ATOM 1155 O GLY A 70 9.742 -8.936 -10.492 1.00 0.00 O ATOM 0 H GLY A 70 11.471 -7.696 -11.034 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.804 -6.992 -8.373 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.905 -5.978 -9.485 1.00 0.00 H new ATOM 1159 N LEU A 71 8.327 -8.071 -8.976 1.00 0.00 N ATOM 1160 CA LEU A 71 7.269 -9.059 -9.140 1.00 0.00 C ATOM 1161 C LEU A 71 5.924 -8.356 -9.189 1.00 0.00 C ATOM 1162 O LEU A 71 5.681 -7.439 -8.408 1.00 0.00 O ATOM 1163 CB LEU A 71 7.234 -10.066 -7.982 1.00 0.00 C ATOM 1164 CG LEU A 71 8.546 -10.851 -7.795 1.00 0.00 C ATOM 1165 CD1 LEU A 71 9.254 -10.354 -6.531 1.00 0.00 C ATOM 1166 CD2 LEU A 71 8.272 -12.351 -7.707 1.00 0.00 C ATOM 0 H LEU A 71 8.108 -7.363 -8.275 1.00 0.00 H new ATOM 0 HA LEU A 71 7.471 -9.597 -10.066 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.006 -9.534 -7.058 1.00 0.00 H new ATOM 0 HB3 LEU A 71 6.421 -10.772 -8.152 1.00 0.00 H new ATOM 0 HG LEU A 71 9.191 -10.683 -8.658 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.184 -10.906 -6.394 1.00 0.00 H new ATOM 0 HD12 LEU A 71 9.475 -9.291 -6.632 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.608 -10.510 -5.667 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.213 -12.886 -7.575 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.618 -12.552 -6.858 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.789 -12.687 -8.625 1.00 0.00 H new ATOM 1178 N GLU A 72 5.042 -8.815 -10.065 1.00 0.00 N ATOM 1179 CA GLU A 72 3.615 -8.534 -9.990 1.00 0.00 C ATOM 1180 C GLU A 72 3.008 -9.653 -9.169 1.00 0.00 C ATOM 1181 O GLU A 72 3.400 -10.813 -9.319 1.00 0.00 O ATOM 1182 CB GLU A 72 2.913 -8.528 -11.363 1.00 0.00 C ATOM 1183 CG GLU A 72 2.902 -7.177 -12.077 1.00 0.00 C ATOM 1184 CD GLU A 72 2.006 -7.229 -13.328 1.00 0.00 C ATOM 1185 OE1 GLU A 72 2.421 -7.815 -14.359 1.00 0.00 O ATOM 1186 OE2 GLU A 72 0.877 -6.683 -13.287 1.00 0.00 O ATOM 0 H GLU A 72 5.301 -9.401 -10.859 1.00 0.00 H new ATOM 0 HA GLU A 72 3.482 -7.540 -9.562 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.402 -9.259 -12.007 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.883 -8.860 -11.229 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.542 -6.404 -11.398 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.918 -6.903 -12.362 1.00 0.00 H new ATOM 1193 N ILE A 73 1.983 -9.343 -8.388 1.00 0.00 N ATOM 1194 CA ILE A 73 1.193 -10.324 -7.687 1.00 0.00 C ATOM 1195 C ILE A 73 -0.270 -9.936 -7.886 1.00 0.00 C ATOM 1196 O ILE A 73 -0.663 -8.819 -7.562 1.00 0.00 O ATOM 1197 CB ILE A 73 1.610 -10.402 -6.204 1.00 0.00 C ATOM 1198 CG1 ILE A 73 3.143 -10.548 -6.032 1.00 0.00 C ATOM 1199 CG2 ILE A 73 0.852 -11.569 -5.552 1.00 0.00 C ATOM 1200 CD1 ILE A 73 3.613 -11.058 -4.676 1.00 0.00 C ATOM 0 H ILE A 73 1.678 -8.383 -8.226 1.00 0.00 H new ATOM 0 HA ILE A 73 1.352 -11.329 -8.079 1.00 0.00 H new ATOM 0 HB ILE A 73 1.347 -9.468 -5.708 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.513 -11.225 -6.802 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.604 -9.577 -6.213 1.00 0.00 H new ATOM 0 HG21 ILE A 73 1.132 -11.643 -4.501 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.221 -11.395 -5.630 1.00 0.00 H new ATOM 0 HG23 ILE A 73 1.107 -12.498 -6.062 1.00 0.00 H new ATOM 0 HD11 ILE A 73 4.701 -11.121 -4.668 1.00 0.00 H new ATOM 0 HD12 ILE A 73 3.283 -10.372 -3.895 1.00 0.00 H new ATOM 0 HD13 ILE A 73 3.191 -12.046 -4.493 1.00 0.00 H new ATOM 1212 N ILE A 74 -1.070 -10.841 -8.440 1.00 0.00 N ATOM 1213 CA ILE A 74 -2.520 -10.723 -8.508 1.00 0.00 C ATOM 1214 C ILE A 74 -3.032 -11.478 -7.269 1.00 0.00 C ATOM 1215 O ILE A 74 -2.423 -12.465 -6.846 1.00 0.00 O ATOM 1216 CB ILE A 74 -3.024 -11.284 -9.868 1.00 0.00 C ATOM 1217 CG1 ILE A 74 -2.789 -10.369 -11.095 1.00 0.00 C ATOM 1218 CG2 ILE A 74 -4.531 -11.570 -9.826 1.00 0.00 C ATOM 1219 CD1 ILE A 74 -1.327 -10.082 -11.459 1.00 0.00 C ATOM 0 H ILE A 74 -0.717 -11.699 -8.865 1.00 0.00 H new ATOM 0 HA ILE A 74 -2.892 -9.699 -8.483 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.427 -12.187 -9.997 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.274 -10.824 -11.959 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.289 -9.418 -10.913 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -4.854 -11.961 -10.791 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -4.740 -12.304 -9.048 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.070 -10.648 -9.609 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.291 -9.432 -12.333 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.833 -9.591 -10.621 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.817 -11.019 -11.682 1.00 0.00 H new ATOM 1231 N VAL A 75 -4.137 -11.024 -6.679 1.00 0.00 N ATOM 1232 CA VAL A 75 -4.654 -11.515 -5.410 1.00 0.00 C ATOM 1233 C VAL A 75 -6.177 -11.590 -5.565 1.00 0.00 C ATOM 1234 O VAL A 75 -6.800 -10.568 -5.856 1.00 0.00 O ATOM 1235 CB VAL A 75 -4.215 -10.600 -4.231 1.00 0.00 C ATOM 1236 CG1 VAL A 75 -3.854 -11.428 -2.992 1.00 0.00 C ATOM 1237 CG2 VAL A 75 -2.996 -9.701 -4.510 1.00 0.00 C ATOM 0 H VAL A 75 -4.710 -10.284 -7.085 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.254 -12.500 -5.168 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.086 -9.963 -4.078 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.551 -10.761 -2.185 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.721 -12.009 -2.677 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -3.033 -12.103 -3.232 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -2.774 -9.105 -3.625 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -2.134 -10.322 -4.755 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -3.216 -9.039 -5.348 1.00 0.00 H new ATOM 1247 N THR A 76 -6.778 -12.778 -5.452 1.00 0.00 N ATOM 1248 CA THR A 76 -8.115 -13.050 -5.995 1.00 0.00 C ATOM 1249 C THR A 76 -9.066 -13.574 -4.909 1.00 0.00 C ATOM 1250 O THR A 76 -8.641 -13.845 -3.780 1.00 0.00 O ATOM 1251 CB THR A 76 -8.033 -13.994 -7.227 1.00 0.00 C ATOM 1252 OG1 THR A 76 -7.916 -15.355 -6.906 1.00 0.00 O ATOM 1253 CG2 THR A 76 -6.845 -13.716 -8.152 1.00 0.00 C ATOM 0 H THR A 76 -6.354 -13.578 -4.983 1.00 0.00 H new ATOM 0 HA THR A 76 -8.539 -12.109 -6.345 1.00 0.00 H new ATOM 0 HB THR A 76 -8.982 -13.781 -7.718 1.00 0.00 H new ATOM 0 HG1 THR A 76 -7.872 -15.883 -7.730 1.00 0.00 H new