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 1 MET CE :methyl -149:sc= -1.01 (180deg=-1.71) USER MOD Set 1.2: A 15 MET CE :methyl 177:sc= -0.0353 (180deg=-0.0488) USER MOD Single : A 1 MET N :NH3+ 171:sc= 1.21 (180deg=1.1) USER MOD Single : A 7 ASN : amide:sc= 1.36 K(o=1.4,f=-9.7!) USER MOD Single : A 9 HIS : no HE2:sc= 0.827 K(o=0.83,f=-3.8!) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 1.26 (180deg=1.26) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -28:sc= 0.284 USER MOD Single : A 17 TYR OH : rot 82:sc= 0.335 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 1.93 K(o=1.9,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0.00266 USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 HIS : no HD1:sc= -0.173 X(o=-0.17,f=-0.014) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 65 GLN : amide:sc= -0.262 X(o=-0.26,f=-0.0029) USER MOD Single : A 69 LYS NZ :NH3+ -169:sc= 1.19 (180deg=1.15) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.65 USER MOD Single : A 77 LYS NZ :NH3+ -179:sc= 1.16 (180deg=1.16) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0.0981 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 179:sc= 1.28 (180deg=1.28) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.782 0.651 -3.804 1.00 0.00 N ATOM 2 CA MET A 1 5.079 -0.478 -4.477 1.00 0.00 C ATOM 3 C MET A 1 3.791 0.001 -5.169 1.00 0.00 C ATOM 4 O MET A 1 3.275 1.075 -4.865 1.00 0.00 O ATOM 5 CB MET A 1 4.846 -1.705 -3.558 1.00 0.00 C ATOM 6 CG MET A 1 3.972 -1.448 -2.319 1.00 0.00 C ATOM 7 SD MET A 1 3.778 -2.836 -1.164 1.00 0.00 S ATOM 8 CE MET A 1 3.206 -4.125 -2.288 1.00 0.00 C ATOM 0 H1 MET A 1 6.559 0.278 -3.221 1.00 0.00 H new ATOM 0 H2 MET A 1 6.167 1.298 -4.522 1.00 0.00 H new ATOM 0 H3 MET A 1 5.111 1.166 -3.198 1.00 0.00 H new ATOM 0 HA MET A 1 5.753 -0.840 -5.253 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.385 -2.497 -4.148 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.815 -2.078 -3.226 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.395 -0.605 -1.772 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.981 -1.144 -2.657 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.546 -4.808 -1.753 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.663 -3.670 -3.117 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.063 -4.677 -2.675 1.00 0.00 H new ATOM 20 N GLU A 2 3.277 -0.785 -6.120 1.00 0.00 N ATOM 21 CA GLU A 2 2.488 -0.303 -7.253 1.00 0.00 C ATOM 22 C GLU A 2 1.175 -1.100 -7.291 1.00 0.00 C ATOM 23 O GLU A 2 1.066 -2.090 -8.012 1.00 0.00 O ATOM 24 CB GLU A 2 3.374 -0.451 -8.521 1.00 0.00 C ATOM 25 CG GLU A 2 4.074 0.849 -8.948 1.00 0.00 C ATOM 26 CD GLU A 2 4.975 1.469 -7.860 1.00 0.00 C ATOM 27 OE1 GLU A 2 5.841 0.764 -7.284 1.00 0.00 O ATOM 28 OE2 GLU A 2 4.825 2.681 -7.572 1.00 0.00 O ATOM 0 H GLU A 2 3.402 -1.797 -6.122 1.00 0.00 H new ATOM 0 HA GLU A 2 2.204 0.747 -7.180 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.129 -1.215 -8.337 1.00 0.00 H new ATOM 0 HB3 GLU A 2 2.755 -0.806 -9.345 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.678 0.649 -9.833 1.00 0.00 H new ATOM 0 HG3 GLU A 2 3.317 1.578 -9.236 1.00 0.00 H new ATOM 35 N ILE A 3 0.221 -0.747 -6.418 1.00 0.00 N ATOM 36 CA ILE A 3 -1.060 -1.449 -6.256 1.00 0.00 C ATOM 37 C ILE A 3 -2.008 -1.075 -7.409 1.00 0.00 C ATOM 38 O ILE A 3 -1.942 0.028 -7.958 1.00 0.00 O ATOM 39 CB ILE A 3 -1.661 -1.146 -4.848 1.00 0.00 C ATOM 40 CG1 ILE A 3 -0.956 -1.924 -3.713 1.00 0.00 C ATOM 41 CG2 ILE A 3 -3.158 -1.499 -4.705 1.00 0.00 C ATOM 42 CD1 ILE A 3 0.517 -1.598 -3.476 1.00 0.00 C ATOM 0 H ILE A 3 0.321 0.052 -5.791 1.00 0.00 H new ATOM 0 HA ILE A 3 -0.907 -2.527 -6.306 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.512 -0.070 -4.760 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.499 -1.741 -2.786 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.039 -2.990 -3.927 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.494 -1.257 -3.697 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -3.738 -0.926 -5.428 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.300 -2.564 -4.889 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.897 -2.207 -2.656 1.00 0.00 H new ATOM 0 HD12 ILE A 3 1.087 -1.810 -4.381 1.00 0.00 H new ATOM 0 HD13 ILE A 3 0.620 -0.543 -3.222 1.00 0.00 H new ATOM 54 N GLU A 4 -2.938 -1.983 -7.714 1.00 0.00 N ATOM 55 CA GLU A 4 -4.059 -1.822 -8.615 1.00 0.00 C ATOM 56 C GLU A 4 -5.309 -2.399 -7.932 1.00 0.00 C ATOM 57 O GLU A 4 -5.219 -3.297 -7.089 1.00 0.00 O ATOM 58 CB GLU A 4 -3.714 -2.575 -9.902 1.00 0.00 C ATOM 59 CG GLU A 4 -4.794 -2.479 -10.972 1.00 0.00 C ATOM 60 CD GLU A 4 -5.104 -1.034 -11.401 1.00 0.00 C ATOM 61 OE1 GLU A 4 -5.950 -0.388 -10.736 1.00 0.00 O ATOM 62 OE2 GLU A 4 -4.514 -0.544 -12.396 1.00 0.00 O ATOM 0 H GLU A 4 -2.917 -2.916 -7.302 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.258 -0.778 -8.856 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -2.780 -2.182 -10.304 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.542 -3.625 -9.664 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -4.481 -3.050 -11.846 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.707 -2.943 -10.599 1.00 0.00 H new ATOM 69 N ARG A 5 -6.494 -1.939 -8.336 1.00 0.00 N ATOM 70 CA ARG A 5 -7.792 -2.411 -7.856 1.00 0.00 C ATOM 71 C ARG A 5 -8.572 -2.843 -9.103 1.00 0.00 C ATOM 72 O ARG A 5 -9.229 -2.015 -9.732 1.00 0.00 O ATOM 73 CB ARG A 5 -8.474 -1.281 -7.046 1.00 0.00 C ATOM 74 CG ARG A 5 -9.747 -1.732 -6.310 1.00 0.00 C ATOM 75 CD ARG A 5 -9.501 -2.507 -5.001 1.00 0.00 C ATOM 76 NE ARG A 5 -9.256 -1.622 -3.845 1.00 0.00 N ATOM 77 CZ ARG A 5 -8.088 -1.239 -3.310 1.00 0.00 C ATOM 78 NH1 ARG A 5 -6.903 -1.604 -3.794 1.00 0.00 N ATOM 79 NH2 ARG A 5 -8.079 -0.473 -2.237 1.00 0.00 N ATOM 0 H ARG A 5 -6.578 -1.199 -9.033 1.00 0.00 H new ATOM 0 HA ARG A 5 -7.724 -3.259 -7.175 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -7.764 -0.888 -6.318 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -8.725 -0.463 -7.721 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -10.350 -0.852 -6.086 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -10.334 -2.359 -6.981 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -10.364 -3.139 -4.791 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -8.645 -3.169 -5.132 1.00 0.00 H new ATOM 0 HE ARG A 5 -10.090 -1.251 -3.391 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -6.851 -2.207 -4.615 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -6.047 -1.281 -3.344 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -8.959 -0.174 -1.817 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -7.192 -0.180 -1.827 1.00 0.00 H new ATOM 93 N ILE A 6 -8.437 -4.118 -9.510 1.00 0.00 N ATOM 94 CA ILE A 6 -9.074 -4.642 -10.720 1.00 0.00 C ATOM 95 C ILE A 6 -10.586 -4.483 -10.571 1.00 0.00 C ATOM 96 O ILE A 6 -11.263 -3.905 -11.424 1.00 0.00 O ATOM 97 CB ILE A 6 -8.681 -6.123 -10.907 1.00 0.00 C ATOM 98 CG1 ILE A 6 -7.153 -6.323 -10.915 1.00 0.00 C ATOM 99 CG2 ILE A 6 -9.331 -6.733 -12.157 1.00 0.00 C ATOM 100 CD1 ILE A 6 -6.404 -5.529 -11.983 1.00 0.00 C ATOM 0 H ILE A 6 -7.882 -4.810 -9.006 1.00 0.00 H new ATOM 0 HA ILE A 6 -8.744 -4.095 -11.603 1.00 0.00 H new ATOM 0 HB ILE A 6 -9.070 -6.659 -10.041 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -6.760 -6.047 -9.936 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -6.941 -7.383 -11.056 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -9.029 -7.776 -12.252 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -10.416 -6.676 -12.067 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -9.010 -6.180 -13.040 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.336 -5.736 -11.908 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -6.762 -5.820 -12.971 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -6.578 -4.463 -11.833 1.00 0.00 H new ATOM 112 N ASN A 7 -11.082 -5.000 -9.451 1.00 0.00 N ATOM 113 CA ASN A 7 -12.461 -4.906 -8.999 1.00 0.00 C ATOM 114 C ASN A 7 -12.455 -5.110 -7.474 1.00 0.00 C ATOM 115 O ASN A 7 -11.406 -4.995 -6.838 1.00 0.00 O ATOM 116 CB ASN A 7 -13.360 -5.890 -9.793 1.00 0.00 C ATOM 117 CG ASN A 7 -13.209 -7.374 -9.470 1.00 0.00 C ATOM 118 OD1 ASN A 7 -12.445 -7.771 -8.604 1.00 0.00 O ATOM 119 ND2 ASN A 7 -13.944 -8.234 -10.153 1.00 0.00 N ATOM 0 H ASN A 7 -10.498 -5.525 -8.800 1.00 0.00 H new ATOM 0 HA ASN A 7 -12.899 -3.928 -9.197 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -14.400 -5.610 -9.626 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -13.159 -5.751 -10.855 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -13.874 -9.233 -9.957 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.581 -7.899 -10.876 1.00 0.00 H new ATOM 126 N GLU A 8 -13.608 -5.388 -6.865 1.00 0.00 N ATOM 127 CA GLU A 8 -13.732 -5.521 -5.412 1.00 0.00 C ATOM 128 C GLU A 8 -13.101 -6.817 -4.858 1.00 0.00 C ATOM 129 O GLU A 8 -12.954 -6.974 -3.645 1.00 0.00 O ATOM 130 CB GLU A 8 -15.228 -5.418 -5.072 1.00 0.00 C ATOM 131 CG GLU A 8 -15.510 -5.299 -3.571 1.00 0.00 C ATOM 132 CD GLU A 8 -16.831 -4.553 -3.298 1.00 0.00 C ATOM 133 OE1 GLU A 8 -17.913 -5.186 -3.306 1.00 0.00 O ATOM 134 OE2 GLU A 8 -16.797 -3.317 -3.076 1.00 0.00 O ATOM 0 H GLU A 8 -14.485 -5.528 -7.366 1.00 0.00 H new ATOM 0 HA GLU A 8 -13.170 -4.722 -4.929 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -15.649 -4.551 -5.582 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -15.742 -6.297 -5.461 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -15.556 -6.294 -3.129 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -14.688 -4.773 -3.087 1.00 0.00 H new ATOM 141 N HIS A 9 -12.706 -7.754 -5.728 1.00 0.00 N ATOM 142 CA HIS A 9 -12.410 -9.140 -5.353 1.00 0.00 C ATOM 143 C HIS A 9 -11.023 -9.581 -5.821 1.00 0.00 C ATOM 144 O HIS A 9 -10.308 -10.234 -5.060 1.00 0.00 O ATOM 145 CB HIS A 9 -13.502 -10.047 -5.929 1.00 0.00 C ATOM 146 CG HIS A 9 -14.896 -9.667 -5.479 1.00 0.00 C ATOM 147 ND1 HIS A 9 -15.942 -9.309 -6.307 1.00 0.00 N ATOM 148 CD2 HIS A 9 -15.339 -9.533 -4.187 1.00 0.00 C ATOM 149 CE1 HIS A 9 -16.989 -8.976 -5.534 1.00 0.00 C ATOM 150 NE2 HIS A 9 -16.674 -9.111 -4.235 1.00 0.00 N ATOM 0 H HIS A 9 -12.582 -7.568 -6.723 1.00 0.00 H new ATOM 0 HA HIS A 9 -12.401 -9.215 -4.266 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -13.457 -10.012 -7.017 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -13.301 -11.077 -5.635 1.00 0.00 H new ATOM 0 HD1 HIS A 9 -15.923 -9.299 -7.327 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -14.762 -9.719 -3.293 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -17.948 -8.646 -5.904 1.00 0.00 H new ATOM 158 N THR A 10 -10.621 -9.200 -7.027 1.00 0.00 N ATOM 159 CA THR A 10 -9.244 -9.279 -7.481 1.00 0.00 C ATOM 160 C THR A 10 -8.578 -7.943 -7.189 1.00 0.00 C ATOM 161 O THR A 10 -9.090 -6.877 -7.545 1.00 0.00 O ATOM 162 CB THR A 10 -9.191 -9.591 -8.984 1.00 0.00 C ATOM 163 OG1 THR A 10 -9.920 -10.784 -9.238 1.00 0.00 O ATOM 164 CG2 THR A 10 -7.750 -9.771 -9.485 1.00 0.00 C ATOM 0 H THR A 10 -11.257 -8.821 -7.728 1.00 0.00 H new ATOM 0 HA THR A 10 -8.721 -10.081 -6.960 1.00 0.00 H new ATOM 0 HB THR A 10 -9.629 -8.746 -9.515 1.00 0.00 H new ATOM 0 HG1 THR A 10 -9.891 -10.987 -10.196 1.00 0.00 H new ATOM 0 HG21 THR A 10 -7.761 -9.990 -10.553 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.186 -8.855 -9.308 