USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 758 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 35 ASN : amide:sc= -0.628 K(o=-0.63,f=-4.2!) USER MOD Set 1.2: A 39 LYS NZ :NH3+ 160:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc=-0.00793 (180deg=-0.181) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl 178:sc= -0.139 (180deg=-0.146) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot -81:sc= 0.123 USER MOD Single : A 26 ASN : amide:sc= -0.333 K(o=-0.33,f=-11!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.0549 X(o=-0.055,f=0) USER MOD Single : A 42 CYS SG : rot 61:sc= 0.685 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -110:sc= -0.199 USER MOD Single : A 56 ASN : amide:sc=-0.00981 K(o=-0.0098,f=-1.5) USER MOD Single : A 58 MET CE :methyl -145:sc= -2.03 (180deg=-6.91!) USER MOD Single : A 60 THR OG1 : rot -39:sc= 0.7 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot 180:sc= -0.0631 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HD1:sc= -1.19 K(o=-1.2,f=-2.4) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 130:sc= -1.3 USER MOD Single : A 88 LYS NZ :NH3+ -129:sc= 0 (180deg=-0.362) USER MOD Single : A 89 THR OG1 : rot 74:sc= 0.0832 USER MOD Single : A 92 LYS NZ :NH3+ -169:sc=-0.00294 (180deg=-0.114) USER MOD Single : A 95 ASN : amide:sc= -0.39 K(o=-0.39,f=-2.2!) USER MOD Single : A 96 LYS NZ :NH3+ -117:sc= 0 (180deg=-0.333) USER MOD Single : A 97 LYS NZ :NH3+ -159:sc= 1.26 (180deg=1.19) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.162 10.715 -22.993 1.00 0.00 N ATOM 2 CA MET A 1 15.213 9.308 -22.611 1.00 0.00 C ATOM 3 C MET A 1 14.437 9.068 -21.319 1.00 0.00 C ATOM 4 O MET A 1 14.538 9.847 -20.371 1.00 0.00 O ATOM 5 CB MET A 1 16.664 8.856 -22.440 1.00 0.00 C ATOM 6 CG MET A 1 17.418 8.724 -23.754 1.00 0.00 C ATOM 7 SD MET A 1 17.250 7.085 -24.487 1.00 0.00 S ATOM 8 CE MET A 1 18.419 7.198 -25.840 1.00 0.00 C ATOM 0 H1 MET A 1 15.418 10.812 -23.996 1.00 0.00 H new ATOM 0 H2 MET A 1 14.200 11.080 -22.844 1.00 0.00 H new ATOM 0 H3 MET A 1 15.832 11.257 -22.411 1.00 0.00 H new ATOM 0 HA MET A 1 14.750 8.724 -23.406 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.185 9.569 -21.801 1.00 0.00 H new ATOM 0 HB3 MET A 1 16.679 7.896 -21.924 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.050 9.472 -24.457 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.474 8.937 -23.586 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.430 6.257 -26.391 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.124 8.007 -26.509 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.415 7.399 -25.445 1.00 0.00 H new ATOM 18 N ALA A 2 13.665 7.987 -21.290 1.00 0.00 N ATOM 19 CA ALA A 2 12.875 7.645 -20.114 1.00 0.00 C ATOM 20 C ALA A 2 13.441 6.416 -19.411 1.00 0.00 C ATOM 21 O ALA A 2 13.812 5.435 -20.057 1.00 0.00 O ATOM 22 CB ALA A 2 11.423 7.411 -20.504 1.00 0.00 C ATOM 0 H ALA A 2 13.570 7.333 -22.067 1.00 0.00 H new ATOM 0 HA ALA A 2 12.922 8.483 -19.418 1.00 0.00 H new ATOM 0 HB1 ALA A 2 10.844 7.156 -19.616 1.00 0.00 H new ATOM 0 HB2 ALA A 2 11.017 8.317 -20.955 1.00 0.00 H new ATOM 0 HB3 ALA A 2 11.366 6.592 -21.221 1.00 0.00 H new ATOM 28 N ARG A 3 13.506 6.475 -18.085 1.00 0.00 N ATOM 29 CA ARG A 3 14.029 