USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=15 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= 2.09 K(o=4.5,f=-8.3!) USER MOD Set 1.2: A 10 THR OG1 : rot 180:sc= 0.459 USER MOD Set 1.3: A 79 GLN : amide:sc= 2 K(o=4.5,f=-7!) USER MOD Set 2.1: A 1 MET CE :methyl -179:sc= -0.458 (180deg=-0.458) USER MOD Set 2.2: A 15 MET CE :methyl -160:sc= -1.06 (180deg=-2.09!) USER MOD Single : A 1 MET N :NH3+ -161:sc= 1.01 (180deg=0.765) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 LYS NZ :NH3+ 169:sc= 1.25 (180deg=1.15) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -23:sc= 0.0456 USER MOD Single : A 17 TYR OH : rot 82:sc= 0.454 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 1.66 K(o=1.7,f=0) USER MOD Single : A 37 SER OG : rot -71:sc= 1.15 USER MOD Single : A 45 MET CE :methyl 153:sc= -0.011 (180deg=-0.99) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 65 GLN : amide:sc= -0.0119 X(o=-0.012,f=0) USER MOD Single : A 69 LYS NZ :NH3+ -174:sc= 1.2 (180deg=1.14) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.861 USER MOD Single : A 77 LYS NZ :NH3+ 174:sc= 1.91 (180deg=1.78) USER MOD Single : A 81 SER OG : rot 180:sc= 0 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 5.535 0.875 -4.210 1.00 0.00 N ATOM 2 CA MET A 1 4.802 -0.291 -4.776 1.00 0.00 C ATOM 3 C MET A 1 3.507 0.155 -5.470 1.00 0.00 C ATOM 4 O MET A 1 2.995 1.246 -5.216 1.00 0.00 O ATOM 5 CB MET A 1 4.592 -1.449 -3.768 1.00 0.00 C ATOM 6 CG MET A 1 3.474 -1.251 -2.731 1.00 0.00 C ATOM 7 SD MET A 1 3.464 -2.462 -1.379 1.00 0.00 S ATOM 8 CE MET A 1 3.066 -3.961 -2.302 1.00 0.00 C ATOM 0 H1 MET A 1 6.527 0.612 -4.040 1.00 0.00 H new ATOM 0 H2 MET A 1 5.497 1.668 -4.882 1.00 0.00 H new ATOM 0 H3 MET A 1 5.094 1.160 -3.313 1.00 0.00 H new ATOM 0 HA MET A 1 5.446 -0.723 -5.542 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.381 -2.359 -4.330 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.529 -1.614 -3.235 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.567 -0.252 -2.304 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.512 -1.291 -3.243 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.003 -4.805 -1.615 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.110 -3.833 -2.809 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.845 -4.152 -3.040 1.00 0.00 H new ATOM 20 N GLU A 2 2.988 -0.678 -6.373 1.00 0.00 N ATOM 21 CA GLU A 2 2.214 -0.249 -7.536 1.00 0.00 C ATOM 22 C GLU A 2 0.895 -1.035 -7.522 1.00 0.00 C ATOM 23 O GLU A 2 0.766 -2.043 -8.213 1.00 0.00 O ATOM 24 CB GLU A 2 3.114 -0.462 -8.786 1.00 0.00 C ATOM 25 CG GLU A 2 3.780 0.820 -9.305 1.00 0.00 C ATOM 26 CD GLU A 2 4.616 1.574 -8.247 1.00 0.00 C ATOM 27 OE1 GLU A 2 5.519 0.972 -7.615 1.00 0.00 O ATOM 28 OE2 GLU A 2 4.374 2.790 -8.045 1.00 0.00 O ATOM 0 H GLU A 2 3.097 -1.690 -6.314 1.00 0.00 H new ATOM 0 HA GLU A 2 1.935 0.805 -7.537 1.00 0.00 H new ATOM 0 HB2 GLU A 2 3.889 -1.188 -8.543 1.00 0.00 H new ATOM 0 HB3 GLU A 2 2.511 -0.895 -9.585 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.424 0.566 -10.147 1.00 0.00 H new ATOM 0 HG3 GLU A 2 3.008 1.489 -9.685 1.00 0.00 H new ATOM 35 N ILE A 3 -0.026 -0.658 -6.625 1.00 0.00 N ATOM 36 CA ILE A 3 -1.319 -1.327 -6.407 1.00 0.00 C ATOM 37 C ILE A 3 -2.246 -1.103 -7.622 1.00 0.00 C ATOM 38 O ILE A 3 -2.164 -0.064 -8.286 1.00 0.00 O ATOM 39 CB ILE A 3 -1.972 -0.821 -5.094 1.00 0.00 C ATOM 40 CG1 ILE A 3 -1.023 -0.822 -3.871 1.00 0.00 C ATOM 41 CG2 ILE A 3 -3.236 -1.632 -4.730 1.00 0.00 C ATOM 42 CD1 ILE A 3 -0.388 -2.157 -3.466 1.00 0.00 C ATOM 0 H ILE A 3 0.111 0.145 -6.012 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.154 -2.400 -6.305 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.235 0.214 -5.312 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.218 -0.114 -4.070 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.579 -0.441 -3.014 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.662 -1.245 -3.804 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -3.969 -1.543 -5.532 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.970 -2.681 -4.597 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.251 -2.007 -2.596 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.172 -2.873 -3.221 1.00 0.00 H new ATOM 0 HD13 ILE A 3 0.209 -2.541 -4.293 1.00 0.00 H new ATOM 54 N GLU A 4 -3.175 -2.033 -7.872 1.00 0.00 N ATOM 55 CA GLU A 4 -4.243 -1.944 -8.853 1.00 0.00 C ATOM 56 C GLU A 4 -5.534 -2.551 -8.277 1.00 0.00 C ATOM 57 O GLU A 4 -5.492 -3.493 -7.479 1.00 0.00 O ATOM 58 CB GLU A 4 -3.799 -2.723 -10.093 1.00 0.00 C ATOM 59 CG GLU A 4 -4.793 -2.643 -11.243 1.00 0.00 C ATOM 60 CD GLU A 4 -5.067 -1.206 -11.720 1.00 0.00 C ATOM 61 OE1 GLU A 4 -5.962 -0.549 -11.137 1.00 0.00 O ATOM 62 OE2 GLU A 4 -4.401 -0.738 -12.677 1.00 0.00 O ATOM 0 H GLU A 4 -3.195 -2.916 -7.361 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.444 -0.904 -9.111 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -2.835 -2.340 -10.428 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.650 -3.768 -9.823 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -4.415 -3.229 -12.081 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.733 -3.100 -10.933 1.00 0.00 H new ATOM 69 N ARG A 5 -6.689 -2.077 -8.751 1.00 0.00 N ATOM 70 CA ARG A 5 -8.027 -2.556 -8.403 1.00 0.00 C ATOM 71 C ARG A 5 -8.647 -3.073 -9.704 1.00 0.00 C ATOM 72 O ARG A 5 -9.210 -2.288 -10.468 1.00 0.00 O ATOM 73 CB ARG A 5 -8.828 -1.403 -7.760 1.00 0.00 C ATOM 74 CG ARG A 5 -10.247 -1.787 -7.286 1.00 0.00 C ATOM 75 CD ARG A 5 -10.308 -2.689 -6.044 1.00 0.00 C ATOM 76 NE ARG A 5 -9.675 -2.047 -4.872 1.00 0.00 N ATOM 77 CZ ARG A 5 -10.289 -1.289 -3.949 1.00 0.00 C ATOM 78 NH1 ARG A 5 -11.608 -1.159 -3.903 1.00 0.00 N ATOM 79 NH2 ARG A 5 -9.558 -0.640 -3.050 1.00 0.00 N ATOM 0 H ARG A 5 -6.716 -1.309 -9.422 1.00 0.00 H new ATOM 0 HA ARG A 5 -8.017 -3.362 -7.669 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -8.267 -1.020 -6.908 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -8.908 -0.589 -8.480 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -10.801 -0.872 -7.077 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -10.761 -2.291 -8.105 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -11.348 -2.922 -5.814 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -9.808 -3.634 -6.256 1.00 0.00 H new ATOM 0 HE ARG A 5 -8.673 -2.194 -4.753 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -12.192 -1.644 -4.584 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -12.038 -0.574 -3.187 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -8.541 -0.720 -3.065 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -10.013 -0.061 -2.344 1.00 0.00 H new ATOM 93 N ILE A 6 -8.482 -4.370 -9.995 1.00 0.00 N ATOM 94 CA ILE A 6 -9.031 -4.983 -11.206 1.00 0.00 C ATOM 95 C ILE A 6 -10.552 -4.826 -11.179 1.00 0.00 C ATOM 96 O ILE A 6 -11.164 -4.309 -12.115 1.00 0.00 O ATOM 97 CB ILE A 6 -8.629 -6.471 -11.254 1.00 0.00 C ATOM 98 CG1 ILE A 6 -7.106 -6.667 -11.120 1.00 0.00 C ATOM 99 CG2 ILE A 6 -9.175 -7.179 -12.505 1.00 0.00 C ATOM 100 CD1 ILE A 6 -6.262 -5.927 -12.162 1.00 0.00 C ATOM 0 H ILE A 6 -7.967 -5.019 -9.400 1.00 0.00 H new ATOM 0 HA ILE A 6 -8.637 -4.496 -12.098 1.00 0.00 H new ATOM 0 HB ILE A 6 -9.093 -6.941 -10.387 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -6.799 -6.339 -10.127 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -6.885 -7.732 -11.186 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -8.866 -8.224 -12.495 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -10.263 -7.122 -12.509 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.783 -6.693 -13.398 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.206 -6.128 -11.984 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -6.533 -6.270 -13.160 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -6.446 -4.855 -12.085 1.00 0.00 H new ATOM 112 N ASN A 7 -11.134 -5.275 -10.070 1.00 0.00 N ATOM 113 CA ASN A 7 -12.548 -5.184 -9.728 1.00 0.00 C ATOM 114 C ASN A 7 -12.635 -5.282 -8.196 1.00 0.00 C ATOM 115 O ASN A 7 -11.615 -5.166 -7.518 1.00 0.00 O ATOM 116 CB ASN A 7 -13.367 -6.256 -10.494 1.00 0.00 C ATOM 117 CG ASN A 7 -13.218 -7.699 -10.012 1.00 0.00 C ATOM 118 OD1 ASN A 7 -12.498 -7.986 -9.069 1.00 0.00 O ATOM 119 ND2 ASN A 7 -13.909 -8.632 -10.637 1.00 0.00 N ATOM 0 H ASN A 7 -10.595 -5.742 -9.341 1.00 0.00 H new ATOM 0 HA ASN A 7 -12.994 -4.239 -10.038 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -14.421 -5.985 -10.438 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -13.083 -6.216 -11.545 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -13.845 -9.604 -10.334 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.508 -8.382 -11.424 1.00 0.00 H new ATOM 126 N GLU A 8 -13.819 -5.491 -7.617 1.00 0.00 N ATOM 127 CA GLU A 8 -13.978 -5.458 -6.158 1.00 0.00 C ATOM 128 C GLU A 8 -13.540 -6.761 -5.451 1.00 0.00 C ATOM 129 O GLU A 8 -13.666 -6.880 -4.231 1.00 0.00 O ATOM 130 CB GLU A 8 -15.426 -5.076 -5.809 1.00 0.00 C ATOM 131 CG GLU A 8 -15.486 -4.177 -4.568 1.00 0.00 C ATOM 132 CD GLU A 8 -15.058 -2.729 -4.891 1.00 0.00 C ATOM 133 OE1 GLU A 8 -13.835 -2.447 -4.934 1.00 0.00 O ATOM 134 OE2 GLU A 8 -15.946 -1.868 -5.104 1.00 0.00 O ATOM 0 H GLU A 8 -14.679 -5.684 -8.131 1.00 0.00 H new ATOM 0 HA GLU A 8 -13.299 -4.696 -5.776 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -15.882 -4.561 -6.655 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -16.010 -5.980 -5.634 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -16.500 -4.176 -4.168 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -14.837 -4.584 -3.792 1.00 0.00 H new ATOM 141 N HIS A 9 -13.026 -7.739 -6.200 1.00 0.00 N ATOM 142 CA HIS A 9 -12.757 -9.103 -5.738 1.00 0.00 C ATOM 143 C HIS A 9 -11.335 -9.552 -6.082 1.00 0.00 C ATOM 144 O HIS A 9 -10.739 -10.343 -5.351 1.00 0.00 O ATOM 145 CB HIS A 9 -13.759 -10.034 -6.429 1.00 0.00 C ATOM 146 CG HIS A 9 -15.211 -9.708 -6.166 1.00 0.00 C ATOM 147 ND1 HIS A 9 -16.192 -9.540 -7.124 1.00 0.00 N ATOM 148 CD2 HIS A 9 -15.798 -9.475 -4.950 1.00 0.00 C ATOM 149 CE1 HIS A 9 -17.339 -9.230 -6.495 1.00 0.00 C ATOM 150 NE2 HIS A 9 -17.151 -9.178 -5.163 1.00 0.00 N ATOM 0 H HIS A 9 -12.777 -7.598 -7.179 1.00 0.00 H new ATOM 0 HA HIS A 9 -12.857 -9.136 -4.653 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -13.583 -10.001 -7.504 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -13.566 -11.057 -6.105 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -15.303 -9.514 -3.991 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -18.281 -9.048 -6.990 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -17.851 -8.965 -4.453 1.00 0.00 H new ATOM 158 N THR A 10 -10.777 -9.027 -7.163 1.00 0.00 N ATOM 159 CA THR A 10 -9.393 -9.189 -7.559 1.00 0.00 C ATOM 160 C THR A 10 -8.705 -7.841 -7.411 1.00 0.00 C ATOM 161 O THR A 10 -9.165 -6.816 -7.921 1.00 0.00 O ATOM 162 CB THR A 10 -9.309 -9.712 -9.003 1.00 0.00 C ATOM 163 OG1 THR A 10 -10.038 -10.926 -9.108 1.00 0.00 O ATOM 164 CG2 THR A 10 -7.858 -9.957 -9.433 1.00 0.00 C ATOM 0 H THR A 10 -11.306 -8.449 -7.817 1.00 0.00 H new ATOM 0 HA THR A 10 -8.893 -9.922 -6.926 1.00 0.00 H new ATOM 0 HB THR A 10 -9.734 -8.953 -9.660 1.00 0.00 H new ATOM 0 HG1 THR A 10 -9.987 -11.260 -10.028 1.00 0.00 H new ATOM 0 HG21 THR A 10 -7.840 -10.326 -10.459 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.298 -9.024 -9.373 