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.279 -10.596 -8.950 1.00 0.00 H new ATOM 172 N VAL A 11 -7.373 -8.009 -6.639 1.00 0.00 N ATOM 173 CA VAL A 11 -6.454 -6.887 -6.558 1.00 0.00 C ATOM 174 C VAL A 11 -5.137 -7.406 -7.121 1.00 0.00 C ATOM 175 O VAL A 11 -4.888 -8.615 -7.116 1.00 0.00 O ATOM 176 CB VAL A 11 -6.372 -6.349 -5.109 1.00 0.00 C ATOM 177 CG1 VAL A 11 -7.762 -5.954 -4.582 1.00 0.00 C ATOM 178 CG2 VAL A 11 -5.769 -7.342 -4.110 1.00 0.00 C ATOM 0 H VAL A 11 -7.001 -8.865 -6.228 1.00 0.00 H new ATOM 0 HA VAL A 11 -6.776 -6.021 -7.136 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.713 -5.484 -5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.672 -5.580 -3.562 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -8.185 -5.176 -5.218 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.416 -6.826 -4.592 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -5.746 -6.891 -3.118 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -6.377 -8.246 -4.084 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -4.754 -7.596 -4.417 1.00 0.00 H new ATOM 188 N LYS A 12 -4.267 -6.530 -7.611 1.00 0.00 N ATOM 189 CA LYS A 12 -2.906 -6.937 -7.904 1.00 0.00 C ATOM 190 C LYS A 12 -1.979 -5.810 -7.535 1.00 0.00 C ATOM 191 O LYS A 12 -2.426 -4.700 -7.269 1.00 0.00 O ATOM 192 CB LYS A 12 -2.761 -7.410 -9.361 1.00 0.00 C ATOM 193 CG LYS A 12 -2.670 -6.318 -10.421 1.00 0.00 C ATOM 194 CD LYS A 12 -2.428 -6.961 -11.799 1.00 0.00 C ATOM 195 CE LYS A 12 -2.051 -5.861 -12.791 1.00 0.00 C ATOM 196 NZ LYS A 12 -1.417 -6.393 -14.025 1.00 0.00 N ATOM 0 H LYS A 12 -4.478 -5.552 -7.809 1.00 0.00 H new ATOM 0 HA LYS A 12 -2.632 -7.804 -7.304 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -1.868 -8.030 -9.432 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.612 -8.048 -9.600 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -3.590 -5.734 -10.437 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -1.859 -5.630 -10.181 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -1.632 -7.703 -11.736 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.324 -7.483 -12.135 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.945 -5.299 -13.060 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -1.368 -5.162 -12.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.182 -5.605 -14.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -0.548 -6.907 -13.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.076 -7.040 -14.503 1.00 0.00 H new ATOM 210 N PHE A 13 -0.692 -6.087 -7.539 1.00 0.00 N ATOM 211 CA PHE A 13 0.319 -5.077 -7.367 1.00 0.00 C ATOM 212 C PHE A 13 1.596 -5.536 -8.043 1.00 0.00 C ATOM 213 O PHE A 13 1.789 -6.723 -8.314 1.00 0.00 O ATOM 214 CB PHE A 13 0.527 -4.793 -5.874 1.00 0.00 C ATOM 215 CG PHE A 13 0.958 -5.968 -5.027 1.00 0.00 C ATOM 216 CD1 PHE A 13 -0.001 -6.890 -4.570 1.00 0.00 C ATOM 217 CD2 PHE A 13 2.297 -6.096 -4.636 1.00 0.00 C ATOM 218 CE1 PHE A 13 0.358 -7.881 -3.642 1.00 0.00 C ATOM 219 CE2 PHE A 13 2.662 -7.106 -3.731 1.00 0.00 C ATOM 220 CZ PHE A 13 1.685 -7.968 -3.198 1.00 0.00 C ATOM 0 H PHE A 13 -0.320 -7.029 -7.663 1.00 0.00 H new ATOM 0 HA PHE A 13 0.005 -4.143 -7.832 1.00 0.00 H new ATOM 0 HB2 PHE A 13 1.275 -4.006 -5.775 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -0.404 -4.400 -5.467 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -1.016 -6.836 -4.934 1.00 0.00 H new ATOM 0 HD2 PHE A 13 3.044 -5.422 -5.028 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -0.384 -8.573 -3.272 1.00 0.00 H new ATOM 0 HE2 PHE A 13 3.696 -7.222 -3.443 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.957 -8.696 -2.448 1.00 0.00 H new ATOM 230 N TYR A 14 2.494 -4.588 -8.261 1.00 0.00 N ATOM 231 CA TYR A 14 3.849 -4.836 -8.669 1.00 0.00 C ATOM 232 C TYR A 14 4.744 -4.356 -7.529 1.00 0.00 C ATOM 233 O TYR A 14 4.434 -3.370 -6.848 1.00 0.00 O ATOM 234 CB TYR A 14 4.075 -4.116 -9.997 1.00 0.00 C ATOM 235 CG TYR A 14 5.524 -4.117 -10.394 1.00 0.00 C ATOM 236 CD1 TYR A 14 6.091 -5.297 -10.894 1.00 0.00 C ATOM 237 CD2 TYR A 14 6.319 -2.984 -10.162 1.00 0.00 C ATOM 238 CE1 TYR A 14 7.454 -5.356 -11.202 1.00 0.00 C ATOM 239 CE2 TYR A 14 7.693 -3.028 -10.469 1.00 0.00 C ATOM 240 CZ TYR A 14 8.265 -4.211 -11.005 1.00 0.00 C ATOM 241 OH TYR A 14 9.593 -4.231 -11.328 1.00 0.00 O ATOM 0 H TYR A 14 2.283 -3.596 -8.153 1.00 0.00 H new ATOM 0 HA TYR A 14 4.078 -5.887 -8.846 1.00 0.00 H new ATOM 0 HB2 TYR A 14 3.484 -4.598 -10.776 1.00 0.00 H new ATOM 0 HB3 TYR A 14 3.721 -3.088 -9.918 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.470 -6.168 -11.043 1.00 0.00 H new ATOM 0 HD2 TYR A 14 5.881 -2.086 -9.752 1.00 0.00 H new ATOM 0 HE1 TYR A 14 7.885 -6.268 -11.587 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.312 -2.160 -10.296 1.00 0.00 H new ATOM 0 HH TYR A 14 9.992 -3.359 -11.127 1.00 0.00 H new ATOM 251 N MET A 15 5.831 -5.079 -7.285 1.00 0.00 N ATOM 252 CA MET A 15 6.755 -4.841 -6.195 1.00 0.00 C ATOM 253 C MET A 15 8.168 -4.984 -6.741 1.00 0.00 C ATOM 254 O MET A 15 8.611 -6.089 -7.050 1.00 0.00 O ATOM 255 CB MET A 15 6.485 -5.874 -5.099 1.00 0.00 C ATOM 256 CG MET A 15 7.166 -5.522 -3.799 1.00 0.00 C ATOM 257 SD MET A 15 6.676 -6.619 -2.449 1.00 0.00 S ATOM 258 CE MET A 15 6.755 -5.442 -1.078 1.00 0.00 C ATOM 0 H MET A 15 6.098 -5.875 -7.865 1.00 0.00 H new ATOM 0 HA MET A 15 6.633 -3.844 -5.773 1.00 0.00 H new ATOM 0 HB2 MET A 15 5.410 -5.953 -4.934 1.00 0.00 H new ATOM 0 HB3 MET A 15 6.829 -6.853 -5.433 1.00 0.00 H new ATOM 0 HG2 MET A 15 8.247 -5.573 -3.932 1.00 0.00 H new ATOM 0 HG3 MET A 15 6.926 -4.493 -3.533 1.00 0.00 H new ATOM 0 HE1 MET A 15 6.430 -5.931 -0.160 1.00 0.00 H new ATOM 0 HE2 MET A 15 7.780 -5.090 -0.959 1.00 0.00 H new ATOM 0 HE3 MET A 15 6.103 -4.594 -1.288 1.00 0.00 H new ATOM 268 N SER A 16 8.879 -3.873 -6.873 1.00 0.00 N ATOM 269 CA SER A 16 10.283 -3.895 -7.256 1.00 0.00 C ATOM 270 C SER A 16 11.094 -4.513 -6.117 1.00 0.00 C ATOM 271 O SER A 16 10.714 -4.390 -4.947 1.00 0.00 O ATOM 272 CB SER A 16 10.774 -2.470 -7.550 1.00 0.00 C ATOM 273 OG SER A 16 9.796 -1.693 -8.225 1.00 0.00 O ATOM 0 H SER A 16 8.502 -2.938 -6.719 1.00 0.00 H new ATOM 0 HA SER A 16 10.410 -4.491 -8.160 1.00 0.00 H new ATOM 0 HB2 SER A 16 11.042 -1.980 -6.614 1.00 0.00 H new ATOM 0 HB3 SER A 16 11.679 -2.517 -8.156 1.00 0.00 H new ATOM 0 HG SER A 16 9.215 -2.282 -8.750 1.00 0.00 H new ATOM 279 N TYR A 17 12.248 -5.104 -6.435 1.00 0.00 N ATOM 280 CA TYR A 17 13.161 -5.652 -5.433 1.00 0.00 C ATOM 281 C TYR A 17 13.499 -4.637 -4.349 1.00 0.00 C ATOM 282 O TYR A 17 13.541 -4.993 -3.177 1.00 0.00 O ATOM 283 CB TYR A 17 14.457 -6.151 -6.081 1.00 0.00 C ATOM 284 CG TYR A 17 14.317 -7.265 -7.092 1.00 0.00 C ATOM 285 CD1 TYR A 17 13.273 -8.207 -7.007 1.00 0.00 C ATOM 286 CD2 TYR A 17 15.272 -7.376 -8.120 1.00 0.00 C ATOM 287 CE1 TYR A 17 13.190 -9.253 -7.937 1.00 0.00 C ATOM 288 CE2 TYR A 17 15.195 -8.426 -9.047 1.00 0.00 C ATOM 289 CZ TYR A 17 14.156 -9.375 -8.959 1.00 0.00 C ATOM 290 OH TYR A 17 14.130 -10.421 -9.829 1.00 0.00 O ATOM 0 H TYR A 17 12.575 -5.215 -7.395 1.00 0.00 H new ATOM 0 HA TYR A 17 12.642 -6.490 -4.969 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.942 -5.306 -6.569 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.126 -6.490 -5.290 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.535 -8.123 -6.223 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.068 -6.650 -8.195 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.384 -9.968 -7.871 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.934 -8.508 -9.830 1.00 0.00 H new ATOM 0 HH TYR A 17 13.488 -10.235 -10.546 1.00 0.00 H new ATOM 300 N GLY A 18 13.677 -3.366 -4.711 1.00 0.00 N ATOM 301 CA GLY A 18 14.059 -2.344 -3.752 1.00 0.00 C ATOM 302 C GLY A 18 12.995 -2.088 -2.680 1.00 0.00 C ATOM 303 O GLY A 18 13.343 -1.683 -1.574 1.00 0.00 O ATOM 0 H GLY A 18 13.561 -3.025 -5.665 1.00 0.00 H new ATOM 0 HA2 GLY A 18 14.989 -2.641 -3.267 1.00 0.00 H new ATOM 0 HA3 GLY A 18 14.260 -1.414 -4.284 1.00 0.00 H new ATOM 307 N ASP A 19 11.714 -2.360 -2.959 1.00 0.00 N ATOM 308 CA ASP A 19 10.650 -2.233 -1.953 1.00 0.00 C ATOM 309 C ASP A 19 10.807 -3.320 -0.885 1.00 0.00 C ATOM 310 O ASP A 19 10.629 -3.084 0.308 1.00 0.00 O ATOM 311 CB ASP A 19 9.275 -2.360 -2.627 1.00 0.00 C ATOM 312 CG ASP A 19 8.171 -1.674 -1.819 1.00 0.00 C ATOM 313 OD1 ASP A 19 7.643 -2.283 -0.862 1.00 0.00 O ATOM 314 OD2 ASP A 19 7.771 -0.548 -2.200 1.00 0.00 O ATOM 0 H ASP A 19 11.388 -2.670 -3.874 1.00 0.00 H new ATOM 0 HA ASP A 19 10.726 -1.255 -1.479 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.319 -1.922 -3.624 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.030 -3.415 -2.753 1.00 0.00 H new ATOM 319 N ILE A 20 11.187 -4.518 -1.331 1.00 0.00 N ATOM 320 CA ILE A 20 11.407 -5.698 -0.503 1.00 0.00 C ATOM 321 C ILE A 20 12.698 -5.485 0.312 1.00 0.00 C ATOM 322 O ILE A 20 12.706 -5.713 1.524 1.00 0.00 O ATOM 323 CB ILE A 20 11.404 -6.931 -1.451 1.00 0.00 C ATOM 324 CG1 ILE A 20 9.990 -7.127 -2.053 1.00 0.00 C ATOM 325 CG2 ILE A 20 11.839 -8.225 -0.760 1.00 0.00 C ATOM 326 CD1 ILE A 20 9.957 -7.811 -3.423 1.00 0.00 C ATOM 0 H ILE A 20 11.356 -4.697 -2.321 1.00 0.00 H new ATOM 0 HA ILE A 20 10.626 -5.874 0.237 1.00 0.00 H new ATOM 0 HB ILE A 20 12.133 -6.722 -2.234 1.00 0.00 H new ATOM 0 HG12 ILE A 20 9.393 -7.715 -1.356 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.510 -6.152 -2.139 1.00 0.00 H new ATOM 0 HG21 ILE A 20 11.815 -9.046 -1.477 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.852 -8.109 -0.375 1.00 0.00 H new ATOM 0 HG23 ILE A 20 11.160 -8.443 0.065 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.924 -7.902 -3.759 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.521 -7.215 -4.141 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.402 -8.803 -3.345 1.00 0.00 H new ATOM 338 N GLU A 21 13.750 -4.969 -0.328 1.00 0.00 N ATOM 339 CA GLU A 21 15.021 -4.606 0.301 1.00 0.00 C ATOM 340 C GLU A 21 14.826 -3.563 1.402 1.00 0.00 C ATOM 341 O GLU A 21 15.469 -3.638 2.448 1.00 0.00 O ATOM 342 CB GLU A 21 15.962 -3.993 -0.739 1.00 0.00 C ATOM 343 CG GLU A 21 16.469 -4.999 -1.769 1.00 0.00 C ATOM 344 CD GLU A 21 17.807 -5.642 -1.360 1.00 0.00 C ATOM 345 OE1 GLU A 21 17.850 -6.418 -0.376 1.00 0.00 O ATOM 346 OE2 GLU A 21 18.838 -5.372 -2.027 1.00 0.00 O ATOM 0 H GLU A 21 13.740 -4.787 -1.331 1.00 0.00 H new ATOM 0 HA GLU A 21 15.438 -5.519 0.727 1.00 0.00 H new ATOM 0 HB2 GLU A 21 15.443 -3.186 -1.256 1.00 0.00 H new ATOM 0 HB3 GLU A 21 16.815 -3.547 -0.228 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.722 -5.780 -1.907 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.589 -4.500 -2.731 1.00 0.00 H new ATOM 353 N ASP A 22 13.961 -2.573 1.168 1.00 0.00 N ATOM 354 CA ASP A 22 13.720 -1.477 2.109 1.00 0.00 C ATOM 355 C ASP A 22 13.143 -1.993 3.421 1.00 0.00 C ATOM 356 O ASP A 22 13.563 -1.598 4.510 1.00 0.00 O ATOM 357 CB ASP A 22 12.727 -0.472 1.535 1.00 0.00 C ATOM 358 CG ASP A 22 12.566 0.729 2.481 1.00 0.00 C ATOM 359 OD1 ASP A 22 13.507 1.554 2.574 1.00 0.00 O ATOM 360 OD2 ASP A 22 11.496 0.868 3.121 1.00 0.00 O ATOM 0 H ASP A 22 13.405 -2.509 0.315 1.00 0.00 H new ATOM 0 HA ASP A 22 14.684 -1.000 2.285 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.071 -0.130 0.559 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.761 -0.953 1.382 1.00 0.00 H new ATOM 365 N ARG A 23 12.207 -2.934 3.294 1.00 0.00 N ATOM 366 CA ARG