ATOM 0 HG21 THR A 76 -6.861 -14.418 -8.986 1.00 0.00 H new ATOM 0 HG22 THR A 76 -6.912 -12.697 -8.534 1.00 0.00 H new ATOM 0 HG23 THR A 76 -5.915 -13.835 -7.596 1.00 0.00 H new ATOM 1261 N LYS A 77 -10.352 -13.739 -5.255 1.00 0.00 N ATOM 1262 CA LYS A 77 -11.339 -14.495 -4.489 1.00 0.00 C ATOM 1263 C LYS A 77 -12.165 -15.369 -5.424 1.00 0.00 C ATOM 1264 O LYS A 77 -12.075 -15.255 -6.648 1.00 0.00 O ATOM 1265 CB LYS A 77 -12.267 -13.583 -3.681 1.00 0.00 C ATOM 1266 CG LYS A 77 -11.490 -12.534 -2.892 1.00 0.00 C ATOM 1267 CD LYS A 77 -12.438 -11.835 -1.928 1.00 0.00 C ATOM 1268 CE LYS A 77 -11.839 -10.534 -1.370 1.00 0.00 C ATOM 1269 NZ LYS A 77 -12.700 -9.911 -0.326 1.00 0.00 N ATOM 0 H LYS A 77 -10.741 -13.333 -6.106 1.00 0.00 H new ATOM 0 HA LYS A 77 -10.792 -15.119 -3.782 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -12.965 -13.086 -4.355 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -12.861 -14.186 -2.995 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -10.674 -13.004 -2.343 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -11.041 -11.809 -3.571 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -13.375 -11.612 -2.439 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -12.676 -12.507 -1.103 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -10.856 -10.742 -0.949 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.693 -9.826 -2.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -12.364 -8.947 -0.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -13.683 -9.872 -0.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -12.655 -10.478 0.545 1.00 0.00 H new ATOM 1283 N ALA A 78 -13.008 -16.200 -4.814 1.00 0.00 N ATOM 1284 CA ALA A 78 -14.101 -16.866 -5.510 1.00 0.00 C ATOM 1285 C ALA A 78 -15.125 -15.804 -5.932 1.00 0.00 C ATOM 1286 O ALA A 78 -15.306 -14.810 -5.224 1.00 0.00 O ATOM 1287 CB ALA A 78 -14.730 -17.912 -4.579 1.00 0.00 C ATOM 0 H ALA A 78 -12.950 -16.429 -3.822 1.00 0.00 H new ATOM 0 HA ALA A 78 -13.741 -17.381 -6.401 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -15.549 -18.413 -5.095 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -13.976 -18.646 -4.295 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.112 -17.420 -3.685 1.00 0.00 H new ATOM 1293 N GLN A 79 -15.816 -16.030 -7.053 1.00 0.00 N ATOM 1294 CA GLN A 79 -16.817 -15.116 -7.610 1.00 0.00 C ATOM 1295 C GLN A 79 -18.067 -15.914 -8.022 1.00 0.00 C ATOM 1296 O GLN A 79 -18.702 -15.606 -9.034 1.00 0.00 O ATOM 1297 CB GLN A 79 -16.201 -14.323 -8.784 1.00 0.00 C ATOM 1298 CG GLN A 79 -14.957 -13.507 -8.392 1.00 0.00 C ATOM 1299 CD GLN A 79 -14.607 -12.479 -9.468 1.00 0.00 C ATOM 1300 OE1 GLN A 79 -14.729 -11.272 -9.258 1.00 0.00 O ATOM 1301 NE2 GLN A 79 -14.193 -12.922 -10.646 1.00 0.00 N ATOM 0 H GLN A 79 -15.692 -16.874 -7.612 1.00 0.00 H new ATOM 0 HA GLN A 79 -17.129 -14.388 -6.861 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -15.933 -15.018 -9.580 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -16.954 -13.648 -9.190 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -15.136 -12.999 -7.445 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -14.112 -14.178 -8.239 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -14.096 -13.924 -10.808 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -13.972 -12.261 -11.390 1.00 0.00 H new ATOM 1310 N LEU A 80 -18.388 -16.978 -7.261 1.00 0.00 N ATOM 1311 CA LEU A 80 -19.354 -18.026 -7.620 1.00 0.00 C ATOM 1312 C LEU A 80 -19.075 -18.515 -9.051 1.00 0.00 C ATOM 1313 O LEU A 80 -19.966 -18.619 -9.893 1.00 0.00 O ATOM 1314 CB LEU A 80 -20.794 -17.534 -7.357 1.00 0.00 C ATOM 1315 CG LEU A 80 -21.901 -18.611 -7.438 1.00 0.00 C ATOM 1316 CD1 LEU A 80 -21.685 -19.766 -6.450 1.00 0.00 C ATOM 1317 CD2 LEU A 80 -23.261 -17.960 -7.155 1.00 0.00 C ATOM 0 H LEU A 80 -17.964 -17.134 -6.346 1.00 0.00 H new ATOM 0 HA LEU A 80 -19.239 -18.904 -6.985 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -20.827 -17.080 -6.366 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -21.026 -16.748 -8.076 1.00 0.00 H new ATOM 0 HG LEU A 80 -21.867 -19.032 -8.443 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -22.493 -20.490 -6.554 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -20.733 -20.253 -6.662 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -21.675 -19.377 -5.432 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -24.045 -18.715 -7.211 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -23.253 -17.519 -6.158 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -23.453 -17.182 -7.894 1.00 0.00 H new ATOM 1329 N SER A 81 -17.793 -18.736 -9.352 1.00 0.00 N ATOM 1330 CA SER A 81 -17.259 -18.669 -10.706 1.00 0.00 C ATOM 1331 C SER A 81 -17.732 -19.800 -11.627 1.00 0.00 C ATOM 1332 O SER A 81 -17.520 -19.722 -12.833 1.00 0.00 O ATOM 1333 CB SER A 81 -15.730 -18.595 -10.639 1.00 0.00 C ATOM 1334 OG SER A 81 -15.298 -17.841 -9.503 1.00 0.00 O ATOM 0 H SER A 81 -17.091 -18.969 -8.650 1.00 0.00 H new ATOM 0 HA SER A 81 -17.657 -17.764 -11.165 1.00 0.00 H new ATOM 0 HB2 SER A 81 -15.316 -19.602 -10.589 1.00 0.00 H new ATOM 0 HB3 SER A 81 -15.345 -18.137 -11.550 1.00 0.00 H new ATOM 0 HG SER A 81 -14.319 -17.811 -9.483 1.00 0.00 H new ATOM 1340 N LYS A 82 -18.423 -20.828 -11.118 1.00 0.00 N ATOM 1341 CA LYS A 82 -19.136 -21.768 -11.988 1.00 0.00 C ATOM 1342 C LYS A 82 -20.120 -21.012 -12.885 1.00 0.00 C ATOM 1343 O LYS A 82 -20.213 -21.312 -14.071 1.00 0.00 O ATOM 1344 CB LYS A 82 -19.857 -22.843 -11.160 1.00 0.00 C ATOM 1345 CG LYS A 82 -18.868 -23.776 -10.441 1.00 0.00 C ATOM 1346 CD LYS A 82 -19.606 -24.874 -9.662 1.00 0.00 C ATOM 1347 CE LYS A 82 -18.597 -25.803 -8.969 1.00 0.00 C ATOM 1348 NZ LYS A 82 -19.266 -26.895 -8.212 1.00 0.00 N ATOM 0 H LYS A 82 -18.503 -21.028 -10.121 1.00 0.00 H new ATOM 0 HA LYS A 82 -18.409 -22.274 -12.623 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -20.502 -22.362 -10.424 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -20.502 -23.432 -11.813 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -18.198 -24.232 -11.170 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -18.248 -23.196 -9.758 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -20.265 -24.423 -8.920 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -20.236 -25.450 -10.340 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -17.932 -26.236 -9.716 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -17.976 -25.220 -8.