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.403 -10.696 -8.774 1.00 0.00 H new ATOM 172 N VAL A 11 -7.536 -7.870 -6.792 1.00 0.00 N ATOM 173 CA VAL A 11 -6.572 -6.785 -6.796 1.00 0.00 C ATOM 174 C VAL A 11 -5.290 -7.384 -7.360 1.00 0.00 C ATOM 175 O VAL A 11 -5.089 -8.601 -7.327 1.00 0.00 O ATOM 176 CB VAL A 11 -6.410 -6.175 -5.380 1.00 0.00 C ATOM 177 CG1 VAL A 11 -7.694 -5.456 -4.952 1.00 0.00 C ATOM 178 CG2 VAL A 11 -6.045 -7.202 -4.297 1.00 0.00 C ATOM 0 H VAL A 11 -7.223 -8.678 -6.255 1.00 0.00 H new ATOM 0 HA VAL A 11 -6.890 -5.943 -7.411 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.578 -5.475 -5.463 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.560 -5.035 -3.956 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -7.915 -4.655 -5.658 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.521 -6.166 -4.938 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -5.949 -6.698 -3.335 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -6.827 -7.958 -4.234 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -5.099 -7.679 -4.552 1.00 0.00 H new ATOM 188 N LYS A 12 -4.395 -6.548 -7.861 1.00 0.00 N ATOM 189 CA LYS A 12 -3.022 -6.963 -8.047 1.00 0.00 C ATOM 190 C LYS A 12 -2.135 -5.813 -7.637 1.00 0.00 C ATOM 191 O LYS A 12 -2.618 -4.711 -7.389 1.00 0.00 O ATOM 192 CB LYS A 12 -2.777 -7.487 -9.472 1.00 0.00 C ATOM 193 CG LYS A 12 -2.583 -6.437 -10.560 1.00 0.00 C ATOM 194 CD LYS A 12 -2.323 -7.143 -11.901 1.00 0.00 C ATOM 195 CE LYS A 12 -1.996 -6.085 -12.951 1.00 0.00 C ATOM 196 NZ LYS A 12 -1.390 -6.664 -14.177 1.00 0.00 N ATOM 0 H LYS A 12 -4.595 -5.588 -8.142 1.00 0.00 H new ATOM 0 HA LYS A 12 -2.779 -7.816 -7.413 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -1.894 -8.126 -9.453 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.621 -8.117 -9.753 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -3.467 -5.804 -10.634 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -1.745 -5.786 -10.309 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -1.497 -7.848 -11.804 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.199 -7.718 -12.202 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.907 -5.550 -13.219 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -1.311 -5.353 -12.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.359 -5.941 -14.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -0.424 -6.987 -13.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -1.962 -7.470 -14.499 1.00 0.00 H new ATOM 210 N PHE A 13 -0.843 -6.052 -7.585 1.00 0.00 N ATOM 211 CA PHE A 13 0.137 -5.009 -7.424 1.00 0.00 C ATOM 212 C PHE A 13 1.414 -5.449 -8.105 1.00 0.00 C ATOM 213 O PHE A 13 1.576 -6.617 -8.463 1.00 0.00 O ATOM 214 CB PHE A 13 0.353 -4.711 -5.935 1.00 0.00 C ATOM 215 CG PHE A 13 0.774 -5.874 -5.078 1.00 0.00 C ATOM 216 CD1 PHE A 13 -0.197 -6.770 -4.604 1.00 0.00 C ATOM 217 CD2 PHE A 13 2.115 -6.010 -4.688 1.00 0.00 C ATOM 218 CE1 PHE A 13 0.168 -7.792 -3.719 1.00 0.00 C ATOM 219 CE2 PHE A 13 2.472 -7.007 -3.767 1.00 0.00 C ATOM 220 CZ PHE A 13 1.492 -7.888 -3.270 1.00 0.00 C ATOM 0 H PHE A 13 -0.442 -6.987 -7.654 1.00 0.00 H new ATOM 0 HA PHE A 13 -0.207 -4.083 -7.885 1.00 0.00 H new ATOM 0 HB2 PHE A 13 1.109 -3.930 -5.848 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -0.573 -4.304 -5.529 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -1.225 -6.671 -4.922 1.00 0.00 H new ATOM 0 HD2 PHE A 13 2.868 -5.351 -5.094 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -0.570 -8.505 -3.383 1.00 0.00 H new ATOM 0 HE2 PHE A 13 3.497 -7.099 -3.440 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.761 -8.639 -2.542 1.00 0.00 H new ATOM 230 N TYR A 14 2.346 -4.519 -8.230 1.00 0.00 N ATOM 231 CA TYR A 14 3.705 -4.790 -8.614 1.00 0.00 C ATOM 232 C TYR A 14 4.595 -4.253 -7.492 1.00 0.00 C ATOM 233 O TYR A 14 4.265 -3.245 -6.855 1.00 0.00 O ATOM 234 CB TYR A 14 3.946 -4.160 -9.985 1.00 0.00 C ATOM 235 CG TYR A 14 5.399 -4.167 -10.366 1.00 0.00 C ATOM 236 CD1 TYR A 14 5.975 -5.345 -10.865 1.00 0.00 C ATOM 237 CD2 TYR A 14 6.187 -3.031 -10.122 1.00 0.00 C ATOM 238 CE1 TYR A 14 7.343 -5.396 -11.155 1.00 0.00 C ATOM 239 CE2 TYR A 14 7.569 -3.078 -10.386 1.00 0.00 C ATOM 240 CZ TYR A 14 8.149 -4.252 -10.931 1.00 0.00 C ATOM 241 OH TYR A 14 9.477 -4.264 -11.243 1.00 0.00 O ATOM 0 H TYR A 14 2.164 -3.530 -8.061 1.00 0.00 H new ATOM 0 HA TYR A 14 3.934 -5.850 -8.729 1.00 0.00 H new ATOM 0 HB2 TYR A 14 3.372 -4.701 -10.737 1.00 0.00 H new ATOM 0 HB3 TYR A 14 3.578 -3.134 -9.981 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.359 -6.217 -11.026 1.00 0.00 H new ATOM 0 HD2 TYR A 14 5.737 -2.129 -9.735 1.00 0.00 H new ATOM 0 HE1 TYR A 14 7.782 -6.302 -11.547 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.188 -2.219 -10.173 1.00 0.00 H new ATOM 0 HH TYR A 14 9.872 -3.395 -11.024 1.00 0.00 H new ATOM 251 N MET A 15 5.691 -4.952 -7.218 1.00 0.00 N ATOM 252 CA MET A 15 6.594 -4.700 -6.113 1.00 0.00 C ATOM 253 C MET A 15 8.007 -4.845 -6.659 1.00 0.00 C ATOM 254 O MET A 15 8.392 -5.934 -7.081 1.00 0.00 O ATOM 255 CB MET A 15 6.322 -5.751 -5.031 1.00 0.00 C ATOM 256 CG MET A 15 7.018 -5.466 -3.720 1.00 0.00 C ATOM 257 SD MET A 15 6.543 -6.660 -2.449 1.00 0.00 S ATOM 258 CE MET A 15 6.578 -5.612 -0.974 1.00 0.00 C ATOM 0 H MET A 15 5.983 -5.745 -7.789 1.00 0.00 H new ATOM 0 HA MET A 15 6.461 -3.708 -5.681 1.00 0.00 H new ATOM 0 HB2 MET A 15 5.248 -5.811 -4.857 1.00 0.00 H new ATOM 0 HB3 MET A 15 6.640 -6.727 -5.397 1.00 0.00 H new ATOM 0 HG2 MET A 15 8.098 -5.497 -3.865 1.00 0.00 H new ATOM 0 HG3 MET A 15 6.770 -4.459 -3.386 1.00 0.00 H new ATOM 0 HE1 MET A 15 6.662 -6.237 -0.085 1.00 0.00 H new ATOM 0 HE2 MET A 15 7.434 -4.939 -1.026 1.00 0.00 H new ATOM 0 HE3 MET A 15 5.660 -5.027 -0.921 1.00 0.00 H new ATOM 268 N SER A 16 8.777 -3.768 -6.681 1.00 0.00 N ATOM 269 CA SER A 16 10.161 -3.838 -7.128 1.00 0.00 C ATOM 270 C SER A 16 10.988 -4.537 -6.044 1.00 0.00 C ATOM 271 O SER A 16 10.623 -4.501 -4.867 1.00 0.00 O ATOM 272 CB SER A 16 10.696 -2.428 -7.407 1.00 0.00 C ATOM 273 OG SER A 16 9.775 -1.658 -8.172 1.00 0.00 O ATOM 0 H SER A 16 8.469 -2.838 -6.396 1.00 0.00 H new ATOM 0 HA SER A 16 10.230 -4.407 -8.055 1.00 0.00 H new ATOM 0 HB2 SER A 16 10.898 -1.922 -6.463 1.00 0.00 H new ATOM 0 HB3 SER A 16 11.644 -2.497 -7.941 1.00 0.00 H new ATOM 0 HG SER A 16 9.178 -2.258 -8.666 1.00 0.00 H new ATOM 279 N TYR A 17 12.142 -5.100 -6.399 1.00 0.00 N ATOM 280 CA TYR A 17 13.087 -5.645 -5.417 1.00 0.00 C ATOM 281 C TYR A 17 13.440 -4.627 -4.339 1.00 0.00 C ATOM 282 O TYR A 17 13.504 -4.975 -3.164 1.00 0.00 O ATOM 283 CB TYR A 17 14.369 -6.125 -6.100 1.00 0.00 C ATOM 284 CG TYR A 17 14.219 -7.255 -7.098 1.00 0.00 C ATOM 285 CD1 TYR A 17 13.191 -8.214 -6.989 1.00 0.00 C ATOM 286 CD2 TYR A 17 15.164 -7.361 -8.130 1.00 0.00 C ATOM 287 CE1 TYR A 17 13.120 -9.279 -7.899 1.00 0.00 C ATOM 288 CE2 TYR A 17 15.103 -8.425 -9.039 1.00 0.00 C ATOM 289 CZ TYR A 17 14.087 -9.399 -8.925 1.00 0.00 C ATOM 290 OH TYR A 17 14.096 -10.473 -9.762 1.00 0.00 O ATOM 0 H TYR A 17 12.450 -5.192 -7.367 1.00 0.00 H new ATOM 0 HA TYR A 17 12.591 -6.491 -4.941 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.822 -5.276 -6.611 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.069 -6.442 -5.327 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.456 -8.128 -6.202 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.942 -6.618 -8.224 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.327 -10.008 -7.817 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.835 -8.501 -9.829 1.00 0.00 H new ATOM 0 HH TYR A 17 13.441 -10.336 -10.477 1.00 0.00 H new ATOM 300 N GLY A 18 13.604 -3.355 -4.706 1.00 0.00 N ATOM 301 CA GLY A 18 13.957 -2.318 -3.751 1.00 0.00 C ATOM 302 C GLY A 18 12.846 -2.033 -2.738 1.00 0.00 C ATOM 303 O GLY A 18 13.140 -1.629 -1.619 1.00 0.00 O ATOM 0 H GLY A 18 13.496 -3.023 -5.664 1.00 0.00 H new ATOM 0 HA2 GLY A 18 14.860 -2.616 -3.217 1.00 0.00 H new ATOM 0 HA3 GLY A 18 14.193 -1.401 -4.290 1.00 0.00 H new ATOM 307 N ASP A 19 11.578 -2.294 -3.076 1.00 0.00 N ATOM 308 CA ASP A 19 10.465 -2.176 -2.123 1.00 0.00 C ATOM 309 C ASP A 19 10.580 -3.258 -1.046 1.00 0.00 C ATOM 310 O ASP A 19 10.223 -3.045 0.115 1.00 0.00 O ATOM 311 CB ASP A 19 9.108 -2.304 -2.849 1.00 0.00 C ATOM 312 CG ASP A 19 8.328 -0.988 -2.932 1.00 0.00 C ATOM 313 OD1 ASP A 19 8.048 -0.371 -1.881 1.00 0.00 O ATOM 314 OD2 ASP A 19 7.911 -0.610 -4.048 1.00 0.00 O ATOM 0 H ASP A 19 11.294 -2.591 -4.010 1.00 0.00 H new ATOM 0 HA ASP A 19 10.517 -1.193 -1.654 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.280 -2.679 -3.858 1.00 0.00 H new ATOM 0 HB3 ASP A 19 8.498 -3.046 -2.333 1.00 0.00 H new ATOM 319 N ILE A 20 11.072 -4.434 -1.429 1.00 0.00 N ATOM 320 CA ILE A 20 11.239 -5.590 -0.558 1.00 0.00 C ATOM 321 C ILE A 20 12.484 -5.350 0.313 1.00 0.00 C ATOM 322 O ILE A 20 12.423 -5.535 1.530 1.00 0.00 O ATOM 323 CB ILE A 20 11.272 -6.848 -1.470 1.00 0.00 C ATOM 324 CG1 ILE A 20 9.860 -7.049 -2.069 1.00 0.00 C ATOM 325 CG2 ILE A 20 11.713 -8.129 -0.760 1.00 0.00 C ATOM 326 CD1 ILE A 20 9.814 -7.791 -3.408 1.00 0.00 C ATOM 0 H ILE A 20 11.375 -4.612 -2.387 1.00 0.00 H new ATOM 0 HA ILE A 20 10.423 -5.750 0.147 1.00 0.00 H new ATOM 0 HB ILE A 20 12.021 -6.665 -2.240 1.00 0.00 H new ATOM 0 HG12 ILE A 20 9.253 -7.597 -1.348 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.396 -6.071 -2.199 1.00 0.00 H new ATOM 0 HG21 ILE A 20 11.708 -8.958 -1.468 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.720 -7.997 -0.363 1.00 0.00 H new ATOM 0 HG23 ILE A 20 11.026 -8.347 0.058 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.780 -7.879 -3.740 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.388 -7.237 -4.151 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.242 -8.786 -3.287 1.00 0.00 H new ATOM 338 N GLU A 21 13.565 -4.845 -0.288 1.00 0.00 N ATOM 339 CA GLU A 21 14.797 -4.442 0.395 1.00 0.00 C ATOM 340 C GLU A 21 14.522 -3.378 1.462 1.00 0.00 C ATOM 341 O GLU A 21 15.107 -3.416 2.544 1.00 0.00 O ATOM 342 CB GLU A 21 15.783 -3.839 -0.608 1.00 0.00 C ATOM 343 CG GLU A 21 16.347 -4.860 -1.591 1.00 0.00 C ATOM 344 CD GLU A 21 17.691 -5.453 -1.127 1.00 0.00 C ATOM 345 OE1 GLU A 21 17.768 -6.030 -0.015 1.00 0.00 O ATOM 346 OE2 GLU A 21 18.690 -5.348 -1.880 1.00 0.00 O ATOM 0 H GLU A 21 13.608 -4.701 -1.297 1.00 0.00 H new ATOM 0 HA GLU A 21 15.210 -5.336 0.862 1.00 0.00 H new ATOM 0 HB2 GLU A 21 15.284 -3.046 -1.165 1.00 0.00 H new ATOM 0 HB3 GLU A 21 16.606 -3.376 -0.064 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.626 -5.666 -1.725 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.480 -4.387 -2.564 1.00 0.00 H new ATOM 353 N ASP A 22 13.647 -2.417 1.155 1.00 0.00 N ATOM 354 CA ASP A 22 13.316 -1.305 2.051 1.00 0.00 C ATOM 355 C ASP A 22 12.684 -1.805 3.344 1.00 0.00 C ATOM 356 O ASP A 22 13.042 -1.381 4.446 1.00 0.00 O ATOM 357 CB ASP A 22 12.319 -0.359 1.387 1.00 0.00 C ATOM 358 CG ASP A 22 12.008 0.834 2.306 1.00 0.00 C ATOM 359 OD1 ASP A 22 12.885 1.715 2.474 1.00 0.00 O ATOM 360 OD2 ASP A 22 10.879 0.906 2.849 1.00 0.00 O ATOM 0 H ASP A 22 13.143 -2.388 0.269 1.00 0.00 H new ATOM 0 HA ASP A 22 14.250 -0.787 2.270 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.725 0.000 0.441 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.399 -0.896 1.156 1.00 0.00 H new ATOM 365 N ARG A 23 11.770 -2.762 3.186 1.00 0.00 N ATOM 366 CA ARG A 23 11.127 -3.473 4.285 1.00 0.00 C