5.368 -17.294 1.00 0.00 C ATOM 30 C ARG A 3 12.977 4.852 -16.318 1.00 0.00 C ATOM 31 O ARG A 3 13.137 4.959 -15.103 1.00 0.00 O ATOM 32 CB ARG A 3 15.279 5.806 -16.529 1.00 0.00 C ATOM 33 CG ARG A 3 16.447 6.173 -17.429 1.00 0.00 C ATOM 34 CD ARG A 3 17.629 6.690 -16.626 1.00 0.00 C ATOM 35 NE ARG A 3 18.331 5.615 -15.930 1.00 0.00 N ATOM 36 CZ ARG A 3 19.103 4.725 -16.542 1.00 0.00 C ATOM 37 NH1 ARG A 3 19.274 4.783 -17.856 1.00 0.00 N ATOM 38 NH2 ARG A 3 19.709 3.775 -15.840 1.00 0.00 N ATOM 0 H ARG A 3 13.203 7.279 -17.535 1.00 0.00 H new ATOM 0 HA ARG A 3 14.293 4.560 -17.976 1.00 0.00 H new ATOM 0 HB2 ARG A 3 15.030 6.663 -15.904 1.00 0.00 H new ATOM 0 HB3 ARG A 3 15.586 5.002 -15.860 1.00 0.00 H new ATOM 0 HG2 ARG A 3 16.752 5.300 -18.005 1.00 0.00 H new ATOM 0 HG3 ARG A 3 16.132 6.933 -18.144 1.00 0.00 H new ATOM 0 HD2 ARG A 3 18.322 7.204 -17.292 1.00 0.00 H new ATOM 0 HD3 ARG A 3 17.280 7.425 -15.900 1.00 0.00 H new ATOM 0 HE ARG A 3 18.222 5.544 -14.918 1.00 0.00 H new ATOM 0 HH11 ARG A 3 18.812 5.513 -18.399 1.00 0.00 H new ATOM 0 HH12 ARG A 3 19.868 4.098 -18.324 1.00 0.00 H new ATOM 0 HH21 ARG A 3 19.582 3.728 -14.829 1.00 0.00 H new ATOM 0 HH22 ARG A 3 20.302 3.092 -16.312 1.00 0.00 H new ATOM 52 N GLY A 4 11.898 4.292 -16.859 1.00 0.00 N ATOM 53 CA GLY A 4 10.835 3.768 -16.021 1.00 0.00 C ATOM 54 C GLY A 4 9.518 3.651 -16.762 1.00 0.00 C ATOM 55 O GLY A 4 8.460 3.961 -16.215 1.00 0.00 O ATOM 0 H GLY A 4 11.742 4.192 -17.862 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.124 2.787 -15.643 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.705 4.418 -15.155 1.00 0.00 H new ATOM 59 N SER A 5 9.581 3.203 -18.011 1.00 0.00 N ATOM 60 CA SER A 5 8.385 3.050 -18.831 1.00 0.00 C ATOM 61 C SER A 5 7.352 2.177 -18.127 1.00 0.00 C ATOM 62 O SER A 5 7.619 1.614 -17.064 1.00 0.00 O ATOM 63 CB SER A 5 8.745 2.442 -20.188 1.00 0.00 C ATOM 64 OG SER A 5 9.432 3.377 -21.000 1.00 0.00 O ATOM 0 H SER A 5 10.449 2.939 -18.478 1.00 0.00 H new ATOM 0 HA SER A 5 7.953 4.038 -18.988 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.366 1.558 -20.041 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.838 2.113 -20.695 1.00 0.00 H new ATOM 0 HG SER A 5 9.652 2.963 -21.861 1.00 0.00 H new ATOM 70 N VAL A 6 6.171 2.067 -18.727 1.00 0.00 N ATOM 71 CA VAL A 6 5.097 1.262 -18.158 1.00 0.00 C ATOM 72 C VAL A 6 4.270 0.596 -19.254 1.00 0.00 C ATOM 73 O VAL A 6 3.528 1.262 -19.976 1.00 0.00 O ATOM 74 CB VAL A 6 4.166 2.111 -17.273 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.190 1.222 -16.518 1.00 0.00 C ATOM 76 CG2 VAL A 6 4.978 2.963 -16.310 1.00 0.00 C ATOM 0 H VAL A 6 5.934 2.525 -19.607 1.00 0.00 H new ATOM 0 HA VAL A 6 5.568 0.495 -17.544 1.00 0.00 H new ATOM 0 HB VAL A 6 3.591 2.778 -17.916 1.00 0.00 H new ATOM 0 HG11 VAL A 6 2.540 1.840 -15.898 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.585 0.659 -17.229 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.744 0.529 -15.885 1.00 0.00 H new ATOM 0 HG21 VAL A 6 4.304 3.557 -15.692 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.581 2.317 -15.672 1.00 0.00 H new ATOM 0 HG23 VAL A 6 5.632 3.627 -16.875 1.00 0.00 H new ATOM 86 N SER A 7 4.404 -0.721 -19.370 1.00 0.00 N ATOM 87 CA SER A 7 