A 23 11.613 -3.649 4.418 1.00 0.00 C ATOM 367 C ARG A 23 12.641 -4.576 5.083 1.00 0.00 C ATOM 368 O ARG A 23 12.385 -5.079 6.178 1.00 0.00 O ATOM 369 CB ARG A 23 10.391 -4.438 3.917 1.00 0.00 C ATOM 370 CG ARG A 23 9.290 -3.548 3.331 1.00 0.00 C ATOM 371 CD ARG A 23 8.365 -4.341 2.396 1.00 0.00 C ATOM 372 NE ARG A 23 7.485 -3.424 1.658 1.00 0.00 N ATOM 373 CZ ARG A 23 6.472 -2.692 2.126 1.00 0.00 C ATOM 374 NH1 ARG A 23 6.023 -2.840 3.370 1.00 0.00 N ATOM 375 NH2 ARG A 23 5.937 -1.797 1.310 1.00 0.00 N ATOM 0 H ARG A 23 11.835 -3.224 2.389 1.00 0.00 H new ATOM 0 HA ARG A 23 11.291 -2.934 5.175 1.00 0.00 H new ATOM 0 HB2 ARG A 23 10.714 -5.151 3.158 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.978 -5.017 4.743 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.704 -3.111 4.140 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.742 -2.721 2.783 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.959 -4.929 1.696 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.767 -5.044 2.975 1.00 0.00 H new ATOM 0 HE ARG A 23 7.673 -3.336 0.659 1.00 0.00 H new ATOM 0 HH11 ARG A 23 6.455 -3.525 3.990 1.00 0.00 H new ATOM 0 HH12 ARG A 23 5.247 -2.268 3.704 1.00 0.00 H new ATOM 0 HH21 ARG A 23 6.301 -1.688 0.363 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.161 -1.217 1.628 1.00 0.00 H new ATOM 389 N GLY A 24 13.783 -4.819 4.436 1.00 0.00 N ATOM 390 CA GLY A 24 14.818 -5.731 4.896 1.00 0.00 C ATOM 391 C GLY A 24 14.488 -7.199 4.615 1.00 0.00 C ATOM 392 O GLY A 24 15.142 -8.089 5.167 1.00 0.00 O ATOM 0 H GLY A 24 14.015 -4.369 3.550 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.761 -5.477 4.411 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.964 -5.596 5.968 1.00 0.00 H new ATOM 396 N PHE A 25 13.483 -7.462 3.774 1.00 0.00 N ATOM 397 CA PHE A 25 13.197 -8.787 3.227 1.00 0.00 C ATOM 398 C PHE A 25 14.127 -8.992 2.012 1.00 0.00 C ATOM 399 O PHE A 25 15.003 -8.164 1.734 1.00 0.00 O ATOM 400 CB PHE A 25 11.690 -8.911 2.894 1.00 0.00 C ATOM 401 CG PHE A 25 10.758 -8.874 4.102 1.00 0.00 C ATOM 402 CD1 PHE A 25 10.667 -7.697 4.864 1.00 0.00 C ATOM 403 CD2 PHE A 25 9.978 -9.988 4.485 1.00 0.00 C ATOM 404 CE1 PHE A 25 9.872 -7.627 6.015 1.00 0.00 C ATOM 405 CE2 PHE A 25 9.188 -9.921 5.643 1.00 0.00 C ATOM 406 CZ PHE A 25 9.136 -8.750 6.416 1.00 0.00 C ATOM 0 H PHE A 25 12.835 -6.745 3.450 1.00 0.00 H new ATOM 0 HA PHE A 25 13.398 -9.581 3.946 1.00 0.00 H new ATOM 0 HB2 PHE A 25 11.415 -8.102 2.217 1.00 0.00 H new ATOM 0 HB3 PHE A 25 11.528 -9.846 2.357 1.00 0.00 H new ATOM 0 HD1 PHE A 25 11.224 -6.825 4.555 1.00 0.00 H new ATOM 0 HD2 PHE A 25 9.990 -10.888 3.889 1.00 0.00 H new ATOM 0 HE1 PHE A 25 9.827 -6.714 6.590 1.00 0.00 H new ATOM 0 HE2 PHE A 25 8.611 -10.783 5.944 1.00 0.00 H new ATOM 0 HZ PHE A 25 8.534 -8.715 7.312 1.00 0.00 H new ATOM 416 N ASP A 26 13.951 -10.091 1.272 1.00 0.00 N ATOM 417 CA ASP A 26 14.751 -10.403 0.086 1.00 0.00 C ATOM 418 C ASP A 26 13.828 -11.025 -0.946 1.00 0.00 C ATOM 419 O ASP A 26 12.897 -11.735 -0.560 1.00 0.00 O ATOM 420 CB ASP A 26 15.837 -11.421 0.429 1.00 0.00 C ATOM 421 CG ASP A 26 16.952 -11.416 -0.623 1.00 0.00 C ATOM 422 OD1 ASP A 26 16.743 -12.035 -1.692 1.00 0.00 O ATOM 423 OD2 ASP A 26 18.023 -10.811 -0.381 1.00 0.00 O ATOM 0 H ASP A 26 13.243 -10.794 1.482 1.00 0.00 H new ATOM 0 HA ASP A 26 15.219 -9.492 -0.288 1.00 0.00 H new ATOM 0 HB2 ASP A 26 16.257 -11.193 1.409 1.00 0.00 H new ATOM 0 HB3 ASP A 26 15.399 -12.417 0.494 1.00 0.00 H new ATOM 428 N ARG A 27 14.072 -10.809 -2.243 1.00 0.00 N ATOM 429 CA ARG A 27 13.270 -11.439 -3.292 1.00 0.00 C ATOM 430 C ARG A 27 13.217 -12.960 -3.119 1.00 0.00 C ATOM 431 O ARG A 27 12.175 -13.554 -3.380 1.00 0.00 O ATOM 432 CB ARG A 27 13.774 -11.031 -4.694 1.00 0.00 C ATOM 433 CG ARG A 27 15.179 -11.556 -5.050 1.00 0.00 C ATOM 434 CD ARG A 27 15.625 -11.120 -6.451 1.00 0.00 C ATOM 435 NE ARG A 27 16.981 -11.621 -6.749 1.00 0.00 N ATOM 436 CZ ARG A 27 17.523 -11.816 -7.961 1.00 0.00 C ATOM 437 NH1 ARG A 27 16.845 -11.548 -9.077 1.00 0.00 N ATOM 438 NH2 ARG A 27 18.765 -12.288 -8.052 1.00 0.00 N ATOM 0 H ARG A 27 14.817 -10.204 -2.589 1.00 0.00 H new ATOM 0 HA ARG A 27 12.247 -11.076 -3.197 1.00 0.00 H new ATOM 0 HB2 ARG A 27 13.066 -11.393 -5.439 1.00 0.00 H new ATOM 0 HB3 ARG A 27 13.779 -9.943 -4.761 1.00 0.00 H new ATOM 0 HG2 ARG A 27 15.897 -11.195 -4.314 1.00 0.00 H new ATOM 0 HG3 ARG A 27 15.183 -12.644 -4.992 1.00 0.00 H new ATOM 0 HD2 ARG A 27 14.922 -11.496 -7.195 1.00 0.00 H new ATOM 0 HD3 ARG A 27 15.611 -10.032 -6.520 1.00 0.00 H new ATOM 0 HE ARG A 27 17.570 -11.843 -5.946 1.00 0.00 H new ATOM 0 HH11 ARG A 27 15.893 -11.186 -9.021 1.00 0.00 H new ATOM 0 HH12 ARG A 27 17.278 -11.704 -9.987 1.00 0.00 H new ATOM 0 HH21 ARG A 27 19.294 -12.497 -7.206 1.00 0.00 H new ATOM 0 HH22 ARG A 27 19.187 -12.440 -8.968 1.00 0.00 H new ATOM 452 N GLU A 28 14.306 -13.584 -2.661 1.00 0.00 N ATOM 453 CA GLU A 28 14.333 -15.025 -2.442 1.00 0.00 C ATOM 454 C GLU A 28 13.654 -15.361 -1.117 1.00 0.00 C ATOM 455 O GLU A 28 12.877 -16.304 -1.028 1.00 0.00 O ATOM 456 CB GLU A 28 15.774 -15.545 -2.457 1.00 0.00 C ATOM 457 CG GLU A 28 16.413 -15.455 -3.848 1.00 0.00 C ATOM 458 CD GLU A 28 17.777 -16.171 -3.891 1.00 0.00 C ATOM 459 OE1 GLU A 28 17.815 -17.390 -4.190 1.00 0.00 O ATOM 460 OE2 GLU A 28 18.824 -15.523 -3.645 1.00 0.00 O ATOM 0 H GLU A 28 15.180 -13.109 -2.436 1.00 0.00 H new ATOM 0 HA GLU A 28 13.789 -15.514 -3.250 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.372 -14.972 -1.748 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.787 -16.582 -2.121 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.745 -15.899 -4.586 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.542 -14.408 -4.123 1.00 0.00 H new ATOM 467 N GLU A 29 13.910 -14.583 -0.071 1.00 0.00 N ATOM 468 CA GLU A 29 13.403 -14.849 1.270 1.00 0.00 C ATOM 469 C GLU A 29 11.875 -14.821 1.295 1.00 0.00 C ATOM 470 O GLU A 29 11.255 -15.657 1.950 1.00 0.00 O ATOM 471 CB GLU A 29 13.999 -13.819 2.240 1.00 0.00 C ATOM 472 CG GLU A 29 15.486 -14.064 2.512 1.00 0.00 C ATOM 473 CD GLU A 29 15.716 -15.084 3.643 1.00 0.00 C ATOM 474 OE1 GLU A 29 15.572 -16.307 3.403 1.00 0.00 O ATOM 475 OE2 GLU A 29 16.037 -14.671 4.783 1.00 0.00 O ATOM 0 H GLU A 29 14.482 -13.741 -0.131 1.00 0.00 H new ATOM 0 HA GLU A 29 13.706 -15.849 1.581 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.868 -12.818 1.828 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.450 -13.851 3.181 1.00 0.00 H new ATOM 0 HG2 GLU A 29 15.965 -14.422 1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 29 15.965 -13.121 2.774 1.00 0.00 H new ATOM 482 N ILE A 30 11.287 -13.908 0.531 1.00 0.00 N ATOM 483 CA ILE A 30 9.847 -13.840 0.267 1.00 0.00 C ATOM 484 C ILE A 30 9.343 -15.184 -0.287 1.00 0.00 C ATOM 485 O ILE A 30 8.294 -15.659 0.149 1.00 0.00 O ATOM 486 CB ILE A 30 9.554 -12.680 -0.713 1.00 0.00 C ATOM 487 CG1 ILE A 30 9.861 -11.306 -0.075 1.00 0.00 C ATOM 488 CG2 ILE A 30 8.138 -12.693 -1.313 1.00 0.00 C ATOM 489 CD1 ILE A 30 8.723 -10.596 0.684 1.00 0.00 C ATOM 0 H ILE A 30 11.812 -13.170 0.062 1.00 0.00 H new ATOM 0 HA ILE A 30 9.314 -13.646 1.198 1.00 0.00 H new ATOM 0 HB ILE A 30 10.233 -12.846 -1.549 1.00 0.00 H new ATOM 0 HG12 ILE A 30 10.694 -11.436 0.616 1.00 0.00 H new ATOM 0 HG13 ILE A 30 10.204 -10.639 -0.866 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.021 -11.845 -1.988 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.986 -13.620 -1.866 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.403 -12.623 -0.512 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.085 -9.645 1.076 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.890 -10.415 0.005 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.388 -11.225 1.509 1.00 0.00 H new ATOM 501 N TRP A 31 10.060 -15.811 -1.225 1.00 0.00 N ATOM 502 CA TRP A 31 9.666 -17.123 -1.746 1.00 0.00 C ATOM 503 C TRP A 31 9.807 -18.249 -0.710 1.00 0.00 C ATOM 504 O TRP A 31 9.076 -19.240 -0.800 1.00 0.00 O ATOM 505 CB TRP A 31 10.470 -17.506 -2.996 1.00 0.00 C ATOM 506 CG TRP A 31 10.419 -16.599 -4.194 1.00 0.00 C ATOM 507 CD1 TRP A 31 11.484 -16.290 -4.965 1.00 0.00 C ATOM 508 CD2 TRP A 31 9.271 -15.958 -4.842 1.00 0.00 C ATOM 509 NE1 TRP A 31 11.094 -15.481 -6.013 1.00 0.00 N ATOM 510 CE2 TRP A 31 9.734 -15.263 -6.003 1.00 0.00 C ATOM 511 CE3 TRP A 31 7.883 -15.916 -4.591 1.00 0.00 C ATOM 512 CZ2 TRP A 31 8.866 -14.574 -6.864 1.00 0.00 C ATOM 513 CZ3 TRP A 31 7.004 -15.230 -5.450 1.00 0.00 C ATOM 514 CH2 TRP A 31 7.486 -14.574 -6.595 1.00 0.00 C ATOM 0 H TRP A 31 10.913 -15.433 -1.637 1.00 0.00 H new ATOM 0 HA TRP A 31 8.612 -17.019 -2.003 1.00 0.00 H new ATOM 0 HB2 TRP A 31 11.514 -17.604 -2.700 1.00 0.00 H new ATOM 0 HB3 TRP A 31 10.135 -18.493 -3.315 1.00 0.00 H new ATOM 0 HD1 TRP A 31 12.495 -16.627 -4.787 1.00 0.00 H new ATOM 0 HE1 TRP A 31 11.733 -15.093 -6.708 1.00 0.00 H new ATOM 0 HE3 TRP A 31 7.487 -16.421 -3.722 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 9.254 -14.049 -7.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 5.948 -15.208 -5.226 1.00 0.00 H new ATOM 0 HH2 TRP A 31 6.801 -14.073 -7.264 1.00 0.00 H new ATOM 525 N TYR A 32 10.730 -18.131 0.251 1.00 0.00 N ATOM 526 CA TYR A 32 11.301 -19.290 0.940 1.00 0.00 C ATOM 527 C TYR A 32 11.092 -19.295 2.461 1.00 0.00 C ATOM 528 O TYR A 32 11.648 -20.157 3.148 1.00 0.00 O ATOM 529 CB TYR A 32 12.788 -19.402 0.549 1.00 0.00 C ATOM 530 CG TYR A 32 13.063 -19.602 -0.930 1.00 0.00 C ATOM 531 CD1 TYR A 32 12.290 -20.497 -1.696 1.00 0.00 C ATOM 532 CD2 TYR A 32 14.103 -18.886 -1.545 1.00 0.00 C ATOM 533 CE1 TYR A 32 12.517 -20.624 -3.075 1.00 0.00 C ATOM 534 CE2 TYR A 32 14.321 -18.988 -2.927 1.00 0.00 C ATOM 535 CZ TYR A 32 13.528 -19.863 -3.706 1.00 0.00 C ATOM 536 OH TYR A 32 13.730 -19.984 -5.052 1.00 0.00 O ATOM 0 H TYR A 32 11.099 -17.235 0.570 1.00 0.00 H new ATOM 0 HA TYR A 32 10.758 -20.176 0.610 1.00 0.00 H new ATOM 0 HB2 TYR A 32 13.301 -18.498 0.877 1.00 0.00 H new ATOM 0 HB3 TYR A 32 13.228 -20.234 1.098 1.00 0.00 H new ATOM 0 HD1 TYR A 32 11.521 -21.087 -1.220 1.00 0.00 H new ATOM 0 HD2 TYR A 32 14.741 -18.251 -0.948 1.00 0.00 H new ATOM 0 HE1 TYR A 32 11.916 -21.307 -3.658 1.00 0.00 H new ATOM 0 HE2 TYR A 32 15.095 -18.398 -3.396 1.00 0.00 H new ATOM 0 HH TYR A 32 14.461 -19.392 -5.328 1.00 0.00 H new ATOM 546 N ASN A 33 10.284 -18.383 3.006 1.00 0.00 N ATOM 547 CA ASN A 33 10.002 -18.268 4.432 1.00 0.00 C ATOM 548 C ASN A 33 8.490 -18.146 4.592 1.00 0.00 C ATOM 549 O ASN A 33 7.942 -17.065 4.394 1.00 0.00 O ATOM 550 CB ASN A 33 10.709 -17.033 4.991 1.00 0.00 C ATOM 551 CG ASN A 33 12.216 -17.198 5.051 1.00 0.00 C ATOM 552 OD1 ASN A 33 12.785 -17.678 6.028 1.00 0.00 O ATOM 553 ND2 ASN A 33 12.882 -16.784 3.995 1.00 0.00 N ATOM 0 H ASN A 33 9.795 -17.684 2.447 1.00 0.00 H new ATOM 0 HA ASN A 33 10.363 -19.139 4.978 1.00 0.00 H new ATOM 0 HB2 ASN A 33 10.467 -16.169 4.372 1.00 0.00 H new ATOM 0 HB3 ASN A 33 10.330 -16.824 5.992 1.00 0.00 H new ATOM 0 HD21 ASN A 33 13.899 -16.857 3.973 1.00 0.00 H new ATOM 0 HD22 ASN A 33 12.381 -16.390 3.199 1.00 0.00 H new ATOM 560 N ARG A 34 7.817 -19.258 4.901 1.00 0.00 N ATOM 561 CA ARG A 34 6.354 -19.399 4.875 1.00 0.00 C ATOM 562 C ARG A 34 5.594 -18.356 5.703 1.00 0.00 C ATOM 563 O ARG A 34 4.415 -18.115 5.438 1.00 0.00 O ATOM 564 CB ARG A 34 6.015 -20.835 5.310 1.00 0.00 C ATOM 565 CG ARG A 34 4.502 -21.078 