ATOM 367 C ARG A 23 12.104 -4.423 4.986 1.00 0.00 C ATOM 368 O ARG A 23 11.761 -4.989 6.025 1.00 0.00 O ATOM 369 CB ARG A 23 9.890 -4.206 3.745 1.00 0.00 C ATOM 370 CG ARG A 23 8.805 -3.238 3.265 1.00 0.00 C ATOM 371 CD ARG A 23 7.781 -3.937 2.363 1.00 0.00 C ATOM 372 NE ARG A 23 6.673 -3.028 2.048 1.00 0.00 N ATOM 373 CZ ARG A 23 6.684 -2.018 1.174 1.00 0.00 C ATOM 374 NH1 ARG A 23 7.757 -1.768 0.434 1.00 0.00 N ATOM 375 NH2 ARG A 23 5.606 -1.264 1.048 1.00 0.00 N ATOM 0 H ARG A 23 11.450 -3.070 2.268 1.00 0.00 H new ATOM 0 HA ARG A 23 10.807 -2.759 5.044 1.00 0.00 H new ATOM 0 HB2 ARG A 23 10.186 -4.855 2.920 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.482 -4.848 4.525 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.296 -2.806 4.126 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.267 -2.414 2.721 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.263 -4.266 1.442 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.398 -4.829 2.859 1.00 0.00 H new ATOM 0 HE ARG A 23 5.800 -3.184 2.551 1.00 0.00 H new ATOM 0 HH11 ARG A 23 8.589 -2.351 0.528 1.00 0.00 H new ATOM 0 HH12 ARG A 23 7.750 -0.993 -0.229 1.00 0.00 H new ATOM 0 HH21 ARG A 23 4.780 -1.457 1.614 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.600 -0.489 0.385 1.00 0.00 H new ATOM 389 N GLY A 24 13.311 -4.601 4.443 1.00 0.00 N ATOM 390 CA GLY A 24 14.346 -5.459 4.992 1.00 0.00 C ATOM 391 C GLY A 24 14.097 -6.942 4.720 1.00 0.00 C ATOM 392 O GLY A 24 14.756 -7.790 5.330 1.00 0.00 O ATOM 0 H GLY A 24 13.597 -4.134 3.582 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.309 -5.174 4.569 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.411 -5.298 6.068 1.00 0.00 H new ATOM 396 N PHE A 25 13.161 -7.263 3.822 1.00 0.00 N ATOM 397 CA PHE A 25 13.011 -8.601 3.259 1.00 0.00 C ATOM 398 C PHE A 25 14.024 -8.746 2.107 1.00 0.00 C ATOM 399 O PHE A 25 14.833 -7.847 1.854 1.00 0.00 O ATOM 400 CB PHE A 25 11.545 -8.833 2.826 1.00 0.00 C ATOM 401 CG PHE A 25 10.543 -8.828 3.972 1.00 0.00 C ATOM 402 CD1 PHE A 25 10.211 -7.604 4.574 1.00 0.00 C ATOM 403 CD2 PHE A 25 9.955 -10.015 4.460 1.00 0.00 C ATOM 404 CE1 PHE A 25 9.373 -7.553 5.698 1.00 0.00 C ATOM 405 CE2 PHE A 25 9.120 -9.965 5.592 1.00 0.00 C ATOM 406 CZ PHE A 25 8.834 -8.739 6.219 1.00 0.00 C ATOM 0 H PHE A 25 12.481 -6.592 3.464 1.00 0.00 H new ATOM 0 HA PHE A 25 13.227 -9.374 3.997 1.00 0.00 H new ATOM 0 HB2 PHE A 25 11.264 -8.061 2.110 1.00 0.00 H new ATOM 0 HB3 PHE A 25 11.479 -9.789 2.306 1.00 0.00 H new ATOM 0 HD1 PHE A 25 10.607 -6.686 4.165 1.00 0.00 H new ATOM 0 HD2 PHE A 25 10.145 -10.957 3.967 1.00 0.00 H new ATOM 0 HE1 PHE A 25 9.144 -6.604 6.160 1.00 0.00 H new ATOM 0 HE2 PHE A 25 8.695 -10.877 5.983 1.00 0.00 H new ATOM 0 HZ PHE A 25 8.204 -8.711 7.096 1.00 0.00 H new ATOM 416 N ASP A 26 13.987 -9.867 1.382 1.00 0.00 N ATOM 417 CA ASP A 26 14.846 -10.117 0.225 1.00 0.00 C ATOM 418 C ASP A 26 14.000 -10.808 -0.826 1.00 0.00 C ATOM 419 O ASP A 26 13.118 -11.586 -0.453 1.00 0.00 O ATOM 420 CB ASP A 26 15.997 -11.053 0.597 1.00 0.00 C ATOM 421 CG ASP A 26 17.138 -10.956 -0.424 1.00 0.00 C ATOM 422 OD1 ASP A 26 16.999 -11.562 -1.512 1.00 0.00 O ATOM 423 OD2 ASP A 26 18.160 -10.290 -0.139 1.00 0.00 O ATOM 0 H ASP A 26 13.350 -10.637 1.586 1.00 0.00 H new ATOM 0 HA ASP A 26 15.259 -9.174 -0.133 1.00 0.00 H new ATOM 0 HB2 ASP A 26 16.370 -10.800 1.589 1.00 0.00 H new ATOM 0 HB3 ASP A 26 15.634 -12.080 0.645 1.00 0.00 H new ATOM 428 N ARG A 27 14.253 -10.583 -2.119 1.00 0.00 N ATOM 429 CA ARG A 27 13.515 -11.282 -3.169 1.00 0.00 C ATOM 430 C ARG A 27 13.599 -12.799 -2.983 1.00 0.00 C ATOM 431 O ARG A 27 12.601 -13.480 -3.202 1.00 0.00 O ATOM 432 CB ARG A 27 13.980 -10.840 -4.573 1.00 0.00 C ATOM 433 CG ARG A 27 15.422 -11.237 -4.943 1.00 0.00 C ATOM 434 CD ARG A 27 15.792 -10.811 -6.366 1.00 0.00 C ATOM 435 NE ARG A 27 17.180 -11.197 -6.689 1.00 0.00 N ATOM 436 CZ ARG A 27 17.682 -11.460 -7.904 1.00 0.00 C ATOM 437 NH1 ARG A 27 16.928 -11.377 -9.000 1.00 0.00 N ATOM 438 NH2 ARG A 27 18.958 -11.817 -8.018 1.00 0.00 N ATOM 0 H ARG A 27 14.957 -9.928 -2.459 1.00 0.00 H new ATOM 0 HA ARG A 27 12.464 -11.006 -3.084 1.00 0.00 H new ATOM 0 HB2 ARG A 27 13.302 -11.265 -5.313 1.00 0.00 H new ATOM 0 HB3 ARG A 27 13.889 -9.756 -4.643 1.00 0.00 H new ATOM 0 HG2 ARG A 27 16.115 -10.780 -4.237 1.00 0.00 H new ATOM 0 HG3 ARG A 27 15.536 -12.317 -4.848 1.00 0.00 H new ATOM 0 HD2 ARG A 27 15.107 -11.273 -7.077 1.00 0.00 H new ATOM 0 HD3 ARG A 27 15.678 -9.732 -6.468 1.00 0.00 H new ATOM 0 HE ARG A 27 17.826 -11.272 -5.903 1.00 0.00 H new ATOM 0 HH11 ARG A 27 15.947 -11.109 -8.925 1.00 0.00 H new ATOM 0 HH12 ARG A 27 17.332 -11.582 -9.914 1.00 0.00 H new ATOM 0 HH21 ARG A 27 19.544 -11.888 -7.186 1.00 0.00 H new ATOM 0 HH22 ARG A 27 19.351 -12.020 -8.937 1.00 0.00 H new ATOM 452 N GLU A 28 14.752 -13.325 -2.559 1.00 0.00 N ATOM 453 CA GLU A 28 14.907 -14.757 -2.348 1.00 0.00 C ATOM 454 C GLU A 28 14.203 -15.152 -1.055 1.00 0.00 C ATOM 455 O GLU A 28 13.467 -16.130 -1.012 1.00 0.00 O ATOM 456 CB GLU A 28 16.387 -15.146 -2.293 1.00 0.00 C ATOM 457 CG GLU A 28 17.071 -15.009 -3.659 1.00 0.00 C ATOM 458 CD GLU A 28 18.502 -15.571 -3.632 1.00 0.00 C ATOM 459 OE1 GLU A 28 18.686 -16.795 -3.845 1.00 0.00 O ATOM 460 OE2 GLU A 28 19.466 -14.792 -3.424 1.00 0.00 O ATOM 0 H GLU A 28 15.588 -12.776 -2.357 1.00 0.00 H new ATOM 0 HA GLU A 28 14.456 -15.290 -3.185 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.900 -14.516 -1.566 1.00 0.00 H new ATOM 0 HB3 GLU A 28 16.478 -16.175 -1.944 1.00 0.00 H new ATOM 0 HG2 GLU A 28 16.487 -15.535 -4.414 1.00 0.00 H new ATOM 0 HG3 GLU A 28 17.097 -13.959 -3.950 1.00 0.00 H new ATOM 467 N GLU A 29 14.392 -14.382 0.012 1.00 0.00 N ATOM 468 CA GLU A 29 13.883 -14.717 1.336 1.00 0.00 C ATOM 469 C GLU A 29 12.363 -14.814 1.337 1.00 0.00 C ATOM 470 O GLU A 29 11.810 -15.719 1.958 1.00 0.00 O ATOM 471 CB GLU A 29 14.379 -13.665 2.337 1.00 0.00 C ATOM 472 CG GLU A 29 15.880 -13.780 2.618 1.00 0.00 C ATOM 473 CD GLU A 29 16.192 -14.797 3.734 1.00 0.00 C ATOM 474 OE1 GLU A 29 16.113 -16.027 3.485 1.00 0.00 O ATOM 475 OE2 GLU A 29 16.512 -14.372 4.872 1.00 0.00 O ATOM 0 H GLU A 29 14.907 -13.502 -0.019 1.00 0.00 H new ATOM 0 HA GLU A 29 14.258 -15.697 1.630 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.161 -12.670 1.950 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.829 -13.771 3.272 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.396 -14.077 1.705 1.00 0.00 H new ATOM 0 HG3 GLU A 29 16.270 -12.802 2.901 1.00 0.00 H new ATOM 482 N ILE A 30 11.707 -13.930 0.591 1.00 0.00 N ATOM 483 CA ILE A 30 10.265 -13.991 0.333 1.00 0.00 C ATOM 484 C ILE A 30 9.900 -15.362 -0.256 1.00 0.00 C ATOM 485 O ILE A 30 8.926 -15.966 0.192 1.00 0.00 O ATOM 486 CB ILE A 30 9.822 -12.845 -0.604 1.00 0.00 C ATOM 487 CG1 ILE A 30 10.044 -11.449 0.021 1.00 0.00 C ATOM 488 CG2 ILE A 30 8.366 -12.993 -1.090 1.00 0.00 C ATOM 489 CD1 ILE A 30 8.876 -10.810 0.797 1.00 0.00 C ATOM 0 H ILE A 30 12.166 -13.138 0.140 1.00 0.00 H new ATOM 0 HA ILE A 30 9.733 -13.864 1.276 1.00 0.00 H new ATOM 0 HB ILE A 30 10.468 -12.927 -1.478 1.00 0.00 H new ATOM 0 HG12 ILE A 30 10.896 -11.517 0.697 1.00 0.00 H new ATOM 0 HG13 ILE A 30 10.326 -10.766 -0.780 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.114 -12.158 -1.744 1.00 0.00 H new ATOM 0 HG22 ILE A 30 8.259 -13.929 -1.638 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.694 -12.997 -0.231 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.181 -9.835 1.176 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.020 -10.690 0.133 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.599 -11.453 1.632 1.00 0.00 H new ATOM 501 N TRP A 31 10.652 -15.880 -1.235 1.00 0.00 N ATOM 502 CA TRP A 31 10.349 -17.188 -1.820 1.00 0.00 C ATOM 503 C TRP A 31 10.600 -18.354 -0.847 1.00 0.00 C ATOM 504 O TRP A 31 10.007 -19.421 -1.030 1.00 0.00 O ATOM 505 CB TRP A 31 11.134 -17.424 -3.117 1.00 0.00 C ATOM 506 CG TRP A 31 10.903 -16.462 -4.249 1.00 0.00 C ATOM 507 CD1 TRP A 31 11.875 -15.869 -4.976 1.00 0.00 C ATOM 508 CD2 TRP A 31 9.642 -16.010 -4.843 1.00 0.00 C ATOM 509 NE1 TRP A 31 11.318 -15.047 -5.934 1.00 0.00 N ATOM 510 CE2 TRP A 31 9.941 -15.093 -5.897 1.00 0.00 C ATOM 511 CE3 TRP A 31 8.276 -16.284 -4.612 1.00 0.00 C ATOM 512 CZ2 TRP A 31 8.941 -14.463 -6.655 1.00 0.00 C ATOM 513 CZ3 TRP A 31 7.265 -15.675 -5.378 1.00 0.00 C ATOM 514 CH2 TRP A 31 7.593 -14.766 -6.403 1.00 0.00 C ATOM 0 H TRP A 31 11.468 -15.416 -1.635 1.00 0.00 H new ATOM 0 HA TRP A 31 9.283 -17.166 -2.045 1.00 0.00 H new ATOM 0 HB2 TRP A 31 12.197 -17.411 -2.875 1.00 0.00 H new ATOM 0 HB3 TRP A 31 10.901 -18.427 -3.474 1.00 0.00 H new ATOM 0 HD1 TRP A 31 12.935 -16.017 -4.829 1.00 0.00 H new ATOM 0 HE1 TRP A 31 11.857 -14.478 -6.587 1.00 0.00 H new ATOM 0 HE3 TRP A 31 8.001 -16.976 -3.830 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 9.206 -13.753 -7.424 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 6.229 -15.906 -5.179 1.00 0.00 H new ATOM 0 HH2 TRP A 31 6.813 -14.305 -6.991 1.00 0.00 H new ATOM 525 N TYR A 32 11.447 -18.180 0.173 1.00 0.00 N ATOM 526 CA TYR A 32 12.055 -19.294 0.907 1.00 0.00 C ATOM 527 C TYR A 32 11.733 -19.312 2.411 1.00 0.00 C ATOM 528 O TYR A 32 12.230 -20.184 3.130 1.00 0.00 O ATOM 529 CB TYR A 32 13.571 -19.297 0.628 1.00 0.00 C ATOM 530 CG TYR A 32 13.948 -19.474 -0.834 1.00 0.00 C ATOM 531 CD1 TYR A 32 13.351 -20.488 -1.610 1.00 0.00 C ATOM 532 CD2 TYR A 32 14.893 -18.618 -1.422 1.00 0.00 C ATOM 533 CE1 TYR A 32 13.652 -20.601 -2.976 1.00 0.00 C ATOM 534 CE2 TYR A 32 15.171 -18.697 -2.793 1.00 0.00 C ATOM 535 CZ TYR A 32 14.551 -19.691 -3.583 1.00 0.00 C ATOM 536 OH TYR A 32 14.831 -19.765 -4.917 1.00 0.00 O ATOM 0 H TYR A 32 11.730 -17.261 0.513 1.00 0.00 H new ATOM 0 HA TYR A 32 11.610 -20.219 0.540 1.00 0.00 H new ATOM 0 HB2 TYR A 32 13.995 -18.359 0.987 1.00 0.00 H new ATOM 0 HB3 TYR A 32 14.032 -20.097 1.207 1.00 0.00 H new ATOM 0 HD1 TYR A 32 12.660 -21.180 -1.152 1.00 0.00 H new ATOM 0 HD2 TYR A 32 15.410 -17.892 -0.812 1.00 0.00 H new ATOM 0 HE1 TYR A 32 13.197 -21.383 -3.565 1.00 0.00 H new ATOM 0 HE2 TYR A 32 15.859 -17.998 -3.246 1.00 0.00 H new ATOM 0 HH TYR A 32 15.468 -19.060 -5.157 1.00 0.00 H new ATOM 546 N ASN A 33 10.889 -18.394 2.901 1.00 0.00 N ATOM 547 CA ASN A 33 10.510 -18.264 4.299 1.00 0.00 C ATOM 548 C ASN A 33 9.005 -17.998 4.324 1.00 0.00 C ATOM 549 O ASN A 33 8.604 -16.836 4.346 1.00 0.00 O ATOM 550 CB ASN A 33 11.269 -17.091 4.934 1.00 0.00 C ATOM 551 CG ASN A 33 12.771 -17.296 5.024 1.00 0.00 C ATOM 552 OD1 ASN A 33 13.302 -17.833 5.993 1.00 0.00 O ATOM 553 ND2 ASN A 33 13.468 -16.835 4.004 1.00 0.00 N ATOM 0 H ASN A 33 10.439 -17.699 2.305 1.00 0.00 H new ATOM 0 HA ASN A 33 10.753 -19.165 4.863 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.071 -16.189 4.355 1.00 0.00 H new ATOM 0 HB3 ASN A 33 10.877 -16.919 5.936 1.00 0.00 H new ATOM 0 HD21 ASN A 33 14.485 -16.918 4.002 1.00 0.00 H new ATOM 0 HD22 ASN A 33 12.991 -16.395 3.217 1.00 0.00 H new ATOM 560 N ARG A 34 8.172 -19.040 4.231 1.00 0.00 N ATOM 561 CA ARG A 34 6.729 -18.918 3.962 1.00 0.00 C ATOM 562 C ARG A 34 6.026 -17.872 4.830 1.00 0.00 C ATOM 563 O ARG A 34 5.183 -17.117 4.340 1.00 0.00 O ATOM 564 CB ARG A 34 6.074 -20.301 4.103 1.00 0.00 C ATOM 565 CG ARG A 34 4.550 -20.259 3.895 1.00 0.00 C ATOM 566 CD ARG A 34 3.979 -21.672 3.752 1.00 0.00 C ATOM 567 NE ARG A 34 2.508 -21.653 