3.672 -1.477 -20.381 1.00 0.00 C ATOM 88 C SER A 7 2.181 -1.161 -20.320 1.00 0.00 C ATOM 89 O SER A 7 1.700 -0.566 -19.356 1.00 0.00 O ATOM 90 CB SER A 7 3.896 -2.977 -20.185 1.00 0.00 C ATOM 91 OG SER A 7 5.043 -3.418 -20.891 1.00 0.00 O ATOM 0 H SER A 7 5.012 -1.287 -18.778 1.00 0.00 H new ATOM 0 HA SER A 7 4.047 -1.186 -21.362 1.00 0.00 H new ATOM 0 HB2 SER A 7 4.013 -3.195 -19.123 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.020 -3.527 -20.529 1.00 0.00 H new ATOM 0 HG SER A 7 5.165 -4.380 -20.748 1.00 0.00 H new ATOM 97 N ASP A 8 1.455 -1.563 -21.358 1.00 0.00 N ATOM 98 CA ASP A 8 0.018 -1.325 -21.425 1.00 0.00 C ATOM 99 C ASP A 8 -0.695 -1.969 -20.239 1.00 0.00 C ATOM 100 O ASP A 8 -1.403 -1.297 -19.490 1.00 0.00 O ATOM 101 CB ASP A 8 -0.551 -1.871 -22.735 1.00 0.00 C ATOM 102 CG ASP A 8 0.016 -3.231 -23.090 1.00 0.00 C ATOM 103 OD1 ASP A 8 1.144 -3.283 -23.625 1.00 0.00 O ATOM 104 OD2 ASP A 8 -0.668 -4.244 -22.833 1.00 0.00 O ATOM 0 H ASP A 8 1.839 -2.055 -22.165 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.149 -0.249 -21.386 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -1.636 -1.943 -22.655 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -0.337 -1.169 -23.541 1.00 0.00 H new ATOM 109 N GLU A 9 -0.502 -3.275 -20.077 1.00 0.00 N ATOM 110 CA GLU A 9 -1.129 -4.008 -18.984 1.00 0.00 C ATOM 111 C GLU A 9 -0.722 -3.426 -17.634 1.00 0.00 C ATOM 112 O GLU A 9 -1.552 -3.270 -16.738 1.00 0.00 O ATOM 113 CB GLU A 9 -0.747 -5.488 -19.049 1.00 0.00 C ATOM 114 CG GLU A 9 0.753 -5.729 -19.072 1.00 0.00 C ATOM 115 CD GLU A 9 1.107 -7.184 -19.308 1.00 0.00 C ATOM 116 OE1 GLU A 9 1.880 -7.461 -20.250 1.00 0.00 O ATOM 117 OE2 GLU A 9 0.611 -8.046 -18.554 1.00 0.00 O ATOM 0 H GLU A 9 0.083 -3.846 -20.688 1.00 0.00 H new ATOM 0 HA GLU A 9 -2.210 -3.913 -19.090 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.176 -6.003 -18.190 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.191 -5.930 -19.941 1.00 0.00 H new ATOM 0 HG2 GLU A 9 1.203 -5.118 -19.854 1.00 0.00 H new ATOM 0 HG3 GLU A 9 1.184 -5.403 -18.125 1.00 0.00 H new ATOM 124 N GLU A 10 0.561 -3.104 -17.496 1.00 0.00 N ATOM 125 CA GLU A 10 1.078 -2.539 -16.255 1.00 0.00 C ATOM 126 C GLU A 10 0.443 -1.182 -15.969 1.00 0.00 C ATOM 127 O GLU A 10 0.030 -0.903 -14.843 1.00 0.00 O ATOM 128 CB GLU A 10 2.599 -2.398 -16.328 1.00 0.00 C ATOM 129 CG GLU A 10 3.236 -1.981 -15.014 1.00 0.00 C ATOM 130 CD GLU A 10 4.028 -3.101 -14.368 1.00 0.00 C ATOM 131 OE1 GLU A 10 4.764 -3.802 -15.094 1.00 0.00 O ATOM 132 OE2 GLU A 10 3.914 -3.277 -13.137 1.00 0.00 O ATOM 0 H GLU A 10 1.261 -3.225 -18.228 1.00 0.00 H new ATOM 0 HA GLU A 10 0.822 -3.218 -15.442 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.029 -3.348 -16.645 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.851 -1.664 -17.093 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.894 -1.129 -15.188 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.458 -1.648 -14.327 1.00 0.00 H new ATOM 139 N MET A 11 0.369 -0.341 -16.996 1.00 0.00 N ATOM 140 CA MET A 11 -0.216 0.987 -16.855 1.00 0.00 C ATOM 141 C MET A 11 -1.656 0.898 -16.359 1.00 0.00 C ATOM 142 O MET A 11 -2.054 1.621 -15.447 1.00 0.00 O ATOM 143 CB MET A 11 -0.170 1.732 -18.191 1.00 