5.333 1.00 0.00 C ATOM 566 CD ARG A 34 4.152 -22.558 5.188 1.00 0.00 C ATOM 567 NE ARG A 34 4.557 -23.351 6.369 1.00 0.00 N ATOM 568 CZ ARG A 34 3.850 -23.541 7.493 1.00 0.00 C ATOM 569 NH1 ARG A 34 2.650 -22.982 7.654 1.00 0.00 N ATOM 570 NH2 ARG A 34 4.352 -24.298 8.465 1.00 0.00 N ATOM 0 H ARG A 34 8.290 -20.116 5.186 1.00 0.00 H new ATOM 0 HA ARG A 34 6.016 -19.208 3.857 1.00 0.00 H new ATOM 0 HB2 ARG A 34 6.487 -21.543 4.628 1.00 0.00 H new ATOM 0 HB3 ARG A 34 6.429 -21.022 6.301 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.089 -20.699 6.268 1.00 0.00 H new ATOM 0 HG3 ARG A 34 4.033 -20.515 4.526 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.078 -22.661 5.035 1.00 0.00 H new ATOM 0 HD3 ARG A 34 4.640 -22.959 4.300 1.00 0.00 H new ATOM 0 HE ARG A 34 5.471 -23.801 6.324 1.00 0.00 H new ATOM 0 HH11 ARG A 34 2.256 -22.399 6.916 1.00 0.00 H new ATOM 0 HH12 ARG A 34 2.126 -23.137 8.515 1.00 0.00 H new ATOM 0 HH21 ARG A 34 5.269 -24.730 8.353 1.00 0.00 H new ATOM 0 HH22 ARG A 34 3.820 -24.447 9.322 1.00 0.00 H new ATOM 584 N GLU A 35 6.222 -17.750 6.706 1.00 0.00 N ATOM 585 CA GLU A 35 5.606 -16.726 7.527 1.00 0.00 C ATOM 586 C GLU A 35 6.074 -15.322 7.134 1.00 0.00 C ATOM 587 O GLU A 35 5.293 -14.372 7.232 1.00 0.00 O ATOM 588 CB GLU A 35 5.853 -17.026 9.018 1.00 0.00 C ATOM 589 CG GLU A 35 7.302 -16.907 9.530 1.00 0.00 C ATOM 590 CD GLU A 35 8.229 -18.020 9.005 1.00 0.00 C ATOM 591 OE1 GLU A 35 8.751 -17.880 7.873 1.00 0.00 O ATOM 592 OE2 GLU A 35 8.433 -19.029 9.722 1.00 0.00 O ATOM 0 H GLU A 35 7.184 -17.962 6.970 1.00 0.00 H new ATOM 0 HA GLU A 35 4.530 -16.745 7.352 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.231 -16.351 9.606 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.505 -18.039 9.221 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.706 -15.939 9.235 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.298 -16.932 10.620 1.00 0.00 H new ATOM 599 N ARG A 36 7.311 -15.161 6.648 1.00 0.00 N ATOM 600 CA ARG A 36 7.815 -13.860 6.229 1.00 0.00 C ATOM 601 C ARG A 36 7.309 -13.491 4.837 1.00 0.00 C ATOM 602 O ARG A 36 7.340 -12.318 4.472 1.00 0.00 O ATOM 603 CB ARG A 36 9.339 -13.824 6.299 1.00 0.00 C ATOM 604 CG ARG A 36 9.919 -13.976 7.718 1.00 0.00 C ATOM 605 CD ARG A 36 9.212 -13.131 8.796 1.00 0.00 C ATOM 606 NE ARG A 36 9.878 -13.248 10.106 1.00 0.00 N ATOM 607 CZ ARG A 36 9.363 -12.860 11.283 1.00 0.00 C ATOM 608 NH1 ARG A 36 8.151 -12.316 11.362 1.00 0.00 N ATOM 609 NH2 ARG A 36 10.076 -13.023 12.397 1.00 0.00 N ATOM 0 H ARG A 36 7.979 -15.924 6.537 1.00 0.00 H new ATOM 0 HA ARG A 36 7.431 -13.110 6.920 1.00 0.00 H new ATOM 0 HB2 ARG A 36 9.737 -14.620 5.670 1.00 0.00 H new ATOM 0 HB3 ARG A 36 9.687 -12.881 5.877 1.00 0.00 H new ATOM 0 HG2 ARG A 36 9.867 -15.026 8.007 1.00 0.00 H new ATOM 0 HG3 ARG A 36 10.974 -13.703 7.696 1.00 0.00 H new ATOM 0 HD2 ARG A 36 9.198 -12.086 8.487 1.00 0.00 H new ATOM 0 HD3 ARG A 36 8.174 -13.451 8.886 1.00 0.00 H new ATOM 0 HE ARG A 36 10.811 -13.660 10.119 1.00 0.00 H new ATOM 0 HH11 ARG A 36 7.594 -12.187 10.517 1.00 0.00 H new ATOM 0 HH12 ARG A 36 7.779 -12.028 12.267 1.00 0.00 H new ATOM 0 HH21 ARG A 36 11.006 -13.440 12.351 1.00 0.00 H new ATOM 0 HH22 ARG A 36 9.692 -12.731 13.296 1.00 0.00 H new ATOM 623 N SER A 37 6.823 -14.457 4.068 1.00 0.00 N ATOM 624 CA SER A 37 6.090 -14.191 2.851 1.00 0.00 C ATOM 625 C SER A 37 4.857 -13.352 3.203 1.00 0.00 C ATOM 626 O SER A 37 4.661 -12.267 2.659 1.00 0.00 O ATOM 627 CB SER A 37 5.721 -15.533 2.209 1.00 0.00 C ATOM 628 OG SER A 37 5.101 -16.387 3.155 1.00 0.00 O ATOM 0 H SER A 37 6.930 -15.449 4.278 1.00 0.00 H new ATOM 0 HA SER A 37 6.683 -13.627 2.131 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.049 -15.366 1.367 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.617 -16.011 1.813 1.00 0.00 H new ATOM 0 HG SER A 37 4.871 -17.238 2.726 1.00 0.00 H new ATOM 634 N GLU A 38 4.061 -13.837 4.159 1.00 0.00 N ATOM 635 CA GLU A 38 2.747 -13.338 4.518 1.00 0.00 C ATOM 636 C GLU A 38 2.746 -11.855 4.893 1.00 0.00 C ATOM 637 O GLU A 38 1.765 -11.165 4.617 1.00 0.00 O ATOM 638 CB GLU A 38 2.206 -14.223 5.651 1.00 0.00 C ATOM 639 CG GLU A 38 0.683 -14.308 5.596 1.00 0.00 C ATOM 640 CD GLU A 38 0.110 -15.150 6.751 1.00 0.00 C ATOM 641 OE1 GLU A 38 0.006 -16.394 6.607 1.00 0.00 O ATOM 642 OE2 GLU A 38 -0.259 -14.574 7.803 1.00 0.00 O ATOM 0 H GLU A 38 4.340 -14.634 4.731 1.00 0.00 H new ATOM 0 HA GLU A 38 2.093 -13.396 3.648 1.00 0.00 H new ATOM 0 HB2 GLU A 38 2.633 -15.223 5.572 1.00 0.00 H new ATOM 0 HB3 GLU A 38 2.517 -13.818 6.614 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.262 -13.303 5.636 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.378 -14.743 4.644 1.00 0.00 H new ATOM 649 N GLU A 39 3.835 -11.332 5.461 1.00 0.00 N ATOM 650 CA GLU A 39 3.953 -9.946 5.903 1.00 0.00 C ATOM 651 C GLU A 39 3.723 -8.973 4.741 1.00 0.00 C ATOM 652 O GLU A 39 3.156 -7.893 4.921 1.00 0.00 O ATOM 653 CB GLU A 39 5.358 -9.699 6.480 1.00 0.00 C ATOM 654 CG GLU A 39 6.007 -10.841 7.263 1.00 0.00 C ATOM 655 CD GLU A 39 5.423 -11.144 8.657 1.00 0.00 C ATOM 656 OE1 GLU A 39 4.236 -10.843 8.937 1.00 0.00 O ATOM 657 OE2 GLU A 39 6.191 -11.680 9.496 1.00 0.00 O ATOM 0 H GLU A 39 4.680 -11.878 5.629 1.00 0.00 H new ATOM 0 HA GLU A 39 3.194 -9.774 6.666 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.020 -9.437 5.655 1.00 0.00 H new ATOM 0 HB3 GLU A 39 5.305 -8.829 7.134 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.939 -11.747 6.661 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.067 -10.614 7.380 1.00 0.00 H new ATOM 664 N LEU A 40 4.153 -9.378 3.541 1.00 0.00 N ATOM 665 CA LEU A 40 3.938 -8.644 2.302 1.00 0.00 C ATOM 666 C LEU A 40 2.431 -8.467 2.081 1.00 0.00 C ATOM 667 O LEU A 40 1.913 -7.363 1.903 1.00 0.00 O ATOM 668 CB LEU A 40 4.597 -9.427 1.149 1.00 0.00 C ATOM 669 CG LEU A 40 4.707 -8.755 -0.238 1.00 0.00 C ATOM 670 CD1 LEU A 40 4.307 -9.757 -1.326 1.00 0.00 C ATOM 671 CD2 LEU A 40 3.936 -7.440 -0.410 1.00 0.00 C ATOM 0 H LEU A 40 4.672 -10.246 3.408 1.00 0.00 H new ATOM 0 HA LEU A 40 4.389 -7.653 2.347 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.604 -9.697 1.466 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.043 -10.357 1.022 1.00 0.00 H new ATOM 0 HG LEU A 40 5.753 -8.465 -0.333 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.385 -9.282 -2.304 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.971 -10.620 -1.288 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.280 -10.082 -1.161 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.086 -7.060 -1.421 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.874 -7.617 -0.243 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.300 -6.708 0.311 1.00 0.00 H new ATOM 683 N PHE A 41 1.705 -9.575 2.132 1.00 0.00 N ATOM 684 CA PHE A 41 0.281 -9.620 1.860 1.00 0.00 C ATOM 685 C PHE A 41 -0.478 -8.879 2.953 1.00 0.00 C ATOM 686 O PHE A 41 -1.473 -8.219 2.666 1.00 0.00 O ATOM 687 CB PHE A 41 -0.160 -11.080 1.739 1.00 0.00 C ATOM 688 CG PHE A 41 0.637 -11.826 0.689 1.00 0.00 C ATOM 689 CD1 PHE A 41 1.912 -12.327 1.008 1.00 0.00 C ATOM 690 CD2 PHE A 41 0.167 -11.906 -0.635 1.00 0.00 C ATOM 691 CE1 PHE A 41 2.715 -12.918 0.019 1.00 0.00 C ATOM 692 CE2 PHE A 41 0.968 -12.505 -1.623 1.00 0.00 C ATOM 693 CZ PHE A 41 2.240 -13.010 -1.300 1.00 0.00 C ATOM 0 H PHE A 41 2.101 -10.485 2.369 1.00 0.00 H new ATOM 0 HA PHE A 41 0.058 -9.121 0.917 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -0.044 -11.575 2.703 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -1.220 -11.119 1.486 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.277 -12.257 2.022 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -0.804 -11.509 -0.891 1.00 0.00 H new ATOM 0 HE1 PHE A 41 3.693 -13.300 0.271 1.00 0.00 H new ATOM 0 HE2 PHE A 41 0.604 -12.578 -2.637 1.00 0.00 H new ATOM 0 HZ PHE A 41 2.851 -13.468 -2.064 1.00 0.00 H new ATOM 703 N TRP A 42 0.008 -8.915 4.190 1.00 0.00 N ATOM 704 CA TRP A 42 -0.561 -8.104 5.249 1.00 0.00 C ATOM 705 C TRP A 42 -0.418 -6.601 4.981 1.00 0.00 C ATOM 706 O TRP A 42 -1.303 -5.850 5.388 1.00 0.00 O ATOM 707 CB TRP A 42 0.034 -8.523 6.596 1.00 0.00 C ATOM 708 CG TRP A 42 -0.631 -9.742 7.154 1.00 0.00 C ATOM 709 CD1 TRP A 42 -0.092 -10.978 7.236 1.00 0.00 C ATOM 710 CD2 TRP A 42 -2.012 -9.882 7.616 1.00 0.00 C ATOM 711 NE1 TRP A 42 -1.023 -11.860 7.738 1.00 0.00 N ATOM 712 CE2 TRP A 42 -2.236 -11.246 7.966 1.00 0.00 C ATOM 713 CE3 TRP A 42 -3.106 -8.997 7.744 1.00 0.00 C ATOM 714 CZ2 TRP A 42 -3.487 -11.710 8.411 1.00 0.00 C ATOM 715 CZ3 TRP A 42 -4.365 -9.450 8.189 1.00 0.00 C ATOM 716 CH2 TRP A 42 -4.558 -10.803 8.521 1.00 0.00 C ATOM 0 H TRP A 42 0.794 -9.498 4.479 1.00 0.00 H new ATOM 0 HA TRP A 42 -1.635 -8.285 5.280 1.00 0.00 H new ATOM 0 HB2 TRP A 42 1.100 -8.716 6.476 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -0.063 -7.701 7.306 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.917 -11.236 6.951 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -0.838 -12.847 7.919 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -2.975 -7.954 7.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -3.624 -12.751 8.665 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -5.186 -8.754 8.275 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -5.525 -11.145 8.859 1.00 0.00 H new ATOM 727 N GLU A 43 0.616 -6.138 4.271 1.00 0.00 N ATOM 728 CA GLU A 43 0.767 -4.729 3.943 1.00 0.00 C ATOM 729 C GLU A 43 -0.194 -4.381 2.809 1.00 0.00 C ATOM 730 O GLU A 43 -0.884 -3.362 2.874 1.00 0.00 O ATOM 731 CB GLU A 43 2.222 -4.465 3.524 1.00 0.00 C ATOM 732 CG GLU A 43 2.500 -3.019 3.109 1.00 0.00 C ATOM 733 CD GLU A 43 2.725 -2.076 4.303 1.00 0.00 C ATOM 734 OE1 GLU A 43 1.813 -1.900 5.145 1.00 0.00 O ATOM 735 OE2 GLU A 43 3.835 -1.499 4.393 1.00 0.00 O ATOM 0 H GLU A 43 1.364 -6.731 3.912 1.00 0.00 H new ATOM 0 HA GLU A 43 0.534 -4.107 4.807 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.881 -4.727 4.352 1.00 0.00 H new ATOM 0 HB3 GLU A 43 2.475 -5.125 2.694 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.380 -2.996 2.466 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.662 -2.651 2.517 1.00 0.00 H new ATOM 742 N VAL A 44 -0.268 -5.223 1.768 1.00 0.00 N ATOM 743 CA VAL A 44 -1.156 -4.944 0.656 1.00 0.00 C ATOM 744 C VAL A 44 -2.595 -4.915 1.154 1.00 0.00 C ATOM 745 O VAL A 44 -3.321 -3.958 0.907 1.00 0.00 O ATOM 746 CB VAL A 44 -0.912 -5.922 -0.510 1.00 0.00 C ATOM 747 CG1 VAL A 44 -1.793 -7.174 -0.562 1.00 0.00 C ATOM 748 CG2 VAL A 44 -1.062 -5.160 -1.829 1.00 0.00 C ATOM 0 H VAL A 44 0.270 -6.085 1.683 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.943 -3.957 0.244 1.00 0.00 H new ATOM 0 HB VAL A 44 0.095 -6.304 -0.341 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.519 -7.776 -1.429 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.648 -7.759 0.346 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.840 -6.879 -0.641 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.892 -5.840 -2.664 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.068 -4.746 -1.898 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.333 -4.350 -1.866 1.00 0.00 H new ATOM 758 N MET A 45 -2.993 -5.938 1.906 1.00 0.00 N ATOM 759 CA MET A 45 -4.339 -6.078 2.401 1.00 0.00 C ATOM 760 C MET A 45 -4.655 -4.927 3.355 1.00 0.00 C ATOM 761 O MET A 45 -5.781 -4.439 3.339 1.00 0.00 O ATOM 762 CB MET A 