3.613 1.00 0.00 N ATOM 568 CZ ARG A 34 1.719 -22.728 3.462 1.00 0.00 C ATOM 569 NH1 ARG A 34 2.243 -23.955 3.424 1.00 0.00 N ATOM 570 NH2 ARG A 34 0.404 -22.566 3.347 1.00 0.00 N ATOM 0 H ARG A 34 8.482 -20.006 4.341 1.00 0.00 H new ATOM 0 HA ARG A 34 6.615 -18.555 2.941 1.00 0.00 H new ATOM 0 HB2 ARG A 34 6.517 -20.984 3.378 1.00 0.00 H new ATOM 0 HB3 ARG A 34 6.291 -20.702 5.093 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.078 -19.755 4.738 1.00 0.00 H new ATOM 0 HG3 ARG A 34 4.316 -19.676 3.004 1.00 0.00 H new ATOM 0 HD2 ARG A 34 4.421 -22.157 2.882 1.00 0.00 H new ATOM 0 HD3 ARG A 34 4.255 -22.266 4.623 1.00 0.00 H new ATOM 0 HE ARG A 34 2.051 -20.741 3.634 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.251 -24.082 3.510 1.00 0.00 H new ATOM 0 HH12 ARG A 34 1.635 -24.766 3.309 1.00 0.00 H new ATOM 0 HH21 ARG A 34 0.001 -21.629 3.374 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -0.202 -23.378 3.232 1.00 0.00 H new ATOM 584 N GLU A 35 6.347 -17.817 6.120 1.00 0.00 N ATOM 585 CA GLU A 35 5.699 -16.881 7.024 1.00 0.00 C ATOM 586 C GLU A 35 6.182 -15.447 6.785 1.00 0.00 C ATOM 587 O GLU A 35 5.400 -14.506 6.924 1.00 0.00 O ATOM 588 CB GLU A 35 5.864 -17.316 8.492 1.00 0.00 C ATOM 589 CG GLU A 35 7.293 -17.352 9.064 1.00 0.00 C ATOM 590 CD GLU A 35 8.098 -18.584 8.602 1.00 0.00 C ATOM 591 OE1 GLU A 35 8.702 -18.537 7.504 1.00 0.00 O ATOM 592 OE2 GLU A 35 8.128 -19.601 9.336 1.00 0.00 O ATOM 0 H GLU A 35 7.051 -18.410 6.559 1.00 0.00 H new ATOM 0 HA GLU A 35 4.631 -16.893 6.808 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.270 -16.644 9.111 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.433 -18.312 8.599 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.821 -16.447 8.764 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.243 -17.346 10.153 1.00 0.00 H new ATOM 599 N ARG A 36 7.438 -15.267 6.366 1.00 0.00 N ATOM 600 CA ARG A 36 7.964 -13.970 5.991 1.00 0.00 C ATOM 601 C ARG A 36 7.484 -13.568 4.601 1.00 0.00 C ATOM 602 O ARG A 36 7.476 -12.375 4.305 1.00 0.00 O ATOM 603 CB ARG A 36 9.488 -13.973 6.073 1.00 0.00 C ATOM 604 CG ARG A 36 10.050 -14.217 7.486 1.00 0.00 C ATOM 605 CD ARG A 36 9.309 -13.469 8.608 1.00 0.00 C ATOM 606 NE ARG A 36 9.955 -13.658 9.918 1.00 0.00 N ATOM 607 CZ ARG A 36 9.408 -13.361 11.106 1.00 0.00 C ATOM 608 NH1 ARG A 36 8.184 -12.846 11.194 1.00 0.00 N ATOM 609 NH2 ARG A 36 10.102 -13.583 12.221 1.00 0.00 N ATOM 0 H ARG A 36 8.114 -16.026 6.280 1.00 0.00 H new ATOM 0 HA ARG A 36 7.588 -13.227 6.694 1.00 0.00 H new ATOM 0 HB2 ARG A 36 9.874 -14.742 5.404 1.00 0.00 H new ATOM 0 HB3 ARG A 36 9.861 -13.016 5.707 1.00 0.00 H new ATOM 0 HG2 ARG A 36 10.017 -15.286 7.696 1.00 0.00 H new ATOM 0 HG3 ARG A 36 11.099 -13.922 7.502 1.00 0.00 H new ATOM 0 HD2 ARG A 36 9.273 -12.405 8.372 1.00 0.00 H new ATOM 0 HD3 ARG A 36 8.278 -13.820 8.658 1.00 0.00 H new ATOM 0 HE ARG A 36 10.898 -14.048 9.922 1.00 0.00 H new ATOM 0 HH11 ARG A 36 7.643 -12.670 10.348 1.00 0.00 H new ATOM 0 HH12 ARG A 36 7.787 -12.628 12.108 1.00 0.00 H new ATOM 0 HH21 ARG A 36 11.042 -13.976 12.167 1.00 0.00 H new ATOM 0 HH22 ARG A 36 9.694 -13.360 13.129 1.00 0.00 H new ATOM 623 N SER A 37 7.047 -14.509 3.760 1.00 0.00 N ATOM 624 CA SER A 37 6.325 -14.144 2.557 1.00 0.00 C ATOM 625 C SER A 37 5.036 -13.446 2.987 1.00 0.00 C ATOM 626 O SER A 37 4.768 -12.333 2.544 1.00 0.00 O ATOM 627 CB SER A 37 6.015 -15.357 1.661 1.00 0.00 C ATOM 628 OG SER A 37 6.934 -16.419 1.822 1.00 0.00 O ATOM 0 H SER A 37 7.182 -15.511 3.893 1.00 0.00 H new ATOM 0 HA SER A 37 6.947 -13.481 1.955 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.011 -15.718 1.884 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.016 -15.040 0.618 1.00 0.00 H new ATOM 0 HG SER A 37 7.796 -16.168 1.430 1.00 0.00 H new ATOM 634 N GLU A 38 4.261 -14.079 3.876 1.00 0.00 N ATOM 635 CA GLU A 38 2.903 -13.700 4.226 1.00 0.00 C ATOM 636 C GLU A 38 2.785 -12.241 4.686 1.00 0.00 C ATOM 637 O GLU A 38 1.772 -11.602 4.399 1.00 0.00 O ATOM 638 CB GLU A 38 2.393 -14.680 5.295 1.00 0.00 C ATOM 639 CG GLU A 38 0.887 -14.881 5.175 1.00 0.00 C ATOM 640 CD GLU A 38 0.351 -15.826 6.266 1.00 0.00 C ATOM 641 OE1 GLU A 38 0.453 -17.067 6.098 1.00 0.00 O ATOM 642 OE2 GLU A 38 -0.193 -15.335 7.285 1.00 0.00 O ATOM 0 H GLU A 38 4.584 -14.901 4.387 1.00 0.00 H new ATOM 0 HA GLU A 38 2.280 -13.762 3.333 1.00 0.00 H new ATOM 0 HB2 GLU A 38 2.901 -15.638 5.188 1.00 0.00 H new ATOM 0 HB3 GLU A 38 2.635 -14.300 6.287 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.384 -13.917 5.249 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.651 -15.289 4.192 1.00 0.00 H new ATOM 649 N GLU A 39 3.815 -11.691 5.338 1.00 0.00 N ATOM 650 CA GLU A 39 3.832 -10.328 5.858 1.00 0.00 C ATOM 651 C GLU A 39 3.541 -9.299 4.759 1.00 0.00 C ATOM 652 O GLU A 39 2.859 -8.300 4.993 1.00 0.00 O ATOM 653 CB GLU A 39 5.204 -10.004 6.481 1.00 0.00 C ATOM 654 CG GLU A 39 5.968 -11.138 7.166 1.00 0.00 C ATOM 655 CD GLU A 39 5.422 -11.616 8.528 1.00 0.00 C ATOM 656 OE1 GLU A 39 4.210 -11.471 8.820 1.00 0.00 O ATOM 657 OE2 GLU A 39 6.245 -12.118 9.335 1.00 0.00 O ATOM 0 H GLU A 39 4.681 -12.199 5.521 1.00 0.00 H new ATOM 0 HA GLU A 39 3.051 -10.268 6.616 1.00 0.00 H new ATOM 0 HB2 GLU A 39 5.841 -9.600 5.694 1.00 0.00 H new ATOM 0 HB3 GLU A 39 5.059 -9.209 7.213 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.989 -11.992 6.489 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.000 -10.817 7.307 1.00 0.00 H new ATOM 664 N LEU A 40 4.059 -9.553 3.554 1.00 0.00 N ATOM 665 CA LEU A 40 3.837 -8.708 2.390 1.00 0.00 C ATOM 666 C LEU A 40 2.346 -8.664 2.063 1.00 0.00 C ATOM 667 O LEU A 40 1.755 -7.590 1.946 1.00 0.00 O ATOM 668 CB LEU A 40 4.753 -9.181 1.243 1.00 0.00 C ATOM 669 CG LEU A 40 4.463 -8.720 -0.198 1.00 0.00 C ATOM 670 CD1 LEU A 40 3.635 -9.764 -0.936 1.00 0.00 C ATOM 671 CD2 LEU A 40 3.830 -7.332 -0.329 1.00 0.00 C ATOM 0 H LEU A 40 4.650 -10.362 3.363 1.00 0.00 H new ATOM 0 HA LEU A 40 4.115 -7.671 2.581 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.769 -8.871 1.487 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.743 -10.271 1.246 1.00 0.00 H new ATOM 0 HG LEU A 40 5.443 -8.620 -0.664 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.440 -9.422 -1.952 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.183 -10.706 -0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.689 -9.913 -0.415 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.667 -7.104 -1.382 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.876 -7.316 0.197 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.496 -6.586 0.105 1.00 0.00 H new ATOM 683 N PHE A 41 1.715 -9.829 1.979 1.00 0.00 N ATOM 684 CA PHE A 41 0.317 -9.959 1.610 1.00 0.00 C ATOM 685 C PHE A 41 -0.558 -9.310 2.682 1.00 0.00 C ATOM 686 O PHE A 41 -1.532 -8.622 2.366 1.00 0.00 O ATOM 687 CB PHE A 41 -0.026 -11.438 1.406 1.00 0.00 C ATOM 688 CG PHE A 41 0.885 -12.109 0.396 1.00 0.00 C ATOM 689 CD1 PHE A 41 2.167 -12.524 0.801 1.00 0.00 C ATOM 690 CD2 PHE A 41 0.514 -12.227 -0.954 1.00 0.00 C ATOM 691 CE1 PHE A 41 3.076 -13.053 -0.126 1.00 0.00 C ATOM 692 CE2 PHE A 41 1.421 -12.770 -1.882 1.00 0.00 C ATOM 693 CZ PHE A 41 2.700 -13.185 -1.473 1.00 0.00 C ATOM 0 H PHE A 41 2.170 -10.722 2.169 1.00 0.00 H new ATOM 0 HA PHE A 41 0.126 -9.443 0.669 1.00 0.00 H new ATOM 0 HB2 PHE A 41 0.047 -11.960 2.360 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -1.060 -11.526 1.073 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.454 -12.434 1.838 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -0.464 -11.902 -1.278 1.00 0.00 H new ATOM 0 HE1 PHE A 41 4.061 -13.358 0.194 1.00 0.00 H new ATOM 0 HE2 PHE A 41 1.132 -12.869 -2.918 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.390 -13.603 -2.191 1.00 0.00 H new ATOM 703 N TRP A 42 -0.175 -9.469 3.949 1.00 0.00 N ATOM 704 CA TRP A 42 -0.806 -8.753 5.041 1.00 0.00 C ATOM 705 C TRP A 42 -0.683 -7.237 4.882 1.00 0.00 C ATOM 706 O TRP A 42 -1.634 -6.542 5.234 1.00 0.00 O ATOM 707 CB TRP A 42 -0.250 -9.249 6.382 1.00 0.00 C ATOM 708 CG TRP A 42 -0.877 -10.526 6.845 1.00 0.00 C ATOM 709 CD1 TRP A 42 -0.267 -11.728 6.922 1.00 0.00 C ATOM 710 CD2 TRP A 42 -2.265 -10.764 7.234 1.00 0.00 C ATOM 711 NE1 TRP A 42 -1.169 -12.685 7.332 1.00 0.00 N ATOM 712 CE2 TRP A 42 -2.427 -12.154 7.522 1.00 0.00 C ATOM 713 CE3 TRP A 42 -3.410 -9.944 7.348 1.00 0.00 C ATOM 714 CZ2 TRP A 42 -3.668 -12.702 7.890 1.00 0.00 C ATOM 715 CZ3 TRP A 42 -4.659 -10.485 7.713 1.00 0.00 C ATOM 716 CH2 TRP A 42 -4.791 -11.860 7.982 1.00 0.00 C ATOM 0 H TRP A 42 0.577 -10.095 4.239 1.00 0.00 H new ATOM 0 HA TRP A 42 -1.875 -8.965 5.020 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.827 -9.393 6.290 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -0.406 -8.480 7.139 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.773 -11.912 6.696 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -0.935 -13.667 7.477 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -3.327 -8.885 7.152 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -3.758 -13.758 8.100 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -5.522 -9.839 7.787 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -5.752 -12.268 8.258 1.00 0.00 H new ATOM 727 N GLU A 43 0.414 -6.695 4.338 1.00 0.00 N ATOM 728 CA GLU A 43 0.565 -5.260 4.204 1.00 0.00 C ATOM 729 C GLU A 43 -0.366 -4.721 3.111 1.00 0.00 C ATOM 730 O GLU A 43 -0.974 -3.668 3.290 1.00 0.00 O ATOM 731 CB GLU A 43 2.024 -4.904 3.884 1.00 0.00 C ATOM 732 CG GLU A 43 2.266 -3.416 4.165 1.00 0.00 C ATOM 733 CD GLU A 43 3.607 -2.929 3.596 1.00 0.00 C ATOM 734 OE1 GLU A 43 4.675 -3.455 3.983 1.00 0.00 O ATOM 735 OE2 GLU A 43 3.607 -1.997 2.756 1.00 0.00 O ATOM 0 H GLU A 43 1.204 -7.237 3.987 1.00 0.00 H new ATOM 0 HA GLU A 43 0.292 -4.795 5.151 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.698 -5.512 4.487 1.00 0.00 H new ATOM 0 HB3 GLU A 43 2.242 -5.127 2.840 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.455 -2.830 3.732 1.00 0.00 H new ATOM 0 HG3 GLU A 43 2.245 -3.243 5.241 1.00 0.00 H new ATOM 742 N VAL A 44 -0.513 -5.423 1.985 1.00 0.00 N ATOM 743 CA VAL A 44 -1.359 -4.941 0.907 1.00 0.00 C ATOM 744 C VAL A 44 -2.832 -5.024 1.292 1.00 0.00 C ATOM 745 O VAL A 44 -3.598 -4.094 1.052 1.00 0.00 O ATOM 746 CB VAL A 44 -1.062 -5.685 -0.392 1.00 0.00 C ATOM 747 CG1 VAL A 44 0.303 -5.251 -0.932 1.00 0.00 C ATOM 748 CG2 VAL A 44 -1.020 -7.203 -0.298 1.00 0.00 C ATOM 0 H VAL A 44 -0.059 -6.318 1.803 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.131 -3.889 0.734 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.899 -5.423 -1.039 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.513 -5.783 -1.860 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.294 -4.178 -1.123 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.075 -5.482 -0.198 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.801 -7.622 -1.280 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -0.243 -7.503 0.406 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.985 -7.573 0.048 1.00 0.00 H new ATOM 758 N MET A 45 -3.227 -6.109 1.941 1.00 0.00 N ATOM 759 CA MET A 45 -4.536 -6.235 2.549 1.00 0.00 C ATOM 760 C MET A 45 -4.761 -5.118 3.575 1.00 0.00 C ATOM 761 O MET A 45 -5.837 -4.525 3.597 1.00 0.00 O ATOM 762 CB MET A 45 -4.645 -7.608 3.216 1.00 0.00 C ATOM 763 CG MET A 45 -4.705 -8.784 2.230 1.00 0.00 C ATOM 764 SD MET A 45 -6.340 -9.205 1.553 1.00 0.00 S ATOM 765 CE MET A 45 -6.511 -8.103 0.119 1.00 0.00 C ATOM 0 H MET A 45 -2.639 -6.934 2.060 1.00 0.00 H new ATOM 0 HA MET A 45 -5.304 -6.143 1.781 1.00 0.00 H new ATOM 0 HB2 MET A 45 -3.790 -7.747 3.878 1.00 0.00 H new ATOM 0 HB3 MET A 45 -5.538 -7.626 3.841 1.00 0.00 H new ATOM 0 HG2 MET A 45 -4.039 -8.562 1.396 1.00 0.00 H new ATOM 0 HG3 MET A 45 -4.307 -9.667 2.730 1.00 0.00 H new ATOM 0 HE1 MET A 45 -7.175 -8.560 -0.614 1.00 0.00 H new ATOM 0 HE2 MET A 45 -6.928 -7.149 0.441 1.00 0.00 H new ATOM 0 HE3 MET A 45 -5.532 -7.938 -0.331 1.00 0.00 H new ATOM 775 N ASP A 46 -3.765 -4.796 4.402 1.00 0.00 N ATOM 776 CA ASP A 46 -3.869 -3.698 5.364 1.00 0.00 C ATOM 777 C ASP A 46 -4.074 -2.351 4.668 1.00 0.00 C ATOM 778 O ASP A 46 -4.916 -1.554 5.082 1.00 0.00 O ATOM 779 CB ASP A 46 -2.640 -3.610 6.264 1.00 0.00 C ATOM 780 CG ASP A 46 -2.792 -2.443 7.252 1.00 0.00 C ATOM 781 OD1 ASP A 46 -3.600 -2.567 8.202 1.00 0.00 O ATOM 782 OD2 ASP A 46 -2.087 -1.415 7.101 1.00 0.00 O ATOM 0 H ASP A 46 -2.870 -5.285 4.424 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.742 -3.919 5.978 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.512 -4.545 6.810 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -1.745 -3.469 5.658 1.00 0.00 H new ATOM 787 N GLU A 47 -3.362 -2.115 3.566 1.00 0.00 N ATOM 788 CA GLU A 47 -3.494 -0.955 2.708 1.00 0.00 C ATOM 789 C GLU A 47 -4.890 -0.883 2.048 1.00 0.00 C ATOM 790 O GLU A 47 -5.286 0.173 1.550 1.00 0.00 O ATOM 791 CB GLU A 47 -2.314 -1.039 1.722 1.00 0.00 C ATOM 792 CG GLU A 47 -2.447 -0.284 0.410 1.00 0.00 C ATOM 793 CD GLU A 47 -2.529 1.254 0.538 1.00 0.00 C ATOM 794 OE1 GLU A 47 -2.158 1.824 1.595 1.00 0.00 O ATOM 795 OE2 GLU A 47 -2.920 1.916 -0.452 1.00 0.00 O ATOM 0 H GLU A 47 -2.646 -2.763 3.239 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.441 -0.016 3.259 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.422 -0.675 2.232 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.142 -2.090 1.490 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -1.595 -0.534 -0.222 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.341 -0.637 -0.104 1.00 0.00 H new ATOM 802 N VAL A 48 -5.674 -1.963 2.104 1.00 0.00 N ATOM 803 CA VAL A 48 -7.032 -2.065 1.579 1.00 0.00 C ATOM 804 C VAL A 48 -8.035 -2.142 2.747 1.00 0.00 C ATOM 805 O VAL A 48 -9.238 -2.124 2.494 1.00 0.00 O ATOM 806 CB VAL A 48 -7.097 -3.276 0.605 1.00 0.00 C ATOM 807 CG1 VAL A 48 -8.491 -3.587 0.033 1.00 0.00 C ATOM 808 CG2 VAL A 48 -6.194 -3.075 -0.624 1.00 0.00 C ATOM 0 H VAL A 48 -5.360 -2.831 2.539 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.310 -1.180 1.006 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.774 -4.101 1.240 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.427 -4.447 -0.633 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -9.178 -3.810 0.849 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.857 -2.724 -0.523 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -6.270 -3.944 -1.277 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.511 -2.184 -1.167 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.160 -2.954 -0.300 1.00 0.00 H new ATOM 818 N HIS A 49 -7.595 -2.213 4.011 1.00 0.00 N ATOM 819 CA HIS A 49 -8.434 -2.670 5.115 1.00 0.00 C ATOM 820 C HIS A 49 -9.740 -1.891 5.299 1.00 0.00 C ATOM 821 O HIS A 49 -10.732 -2.493 5.700 1.00 0.00 O ATOM 822 CB HIS A 49 -7.645 -2.725 6.427 1.00 0.00 C ATOM 823 CG HIS A 49 -8.323 -3.581 7.465 1.00 0.00 C ATOM 824 ND1 HIS A 49 -8.929 -3.159 8.627 1.00 0.00 N ATOM 825 CD2 HIS A 49 -8.485 -4.938 7.393 1.00 0.00 C ATOM 826 CE1 HIS A 49 -9.442 -4.240 9.242 1.00 0.00 C ATOM 827 NE2 HIS A 49 -9.196 -5.354 8.526 1.00 0.00 N ATOM 0 H HIS A 49 -6.649 -1.955 4.291 1.00 0.00 H new ATOM 0 HA HIS A 49 -8.738 -3.678 4.832 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.647 -3.116 6.232 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -7.521 -1.715 6.817 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -8.127 -5.578 6.600 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.977 -4.218 10.180 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -9.472 -6.307 8.761 1.00 0.00 H new ATOM 835 N GLU A 50 -9.779 -0.594 4.971 1.00 0.00 N ATOM 836 CA GLU A 50 -11.000 0.207 5.087 1.00 0.00 C ATOM 837 C GLU A 50 -12.122 -0.267 4.141 1.00 0.00 C ATOM 838 O GLU A 50 -13.285 0.109 4.315 1.00 0.00 O ATOM 839 CB GLU A 50 -10.685 1.693 4.842 1.00 0.00 C ATOM 840 CG GLU A 50 -9.760 2.290 5.914 1.00 0.00 C ATOM 841 CD GLU A 50 -9.552 3.800 5.690 1.00 0.00 C ATOM 842 OE1 GLU A 50 -8.617 4.185 4.947 1.00 0.00 O ATOM 843 OE2 GLU A 50 -10.308 4.618 6.269 1.00 0.00 O ATOM 0 H GLU A 50 -8.973 -0.076 4.621 1.00 0.00 H new ATOM 0 HA GLU A 50 -11.371 0.074 6.103 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -10.218 1.804 3.863 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -11.617 2.258 4.817 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -10.188 2.122 6.902 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.797 1.780 5.892 1.00 0.00 H new ATOM 850 N GLU A 51 -11.787 -1.100 3.154 1.00 0.00 N ATOM 851 CA GLU A 51 -12.708 -1.758 2.242 1.00 0.00 C ATOM 852 C GLU A 51 -12.675 -3.276 2.470 1.00 0.00 C ATOM 853 O GLU A 51 -13.717 -3.931 2.427 1.00 0.00 O ATOM 854 CB GLU A 51 -12.309 -1.426 0.800 1.00 0.00 C ATOM 855 CG GLU A 51 -12.572 0.053 0.486 1.00 0.00 C ATOM 856 CD GLU A 51 -12.063 0.417 -0.916 1.00 0.00 C ATOM 857 OE1 GLU A 51 -10.870 0.772 -1.068 1.00 0.00 O ATOM 858 OE2 GLU A 51 -12.837 0.315 -1.896 1.00 0.00 O ATOM 0 H GLU A 51 -10.815 -1.342 2.964 1.00 0.00 H new ATOM 0 HA GLU A 51 -13.723 -1.404 2.425 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -11.253 -1.652 0.649 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -12.871 -2.054 0.109 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.640 0.258 0.554 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -12.079 0.679 1.230 1.00 0.00 H new ATOM 865 N GLU A 52 -11.500 -3.846 2.765 1.00 0.00 N ATOM 866 CA GLU A 52 -11.320 -5.256 3.092 1.00 0.00 C ATOM 867 C GLU A 52 -12.150 -5.660 4.318 1.00 0.00 C ATOM 868 O GLU A 52 -12.586 -6.806 4.392 1.00 0.00 O ATOM 869 CB GLU A 52 -9.826 -5.544 3.299 1.00 0.00 C ATOM 870 CG GLU A 52 -9.267 -6.620 2.372 1.00 0.00 C ATOM 871 CD GLU A 52 -9.683 -8.045 2.788 1.00 0.00 C ATOM 872 OE1 GLU A 52 -9.258 -8.519 3.868 1.00 0.00 O ATOM 873 OE2 GLU A 52 -10.421 -8.699 2.008 1.00 0.00 O ATOM 0 H GLU A 52 -10.627 -3.319 2.782 1.00 0.00 H new ATOM 0 HA GLU A 52 -11.682 -5.861 2.260 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.265 -4.622 3.149 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -9.665 -5.850 4.333 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -9.609 -6.429 1.355 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.179 -6.553 2.360 1.00 0.00 H new ATOM 880 N GLU A 53 -12.442 -4.739 5.248 1.00 0.00 N ATOM 881 CA GLU A 53 -13.324 -5.004 6.383 1.00 0.00 C ATOM 882 C GLU A 53 -14.725 -5.478 5.947 1.00 0.00 C ATOM 883 O GLU A 53 -15.393 -6.188 6.702 1.00 0.00 O ATOM 884 CB GLU A 53 -13.412 -3.787 7.321 1.00 0.00 C ATOM 885 CG GLU A 53 -14.059 -2.543 6.695 1.00 0.00 C ATOM 886 CD GLU A 53 -14.212 -1.414 7.731 1.00 0.00 C ATOM 887 OE1 GLU A 53 -13.240 -0.660 7.983 1.00 0.00 O ATOM 888 OE2 GLU A 53 -15.321 -1.265 8.305 1.00 0.00 O ATOM 0 H GLU A 53 -12.070 -3.789 5.230 1.00 0.00 H new ATOM 0 HA GLU A 53 -12.875 -5.827 6.940 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -13.980 -4.069 8.208 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -12.407 -3.529 7.655 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.451 -2.194 5.860 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -15.037 -2.803 6.290 1.00 0.00 H new ATOM 895 N PHE A 54 -15.166 -5.130 4.732 1.00 0.00 N ATOM 896 CA PHE A 54 -16.452 -5.546 4.178 1.00 0.00 C ATOM 897 C PHE A 54 -16.382 -6.951 3.550 1.00 0.00 C ATOM 898 O PHE A 54 -17.418 -7.520 3.197 1.00 0.00 O ATOM 899 CB PHE A 54 -16.904 -4.498 3.144 1.00 0.00 C ATOM 900 CG PHE A 54 -18.364 -4.585 2.734 1.00 0.00 C ATOM 901 CD1 PHE A 54 -19.374 -4.203 3.640 1.00 0.00 C ATOM 902 CD2 PHE A 54 -18.721 -5.031 1.446 1.00 0.00 C ATOM 903 CE1 PHE A 54 -20.729 -4.273 3.266 1.00 0.00 C ATOM 904 CE2 PHE A 54 -20.075 -5.099 1.070 1.00 0.00 C ATOM 905 CZ PHE A 54 -21.079 -4.723 1.980 1.00 0.00 C ATOM 0 H PHE A 54 -14.626 -4.541 4.098 1.00 0.00 H new ATOM 0 HA PHE A 54 -17.182 -5.607 4.985 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -16.716 -3.504 3.551 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -16.286 -4.600 2.252 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -19.107 -3.855 4.627 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -17.953 -5.322 0.745 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -21.499 -3.982 3.965 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -20.344 -5.440 0.081 1.00 0.00 H new ATOM 0 HZ PHE A 54 -22.118 -4.780 1.692 1.00 0.00 H new ATOM 915 N ALA A 55 -15.177 -7.521 3.396 1.00 0.00 N ATOM 916 CA ALA A 55 -14.930 -8.739 2.631 1.00 0.00 C ATOM 917 C ALA A 55 -14.003 -9.723 3.349 1.00 0.00 C ATOM 918 O ALA A 55 -13.618 -10.739 2.759 1.00 0.00 O ATOM 919 CB ALA A 55 -14.395 -8.360 1.245 1.00 0.00 C ATOM 0 H ALA A 55 -14.331 -7.133 3.813 1.00 0.00 H new ATOM 0 HA ALA A 55 -15.877 -9.268 2.523 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -14.208 -9.265 0.667 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -15.130 -7.744 0.727 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -13.466 -7.801 1.354 1.00 0.00 H new ATOM 925 N VAL A 56 -13.668 -9.478 4.617 1.00 0.00 N ATOM 926 CA VAL A 56 -12.964 -10.415 5.481 1.00 0.00 C ATOM 927 C VAL A 56 -13.979 -11.372 6.118 1.00 0.00 C ATOM 928 O VAL A 56 -14.214 -11.401 7.327 1.00 0.00 O ATOM 929 CB VAL A 56 -11.998 -9.667 6.420 1.00 0.00 C ATOM 930 CG1 VAL A 56 -12.666 -8.669 7.374 1.00 0.00 C ATOM 931 CG2 VAL A 56 -11.144 -10.677 7.190 1.00 0.00 C ATOM 0 H VAL A 56 -13.887 -8.596 5.080 1.00 0.00 H new ATOM 0 HA VAL A 56 -12.293 -11.068 4.923 1.00 0.00 H new ATOM 0 HB VAL A 56 -11.369 -9.051 5.777 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.906 -8.193 7.994 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -13.191 -7.909 6.796 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -13.377 -9.195 8.012 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -10.462 -10.146 7.853 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -11.791 -11.326 7.780 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -10.570 -11.280 6.486 1.00 0.00 H new ATOM 941 N GLU A 57 -14.656 -12.122 5.255 1.00 0.00 N ATOM 942 CA GLU A 57 -15.784 -12.975 5.605 1.00 0.00 C ATOM 943 C GLU A 57 -15.923 -14.095 4.560 1.00 0.00 C ATOM 944 O GLU A 57 -17.021 -14.542 4.217 1.00 0.00 O ATOM 945 CB GLU A 57 -17.039 -12.095 5.754 1.00 0.00 C ATOM 946 CG GLU A 57 -17.289 -11.152 4.563 1.00 0.00 C ATOM 947 CD GLU A 57 -18.784 -10.807 4.415 1.00 0.00 C ATOM 948 OE1 GLU A 57 -19.356 -10.137 5.310 1.00 0.00 O ATOM 949 OE2 GLU A 57 -19.405 -11.203 3.397 1.00 0.00 O ATOM 0 H GLU A 57 -14.427 -12.153 4.262 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.632 -13.474 6.562 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -17.909 -12.739 5.882 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -16.947 -11.500 6.662 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.715 -10.235 4.698 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -16.931 -11.620 3.646 1.00 0.00 H new ATOM 956 N GLY A 58 -14.783 -14.512 4.002 1.00 0.00 N ATOM 957 CA GLY A 58 -14.666 -15.438 2.888 1.00 0.00 C ATOM 958 C GLY A 58 -13.191 -15.768 2.657 1.00 0.00 C ATOM 959 O GLY A 58 -12.330 -15.314 3.421 1.00 0.00 O ATOM 0 H GLY A 58 -13.874 -14.192 4.337 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -15.226 -16.349 3.098 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -15.097 -14.999 1.988 1.00 0.00 H new ATOM 963 N PRO A 59 -12.893 -16.571 1.627 1.00 0.00 N ATOM 964 CA PRO A 59 -11.542 -17.020 1.324 1.00 0.00 C ATOM 965 C PRO A 59 -10.656 -15.877 0.797 1.00 0.00 C ATOM 966 O PRO A 59 -11.125 -14.776 0.491 1.00 0.00 O ATOM 967 CB PRO A 59 -11.726 -18.143 0.300 1.00 0.00 C ATOM 968 CG PRO A 59 -13.023 -17.772 -0.412 1.00 0.00 C ATOM 969 CD PRO A 59 -13.852 -17.130 0.687 1.00 0.00 C ATOM 0 HA PRO A 59 -11.019 -17.372 2.213 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -10.888 -18.193 -0.395 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -11.799 -19.118 0.783 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -12.846 -17.083 -1.237 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -13.518 -18.649 -0.830 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -14.503 -16.354 0.284 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.494 -17.865 1.173 1.00 0.00 H new ATOM 977 N LEU A 60 -9.367 -16.181 0.630 1.00 0.00 N ATOM 978 CA LEU A 60 -8.380 -15.341 -0.043 1.00 0.00 C ATOM 979 C LEU A 60 -7.529 -16.274 -0.902 1.00 0.00 C ATOM 980 O LEU A 60 -7.332 -17.441 -0.548 1.00 0.00 O ATOM 981 CB LEU A 60 -7.487 -14.623 0.983 1.00 0.00 C ATOM 982 CG LEU A 60 -6.562 -13.533 0.396 1.00 0.00 C ATOM 983 CD1 LEU A 60 -7.357 -12.383 -0.239 1.00 0.00 C ATOM 984 CD2 LEU A 60 -5.663 -12.966 1.500 1.00 0.00 C ATOM 0 H LEU A 60 -8.969 -17.055 0.975 1.00 0.00 H new ATOM 0 HA LEU A 60 -8.871 -14.576 -0.644 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -8.124 -14.167 1.741 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.871 -15.366 1.489 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.961 -14.002 -0.383 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.666 -11.640 -0.638 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.978 -12.772 -1.046 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -7.992 -11.919 0.516 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -5.013 -12.198 1.081 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.281 -12.530 2.284 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.055 -13.767 1.921 1.00 0.00 H new ATOM 996 N TRP A 61 -7.020 -15.750 -2.011 1.00 0.00 N ATOM 997 CA TRP A 61 -6.365 -16.514 -3.057 1.00 0.00 C ATOM 998 C TRP A 61 -5.208 -15.682 -3.592 1.00 0.00 C ATOM 999 O TRP A 61 -5.308 -14.454 -3.603 1.00 0.00 O ATOM 1000 CB TRP A 61 -7.392 -16.708 -4.172 1.00 0.00 C ATOM 1001 CG TRP A 61 -8.615 -17.511 -3.864 1.00 0.00 C ATOM 1002 CD1 TRP A 61 -9.757 -17.035 -3.315 1.00 0.00 C ATOM 1003 CD2 TRP A 61 -8.856 -18.920 -4.125 1.00 0.00 C ATOM 1004 NE1 TRP A 61 -10.685 -18.055 -3.231 1.00 0.00 N ATOM 1005 CE2 TRP A 61 -10.178 -19.247 -3.709 1.00 0.00 C ATOM 1006 CE3 TRP A 61 -8.081 -19.947 -4.694 1.00 0.00 C ATOM 1007 CZ2 TRP A 61 -10.700 -20.545 -3.837 1.00 0.00 C ATOM 1008 CZ3 TRP A 61 -8.590 -21.254 -4.824 1.00 0.00 C ATOM 1009 CH2 TRP A 61 -9.897 -21.555 -4.396 1.00 0.00 C ATOM 0 H TRP A 61 -7.055 -14.750 -2.210 1.00 0.00 H new ATOM 0 HA TRP A 61 -5.997 -17.473 -2.692 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -7.715 -15.722 -4.505 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -6.886 -17.179 -5.015 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -9.918 -16.017 -2.993 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -11.629 -17.941 -2.861 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -7.080 -19.730 -5.037 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -11.706 -20.764 -3.510 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -7.974 -22.030 -5.254 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -10.282 -22.559 -4.497 1.00 0.00 H new ATOM 1020 N ILE A 62 -4.139 -16.325 -4.063 1.00 0.00 N ATOM 1021 CA ILE A 62 -2.896 -15.660 -4.448 1.00 0.00 C ATOM 1022 C ILE A 62 -2.446 -16.232 -5.803 1.00 0.00 C ATOM 1023 O ILE A 62 -2.578 -17.436 -6.043 1.00 0.00 O ATOM 1024 CB ILE A 62 -1.794 -15.900 -3.375 1.00 0.00 C ATOM 1025 CG1 ILE A 62 -2.234 -15.928 -1.888 1.00 0.00 C ATOM 1026 CG2 ILE A 62 -0.659 -14.878 -3.554 1.00 0.00 C ATOM 1027 CD1 ILE A 62 -2.717 -14.606 -1.276 1.00 0.00 C ATOM 0 H ILE A 62 -4.113 -17.337 -4.189 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.060 -14.585 -4.527 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.470 -16.922 -3.570 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.035 -16.660 -1.786 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.395 -16.289 -1.294 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.109 -15.051 -2.800 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.224 -14.988 -4.547 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.057 -13.869 -3.442 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.993 -14.767 -0.234 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.918 -13.867 -1.329 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.583 -14.244 -1.829 1.00 0.00 H new ATOM 1039 N GLN A 63 -1.852 -15.389 -6.652 1.00 0.00 N ATOM 1040 CA GLN A 63 -1.044 -15.790 -7.807 1.00 0.00 C ATOM 1041 C GLN A 63 0.115 -14.784 -7.915 1.00 0.00 C ATOM 1042 O GLN A 63 -0.020 -13.647 -7.474 1.00 0.00 O ATOM 1043 CB GLN A 63 -1.958 -15.857 -9.050 1.00 0.00 C ATOM 1044 CG GLN A 63 -1.263 -16.322 -10.341 1.00 0.00 C ATOM 1045 CD GLN A 63 -2.256 -16.548 -11.492 1.00 0.00 C ATOM 1046 OE1 GLN A 63 -3.309 -17.160 -11.325 1.00 0.00 O ATOM 1047 NE2 GLN A 63 -1.955 -16.057 -12.688 1.00 0.00 N ATOM 0 H GLN A 63 -1.922 -14.376 -6.551 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.606 -16.783 -7.709 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -2.787 -16.532 -8.837 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -2.387 -14.870 -9.221 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.526 -15.578 -10.642 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.721 -17.247 -10.146 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -1.081 -15.549 -12.826 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -2.598 -16.187 -13.469 1.00 0.00 H new ATOM 1056 N VAL A 64 1.273 -15.167 -8.453 1.00 0.00 N ATOM 1057 CA VAL A 64 2.497 -14.368 -8.319 1.00 0.00 C ATOM 1058 C VAL A 64 3.337 -14.487 -9.594 1.00 0.00 C ATOM 1059 O VAL A 64 3.164 -15.438 -10.363 1.00 0.00 O ATOM 1060 CB VAL A 64 3.216 -14.823 -7.026 1.00 0.00 C ATOM 1061 CG1 VAL A 64 4.002 -16.130 -7.198 1.00 0.00 C ATOM 1062 CG2 VAL A 64 4.097 -13.714 -6.435 1.00 0.00 C ATOM 0 H VAL A 64 1.392 -16.028 -8.988 1.00 0.00 H new ATOM 0 HA VAL A 64 2.289 -13.303 -8.216 1.00 0.00 H new ATOM 0 HB VAL A 64 2.423 -15.034 -6.309 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.482 -16.393 -6.255 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.321 -16.928 -7.493 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.762 -15.999 -7.968 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.582 -14.078 -5.529 1.00 0.00 H new ATOM 0 HG22 VAL A 64 4.856 -13.426 -7.162 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.480 -12.849 -6.193 1.00 0.00 H new ATOM 1072 N GLN A 65 4.229 -13.530 -9.840 1.00 0.00 N ATOM 1073 CA GLN A 65 5.244 -13.600 -10.884 1.00 0.00 C ATOM 1074 C GLN A 65 6.558 -13.102 -10.299 1.00 0.00 C ATOM 1075 O GLN A 65 6.547 -12.212 -9.450 1.00 0.00 O ATOM 1076 CB GLN A 65 4.888 -12.692 -12.079 1.00 0.00 C ATOM 1077 CG GLN A 65 3.820 -13.227 -13.039 1.00 0.00 C ATOM 1078 CD GLN A 65 2.402 -12.764 -12.712 1.00 0.00 C ATOM 1079 OE1 GLN A 65 1.972 -11.682 -13.103 1.00 0.00 O ATOM 1080 NE2 GLN A 65 1.634 -13.585 -12.014 1.00 0.00 N ATOM 0 H GLN A 65 4.265 -12.663 -9.304 1.00 0.00 H new ATOM 0 HA GLN A 65 5.312 -14.631 -11.232 1.00 0.00 H new ATOM 0 HB2 GLN A 65 4.550 -11.731 -11.691 1.00 0.00 H new ATOM 0 HB3 GLN A 65 5.798 -12.503 -12.649 1.00 0.00 H new ATOM 0 HG2 GLN A 65 4.068 -12.914 -14.053 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.847 -14.317 -13.026 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.003 -14.481 -11.695 1.00 0.00 H new ATOM 0 HE22 GLN A 65 0.673 -13.322 -11.795 1.00 0.00 H new ATOM 1089 N ALA A 66 7.678 -13.587 -10.835 1.00 0.00 N ATOM 1090 CA ALA A 66 8.969 -12.921 -10.734 1.00 0.00 C ATOM 1091 C ALA A 66 9.249 -12.286 -12.096 1.00 0.00 C ATOM 1092 O ALA A 66 9.069 -12.929 -13.134 1.00 0.00 O ATOM 1093 CB ALA A 66 10.063 -13.930 -10.372 1.00 0.00 C ATOM 0 H ALA A 66 7.711 -14.463 -11.356 1.00 0.00 H new ATOM 0 HA ALA A 66 8.957 -12.163 -9.951 1.00 0.00 H new ATOM 0 HB1 ALA A 66 11.022 -13.417 -10.300 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.827 -14.394 -9.414 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.119 -14.698 -11.143 1.00 0.00 H new ATOM 1099 N LEU A 67 9.671 -11.025 -12.081 1.00 0.00 N ATOM 1100 CA LEU A 67 9.990 -10.203 -13.241 1.00 0.00 C ATOM 1101 C LEU A 67 11.433 -9.707 -13.091 1.00 0.00 C ATOM 1102 O LEU A 67 12.095 -10.008 -12.098 1.00 0.00 O ATOM 1103 CB LEU A 67 8.978 -9.042 -13.337 1.00 0.00 C ATOM 1104 CG LEU A 67 7.529 -9.532 -13.541 1.00 0.00 C ATOM 1105 CD1 LEU A 67 6.768 -9.637 -12.236 1.00 0.00 C ATOM 1106 CD2 LEU A 67 6.739 -8.574 -14.429 1.00 0.00 C ATOM 0 H LEU A 67 9.807 -10.521 -11.205 1.00 0.00 H new ATOM 0 HA LEU A 67 9.916 -10.773 -14.167 1.00 0.00 H new ATOM 0 HB2 LEU A 67 9.030 -8.443 -12.428 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.257 -8.390 -14.165 1.00 0.00 H new ATOM 0 HG LEU A 67 7.620 -10.515 -14.004 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.754 -9.986 -12.433 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.273 -10.343 -11.576 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.729 -8.658 -11.758 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.723 -8.948 -14.553 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.709 -7.588 -13.965 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.220 -8.501 -15.404 1.00 0.00 H new ATOM 1118 N ASP A 68 11.935 -8.959 -14.077 1.00 0.00 N ATOM 1119 CA ASP A 68 13.370 -8.681 -14.203 1.00 0.00 C ATOM 1120 C ASP A 68 13.970 -7.948 -12.996 1.00 0.00 C ATOM 1121 O ASP A 68 15.136 -8.179 -12.668 1.00 0.00 O ATOM 1122 CB ASP A 68 13.645 -7.899 -15.488 1.00 0.00 C ATOM 1123 CG ASP A 68 15.159 -7.760 -15.730 1.00 0.00 C ATOM 1124 OD1 ASP A 68 15.822 -8.781 -16.024 1.00 0.00 O ATOM 1125 OD2 ASP A 68 15.692 -6.627 -15.649 1.00 0.00 O ATOM 0 H ASP A 68 11.364 -8.531 -14.806 1.00 0.00 H new ATOM 0 HA ASP A 68 13.864 -9.652 -14.242 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.182 -8.407 -16.334 1.00 0.00 H new ATOM 0 HB3 ASP A 68 13.190 -6.911 -15.422 1.00 0.00 H new ATOM 1130 N LYS A 69 13.182 -7.091 -12.322 1.00 0.00 N ATOM 1131 CA LYS A 69 13.613 -6.309 -11.149 1.00 0.00 C ATOM 1132 C LYS A 69 12.525 -6.214 -10.069 1.00 0.00 C ATOM 1133 O LYS A 69 12.520 -5.279 -9.266 1.00 0.00 O ATOM 1134 CB LYS A 69 14.096 -4.913 -11.580 1.00 0.00 C ATOM 1135 CG LYS A 69 15.320 -4.899 -12.507 1.00 0.00 C ATOM 1136 CD LYS A 69 16.620 -5.361 -11.818 1.00 0.00 C ATOM 1137 CE LYS A 69 17.818 -5.341 -12.780 1.00 0.00 C ATOM 1138 NZ LYS A 69 17.756 -6.423 -13.795 1.00 0.00 N ATOM 0 H LYS A 69 12.211 -6.919 -12.582 1.00 0.00 H new ATOM 0 HA LYS A 69 14.448 -6.843 -10.696 1.00 0.00 H new ATOM 0 HB2 LYS A 69 13.275 -4.402 -12.082 1.00 0.00 H new ATOM 0 HB3 LYS A 69 14.332 -4.336 -10.686 1.00 0.00 H new ATOM 0 HG2 LYS A 69 15.124 -5.543 -13.364 1.00 0.00 H new ATOM 0 HG3 LYS A 69 15.462 -3.890 -12.893 1.00 0.00 H new ATOM 0 HD2 LYS A 69 16.828 -4.714 -10.966 1.00 0.00 H new ATOM 0 HD3 LYS A 69 16.485 -6.370 -11.428 1.00 0.00 H new ATOM 0 HE2 LYS A 69 17.857 -4.376 -13.285 1.00 0.00 H new ATOM 0 HE3 LYS A 69 18.740 -5.438 -12.