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -18.547 -27.496 -7.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -19.881 -26.484 -7.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -19.838 -27.469 -8.864 1.00 0.00 H new ATOM 1362 N ASP A 83 -20.773 -19.971 -12.365 1.00 0.00 N ATOM 1363 CA ASP A 83 -21.703 -19.110 -13.104 1.00 0.00 C ATOM 1364 C ASP A 83 -20.990 -18.165 -14.095 1.00 0.00 C ATOM 1365 O ASP A 83 -21.635 -17.331 -14.734 1.00 0.00 O ATOM 1366 CB ASP A 83 -22.535 -18.307 -12.093 1.00 0.00 C ATOM 1367 CG ASP A 83 -23.727 -17.581 -12.744 1.00 0.00 C ATOM 1368 OD1 ASP A 83 -24.568 -18.254 -13.391 1.00 0.00 O ATOM 1369 OD2 ASP A 83 -23.874 -16.350 -12.548 1.00 0.00 O ATOM 0 H ASP A 83 -20.667 -19.694 -11.389 1.00 0.00 H new ATOM 0 HA ASP A 83 -22.348 -19.748 -13.709 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -22.904 -18.979 -11.318 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -21.894 -17.575 -11.602 1.00 0.00 H new ATOM 1374 N LEU A 84 -19.665 -18.282 -14.235 1.00 0.00 N ATOM 1375 CA LEU A 84 -18.818 -17.460 -15.094 1.00 0.00 C ATOM 1376 C LEU A 84 -18.076 -18.355 -16.090 1.00 0.00 C ATOM 1377 O LEU A 84 -17.875 -17.961 -17.241 1.00 0.00 O ATOM 1378 CB LEU A 84 -17.798 -16.665 -14.253 1.00 0.00 C ATOM 1379 CG LEU A 84 -18.385 -15.641 -13.264 1.00 0.00 C ATOM 1380 CD1 LEU A 84 -17.253 -14.980 -12.472 1.00 0.00 C ATOM 1381 CD2 LEU A 84 -19.194 -14.555 -13.980 1.00 0.00 C ATOM 0 H LEU A 84 -19.132 -18.988 -13.726 1.00 0.00 H new ATOM 0 HA LEU A 84 -19.450 -16.754 -15.633 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -17.190 -17.374 -13.692 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -17.128 -16.139 -14.933 1.00 0.00 H new ATOM 0 HG LEU A 84 -19.055 -16.179 -12.594 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -17.672 -14.256 -11.773 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -16.703 -15.741 -11.919 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -16.577 -14.471 -13.159 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -19.590 -13.853 -13.246 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -18.549 -14.023 -14.680 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -20.019 -15.015 -14.524 1.00 0.00 H new ATOM 1393 N ASP A 85 -17.683 -19.562 -15.668 1.00 0.00 N ATOM 1394 CA ASP A 85 -17.192 -20.610 -16.556 1.00 0.00 C ATOM 1395 C ASP A 85 -18.315 -21.109 -17.470 1.00 0.00 C ATOM 1396 O ASP A 85 -18.103 -21.273 -18.676 1.00 0.00 O ATOM 1397 CB ASP A 85 -16.640 -21.779 -15.737 1.00 0.00 C ATOM 1398 CG ASP A 85 -16.194 -22.922 -16.665 1.00 0.00 C ATOM 1399 OD1 ASP A 85 -15.140 -22.776 -17.332 1.00 0.00 O ATOM 1400 OD2 ASP A 85 -16.876 -23.973 -16.710 1.00 0.00 O ATOM 0 H ASP A 85 -17.699 -19.837 -14.686 1.00 0.00 H new ATOM 0 HA ASP A 85 -16.395 -20.193 -17.171 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -15.797 -21.442 -15.134 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -17.402 -22.139 -15.046 1.00 0.00 H new ATOM 1405 N LYS A 86 -19.521 -21.313 -16.918 1.00 0.00 N