0.00 C ATOM 144 CG MET A 11 -0.025 3.238 -18.042 1.00 0.00 C ATOM 145 SD MET A 11 -1.518 4.019 -17.400 1.00 0.00 S ATOM 146 CE MET A 11 -0.868 4.857 -15.957 1.00 0.00 C ATOM 0 H MET A 11 0.707 -0.556 -17.934 1.00 0.00 H new ATOM 0 HA MET A 11 0.369 1.538 -16.119 1.00 0.00 H new ATOM 0 HB2 MET A 11 0.664 1.352 -18.781 1.00 0.00 H new ATOM 0 HB3 MET A 11 -1.081 1.516 -18.750 1.00 0.00 H new ATOM 0 HG2 MET A 11 0.809 3.455 -17.375 1.00 0.00 H new ATOM 0 HG3 MET A 11 0.220 3.673 -19.011 1.00 0.00 H new ATOM 0 HE1 MET A 11 -1.667 5.417 -15.471 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.464 4.122 -15.261 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.077 5.543 -16.260 1.00 0.00 H new ATOM 156 N MET A 12 -2.432 0.004 -16.965 1.00 0.00 N ATOM 157 CA MET A 12 -3.827 -0.179 -16.584 1.00 0.00 C ATOM 158 C MET A 12 -3.933 -0.823 -15.206 1.00 0.00 C ATOM 159 O MET A 12 -4.643 -0.326 -14.332 1.00 0.00 O ATOM 160 CB MET A 12 -4.552 -1.041 -17.620 1.00 0.00 C ATOM 161 CG MET A 12 -4.492 -0.476 -19.029 1.00 0.00 C ATOM 162 SD MET A 12 -4.850 -1.715 -20.290 1.00 0.00 S ATOM 163 CE MET A 12 -6.512 -1.246 -20.763 1.00 0.00 C ATOM 0 H MET A 12 -2.118 -0.604 -17.721 1.00 0.00 H new ATOM 0 HA MET A 12 -4.299 0.803 -16.545 1.00 0.00 H new ATOM 0 HB2 MET A 12 -4.116 -2.040 -17.619 1.00 0.00 H new ATOM 0 HB3 MET A 12 -5.596 -1.149 -17.325 1.00 0.00 H new ATOM 0 HG2 MET A 12 -5.205 0.344 -19.118 1.00 0.00 H new ATOM 0 HG3 MET A 12 -3.501 -0.058 -19.207 1.00 0.00 H new ATOM 0 HE1 MET A 12 -6.874 -1.921 -21.538 1.00 0.00 H new ATOM 0 HE2 MET A 12 -7.168 -1.306 -19.895 1.00 0.00 H new ATOM 0 HE3 MET A 12 -6.507 -0.225 -21.144 1.00 0.00 H new ATOM 173 N GLU A 13 -3.223 -1.931 -15.018 1.00 0.00 N ATOM 174 CA GLU A 13 -3.240 -2.642 -13.746 1.00 0.00 C ATOM 175 C GLU A 13 -2.809 -1.726 -12.605 1.00 0.00 C ATOM 176 O GLU A 13 -3.322 -1.822 -11.488 1.00 0.00 O ATOM 177 CB GLU A 13 -2.322 -3.865 -13.808 1.00 0.00 C ATOM 178 CG GLU A 13 -3.011 -5.120 -14.314 1.00 0.00 C ATOM 179 CD GLU A 13 -3.871 -5.782 -13.254 1.00 0.00 C ATOM 180 OE1 GLU A 13 -4.511 -5.052 -12.469 1.00 0.00 O ATOM 181 OE2 GLU A 13 -3.903 -7.030 -13.210 1.00 0.00 O ATOM 0 H GLU A 13 -2.629 -2.355 -15.731 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.261 -2.972 -13.557 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.475 -3.640 -14.456 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.920 -4.058 -12.813 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.631 -4.868 -15.174 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.259 -5.828 -14.660 1.00 0.00 H new ATOM 188 N LEU A 14 -1.864 -0.837 -12.891 1.00 0.00 N ATOM 189 CA LEU A 14 -1.362 0.097 -11.890 1.00 0.00 C ATOM 190 C LEU A 14 -2.355 1.231 -11.658 1.00 0.00 C ATOM 191 O LEU A 14 -2.830 1.434 -10.540 1.00 0.00 O ATOM 192 CB LEU A 14 -0.013 0.668 -12.328 1.00 0.00 C ATOM 193 CG LEU A 14 1.206 -0.221 -12.075 1.00 0.00 C ATOM 194 CD1 LEU A 14 2.437 0.356 -12.757 1.00 0.00 C ATOM 195 CD2 LEU A 14 1.448 -0.383 -10.581 1.00 0.00 C ATOM 0 H LEU A 14 -1.430 -0.744 -13.809 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.233 -0.446 -10.954 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.063 0.887 -13.395 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.141 