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 18.634 -6.427 -14.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 17.644 -7.340 -13.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 16.946 -6.260 -14.427 1.00 0.00 H new ATOM 1152 N GLY A 70 11.561 -7.133 -10.053 1.00 0.00 N ATOM 1153 CA GLY A 70 10.420 -7.053 -9.148 1.00 0.00 C ATOM 1154 C GLY A 70 9.506 -8.260 -9.290 1.00 0.00 C ATOM 1155 O GLY A 70 9.858 -9.245 -9.933 1.00 0.00 O ATOM 0 H GLY A 70 11.550 -7.949 -10.664 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.775 -6.984 -8.120 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.856 -6.143 -9.352 1.00 0.00 H new ATOM 1159 N LEU A 71 8.319 -8.187 -8.698 1.00 0.00 N ATOM 1160 CA LEU A 71 7.270 -9.205 -8.734 1.00 0.00 C ATOM 1161 C LEU A 71 5.957 -8.496 -9.050 1.00 0.00 C ATOM 1162 O LEU A 71 5.683 -7.447 -8.471 1.00 0.00 O ATOM 1163 CB LEU A 71 7.066 -9.872 -7.352 1.00 0.00 C ATOM 1164 CG LEU A 71 8.115 -10.854 -6.797 1.00 0.00 C ATOM 1165 CD1 LEU A 71 9.463 -10.209 -6.463 1.00 0.00 C ATOM 1166 CD2 LEU A 71 7.580 -11.469 -5.499 1.00 0.00 C ATOM 0 H LEU A 71 8.046 -7.372 -8.149 1.00 0.00 H new ATOM 0 HA LEU A 71 7.554 -9.959 -9.468 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.956 -9.071 -6.621 1.00 0.00 H new ATOM 0 HB3 LEU A 71 6.115 -10.403 -7.388 1.00 0.00 H new ATOM 0 HG LEU A 71 8.282 -11.589 -7.585 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.144 -10.968 -6.078 1.00 0.00 H new ATOM 0 HD12 LEU A 71 9.886 -9.764 -7.363 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.319 -9.435 -5.709 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.315 -12.166 -5.097 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.394 -10.679 -4.772 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.650 -12.000 -5.704 1.00 0.00 H new ATOM 1178 N GLU A 72 5.115 -9.078 -9.896 1.00 0.00 N ATOM 1179 CA GLU A 72 3.690 -8.778 -9.922 1.00 0.00 C ATOM 1180 C GLU A 72 3.036 -9.825 -9.052 1.00 0.00 C ATOM 1181 O GLU A 72 3.456 -10.986 -9.043 1.00 0.00 O ATOM 1182 CB GLU A 72 3.031 -8.848 -11.309 1.00 0.00 C ATOM 1183 CG GLU A 72 3.231 -7.597 -12.169 1.00 0.00 C ATOM 1184 CD GLU A 72 2.374 -7.661 -13.450 1.00 0.00 C ATOM 1185 OE1 GLU A 72 1.147 -7.411 -13.371 1.00 0.00 O ATOM 1186 OE2 GLU A 72 2.921 -7.933 -14.545 1.00 0.00 O ATOM 0 H GLU A 72 5.403 -9.773 -10.585 1.00 0.00 H new ATOM 0 HA GLU A 72 3.563 -7.749 -9.586 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.430 -9.709 -11.844 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.962 -9.019 -11.182 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.965 -6.710 -11.594 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.283 -7.500 -12.436 1.00 0.00 H new ATOM 1193 N ILE A 73 2.001 -9.424 -8.331 1.00 0.00 N ATOM 1194 CA ILE A 73 1.352 -10.262 -7.354 1.00 0.00 C ATOM 1195 C ILE A 73 -0.139 -9.972 -7.464 1.00 0.00 C ATOM 1196 O ILE A 73 -0.561 -8.822 -7.359 1.00 0.00 O ATOM 1197 CB ILE A 73 1.943 -9.992 -5.955 1.00 0.00 C ATOM 1198 CG1 ILE A 73 3.493 -10.061 -5.964 1.00 0.00 C ATOM 1199 CG2 ILE A 73 1.321 -10.990 -4.965 1.00 0.00 C ATOM 1200 CD1 ILE A 73 4.182 -10.068 -4.611 1.00 0.00 C ATOM 0 H ILE A 73 1.588 -8.495 -8.414 1.00 0.00 H new ATOM 0 HA ILE A 73 1.516 -11.325 -7.530 1.00 0.00 H new ATOM 0 HB ILE A 73 1.696 -8.978 -5.641 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.791 -10.961 -6.502 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.868 -9.210 -6.533 1.00 0.00 H new ATOM 0 HG21 ILE A 73 1.727 -10.815 -3.969 1.00 0.00 H new ATOM 0 HG22 ILE A 73 0.239 -10.856 -4.945 1.00 0.00 H new ATOM 0 HG23 ILE A 73 1.555 -12.007 -5.279 1.00 0.00 H new ATOM 0 HD11 ILE A 73 5.262 -10.118 -4.753 1.00 0.00 H new ATOM 0 HD12 ILE A 73 3.929 -9.157 -4.069 1.00 0.00 H new ATOM 0 HD13 ILE A 73 3.850 -10.934 -4.038 1.00 0.00 H new ATOM 1212 N ILE A 74 -0.924 -11.004 -7.743 1.00 0.00 N ATOM 1213 CA ILE A 74 -2.363 -10.967 -7.952 1.00 0.00 C ATOM 1214 C ILE A 74 -2.976 -11.609 -6.700 1.00 0.00 C ATOM 1215 O ILE A 74 -2.434 -12.577 -6.159 1.00 0.00 O ATOM 1216 CB ILE A 74 -2.697 -11.727 -9.263 1.00 0.00 C ATOM 1217 CG1 ILE A 74 -2.260 -11.034 -10.579 1.00 0.00 C ATOM 1218 CG2 ILE A 74 -4.207 -11.983 -9.396 1.00 0.00 C ATOM 1219 CD1 ILE A 74 -0.759 -10.775 -10.771 1.00 0.00 C ATOM 0 H ILE A 74 -0.548 -11.948 -7.835 1.00 0.00 H new ATOM 0 HA ILE A 74 -2.766 -9.962 -8.075 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.119 -12.645 -9.155 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -2.607 -11.644 -11.413 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.779 -10.078 -10.646 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -4.405 -12.517 -10.325 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -4.550 -12.583 -8.553 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -4.738 -11.031 -9.404 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.594 -10.286 -11.731 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.395 -10.132 -9.969 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.221 -11.722 -10.749 1.00 0.00 H new ATOM 1231 N VAL A 75 -4.109 -11.091 -6.234 1.00 0.00 N ATOM 1232 CA VAL A 75 -4.774 -11.536 -5.021 1.00 0.00 C ATOM 1233 C VAL A 75 -6.273 -11.540 -5.340 1.00 0.00 C ATOM 1234 O VAL A 75 -6.773 -10.559 -5.896 1.00 0.00 O ATOM 1235 CB VAL A 75 -4.409 -10.621 -3.820 1.00 0.00 C ATOM 1236 CG1 VAL A 75 -4.252 -11.443 -2.537 1.00 0.00 C ATOM 1237 CG2 VAL A 75 -3.102 -9.811 -3.968 1.00 0.00 C ATOM 0 H VAL A 75 -4.600 -10.331 -6.704 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.455 -12.534 -4.720 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.242 -9.919 -3.783 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.996 -10.781 -1.710 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.189 -11.955 -2.316 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -3.459 -12.179 -2.671 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -2.945 -9.208 -3.074 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -2.263 -10.495 -4.097 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -3.175 -9.158 -4.838 1.00 0.00 H new ATOM 1247 N THR A 76 -6.988 -12.637 -5.072 1.00 0.00 N ATOM 1248 CA THR A 76 -8.318 -12.863 -5.643 1.00 0.00 C ATOM 1249 C THR A 76 -9.306 -13.346 -4.576 1.00 0.00 C ATOM 1250 O THR A 76 -8.915 -13.715 -3.462 1.00 0.00 O ATOM 1251 CB THR A 76 -8.250 -13.790 -6.892 1.00 0.00 C ATOM 1252 OG1 THR A 76 -8.311 -15.165 -6.611 1.00 0.00 O ATOM 1253 CG2 THR A 76 -6.986 -13.626 -7.746 1.00 0.00 C ATOM 0 H THR A 76 -6.665 -13.386 -4.460 1.00 0.00 H new ATOM 0 HA THR A 76 -8.705 -11.909 -6.001 1.00 0.00 H new ATOM 0 HB THR A 76 -9.138 -13.457 -7.429 1.00 0.00 H new ATOM 0 HG1 THR A 76 -8.264 -15.672 -7.448 1.00 0.00 H new ATOM 0 HG21 THR A 76 -7.027 -14.312 -8.592 1.00 0.00 H new ATOM 0 HG22 THR A 76 -6.924 -12.601 -8.112 1.00 0.00 H new ATOM 0 HG23 THR A 76 -6.107 -13.849 -7.141 1.00 0.00 H new ATOM 1261 N LYS A 77 -10.597 -13.356 -4.927 1.00 0.00 N ATOM 1262 CA LYS A 77 -11.681 -13.990 -4.189 1.00 0.00 C ATOM 1263 C LYS A 77 -12.594 -14.730 -5.151 1.00 0.00 C ATOM 1264 O LYS A 77 -12.546 -14.520 -6.368 1.00 0.00 O ATOM 1265 CB LYS A 77 -12.492 -12.959 -3.406 1.00 0.00 C ATOM 1266 CG LYS A 77 -11.608 -12.213 -2.415 1.00 0.00 C ATOM 1267 CD LYS A 77 -12.511 -11.474 -1.444 1.00 0.00 C ATOM 1268 CE LYS A 77 -11.698 -10.481 -0.605 1.00 0.00 C ATOM 1269 NZ LYS A 77 -11.448 -10.941 0.788 1.00 0.00 N ATOM 0 H LYS A 77 -10.924 -12.897 -5.777 1.00 0.00 H new ATOM 0 HA LYS A 77 -11.243 -14.693 -3.481 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -12.950 -12.250 -4.096 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -13.303 -13.456 -2.874 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -10.963 -12.910 -1.880 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -10.957 -11.513 -2.938 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -13.289 -10.944 -1.993 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -13.012 -12.187 -0.790 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -10.742 -10.301 -1.096 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -12.225 -9.527 -0.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -10.810 -10.272 1.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -12.349 -10.989 1.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -11.009 -11.884 0.769 1.00 0.00 H new ATOM 1283 N ALA A 78 -13.471 -15.539 -4.561 1.00 0.00 N ATOM 1284 CA ALA A 78 -14.603 -16.133 -5.258 1.00 0.00 C ATOM 1285 C ALA A 78 -15.489 -14.993 -5.777 1.00 0.00 C ATOM 1286 O ALA A 78 -15.720 -14.011 -5.066 1.00 0.00 O ATOM 1287 CB ALA A 78 -15.373 -17.057 -4.305 1.00 0.00 C ATOM 0 H ALA A 78 -13.413 -15.801 -3.577 1.00 0.00 H new ATOM 0 HA ALA A 78 -14.269 -16.740 -6.100 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -16.219 -17.499 -4.831 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -14.712 -17.848 -3.952 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.736 -16.481 -3.454 1.00 0.00 H new ATOM 1293 N GLN A 79 -15.966 -15.116 -7.016 1.00 0.00 N ATOM 1294 CA GLN A 79 -16.745 -14.099 -7.717 1.00 0.00 C ATOM 1295 C GLN A 79 -17.541 -14.775 -8.840 1.00 0.00 C ATOM 1296 O GLN A 79 -17.194 -15.881 -9.265 1.00 0.00 O ATOM 1297 CB GLN A 79 -15.802 -12.990 -8.237 1.00 0.00 C ATOM 1298 CG GLN A 79 -14.682 -13.462 -9.185 1.00 0.00 C ATOM 1299 CD GLN A 79 -13.574 -12.411 -9.294 1.00 0.00 C ATOM 1300 OE1 GLN A 79 -13.692 -11.430 -10.026 1.00 0.00 O ATOM 1301 NE2 GLN A 79 -12.484 -12.575 -8.557 1.00 0.00 N ATOM 0 H GLN A 79 -15.815 -15.955 -7.576 1.00 0.00 H new ATOM 0 HA GLN A 79 -17.457 -13.620 -7.045 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -16.401 -12.241 -8.755 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -15.344 -12.495 -7.380 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -14.263 -14.400 -8.820 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -15.097 -13.661 -10.173 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -12.395 -13.392 -7.953 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -11.734 -11.884 -8.594 1.00 0.00 H new ATOM 1310 N LEU A 80 -18.608 -14.121 -9.310 1.00 0.00 N ATOM 1311 CA LEU A 80 -19.560 -14.682 -10.275 1.00 0.00 C ATOM 1312 C LEU A 80 -20.025 -13.559 -11.210 1.00 0.00 C ATOM 1313 O LEU A 80 -21.210 -13.246 -11.310 1.00 0.00 O ATOM 1314 CB LEU A 80 -20.708 -15.392 -9.522 1.00 0.00 C ATOM 1315 CG LEU A 80 -21.653 -16.235 -10.409 1.00 0.00 C ATOM 1316 CD1 LEU A 80 -20.927 -17.385 -11.122 1.00 0.00 C ATOM 1317 CD2 LEU A 80 -22.770 -16.822 -9.536 1.00 0.00 C ATOM 0 H LEU A 80 -18.839 -13.169 -9.025 1.00 0.00 H new ATOM 0 HA LEU A 80 -19.097 -15.446 -10.899 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -20.275 -16.041 -8.760 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -21.300 -14.639 -9.001 1.00 0.00 H new ATOM 0 HG LEU A 80 -22.055 -15.573 -11.175 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -21.639 -17.943 -11.730 