ATOM 1406 CA LYS A 86 -20.710 -21.597 -17.719 1.00 0.00 C ATOM 1407 C LYS A 86 -21.221 -20.314 -18.362 1.00 0.00 C ATOM 1408 O LYS A 86 -20.941 -19.210 -17.888 1.00 0.00 O ATOM 1409 CB LYS A 86 -21.791 -22.283 -16.880 1.00 0.00 C ATOM 1410 CG LYS A 86 -21.363 -23.652 -16.335 1.00 0.00 C ATOM 1411 CD LYS A 86 -20.824 -24.646 -17.378 1.00 0.00 C ATOM 1412 CE LYS A 86 -20.508 -26.010 -16.743 1.00 0.00 C ATOM 1413 NZ LYS A 86 -21.723 -26.813 -16.431 1.00 0.00 N ATOM 0 H LYS A 86 -19.693 -21.285 -15.913 1.00 0.00 H new ATOM 0 HA LYS A 86 -20.441 -22.292 -18.515 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -22.058 -21.635 -16.045 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -22.688 -22.406 -17.487 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -20.595 -23.497 -15.577 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -22.218 -24.107 -15.834 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -21.558 -24.775 -18.173 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -19.923 -24.240 -17.838 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -19.870 -26.578 -17.420 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -19.940 -25.853 -15.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -21.441 -27.719 -16.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -22.323 -26.289 -15.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -22.255 -26.992 -17.307 1.00 0.00 H new ATOM 1427 N LEU A 87 -21.966 -20.470 -19.459 1.00 0.00 N ATOM 1428 CA LEU A 87 -22.326 -19.383 -20.357 1.00 0.00 C ATOM 1429 C LEU A 87 -23.682 -19.676 -21.005 1.00 0.00 C ATOM 1430 O LEU A 87 -24.081 -20.840 -21.103 1.00 0.00 O ATOM 1431 CB LEU A 87 -21.218 -19.247 -21.404 1.00 0.00 C ATOM 1432 CG LEU A 87 -21.217 -17.904 -22.155 1.00 0.00 C ATOM 1433 CD1 LEU A 87 -21.277 -16.674 -21.235 1.00 0.00 C ATOM 1434 CD2 LEU A 87 -19.904 -17.848 -22.921 1.00 0.00 C ATOM 0 H LEU A 87 -22.340 -21.374 -19.749 1.00 0.00 H new ATOM 0 HA LEU A 87 -22.421 -18.443 -19.814 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -20.253 -19.376 -20.914 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -21.318 -20.055 -22.129 1.00 0.00 H new ATOM 0 HG LEU A 87 -22.106 -17.865 -22.784 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -21.273 -15.767 -21.839 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -22.189 -16.709 -20.640 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -20.411 -16.673 -20.572 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -19.846 -16.912 -23.476 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -19.071 -17.906 -22.220 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -19.852 -18.686 -23.616 1.00 0.00 H new ATOM 1446 N VAL A 88 -24.370 -18.634 -21.474 1.00 0.00 N ATOM 1447 CA VAL A 88 -25.674 -18.717 -22.135 1.00 0.00 C ATOM 1448 C VAL A 88 -25.677 -17.759 -23.344 1.00 0.00 C ATOM 1449 O VAL A 88 -24.822 -16.867 -23.412 1.00 0.00 O ATOM 1450 CB VAL A 88 -26.813 -18.421 -21.130 1.00 0.00 C ATOM 1451 CG1 VAL A 88 -26.866 -19.440 -19.982 1.00 0.00 C ATOM 1452 CG2 VAL A 88 -26.735 -17.008 -20.544 1.00 0.00 C ATOM 0 H VAL A 88 -24.024 -17.677 -21.402 1.00 0.00 H new ATOM 0 HA VAL A 