45 -4.491 -7.457 3.054 1.00 0.00 C ATOM 763 CG MET A 45 -5.853 -7.640 3.713 1.00 0.00 C ATOM 764 SD MET A 45 -7.316 -7.274 2.697 1.00 0.00 S ATOM 765 CE MET A 45 -7.163 -8.488 1.355 1.00 0.00 C ATOM 0 H MET A 45 -2.373 -6.698 2.187 1.00 0.00 H new ATOM 0 HA MET A 45 -5.062 -6.022 1.587 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.348 -8.231 2.300 1.00 0.00 H new ATOM 0 HB3 MET A 45 -3.708 -7.591 3.800 1.00 0.00 H new ATOM 0 HG2 MET A 45 -5.928 -8.672 4.056 1.00 0.00 H new ATOM 0 HG3 MET A 45 -5.889 -7.006 4.599 1.00 0.00 H new ATOM 0 HE1 MET A 45 -7.997 -8.372 0.662 1.00 0.00 H new ATOM 0 HE2 MET A 45 -6.225 -8.327 0.824 1.00 0.00 H new ATOM 0 HE3 MET A 45 -7.176 -9.495 1.772 1.00 0.00 H new ATOM 775 N ASP A 46 -3.683 -4.445 4.135 1.00 0.00 N ATOM 776 CA ASP A 46 -3.888 -3.280 4.983 1.00 0.00 C ATOM 777 C ASP A 46 -4.311 -2.065 4.160 1.00 0.00 C ATOM 778 O ASP A 46 -5.225 -1.333 4.555 1.00 0.00 O ATOM 779 CB ASP A 46 -2.631 -2.942 5.781 1.00 0.00 C ATOM 780 CG ASP A 46 -2.852 -1.645 6.577 1.00 0.00 C ATOM 781 OD1 ASP A 46 -3.530 -1.697 7.632 1.00 0.00 O ATOM 782 OD2 ASP A 46 -2.337 -0.579 6.165 1.00 0.00 O ATOM 0 H ASP A 46 -2.748 -4.848 4.193 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.688 -3.532 5.680 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.390 -3.760 6.460 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -1.782 -2.826 5.107 1.00 0.00 H new ATOM 787 N GLU A 47 -3.692 -1.876 2.994 1.00 0.00 N ATOM 788 CA GLU A 47 -4.061 -0.814 2.069 1.00 0.00 C ATOM 789 C GLU A 47 -5.516 -0.974 1.590 1.00 0.00 C ATOM 790 O GLU A 47 -6.226 0.025 1.450 1.00 0.00 O ATOM 791 CB GLU A 47 -3.015 -0.692 0.951 1.00 0.00 C ATOM 792 CG GLU A 47 -3.477 -0.954 -0.483 1.00 0.00 C ATOM 793 CD GLU A 47 -4.419 0.103 -1.092 1.00 0.00 C ATOM 794 OE1 GLU A 47 -4.192 1.323 -0.906 1.00 0.00 O ATOM 795 OE2 GLU A 47 -5.363 -0.301 -1.814 1.00 0.00 O ATOM 0 H GLU A 47 -2.920 -2.458 2.668 1.00 0.00 H new ATOM 0 HA GLU A 47 -4.048 0.147 2.583 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -2.597 0.314 0.991 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.203 -1.384 1.174 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.595 -1.036 -1.119 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.981 -1.920 -0.511 1.00 0.00 H new ATOM 802 N VAL A 48 -5.990 -2.209 1.400 1.00 0.00 N ATOM 803 CA VAL A 48 -7.357 -2.486 0.982 1.00 0.00 C ATOM 804 C VAL A 48 -8.314 -2.498 2.189 1.00 0.00 C ATOM 805 O VAL A 48 -9.525 -2.480 1.988 1.00 0.00 O ATOM 806 CB VAL A 48 -7.420 -3.820 0.188 1.00 0.00 C ATOM 807 CG1 VAL A 48 -8.707 -3.936 -0.637 1.00 0.00 C ATOM 808 CG2 VAL A 48 -6.283 -4.003 -0.835 1.00 0.00 C ATOM 0 H VAL A 48 -5.426 -3.048 1.535 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.685 -1.685 0.319 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.351 -4.574 0.972 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.710 -4.883 -1.176 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -9.570 -3.894 0.027 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.758 -3.113 -1.350 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -6.403 -4.959 -1.345 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.318 -3.195 -1.566 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.323 -3.984 -0.319 1.00 0.00 H new ATOM 818 N HIS A 49 -7.824 -2.533 3.434 1.00 0.00 N ATOM 819 CA HIS A 49 -8.594 -3.124 4.522 1.00 0.00 C ATOM 820 C HIS A 49 -9.955 -2.470 4.799 1.00 0.00 C ATOM 821 O HIS A 49 -10.885 -3.167 5.207 1.00 0.00 O ATOM 822 CB HIS A 49 -7.771 -3.235 5.805 1.00 0.00 C ATOM 823 CG HIS A 49 -8.298 -4.299 6.738 1.00 0.00 C ATOM 824 ND1 HIS A 49 -8.538 -4.176 8.087 1.00 0.00 N ATOM 825 CD2 HIS A 49 -8.612 -5.586 6.389 1.00 0.00 C ATOM 826 CE1 HIS A 49 -8.988 -5.362 8.538 1.00 0.00 C ATOM 827 NE2 HIS A 49 -9.053 -6.258 7.538 1.00 0.00 N ATOM 0 H HIS A 49 -6.913 -2.164 3.705 1.00 0.00 H new ATOM 0 HA HIS A 49 -8.831 -4.125 4.161 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.735 -3.460 5.550 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -7.772 -2.273 6.318 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -8.533 -6.010 5.399 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.260 -5.566 9.563 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -9.360 -7.228 7.602 1.00 0.00 H new ATOM 835 N GLU A 50 -10.112 -1.165 4.553 1.00 0.00 N ATOM 836 CA GLU A 50 -11.387 -0.475 4.756 1.00 0.00 C ATOM 837 C GLU A 50 -12.504 -1.033 3.851 1.00 0.00 C ATOM 838 O GLU A 50 -13.688 -0.869 4.156 1.00 0.00 O ATOM 839 CB GLU A 50 -11.224 1.040 4.530 1.00 0.00 C ATOM 840 CG GLU A 50 -10.322 1.698 5.582 1.00 0.00 C ATOM 841 CD GLU A 50 -10.267 3.226 5.393 1.00 0.00 C ATOM 842 OE1 GLU A 50 -9.397 3.718 4.633 1.00 0.00 O ATOM 843 OE2 GLU A 50 -11.083 3.953 6.015 1.00 0.00 O ATOM 0 H GLU A 50 -9.364 -0.562 4.210 1.00 0.00 H new ATOM 0 HA GLU A 50 -11.686 -0.653 5.789 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -10.806 1.213 3.538 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -12.205 1.514 4.550 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -10.694 1.466 6.580 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -9.316 1.284 5.512 1.00 0.00 H new ATOM 850 N GLU A 51 -12.148 -1.704 2.751 1.00 0.00 N ATOM 851 CA GLU A 51 -13.066 -2.334 1.803 1.00 0.00 C ATOM 852 C GLU A 51 -13.235 -3.839 2.115 1.00 0.00 C ATOM 853 O GLU A 51 -13.979 -4.536 1.421 1.00 0.00 O ATOM 854 CB GLU A 51 -12.514 -2.149 0.373 1.00 0.00 C ATOM 855 CG GLU A 51 -12.454 -0.683 -0.088 1.00 0.00 C ATOM 856 CD GLU A 51 -11.422 -0.484 -1.214 1.00 0.00 C ATOM 857 OE1 GLU A 51 -11.575 -1.055 -2.322 1.00 0.00 O ATOM 858 OE2 GLU A 51 -10.428 0.252 -1.006 1.00 0.00 O ATOM 0 H GLU A 51 -11.170 -1.827 2.488 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.045 -1.862 1.888 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -11.513 -2.577 0.323 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -13.137 -2.713 -0.322 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.438 -0.370 -0.436 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -12.198 -0.045 0.758 1.00 0.00 H new ATOM 865 N GLU A 52 -12.535 -4.357 3.131 1.00 0.00 N ATOM 866 CA GLU A 52 -12.235 -5.775 3.283 1.00 0.00 C ATOM 867 C GLU A 52 -12.441 -6.304 4.700 1.00 0.00 C ATOM 868 O GLU A 52 -12.552 -7.517 4.875 1.00 0.00 O ATOM 869 CB GLU A 52 -10.779 -5.990 2.889 1.00 0.00 C ATOM 870 CG GLU A 52 -10.610 -6.096 1.383 1.00 0.00 C ATOM 871 CD GLU A 52 -11.196 -7.400 0.832 1.00 0.00 C ATOM 872 OE1 GLU A 52 -10.791 -8.500 1.273 1.00 0.00 O ATOM 873 OE2 GLU A 52 -12.047 -7.352 -0.087 1.00 0.00 O ATOM 0 H GLU A 52 -12.155 -3.784 3.885 1.00 0.00 H new ATOM 0 HA GLU A 52 -12.929 -6.323 2.645 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.175 -5.164 3.265 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.405 -6.899 3.361 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.097 -5.248 0.903 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.551 -6.039 1.132 1.00 0.00 H new ATOM 880 N GLU A 53 -12.549 -5.439 5.710 1.00 0.00 N ATOM 881 CA GLU A 53 -12.768 -5.823 7.104 1.00 0.00 C ATOM 882 C GLU A 53 -14.086 -6.602 7.324 1.00 0.00 C ATOM 883 O GLU A 53 -14.288 -7.184 8.393 1.00 0.00 O ATOM 884 CB GLU A 53 -12.667 -4.580 8.004 1.00 0.00 C ATOM 885 CG GLU A 53 -13.755 -3.526 7.739 1.00 0.00 C ATOM 886 CD GLU A 53 -13.619 -2.337 8.708 1.00 0.00 C ATOM 887 OE1 GLU A 53 -14.205 -2.387 9.820 1.00 0.00 O ATOM 888 OE2 GLU A 53 -12.941 -1.336 8.368 1.00 0.00 O ATOM 0 H GLU A 53 -12.485 -4.430 5.578 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.981 -6.524 7.383 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -12.725 -4.893 9.046 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -11.689 -4.121 7.863 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.681 -3.172 6.711 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.740 -3.979 7.850 1.00 0.00 H new ATOM 895 N PHE A 54 -14.957 -6.655 6.308 1.00 0.00 N ATOM 896 CA PHE A 54 -16.218 -7.391 6.272 1.00 0.00 C ATOM 897 C PHE A 54 -16.205 -8.476 5.173 1.00 0.00 C ATOM 898 O PHE A 54 -17.259 -9.012 4.822 1.00 0.00 O ATOM 899 CB PHE A 54 -17.372 -6.384 6.109 1.00 0.00 C ATOM 900 CG PHE A 54 -17.242 -5.463 4.906 1.00 0.00 C ATOM 901 CD1 PHE A 54 -17.698 -5.877 3.640 1.00 0.00 C ATOM 902 CD2 PHE A 54 -16.655 -4.189 5.048 1.00 0.00 C ATOM 903 CE1 PHE A 54 -17.560 -5.028 2.526 1.00 0.00 C ATOM 904 CE2 PHE A 54 -16.512 -3.343 3.934 1.00 0.00 C ATOM 905 CZ PHE A 54 -16.966 -3.763 2.672 1.00 0.00 C ATOM 0 H PHE A 54 -14.785 -6.152 5.437 1.00 0.00 H new ATOM 0 HA PHE A 54 -16.363 -7.929 7.209 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -18.309 -6.935 6.029 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -17.436 -5.775 7.011 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -18.155 -6.849 3.523 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -16.313 -3.861 6.018 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -17.911 -5.350 1.557 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -16.054 -2.372 4.048 1.00 0.00 H new ATOM 0 HZ PHE A 54 -16.858 -3.114 1.815 1.00 0.00 H new ATOM 915 N ALA A 55 -15.027 -8.801 4.617 1.00 0.00 N ATOM 916 CA ALA A 55 -14.851 -9.766 3.532 1.00 0.00 C ATOM 917 C ALA A 55 -13.685 -10.737 3.773 1.00 0.00 C ATOM 918 O ALA A 55 -13.730 -11.843 3.234 1.00 0.00 O ATOM 919 CB ALA A 55 -14.654 -9.021 2.206 1.00 0.00 C ATOM 0 H ALA A 55 -14.148 -8.384 4.923 1.00 0.00 H new ATOM 0 HA ALA A 55 -15.756 -10.372 3.492 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -14.523 -9.742 1.399 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -15.529 -8.403 2.002 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -13.770 -8.387 2.273 1.00 0.00 H new ATOM 925 N VAL A 56 -12.681 -10.408 4.600 1.00 0.00 N ATOM 926 CA VAL A 56 -11.580 -11.342 4.896 1.00 0.00 C ATOM 927 C VAL A 56 -11.999 -12.535 5.771 1.00 0.00 C ATOM 928 O VAL A 56 -11.220 -13.462 5.992 1.00 0.00 O ATOM 929 CB VAL A 56 -10.338 -10.615 5.458 1.00 0.00 C ATOM 930 CG1 VAL A 56 -9.728 -9.675 4.411 1.00 0.00 C ATOM 931 CG2 VAL A 56 -10.624 -9.839 6.752 1.00 0.00 C ATOM 0 H VAL A 56 -12.607 -9.508 5.074 1.00 0.00 H new ATOM 0 HA VAL A 56 -11.297 -11.773 3.936 1.00 0.00 H new ATOM 0 HB VAL A 56 -9.621 -11.398 5.705 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.856 -9.177 4.834 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -9.428 -10.251 3.536 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -10.466 -8.928 4.118 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.711 -9.352 7.094 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -11.388 -9.085 6.563 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -10.976 -10.528 7.519 1.00 0.00 H new ATOM 941 N GLU A 57 -13.251 -12.535 6.220 1.00 0.00 N ATOM 942 CA GLU A 57 -13.985 -13.707 6.683 1.00 0.00 C ATOM 943 C GLU A 57 -14.046 -14.852 5.659 1.00 0.00 C ATOM 944 O GLU A 57 -14.291 -16.002 6.033 1.00 0.00 O ATOM 945 CB GLU A 57 -15.402 -13.261 7.079 1.00 0.00 C ATOM 946 CG GLU A 57 -16.051 -12.358 6.014 1.00 0.00 C ATOM 947 CD GLU A 57 -17.559 -12.188 6.279 1.00 0.00 C ATOM 948 OE1 GLU A 57 -17.924 -11.476 7.245 1.00 0.00 O ATOM 949 OE2 GLU A 57 -18.380 -12.780 5.537 1.00 0.00 O ATOM 0 H GLU A 57 -13.805 -11.680 6.273 1.00 0.00 H new ATOM 0 HA GLU A 57 -13.446 -14.117 7.537 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -16.027 -14.140 7.236 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -15.360 -12.727 8.028 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -15.566 -11.382 6.015 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -15.898 -12.789 5.025 1.00 0.00 H new ATOM 956 N GLY A 58 -13.832 -14.543 4.383 1.00 0.00 N ATOM 957 CA GLY A 58 -13.892 -15.488 3.285 1.00 0.00 C ATOM 958 C GLY A 58 -12.521 -16.091 2.948 1.00 0.00 C ATOM 959 O GLY A 58 -11.544 -15.860 3.671 1.00 0.00 O ATOM 0 H GLY A 58 -13.605 -13.596 4.081 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -14.585 -16.290 3.539 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -14.292 -14.989 2.402 1.00 0.00 H new ATOM 963 N PRO A 59 -12.437 -16.875 1.860 1.00 0.00 N ATOM 964 CA PRO A 59 -11.188 -17.461 1.381 1.00 0.00 C ATOM 965 C PRO A 59 -10.245 -16.381 0.837 1.00 0.00 C ATOM 966 O PRO A 59 -10.624 -15.216 0.675 1.00 0.00 O ATOM 967 CB PRO A 59 -11.604 -18.470 0.308 1.00 0.00 C ATOM 968 CG PRO A 59 -12.882 -17.860 -0.254 1.00 0.00 C ATOM 969 CD PRO A 59 -13.531 -17.217 0.968 1.00 0.00 C ATOM 0 HA PRO A 59 -10.627 -17.950 2.178 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -10.838 -18.582 -0.460 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -11.780 -19.459 0.730 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -12.669 -17.125 -1.030 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -13.527 -18.617 -0.700 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -14.100 -16.330 0.688 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.228 -17.904 1.448 1.00 0.00 H new ATOM 977 N LEU A 60 -9.015 -16.780 0.500 1.00 0.00 N ATOM 978 CA LEU A 60 -8.004 -15.924 -0.116 1.00 0.00 C ATOM 979 C LEU A 60 -7.164 -16.777 -1.071 1.00 0.00 C ATOM 980 O LEU A 60 -6.975 -17.977 -0.841 1.00 0.00 O ATOM 981 CB LEU A 60 -7.119 -15.269 0.969 1.00 0.00 C ATOM 982 CG LEU A 60 -7.228 -13.732 1.004 1.00 0.00 C ATOM 983 CD1 LEU A 60 -6.447 -13.186 2.205 1.00 0.00 C ATOM 984 CD2 LEU A 60 -6.681 -13.084 -0.276 1.00 0.00 C ATOM 0 H LEU A 60 -8.689 -17.734 0.654 1.00 0.00 H new ATOM 0 HA LEU A 60 -8.483 -15.120 -0.675 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.398 -15.668 1.944 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.080 -15.548 0.796 1.00 0.00 H new ATOM 0 HG LEU A 60 -8.286 -13.484 1.086 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.526 -12.099 2.227 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.860 -13.598 3.126 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.399 -13.472 2.118 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -6.779 -12.001 -0.206 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.630 -13.347 -0.396 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -7.246 -13.444 -1.136 1.00 0.00 H new ATOM 996 N TRP A 61 -6.655 -16.146 -2.128 1.00 0.00 N ATOM 997 CA TRP A 61 -6.040 -16.797 -3.279 1.00 0.00 C ATOM 998 C TRP A 61 -4.943 -15.881 -3.808 1.00 0.00 C ATOM 999 O TRP A 61 -5.104 -14.661 -3.748 1.00 0.00 O ATOM 1000 CB TRP A 61 -7.118 -16.930 -4.356 1.00 0.00 C ATOM 1001 CG TRP A 61 -8.286 -17.814 -4.051 1.00 0.00 C ATOM 1002 CD1 TRP A 61 -9.438 -17.420 -3.465 1.00 0.00 C ATOM 1003 CD2 TRP A 61 -8.449 -19.229 -4.336 1.00 0.00 C ATOM 1004 NE1 TRP A 61 -10.297 -18.498 -3.357 1.00 0.00 N ATOM 1005 CE2 TRP A 61 -9.731 -19.646 -3.878 1.00 0.00 C ATOM 1006 CE3 TRP A 61 -7.633 -20.193 -4.954 1.00 0.00 C ATOM 1007 CZ2 TRP A 61 -10.174 -20.972 -4.020 1.00 0.00 C ATOM 1008 CZ3 TRP A 61 -8.064 -21.525 -5.105 1.00 0.00 C ATOM 1009 CH2 TRP A 61 -9.334 -21.917 -4.636 1.00 0.00 C ATOM 0 H TRP A 61 -6.661 -15.129 -2.207 1.00 0.00 H new ATOM 0 HA TRP A 61 -5.628 -17.771 -3.013 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -7.498 -15.933 -4.578 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -6.643 -17.300 -5.265 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -9.655 -16.416 -3.132 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -11.229 -18.452 -2.945 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.658 -19.907 -5.320 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -11.150 -21.263 -3.660 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -7.419 -22.249 -5.582 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -9.661 -22.940 -4.749 1.00 0.00 H new ATOM 1020 N ILE A 62 -3.867 -16.440 -4.366 1.00 0.00 N ATOM 1021 CA ILE A 62 -2.726 -15.686 -4.886 1.00 0.00 C ATOM 1022 C ILE A 62 -2.340 -16.283 -6.250 1.00 0.00 C ATOM 1023 O ILE A 62 -2.461 -17.496 -6.458 1.00 0.00 O ATOM 1024 CB ILE A 62 -1.513 -15.739 -3.914 1.00 0.00 C ATOM 1025 CG1 ILE A 62 -1.798 -15.811 -2.390 1.00 0.00 C ATOM 1026 CG2 ILE A 62 -0.554 -14.567 -4.198 1.00 0.00 C ATOM 1027 CD1 ILE A 62 -2.355 -14.554 -1.704 1.00 0.00 C ATOM 0 H ILE A 62 -3.763 -17.449 -4.471 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.007 -14.638 -4.991 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.071 -16.710 -4.138 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.502 -16.625 -2.219 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -0.869 -16.082 -1.888 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.291 -14.614 -3.512 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.192 -14.633 -5.224 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.082 -13.623 -4.059 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.504 -14.754 -0.643 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.649 -13.732 -1.823 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.308 -14.283 -2.159 1.00 0.00 H new ATOM 1039 N GLN A 63 -1.811 -15.449 -7.148 1.00 0.00 N ATOM 1040 CA GLN A 63 -1.042 -15.844 -8.330 1.00 0.00 C ATOM 1041 C GLN A 63 0.124 -14.849 -8.428 1.00 0.00 C ATOM 1042 O GLN A 63 -0.043 -13.680 -8.096 1.00 0.00 O ATOM 1043 CB GLN A 63 -1.970 -15.829 -9.560 1.00 0.00 C ATOM 1044 CG GLN A 63 -1.259 -16.165 -10.885 1.00 0.00 C ATOM 1045 CD GLN A 63 -2.233 -16.235 -12.071 1.00 0.00 C ATOM 1046 OE1 GLN A 63 -3.303 -16.837 -11.994 1.00 0.00 O ATOM 1047 NE2 GLN A 63 -1.892 -15.626 -13.199 1.00 0.00 N ATOM 0 H GLN A 63 -1.911 -14.437 -7.068 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.640 -16.856 -8.270 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -2.778 -16.543 -9.402 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -2.428 -14.844 -9.645 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.498 -15.411 -11.087 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.743 -17.120 -10.785 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -1.004 -15.127 -13.261 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -2.517 -15.656 -14.004 1.00 0.00 H new ATOM 1056 N VAL A 64 1.319 -15.268 -8.844 1.00 0.00 N ATOM 1057 CA VAL A 64 2.515 -14.431 -8.725 1.00 0.00 C ATOM 1058 C VAL A 64 3.468 -14.719 -9.884 1.00 0.00 C ATOM 1059 O VAL A 64 3.419 -15.808 -10.461 1.00 0.00 O ATOM 1060 CB VAL A 64 3.134 -14.675 -7.329 1.00 0.00 C ATOM 1061 CG1 VAL A 64 3.923 -15.990 -7.224 1.00 0.00 C ATOM 1062 CG2 VAL A 64 3.989 -13.481 -6.900 1.00 0.00 C ATOM 0 H VAL A 64 1.486 -16.181 -9.266 1.00 0.00 H new ATOM 0 HA VAL A 64 2.275 -13.370 -8.798 1.00 0.00 H new ATOM 0 HB VAL A 64 2.297 -14.778 -6.639 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.327 -16.092 -6.217 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.261 -16.829 -7.436 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.741 -15.982 -7.944 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.415 -13.674 -5.915 1.00 0.00 H new ATOM 0 HG22 VAL A 64 4.793 -13.332 -7.620 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.369 -12.586 -6.858 1.00 0.00 H new ATOM 1072 N GLN A 65 4.353 -13.770 -10.214 1.00 0.00 N ATOM 1073 CA GLN A 65 5.471 -14.034 -11.099 1.00 0.00 C ATOM 1074 C GLN A 65 6.634 -13.126 -10.721 1.00 0.00 C ATOM 1075 O GLN A 65 6.424 -12.005 -10.253 1.00 0.00 O ATOM 1076 CB GLN A 65 5.067 -13.820 -12.566 1.00 0.00 C ATOM 1077 CG GLN A 65 4.341 -12.499 -12.868 1.00 0.00 C ATOM 1078 CD GLN A 65 2.824 -12.636 -12.835 1.00 0.00 C ATOM 1079 OE1 GLN A 65 2.208 -13.169 -13.756 1.00 0.00 O ATOM 1080 NE2 GLN A 65 2.171 -12.156 -11.791 1.00 0.00 N ATOM 0 H GLN A 65 4.307 -12.810 -9.874 1.00 0.00 H new ATOM 0 HA GLN A 65 5.778 -15.074 -10.990 1.00 0.00 H new ATOM 0 HB2 GLN A 65 5.964 -13.870 -13.183 1.00 0.00 H new ATOM 0 HB3 GLN A 65 4.424 -14.645 -12.871 1.00 0.00 H new ATOM 0 HG2 GLN A 65 4.649 -11.747 -12.142 1.00 0.00 H new ATOM 0 HG3 GLN A 65 4.647 -12.138 -13.850 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.684 -11.714 -11.028 1.00 0.00 H new ATOM 0 HE22 GLN A 65 1.154 -12.227 -11.748 1.00 0.00 H new ATOM 1089 N ALA A 66 7.849 -13.606 -10.977 1.00 0.00 N ATOM 1090 CA ALA A 66 9.047 -12.784 -10.988 1.00 0.00 C ATOM 1091 C ALA A 66 9.157 -12.096 -12.353 1.00 0.00 C ATOM 1092 O ALA A 66 8.825 -12.678 -13.389 1.00 0.00 O ATOM 1093 CB ALA A 66 10.281 -13.663 -10.751 1.00 0.00 C ATOM 0 H ALA A 66 8.027 -14.589 -11.185 1.00 0.00 H new ATOM 0 HA ALA A 66 8.991 -12.035 -10.198 1.00 0.00 H new ATOM 0 HB1 ALA A 66 11.177 -13.042 -10.760 1.00 0.00 H new ATOM 0 HB2 ALA A 66 10.194 -14.160 -9.785 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.351 -14.412 -11.539 1.00 0.00 H new ATOM 1099 N LEU A 67 9.671 -10.871 -12.335 1.00 0.00 N ATOM 1100 CA LEU A 67 10.011 -10.030 -13.473 1.00 0.00 C ATOM 1101 C LEU A 67 11.475 -9.593 -13.315 1.00 0.00 C ATOM 1102 O LEU A 67 12.141 -9.977 -12.353 1.00 0.00 O ATOM 1103 CB LEU A 67 9.042 -8.832 -13.523 1.00 0.00 C ATOM 1104 CG LEU A 67 7.575 -9.263 -13.729 1.00 0.00 C ATOM 1105 CD1 LEU A 67 6.817 -9.324 -12.423 1.00 0.00 C ATOM 1106 CD2 LEU A 67 6.819 -8.290 -14.624 1.00 0.00 C ATOM 0 H LEU A 67 9.877 -10.404 -11.452 1.00 0.00 H new ATOM 0 HA LEU A 67 9.910 -10.566 -14.417 1.00 0.00 H new ATOM 0 HB2 LEU A 67 9.123 -8.265 -12.596 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.338 -8.164 -14.332 1.00 0.00 H new ATOM 0 HG LEU A 67 7.628 -10.249 -14.190 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.789 -9.631 -12.613 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.294 -10.045 -11.759 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.821 -8.340 -11.954 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.790 -8.630 -14.744 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.823 -7.299 -14.170 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.302 -8.244 -15.600 1.00 0.00 H new ATOM 1118 N ASP A 68 11.996 -8.802 -14.260 1.00 0.00 N ATOM 1119 CA ASP A 68 13.439 -8.557 -14.383 1.00 0.00 C ATOM 1120 C ASP A 68 14.069 -7.892 -13.151 1.00 0.00 C ATOM 1121 O ASP A 68 15.230 -8.172 -12.840 1.00 0.00 O ATOM 1122 CB ASP A 68 13.726 -7.730 -15.639 1.00 0.00 C ATOM 1123 CG ASP A 68 15.238 -7.618 -15.893 1.00 0.00 C ATOM 1124 OD1 ASP A 68 15.876 -8.642 -16.234 1.00 0.00 O ATOM 1125 OD2 ASP A 68 15.800 -6.505 -15.765 1.00 0.00 O ATOM 0 H ASP A 68 11.433 -8.316 -14.958 1.00 0.00 H new ATOM 0 HA ASP A 68 13.907 -9.538 -14.463 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.242 -8.191 -16.500 1.00 0.00 H new ATOM 0 HB3 ASP A 68 13.298 -6.734 -15.528 1.00 0.00 H new ATOM 1130 N LYS A 69 13.316 -7.036 -12.438 1.00 0.00 N ATOM 1131 CA LYS A 69 13.786 -6.320 -11.237 1.00 0.00 C ATOM 1132 C LYS A 69 12.704 -6.236 -10.150 1.00 0.00 C ATOM 1133 O LYS A 69 12.712 -5.321 -9.321 1.00 0.00 O ATOM 1134 CB LYS A 69 14.311 -4.923 -11.612 1.00 0.00 C ATOM 1135 CG LYS A 69 15.516 -4.905 -12.558 1.00 0.00 C ATOM 1136 CD LYS A 69 16.812 -5.423 -11.908 1.00 0.00 C ATOM 1137 CE LYS A 69 17.996 -5.413 -12.889 1.00 0.00 C ATOM 1138 NZ LYS A 69 17.890 -6.468 -13.928 1.00 0.00 N ATOM 0 H LYS A 69 12.350 -6.818 -12.683 1.00 0.00 H new ATOM 0 HA LYS A 69 14.609 -6.896 -10.814 1.00 0.00 H new ATOM 0 HB2 LYS A 69 13.500 -4.361 -12.074 1.00 0.00 H new ATOM 0 HB3 LYS A 69 14.582 -4.398 -10.696 1.00 0.00 H new ATOM 0 HG2 LYS A 69 15.290 -5.513 -13.434 1.00 0.00 H new ATOM 0 HG3 LYS A 69 15.677 -3.886 -12.910 1.00 0.00 H new ATOM 0 HD2 LYS A 69 17.054 -4.807 -11.042 1.00 0.00 H new ATOM 0 HD3 LYS A 69 16.653 -6.438 -11.543 1.00 0.00 H new ATOM 0 HE2 LYS A 69 18.053 -4.438 -13.372 1.00 0.00 H new ATOM 0 HE3 LYS A 69 18.924 -5.548 -12.