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -20.143 -16.979 -11.761 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -20.483 -18.050 -10.381 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -23.441 -17.418 -10.155 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -22.333 -17.453 -8.762 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -23.331 -16.012 -9.069 1.00 0.00 H new ATOM 1329 N SER A 81 -19.062 -12.907 -11.862 1.00 0.00 N ATOM 1330 CA SER A 81 -19.228 -11.739 -12.732 1.00 0.00 C ATOM 1331 C SER A 81 -19.917 -12.067 -14.077 1.00 0.00 C ATOM 1332 O SER A 81 -19.550 -11.517 -15.117 1.00 0.00 O ATOM 1333 CB SER A 81 -17.843 -11.103 -12.936 1.00 0.00 C ATOM 1334 OG SER A 81 -17.114 -11.056 -11.710 1.00 0.00 O ATOM 0 H SER A 81 -18.086 -13.196 -11.794 1.00 0.00 H new ATOM 0 HA SER A 81 -19.902 -11.033 -12.247 1.00 0.00 H new ATOM 0 HB2 SER A 81 -17.282 -11.675 -13.675 1.00 0.00 H new ATOM 0 HB3 SER A 81 -17.957 -10.095 -13.334 1.00 0.00 H new ATOM 0 HG SER A 81 -16.236 -10.649 -11.867 1.00 0.00 H new ATOM 1340 N LYS A 82 -20.878 -13.001 -14.095 1.00 0.00 N ATOM 1341 CA LYS A 82 -21.666 -13.310 -15.288 1.00 0.00 C ATOM 1342 C LYS A 82 -22.511 -12.093 -15.670 1.00 0.00 C ATOM 1343 O LYS A 82 -22.588 -11.736 -16.847 1.00 0.00 O ATOM 1344 CB LYS A 82 -22.560 -14.540 -15.051 1.00 0.00 C ATOM 1345 CG LYS A 82 -21.743 -15.828 -14.841 1.00 0.00 C ATOM 1346 CD LYS A 82 -22.614 -17.071 -14.599 1.00 0.00 C ATOM 1347 CE LYS A 82 -23.451 -17.453 -15.834 1.00 0.00 C ATOM 1348 NZ LYS A 82 -24.237 -18.697 -15.622 1.00 0.00 N ATOM 0 H LYS A 82 -21.128 -13.562 -13.281 1.00 0.00 H new ATOM 0 HA LYS A 82 -20.988 -13.546 -16.108 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -23.189 -14.366 -14.178 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -23.227 -14.671 -15.903 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -21.115 -15.998 -15.716 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -21.075 -15.691 -13.991 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -21.975 -17.910 -14.323 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -23.280 -16.886 -13.756 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -24.129 -16.635 -16.077 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -22.790 -17.585 -16.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -24.783 -18.913 -16.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -23.591 -19.485 -15.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -24.888 -18.564 -14.822 1.00 0.00 H new ATOM 1362 N ASP A 83 -23.120 -11.440 -14.678 1.00 0.00 N ATOM 1363 CA ASP A 83 -23.726 -10.122 -14.839 1.00 0.00 C ATOM 1364 C ASP A 83 -22.597 -9.093 -14.886 1.00 0.00 C ATOM 1365 O ASP A 83 -21.946 -8.845 -13.865 1.00 0.00 O ATOM 1366 CB ASP A 83 -24.683 -9.815 -13.680 1.00 0.00 C ATOM 1367 CG ASP A 83 -25.165 -8.352 -13.732 1.00 0.00 C ATOM 1368 OD1 ASP A 83 -25.547 -7.876 -14.827 1.00 0.00 O ATOM 1369 OD2 ASP A 83 -25.188 -7.684 -12.670 1.00 0.00 O ATOM 0 H ASP A 83 -23.206 -11.816 -13.734 1.00 0.00 H new ATOM 0 HA ASP A 83 -24.310 -10.089 -15.759 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -25.541 -10.486 -13.725 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -24.181 -10.003 -12.731 1.00 0.00 H new ATOM 1374 N LEU A 84 -22.321 -8.545 -16.075 1.00 0.00 N ATOM 1375 CA LEU A 84 -21.241 -7.578 -16.291 1.00 0.00 C ATOM 1376 C LEU A 84 -21.485 -6.745 -17.550 1.00 0.00 C ATOM 1377 O LEU A 84 -21.241 -5.539 -17.542 1.00 0.00 O ATOM 1378 CB LEU A 84 -19.902 -8.333 -16.416 1.00 0.00 C ATOM 1379 CG LEU A 84 -18.653 -7.430 -16.472 1.00 0.00 C ATOM 1380 CD1 LEU A 84 -18.418 -6.701 -15.142 1.00 0.00 C ATOM 1381 CD2 LEU A 84 -17.416 -8.279 -16.792 1.00 0.00 C ATOM 0 H LEU A 84 -22.847 -8.763 -16.922 1.00 0.00 H new ATOM 0 HA LEU A 84 -21.209 -6.898 -15.440 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -19.804 -9.013 -15.570 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -19.930 -8.947 -17.316 1.00 0.00 H new ATOM 0 HG LEU A 84 -18.821 -6.686 -17.250 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -17.529 -6.075 -15.222 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -19.282 -6.077 -14.912 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -18.276 -7.432 -14.346 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -16.535 -7.638 -16.831 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -17.282 -9.033 -16.017 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -17.551 -8.769 -17.756 1.00 0.00 H new ATOM 1393 N ASP A 85 -21.968 -7.379 -18.628 1.00 0.00 N ATOM 1394 CA ASP A 85 -22.154 -6.725 -19.930 1.00 0.00 C ATOM 1395 C ASP A 85 -23.278 -5.677 -19.922 1.00 0.00 C ATOM 1396 O ASP A 85 -23.244 -4.723 -20.706 1.00 0.00 O ATOM 1397 CB ASP A 85 -22.461 -7.790 -20.991 1.00 0.00 C ATOM 1398 CG ASP A 85 -22.671 -7.165 -22.383 1.00 0.00 C ATOM 1399 OD1 ASP A 85 -21.676 -6.717 -23.005 1.00 0.00 O ATOM 1400 OD2 ASP A 85 -23.820 -7.175 -22.887 1.00 0.00 O ATOM 0 H ASP A 85 -22.241 -8.362 -18.621 1.00 0.00 H new ATOM 0 HA ASP A 85 -21.228 -6.199 -20.160 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -21.641 -8.507 -21.034 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -23.354 -8.344 -20.702 1.00 0.00 H new ATOM 1405 N LYS A 86 -24.279 -5.842 -19.047 1.00 0.00 N ATOM 1406 CA LYS A 86 -25.435 -4.947 -18.969 1.00 0.00 C ATOM 1407 C LYS A 86 -24.999 -3.525 -18.604 1.00 0.00 C ATOM 1408 O LYS A 86 -24.044 -3.329 -17.844 1.00 0.00 O ATOM 1409 CB LYS A 86 -26.474 -5.469 -17.973 1.00 0.00 C ATOM 1410 CG LYS A 86 -27.078 -6.823 -18.371 1.00 0.00 C ATOM 1411 CD LYS A 86 -27.732 -6.866 -19.759 1.00 0.00 C ATOM 1412 CE LYS A 86 -28.483 -8.195 -19.920 1.00 0.00 C ATOM 1413 NZ LYS A 86 -29.201 -8.291 -21.217 1.00 0.00 N ATOM 0 H LYS A 86 -24.307 -6.605 -18.371 1.00 0.00 H new ATOM 0 HA LYS A 86 -25.901 -4.919 -19.954 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -26.010 -5.562 -16.991 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -27.275 -4.736 -17.879 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -26.293 -7.578 -18.334 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -27.824 -7.102 -17.627 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -28.420 -6.029 -19.876 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -26.973 -6.766 -20.535 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -27.776 -9.020 -19.838 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -29.197 -8.306 -19.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -29.691 -9.206 -21.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -29.896 -7.521 -21.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -28.519 -8.213 -21.998 1.00 0.00 H new ATOM 1427 N LEU A 87 -25.728 -2.534 -19.126 1.00 0.00 N ATOM 1428 CA LEU A 87 -25.532 -1.131 -18.787 1.00 0.00 C ATOM 1429 C LEU A 87 -25.904 -0.902 -17.317 1.00 0.00 C ATOM 1430 O LEU A 87 -26.694 -1.653 -16.735 1.00 0.00 O ATOM 1431 CB LEU A 87 -26.394 -0.236 -19.706 1.00 0.00 C ATOM 1432 CG LEU A 87 -25.824 0.128 -21.090 1.00 0.00 C ATOM 1433 CD1 LEU A 87 -24.520 0.921 -20.970 1.00 0.00 C ATOM 1434 CD2 LEU A 87 -25.613 -1.097 -21.981 1.00 0.00 C ATOM 0 H LEU A 87 -26.476 -2.690 -19.801 1.00 0.00 H new ATOM 0 HA LEU A 87 -24.484 -0.868 -18.934 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -27.351 -0.735 -19.858 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -26.600 0.692 -19.173 1.00 0.00 H new ATOM 0 HG LEU A 87 -26.575 0.757 -21.568 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -24.147 1.160 -21.966 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -24.705 1.844 -20.420 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -23.779 0.324 -20.439 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -25.210 -0.782 -22.943 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -24.913 -1.780 -21.500 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -26.566 -1.603 -22.135 1.00 0.00 H new ATOM 1446 N VAL A 88 -25.381 0.183 -16.743 1.00 0.00 N ATOM 1447 CA VAL A 88 -25.653 0.630 -15.376 1.00 0.00 C ATOM 1448 C VAL A 88 -25.829 2.162 -15.389 1.00 0.00 C ATOM 1449 O VAL A 88 -25.416 2.810 -16.360 1.00 0.00 O ATOM 1450 CB VAL A 88 -24.527 0.163 -14.416 1.00 0.00 C ATOM 1451 CG1 VAL A 88 -24.417 -1.369 -14.334 1.00 0.00 C ATOM 1452 CG2 VAL A 88 -23.155 0.744 -14.779 1.00 0.00 C ATOM 0 H VAL A 88 -24.732 0.797 -17.236 1.00 0.00 H new ATOM 0 HA VAL A 88 -26.574 0.183 -15.002 1.00 0.00 H new ATOM 0 HB VAL A 88 -24.820 0.548 -13.439 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -23.614 -1.640 -13.649 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -25.358 -1.782 -13.972 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -24.201 -1.772 -15.324 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -22.408 0.382 -14.072 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -22.883 0.431 -15.787 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -23.198 1.832 -14.736 1.00 0.00 H new ATOM 1462 N PRO A 89 -26.448 2.753 -14.348 1.00 0.00 N ATOM 1463 CA PRO A 89 -26.594 4.196 -14.196 1.00 0.00 C ATOM 1464 C PRO A 89 -25.263 4.955 -14.287 1.00 0.00 C ATOM 1465 O PRO A 89 -24.191 4.411 -13.983 1.00 0.00 O ATOM 1466 CB PRO A 89 -27.250 4.406 -12.828 1.00 0.00 C ATOM 1467 CG PRO A 89 -27.995 3.103 -12.569 1.00 0.00 C ATOM 1468 CD PRO A 89 -27.131 2.062 -13.268 1.00 0.00 C ATOM 0 HA PRO A 89 -27.196 4.596 -15.012 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -26.506 4.600 -12.055 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -27.929 5.258 -12.838 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -28.089 2.898 -11.503 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -29.005 3.129 -12.978 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -26.415 1.623 -12.574 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -27.742 1.246 -13.654 1.00 0.00 H new ATOM 1476 N ARG A 90 -25.349 6.239 -14.645 1.00 0.00 N ATOM 1477 CA ARG A 90 -24.235 7.176 -14.749 1.00 0.00 C ATOM 1478 C ARG A 90 -24.698 8.523 -14.207 1.00 0.00 C ATOM 1479 O ARG A 90 -25.843 8.932 -14.512 1.00 0.00 O ATOM 1480 CB ARG A 90 -23.745 7.311 -16.187 1.00 0.00 C ATOM 1481 CG ARG A 90 -22.965 6.058 -16.621 1.00 0.00 C ATOM 1482 CD ARG A 90 -22.337 6.310 -17.985 1.00 0.00 C ATOM 1483 NE ARG A 90 -21.138 7.168 -17.911 1.00 0.00 N ATOM 1484 CZ ARG A 90 -20.471 7.688 -18.951 1.00 0.00 C ATOM 1485 NH1 ARG A 90 -20.863 7.448 -20.202 1.00 0.00 N ATOM 1486 NH2 ARG A 90 -19.402 8.450 -18.735 1.00 0.00 N ATOM 1487 OXT ARG A 90 -23.931 9.159 -13.454 1.00 0.00 O ATOM 0 H ARG A 90 -26.242 6.671 -14.881 1.00 0.00 H new ATOM 0 HA ARG A 90 -23.393 6.803 -14.166 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -24.595 7.464 -16.852 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -23.107 8.191 -16.277 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -22.192 5.824 -15.889 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -23.632 5.197 -16.667 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -22.068 5.356 -18.439 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -23.073 6.778 -18.639 1.00 0.00 H new ATOM 0 HE ARG A 90 -20.783 7.386 -16.980 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -21.680 6.862 -20.377 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -20.346 7.850 -20.984 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -19.093 8.636 -17.781 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -18.891 8.848 -19.523 1.00 0.00 H new TER 1501 ARG A 90