1.617 -11.814 1.00 0.00 H new ATOM 0 HG LEU A 14 1.008 -1.206 -12.499 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.295 -0.289 -12.566 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.262 0.419 -13.831 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.638 1.352 -12.363 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.319 -1.018 -10.420 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.625 0.595 -10.133 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.574 -0.842 -10.118 1.00 0.00 H new ATOM 207 N ARG A 15 -2.668 1.965 -12.721 1.00 0.00 N ATOM 208 CA ARG A 15 -3.606 3.077 -12.633 1.00 0.00 C ATOM 209 C ARG A 15 -4.925 2.628 -12.011 1.00 0.00 C ATOM 210 O ARG A 15 -5.547 3.368 -11.250 1.00 0.00 O ATOM 211 CB ARG A 15 -3.860 3.669 -14.020 1.00 0.00 C ATOM 212 CG ARG A 15 -4.945 2.946 -14.802 1.00 0.00 C ATOM 213 CD ARG A 15 -6.321 3.521 -14.507 1.00 0.00 C ATOM 214 NE ARG A 15 -7.253 3.305 -15.610 1.00 0.00 N ATOM 215 CZ ARG A 15 -8.405 3.955 -15.738 1.00 0.00 C ATOM 216 NH1 ARG A 15 -8.763 4.859 -14.837 1.00 0.00 N ATOM 217 NH2 ARG A 15 -9.199 3.703 -16.771 1.00 0.00 N ATOM 0 H ARG A 15 -2.285 1.809 -13.654 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.164 3.842 -11.994 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -4.139 4.717 -13.913 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -2.933 3.643 -14.592 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.738 3.023 -15.869 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -4.931 1.886 -14.550 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.719 3.063 -13.602 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -6.233 4.590 -14.311 1.00 0.00 H new ATOM 0 HE ARG A 15 -7.006 2.617 -16.322 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -8.154 5.057 -14.043 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -9.648 5.357 -14.937 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -8.925 3.010 -17.467 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -10.083 4.202 -16.868 1.00 0.00 H new ATOM 231 N GLU A 16 -5.345 1.411 -12.341 1.00 0.00 N ATOM 232 CA GLU A 16 -6.591 0.865 -11.816 1.00 0.00 C ATOM 233 C GLU A 16 -6.432 0.458 -10.353 1.00 0.00 C ATOM 234 O GLU A 16 -7.355 0.607 -9.552 1.00 0.00 O ATOM 235 CB GLU A 16 -7.036 -0.341 -12.646 1.00 0.00 C ATOM 236 CG GLU A 16 -6.314 -1.628 -12.286 1.00 0.00 C ATOM 237 CD GLU A 16 -6.824 -2.822 -13.071 1.00 0.00 C ATOM 238 OE1 GLU A 16 -7.361 -3.758 -12.442 1.00 0.00 O ATOM 239 OE2 GLU A 16 -6.685 -2.821 -14.311 1.00 0.00 O ATOM 0 H GLU A 16 -4.841 0.785 -12.969 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.353 1.642 -11.880 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.108 -0.487 -12.514 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.872 -0.125 -13.702 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.247 -1.505 -12.471 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.433 -1.821 -11.220 1.00 0.00 H new ATOM 246 N ALA A 17 -5.256 -0.058 -10.012 1.00 0.00 N ATOM 247 CA ALA A 17 -4.975 -0.485 -8.648 1.00 0.00 C ATOM 248 C ALA A 17 -5.056 0.689 -7.678 1.00 0.00 C ATOM 249 O ALA A 17 -5.527 0.544 -6.550 1.00 0.00 O ATOM 250 CB ALA A 17 -3.605 -1.142 -8.572 1.00 0.00 C