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 18.791 -6.540 -14.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 17.676 -7.380 -13.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 17.129 -6.225 -14.594 1.00 0.00 H new ATOM 1152 N GLY A 70 11.726 -7.140 -10.162 1.00 0.00 N ATOM 1153 CA GLY A 70 10.579 -7.072 -9.263 1.00 0.00 C ATOM 1154 C GLY A 70 9.680 -8.282 -9.440 1.00 0.00 C ATOM 1155 O GLY A 70 10.039 -9.229 -10.134 1.00 0.00 O ATOM 0 H GLY A 70 11.708 -7.939 -10.795 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.924 -7.018 -8.230 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.013 -6.161 -9.458 1.00 0.00 H new ATOM 1159 N LEU A 71 8.501 -8.248 -8.828 1.00 0.00 N ATOM 1160 CA LEU A 71 7.467 -9.280 -8.907 1.00 0.00 C ATOM 1161 C LEU A 71 6.148 -8.578 -9.223 1.00 0.00 C ATOM 1162 O LEU A 71 5.911 -7.483 -8.722 1.00 0.00 O ATOM 1163 CB LEU A 71 7.266 -9.973 -7.537 1.00 0.00 C ATOM 1164 CG LEU A 71 8.282 -10.994 -6.999 1.00 0.00 C ATOM 1165 CD1 LEU A 71 9.720 -10.478 -6.894 1.00 0.00 C ATOM 1166 CD2 LEU A 71 7.826 -11.417 -5.592 1.00 0.00 C ATOM 0 H LEU A 71 8.225 -7.465 -8.235 1.00 0.00 H new ATOM 0 HA LEU A 71 7.761 -10.015 -9.657 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.185 -9.183 -6.791 1.00 0.00 H new ATOM 0 HB3 LEU A 71 6.300 -10.476 -7.575 1.00 0.00 H new ATOM 0 HG LEU A 71 8.303 -11.815 -7.715 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.363 -11.268 -6.505 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.071 -10.177 -7.881 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.751 -9.621 -6.221 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.530 -12.143 -5.184 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.790 -10.542 -4.943 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.835 -11.866 -5.651 1.00 0.00 H new ATOM 1178 N GLU A 72 5.247 -9.236 -9.952 1.00 0.00 N ATOM 1179 CA GLU A 72 3.823 -8.904 -9.948 1.00 0.00 C ATOM 1180 C GLU A 72 3.130 -9.983 -9.139 1.00 0.00 C ATOM 1181 O GLU A 72 3.378 -11.177 -9.339 1.00 0.00 O ATOM 1182 CB GLU A 72 3.154 -8.858 -11.333 1.00 0.00 C ATOM 1183 CG GLU A 72 3.219 -7.504 -12.052 1.00 0.00 C ATOM 1184 CD GLU A 72 2.284 -7.498 -13.274 1.00 0.00 C ATOM 1185 OE1 GLU A 72 1.079 -7.182 -13.120 1.00 0.00 O ATOM 1186 OE2 GLU A 72 2.746 -7.812 -14.395 1.00 0.00 O ATOM 0 H GLU A 72 5.485 -10.017 -10.564 1.00 0.00 H new ATOM 0 HA GLU A 72 3.732 -7.898 -9.539 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.621 -9.610 -11.968 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.107 -9.141 -11.221 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.935 -6.707 -11.365 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.242 -7.302 -12.369 1.00 0.00 H new ATOM 1193 N ILE A 73 2.217 -9.553 -8.280 1.00 0.00 N ATOM 1194 CA ILE A 73 1.474 -10.371 -7.356 1.00 0.00 C ATOM 1195 C ILE A 73 0.004 -10.029 -7.617 1.00 0.00 C ATOM 1196 O ILE A 73 -0.393 -8.875 -7.497 1.00 0.00 O ATOM 1197 CB ILE A 73 1.858 -10.067 -5.884 1.00 0.00 C ATOM 1198 CG1 ILE A 73 3.342 -10.001 -5.428 1.00 0.00 C ATOM 1199 CG2 ILE A 73 1.182 -11.109 -4.979 1.00 0.00 C ATOM 1200 CD1 ILE A 73 4.210 -8.925 -6.079 1.00 0.00 C ATOM 0 H ILE A 73 1.967 -8.566 -8.212 1.00 0.00 H new ATOM 0 HA ILE A 73 1.685 -11.430 -7.503 1.00 0.00 H new ATOM 0 HB ILE A 73 1.525 -9.032 -5.801 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.360 -9.847 -4.349 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.801 -10.971 -5.620 1.00 0.00 H new ATOM 0 HG21 ILE A 73 1.441 -10.911 -3.939 1.00 0.00 H new ATOM 0 HG22 ILE A 73 0.100 -11.050 -5.101 1.00 0.00 H new ATOM 0 HG23 ILE A 73 1.524 -12.107 -5.254 1.00 0.00 H new ATOM 0 HD11 ILE A 73 5.222 -8.982 -5.678 1.00 0.00 H new ATOM 0 HD12 ILE A 73 4.238 -9.083 -7.157 1.00 0.00 H new ATOM 0 HD13 ILE A 73 3.790 -7.942 -5.867 1.00 0.00 H new ATOM 1212 N ILE A 74 -0.798 -11.015 -7.993 1.00 0.00 N ATOM 1213 CA ILE A 74 -2.252 -10.940 -8.101 1.00 0.00 C ATOM 1214 C ILE A 74 -2.771 -11.654 -6.847 1.00 0.00 C ATOM 1215 O ILE A 74 -2.203 -12.662 -6.425 1.00 0.00 O ATOM 1216 CB ILE A 74 -2.715 -11.625 -9.417 1.00 0.00 C ATOM 1217 CG1 ILE A 74 -2.375 -10.867 -10.722 1.00 0.00 C ATOM 1218 CG2 ILE A 74 -4.236 -11.848 -9.436 1.00 0.00 C ATOM 1219 CD1 ILE A 74 -0.892 -10.615 -11.004 1.00 0.00 C ATOM 0 H ILE A 74 -0.437 -11.935 -8.244 1.00 0.00 H new ATOM 0 HA ILE A 74 -2.635 -9.921 -8.149 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.154 -12.559 -9.406 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -2.790 -11.428 -11.559 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.885 -9.904 -10.699 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -4.522 -12.329 -10.372 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -4.521 -12.485 -8.599 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -4.746 -10.888 -9.351 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.787 -10.077 -11.946 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.464 -10.021 -10.197 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.367 -11.568 -11.070 1.00 0.00 H new ATOM 1231 N VAL A 75 -3.867 -11.180 -6.260 1.00 0.00 N ATOM 1232 CA VAL A 75 -4.544 -11.864 -5.169 1.00 0.00 C ATOM 1233 C VAL A 75 -6.051 -11.758 -5.436 1.00 0.00 C ATOM 1234 O VAL A 75 -6.522 -10.742 -5.953 1.00 0.00 O ATOM 1235 CB VAL A 75 -4.022 -11.415 -3.769 1.00 0.00 C ATOM 1236 CG1 VAL A 75 -2.957 -10.295 -3.768 1.00 0.00 C ATOM 1237 CG2 VAL A 75 -5.127 -11.049 -2.771 1.00 0.00 C ATOM 0 H VAL A 75 -4.311 -10.303 -6.533 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.309 -12.928 -5.135 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.527 -12.328 -3.437 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.670 -10.067 -2.742 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.080 -10.626 -4.325 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -3.368 -9.401 -4.237 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -4.678 -10.748 -1.825 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.719 -10.225 -3.169 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.771 -11.913 -2.608 1.00 0.00 H new ATOM 1247 N THR A 76 -6.803 -12.825 -5.156 1.00 0.00 N ATOM 1248 CA THR A 76 -8.169 -12.991 -5.636 1.00 0.00 C ATOM 1249 C THR A 76 -9.056 -13.504 -4.499 1.00 0.00 C ATOM 1250 O THR A 76 -8.555 -13.972 -3.468 1.00 0.00 O ATOM 1251 CB THR A 76 -8.207 -13.875 -6.918 1.00 0.00 C ATOM 1252 OG1 THR A 76 -8.192 -15.258 -6.664 1.00 0.00 O ATOM 1253 CG2 THR A 76 -7.035 -13.646 -7.881 1.00 0.00 C ATOM 0 H THR A 76 -6.474 -13.603 -4.584 1.00 0.00 H new ATOM 0 HA THR A 76 -8.576 -12.027 -5.941 1.00 0.00 H new ATOM 0 HB THR A 76 -9.151 -13.560 -7.362 1.00 0.00 H new ATOM 0 HG1 THR A 76 -8.219 -15.747 -7.513 1.00 0.00 H new ATOM 0 HG21 THR A 76 -7.141 -14.302 -8.745 1.00 0.00 H new ATOM 0 HG22 THR A 76 -7.033 -12.607 -8.212 1.00 0.00 H new ATOM 0 HG23 THR A 76 -6.097 -13.866 -7.371 1.00 0.00 H new ATOM 1261 N LYS A 77 -10.377 -13.404 -4.666 1.00 0.00 N ATOM 1262 CA LYS A 77 -11.394 -13.971 -3.780 1.00 0.00 C ATOM 1263 C LYS A 77 -12.611 -14.343 -4.628 1.00 0.00 C ATOM 1264 O LYS A 77 -12.760 -13.839 -5.745 1.00 0.00 O ATOM 1265 CB LYS A 77 -11.805 -12.967 -2.686 1.00 0.00 C ATOM 1266 CG LYS A 77 -10.747 -12.751 -1.587 1.00 0.00 C ATOM 1267 CD LYS A 77 -9.875 -11.487 -1.714 1.00 0.00 C ATOM 1268 CE LYS A 77 -10.649 -10.167 -1.877 1.00 0.00 C ATOM 1269 NZ LYS A 77 -11.666 -9.943 -0.818 1.00 0.00 N ATOM 0 H LYS A 77 -10.783 -12.904 -5.457 1.00 0.00 H new ATOM 0 HA LYS A 77 -10.987 -14.851 -3.282 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -12.025 -12.008 -3.155 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -12.728 -13.313 -2.221 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -11.256 -12.719 -0.624 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -10.089 -13.620 -1.571 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -9.243 -11.411 -0.829 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -9.212 -11.608 -2.570 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -9.942 -9.337 -1.872 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.141 -10.161 -2.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -12.162 -9.046 -0.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -12.352 -10.725 -0.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -11.198 -9.901 0.110 1.00 0.00 H new ATOM 1283 N ALA A 78 -13.494 -15.181 -4.078 1.00 0.00 N ATOM 1284 CA ALA A 78 -14.852 -15.335 -4.592 1.00 0.00 C ATOM 1285 C ALA A 78 -15.596 -13.999 -4.442 1.00 0.00 C ATOM 1286 O ALA A 78 -15.229 -13.170 -3.603 1.00 0.00 O ATOM 1287 CB ALA A 78 -15.568 -16.462 -3.833 1.00 0.00 C ATOM 0 H ALA A 78 -13.287 -15.767 -3.269 1.00 0.00 H new ATOM 0 HA ALA A 78 -14.829 -15.605 -5.648 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -16.581 -16.574 -4.219 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -15.022 -17.396 -3.969 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.609 -16.217 -2.772 1.00 0.00 H new ATOM 1293 N GLN A 79 -16.655 -13.798 -5.232 1.00 0.00 N ATOM 1294 CA GLN A 79 -17.486 -12.603 -5.119 1.00 0.00 C ATOM 1295 C GLN A 79 -18.170 -12.576 -3.745 1.00 0.00 C ATOM 1296 O GLN A 79 -18.768 -13.571 -3.325 1.00 0.00 O ATOM 1297 CB GLN A 79 -18.477 -12.502 -6.296 1.00 0.00 C ATOM 1298 CG GLN A 79 -19.459 -13.678 -6.457 1.00 0.00 C ATOM 1299 CD GLN A 79 -20.411 -13.459 -7.636 1.00 0.00 C ATOM 1300 OE1 GLN A 79 -21.579 -13.123 -7.458 1.00 0.00 O ATOM 1301 NE2 GLN A 79 -19.946 -13.652 -8.863 1.00 0.00 N ATOM 0 H GLN A 79 -16.955 -14.450 -5.957 1.00 0.00 H new ATOM 0 HA GLN A 79 -16.859 -11.714 -5.185 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -19.055 -11.585 -6.180 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -17.905 -12.404 -7.219 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -18.900 -14.602 -6.606 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -20.036 -13.799 -5.540 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -18.975 -13.931 -9.002 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -20.560 -13.521 -9.667 1.00 0.00 H new ATOM 1310 N LEU A 80 -18.117 -11.435 -3.050 1.00 0.00 N ATOM 1311 CA LEU A 80 -18.831 -11.230 -1.789 1.00 0.00 C ATOM 1312 C LEU A 80 -20.347 -11.285 -2.030 1.00 0.00 C ATOM 1313 O LEU A 80 -21.091 -11.800 -1.198 1.00 0.00 O ATOM 1314 CB LEU A 80 -18.421 -9.872 -1.186 1.00 0.00 C ATOM 1315 CG LEU A 80 -19.068 -9.555 0.178 1.00 0.00 C ATOM 1316 CD1 LEU A 80 -18.654 -10.558 1.264 1.00 0.00 C ATOM 1317 CD2 LEU A 80 -18.664 -8.145 0.616 1.00 0.00 C ATOM 0 H LEU A 80 -17.574 -10.625 -3.349 1.00 0.00 H new ATOM 0 HA LEU A 80 -18.570 -12.021 -1.086 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -17.337 -9.852 -1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -18.683 -9.082 -1.890 