88 -25.851 -19.727 -22.504 1.00 0.00 H new ATOM 0 HB VAL A 88 -27.729 -18.504 -21.715 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -27.683 -19.185 -19.307 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -27.029 -20.438 -20.389 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -25.923 -19.421 -19.435 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -27.559 -16.857 -19.846 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -25.788 -16.883 -20.019 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -26.803 -16.276 -21.349 1.00 0.00 H new ATOM 1462 N PRO A 89 -26.602 -17.934 -24.306 1.00 0.00 N ATOM 1463 CA PRO A 89 -26.778 -17.039 -25.442 1.00 0.00 C ATOM 1464 C PRO A 89 -26.998 -15.576 -25.032 1.00 0.00 C ATOM 1465 O PRO A 89 -27.467 -15.279 -23.925 1.00 0.00 O ATOM 1466 CB PRO A 89 -27.994 -17.573 -26.209 1.00 0.00 C ATOM 1467 CG PRO A 89 -28.056 -19.048 -25.831 1.00 0.00 C ATOM 1468 CD PRO A 89 -27.506 -19.067 -24.410 1.00 0.00 C ATOM 0 HA PRO A 89 -25.873 -17.028 -26.049 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -28.906 -17.050 -25.923 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -27.875 -17.442 -27.285 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -29.075 -19.432 -25.873 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -27.456 -19.661 -26.503 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -28.312 -18.989 -23.680 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -26.983 -20.002 -24.208 1.00 0.00 H new ATOM 1476 N ARG A 90 -26.696 -14.663 -25.962 1.00 0.00 N ATOM 1477 CA ARG A 90 -26.980 -13.237 -25.829 1.00 0.00 C ATOM 1478 C ARG A 90 -28.490 -13.050 -25.690 1.00 0.00 C ATOM 1479 O ARG A 90 -28.915 -12.235 -24.839 1.00 0.00 O ATOM 1480 CB ARG A 90 -26.458 -12.447 -27.043 1.00 0.00 C ATOM 1481 CG ARG A 90 -24.925 -12.305 -27.134 1.00 0.00 C ATOM 1482 CD ARG A 90 -24.115 -13.584 -27.400 1.00 0.00 C ATOM 1483 NE ARG A 90 -24.559 -14.291 -28.615 1.00 0.00 N ATOM 1484 CZ ARG A 90 -24.140 -15.498 -29.023 1.00 0.00 C ATOM 1485 NH1 ARG A 90 -23.263 -16.198 -28.306 1.00 0.00 N ATOM 1486 NH2 ARG A 90 -24.614 -16.007 -30.156 1.00 0.00 N ATOM 1487 OXT ARG A 90 -29.252 -13.690 -26.455 1.00 0.00 O ATOM 0 H ARG A 90 -26.239 -14.903 -26.842 1.00 0.00 H new ATOM 0 HA ARG A 90 -26.470 -12.855 -24.945 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -26.815 -12.933 -27.951 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -26.897 -11.450 -27.021 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -24.698 -11.591 -27.926 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -24.570 -11.869 -26.200 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -23.060 -13.328 -27.497 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -24.203 -14.251 -26.543 1.00 0.00 H new ATOM 0 HE ARG A 90 -25.249 -13.819 -29.199 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -22.900 -15.818 -27.432 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -22.955 -17.115 -28.631 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -25.291 -15.480 -30.708 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -24.301 -16.924 -30.473 1.00 0.00 H new TER 1501 ARG A 90