1.00 0.00 H new ATOM 0 HG LEU A 80 -20.149 -9.626 0.054 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -19.135 -10.293 2.206 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -18.962 -11.561 0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -17.572 -10.532 1.389 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -19.120 -7.919 1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -17.579 -8.089 0.706 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -19.005 -7.422 -0.125 1.00 0.00 H new ATOM 1329 N SER A 81 -20.787 -10.802 -3.197 1.00 0.00 N ATOM 1330 CA SER A 81 -22.171 -10.759 -3.653 1.00 0.00 C ATOM 1331 C SER A 81 -22.763 -12.144 -4.006 1.00 0.00 C ATOM 1332 O SER A 81 -23.837 -12.212 -4.614 1.00 0.00 O ATOM 1333 CB SER A 81 -22.250 -9.755 -4.818 1.00 0.00 C ATOM 1334 OG SER A 81 -21.094 -9.822 -5.652 1.00 0.00 O ATOM 0 H SER A 81 -20.145 -10.409 -3.885 1.00 0.00 H new ATOM 0 HA SER A 81 -22.802 -10.425 -2.830 1.00 0.00 H new ATOM 0 HB2 SER A 81 -23.140 -9.958 -5.413 1.00 0.00 H new ATOM 0 HB3 SER A 81 -22.355 -8.745 -4.422 1.00 0.00 H new ATOM 0 HG SER A 81 -21.179 -9.173 -6.381 1.00 0.00 H new ATOM 1340 N LYS A 82 -22.100 -13.252 -3.631 1.00 0.00 N ATOM 1341 CA LYS A 82 -22.635 -14.613 -3.768 1.00 0.00 C ATOM 1342 C LYS A 82 -24.016 -14.736 -3.101 1.00 0.00 C ATOM 1343 O LYS A 82 -24.864 -15.496 -3.577 1.00 0.00 O ATOM 1344 CB LYS A 82 -21.622 -15.618 -3.191 1.00 0.00 C ATOM 1345 CG LYS A 82 -22.030 -17.079 -3.426 1.00 0.00 C ATOM 1346 CD LYS A 82 -20.952 -18.050 -2.922 1.00 0.00 C ATOM 1347 CE LYS A 82 -21.401 -19.498 -3.165 1.00 0.00 C ATOM 1348 NZ LYS A 82 -20.402 -20.491 -2.687 1.00 0.00 N ATOM 0 H LYS A 82 -21.167 -13.224 -3.220 1.00 0.00 H new ATOM 0 HA LYS A 82 -22.781 -14.840 -4.824 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -20.646 -15.442 -3.642 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -21.515 -15.444 -2.120 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -22.972 -17.282 -2.916 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -22.202 -17.244 -4.490 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -20.010 -17.861 -3.436 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -20.773 -17.889 -1.859 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -22.351 -19.670 -2.659 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -21.576 -19.647 -4.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -20.752 -21.453 -2.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -19.502 -20.346 -3.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -20.253 -20.369 -1.665 1.00 0.00 H new ATOM 1362 N ASP A 83 -24.266 -13.949 -2.052 1.00 0.00 N ATOM 1363 CA ASP A 83 -25.605 -13.595 -1.585 1.00 0.00 C ATOM 1364 C ASP A 83 -25.596 -12.081 -1.325 1.00 0.00 C ATOM 1365 O ASP A 83 -24.528 -11.455 -1.327 1.00 0.00 O ATOM 1366 CB ASP A 83 -26.000 -14.409 -0.340 1.00 0.00 C ATOM 1367 CG ASP A 83 -27.531 -14.518 -0.196 1.00 0.00 C ATOM 1368 OD1 ASP A 83 -28.198 -13.485 0.041 1.00 0.00 O ATOM 1369 OD2 ASP A 83 -28.068 -15.645 -0.320 1.00 0.00 O ATOM 0 H ASP A 83 -23.524 -13.531 -1.491 1.00 0.00 H new ATOM 0 HA ASP A 83 -26.360 -13.838 -2.333 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -25.568 -15.408 -0.405 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -25.583 -13.939 0.550 1.00 0.00 H new ATOM 1374 N LEU A 84 -26.767 -11.479 -1.141 1.00 0.00 N ATOM 1375 CA LEU A 84 -26.952 -10.041 -0.957 1.00 0.00 C ATOM 1376 C LEU A 84 -28.215 -9.769 -0.134 1.00 0.00 C ATOM 1377 O LEU A 84 -28.236 -8.829 0.661 1.00 0.00 O ATOM 1378 CB LEU A 84 -27.044 -9.364 -2.337 1.00 0.00 C ATOM 1379 CG LEU A 84 -27.135 -7.824 -2.289 1.00 0.00 C ATOM 1380 CD1 LEU A 84 -25.889 -7.188 -1.655 1.00 0.00 C ATOM 1381 CD2 LEU A 84 -27.293 -7.287 -3.719 1.00 0.00 C ATOM 0 H LEU A 84 -27.646 -11.997 -1.115 1.00 0.00 H new ATOM 0 HA LEU A 84 -26.102 -9.630 -0.413 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -26.170 -9.646 -2.925 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -27.918 -9.751 -2.860 1.00 0.00 H new ATOM 0 HG LEU A 84 -27.995 -7.562 -1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -26.000 -6.104 -1.644 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -25.774 -7.552 -0.634 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -25.007 -7.456 -2.237 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -27.358 -6.199 -3.694 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -26.432 -7.585 -4.317 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -28.201 -7.695 -4.162 1.00 0.00 H new ATOM 1393 N ASP A 85 -29.258 -10.597 -0.293 1.00 0.00 N ATOM 1394 CA ASP A 85 -30.427 -10.584 0.586 1.00 0.00 C ATOM 1395 C ASP A 85 -30.015 -10.880 2.030 1.00 0.00 C ATOM 1396 O ASP A 85 -30.466 -10.198 2.955 1.00 0.00 O ATOM 1397 CB ASP A 85 -31.449 -11.620 0.111 1.00 0.00 C ATOM 1398 CG ASP A 85 -32.614 -11.766 1.105 1.00 0.00 C ATOM 1399 OD1 ASP A 85 -33.419 -10.814 1.250 1.00 0.00 O ATOM 1400 OD2 ASP A 85 -32.742 -12.858 1.712 1.00 0.00 O ATOM 0 H ASP A 85 -29.311 -11.293 -1.036 1.00 0.00 H new ATOM 0 HA ASP A 85 -30.879 -9.593 0.550 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -31.837 -11.328 -0.865 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -30.957 -12.584 -0.018 1.00 0.00 H new ATOM 1405 N LYS A 86 -29.106 -11.847 2.228 1.00 0.00 N ATOM 1406 CA LYS A 86 -28.391 -11.997 3.488 1.00 0.00 C ATOM 1407 C LYS A 86 -27.275 -10.955 3.485 1.00 0.00 C ATOM 1408 O LYS A 86 -26.365 -11.005 2.653 1.00 0.00 O ATOM 1409 CB LYS A 86 -27.829 -13.420 3.658 1.00 0.00 C ATOM 1410 CG LYS A 86 -28.790 -14.403 4.335 1.00 0.00 C ATOM 1411 CD LYS A 86 -30.197 -14.549 3.743 1.00 0.00 C ATOM 1412 CE LYS A 86 -30.123 -15.120 2.326 1.00 0.00 C ATOM 1413 NZ LYS A 86 -31.469 -15.339 1.741 1.00 0.00 N ATOM 0 H LYS A 86 -28.853 -12.537 1.521 1.00 0.00 H new ATOM 0 HA LYS A 86 -29.065 -11.842 4.331 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -27.560 -13.811 2.677 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -26.911 -13.367 4.243 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -28.321 -15.387 4.331 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -28.895 -14.105 5.378 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -30.798 -15.203 4.375 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -30.693 -13.579 3.725 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -29.558 -14.438 1.690 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -29.578 -16.064 2.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -31.371 -15.711 0.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -31.994 -16.023 2.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -31.987 -14.438 1.715 1.00 0.00 H new ATOM 1427 N LEU A 87 -27.369 -9.999 4.409 1.00 0.00 N ATOM 1428 CA LEU A 87 -26.346 -8.996 4.659 1.00 0.00 C ATOM 1429 C LEU A 87 -25.096 -9.656 5.250 1.00 0.00 C ATOM 1430 O LEU A 87 -25.169 -10.744 5.829 1.00 0.00 O ATOM 1431 CB LEU A 87 -26.907 -7.946 5.608 1.00 0.00 C ATOM 1432 CG LEU A 87 -28.087 -7.149 5.024 1.00 0.00 C ATOM 1433 CD1 LEU A 87 -28.388 -6.046 6.020 1.00 0.00 C ATOM 1434 CD2 LEU A 87 -27.791 -6.515 3.662 1.00 0.00 C ATOM 0 H LEU A 87 -28.182 -9.902 5.018 1.00 0.00 H new ATOM 0 HA LEU A 87 -26.060 -8.515 3.724 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -27.230 -8.436 6.527 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -26.111 -7.253 5.879 1.00 0.00 H new ATOM 0 HG LEU A 87 -28.921 -7.832 4.863 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -29.221 -5.445 5.656 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -28.651 -6.486 6.982 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -27.509 -5.413 6.139 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -28.669 -5.971 3.316 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -26.951 -5.827 3.756 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -27.542 -7.296 2.944 1.00 0.00 H new ATOM 1446 N VAL A 88 -23.956 -8.965 5.159 1.00 0.00 N ATOM 1447 CA VAL A 88 -22.790 -9.284 5.983 1.00 0.00 C ATOM 1448 C VAL A 88 -23.137 -9.052 7.474 1.00 0.00 C ATOM 1449 O VAL A 88 -24.077 -8.303 7.773 1.00 0.00 O ATOM 1450 CB VAL A 88 -21.553 -8.483 5.520 1.00 0.00 C ATOM 1451 CG1 VAL A 88 -21.186 -8.803 4.062 1.00 0.00 C ATOM 1452 CG2 VAL A 88 -21.729 -6.969 5.678 1.00 0.00 C ATOM 0 H VAL A 88 -23.817 -8.181 4.522 1.00 0.00 H new ATOM 0 HA VAL A 88 -22.529 -10.336 5.864 1.00 0.00 H new ATOM 0 HB VAL A 88 -20.740 -8.797 6.175 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -20.311 -8.221 3.771 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -20.963 -9.866 3.968 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -22.023 -8.549 3.412 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -20.828 -6.460 5.336 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -22.580 -6.638 5.083 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -21.905 -6.731 6.727 1.00 0.00 H new ATOM 1462 N PRO A 89 -22.403 -9.673 8.415 1.00 0.00 N ATOM 1463 CA PRO A 89 -22.581 -9.477 9.849 1.00 0.00 C ATOM 1464 C PRO A 89 -22.531 -8.003 10.277 1.00 0.00 C ATOM 1465 O PRO A 89 -21.876 -7.168 9.638 1.00 0.00 O ATOM 1466 CB PRO A 89 -21.462 -10.275 10.521 1.00 0.00 C ATOM 1467 CG PRO A 89 -21.107 -11.346 9.501 1.00 0.00 C ATOM 1468 CD PRO A 89 -21.375 -10.668 8.166 1.00 0.00 C ATOM 0 HA PRO A 89 -23.573 -9.817 10.146 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -20.604 -9.643 10.751 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -21.795 -10.715 11.461 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -20.066 -11.657 9.591 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -21.719 -12.239 9.627 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -20.469 -10.203 7.777 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -21.706 -11.392 7.422 1.00 0.00 H new ATOM 1476 N ARG A 90 -23.179 -7.705 11.403 1.00 0.00 N ATOM 1477 CA ARG A 90 -23.266 -6.392 12.029 1.00 0.00 C ATOM 1478 C ARG A 90 -23.189 -6.599 13.536 1.00 0.00 C ATOM 1479 O ARG A 90 -23.818 -7.559 14.043 1.00 0.00 O ATOM 1480 CB ARG A 90 -24.584 -5.700 11.656 1.00 0.00 C ATOM 1481 CG ARG A 90 -24.636 -5.266 10.183 1.00 0.00 C ATOM 1482 CD ARG A 90 -25.906 -4.451 9.945 1.00 0.00 C ATOM 1483 NE ARG A 90 -25.932 -3.859 8.594 1.00 0.00 N ATOM 1484 CZ ARG A 90 -26.902 -3.076 8.099 1.00 0.00 C ATOM 1485 NH1 ARG A 90 -27.991 -2.807 8.818 1.00 0.00 N ATOM 1486 NH2 ARG A 90 -26.779 -2.562 6.877 1.00 0.00 N ATOM 1487 OXT ARG A 90 -22.483 -5.819 14.212 1.00 0.00 O ATOM 0 H ARG A 90 -23.685 -8.416 11.930 1.00 0.00 H new ATOM 0 HA ARG A 90 -22.452 -5.755 11.684 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -25.414 -6.377 11.860 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -24.722 -4.826 12.292 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -23.756 -4.672 9.935 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -24.624 -6.141 9.533 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -26.779 -5.090 10.078 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -25.974 -3.659 10.690 1.00 0.00 H new ATOM 0 HE ARG A 90 -25.142 -4.063 7.982 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -28.093 -3.198 9.755 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -28.723 -2.210 8.432 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -25.949 -2.764 6.320 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -27.515 -1.966 6.498 1.00 0.00 H new TER 1501 ARG A 90