ATOM 0 H ALA A 17 -4.482 -0.190 -10.663 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.732 -1.214 -8.359 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.408 -1.456 -7.547 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.582 -2.012 -9.229 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.842 -0.430 -8.886 1.00 0.00 H new ATOM 256 N PHE A 18 -4.592 1.851 -8.123 1.00 0.00 N ATOM 257 CA PHE A 18 -4.610 3.050 -7.293 1.00 0.00 C ATOM 258 C PHE A 18 -6.027 3.604 -7.168 1.00 0.00 C ATOM 259 O PHE A 18 -6.505 3.870 -6.067 1.00 0.00 O ATOM 260 CB PHE A 18 -3.684 4.117 -7.880 1.00 0.00 C ATOM 261 CG PHE A 18 -2.395 3.562 -8.417 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.677 2.621 -7.697 1.00 0.00 C ATOM 263 CD2 PHE A 18 -1.902 3.982 -9.642 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.492 2.108 -8.188 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.716 3.473 -10.138 1.00 0.00 C ATOM 266 CZ PHE A 18 -0.010 2.535 -9.410 1.00 0.00 C ATOM 0 H PHE A 18 -4.199 1.989 -9.054 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.255 2.778 -6.299 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.207 4.640 -8.681 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.460 4.856 -7.110 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.048 2.284 -6.740 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.450 4.715 -10.216 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.057 1.374 -7.617 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.342 3.809 -11.094 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.917 2.136 -9.795 1.00 0.00 H new ATOM 276 N ALA A 19 -6.691 3.774 -8.307 1.00 0.00 N ATOM 277 CA ALA A 19 -8.052 4.294 -8.326 1.00 0.00 C ATOM 278 C ALA A 19 -9.022 3.322 -7.663 1.00 0.00 C ATOM 279 O ALA A 19 -10.158 3.677 -7.349 1.00 0.00 O ATOM 280 CB ALA A 19 -8.487 4.584 -9.755 1.00 0.00 C ATOM 0 H ALA A 19 -6.308 3.559 -9.228 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.066 5.224 -7.758 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.506 4.972 -9.754 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.818 5.323 -10.196 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.449 3.665 -10.340 1.00 0.00 H new ATOM 286 N LYS A 20 -8.566 2.091 -7.453 1.00 0.00 N ATOM 287 CA LYS A 20 -9.391 1.066 -6.826 1.00 0.00 C ATOM 288 C LYS A 20 -9.700 1.426 -5.376 1.00 0.00 C ATOM 289 O LYS A 20 -10.862 1.572 -4.996 1.00 0.00 O ATOM 290 CB LYS A 20 -8.688 -0.292 -6.887 1.00 0.00 C ATOM 291 CG LYS A 20 -9.491 -1.361 -7.607 1.00 0.00 C ATOM 292 CD LYS A 20 -9.700 -1.011 -9.070 1.00 0.00 C ATOM 293 CE LYS A 20 -11.095 -1.394 -9.542 1.00 0.00 C ATOM 294 NZ LYS A 20 -11.161 -2.815 -9.982 1.00 0.00 N ATOM 0 H LYS A 20 -7.629 1.780 -7.708 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.331 1.007 -7.375 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.727 -0.172 -7.388 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.478 -0.629 -5.872 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.975 -2.318 -7.531 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.458 -1.481 -7.119 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -9.547 0.058 -9.215 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.955 -1.525 -9.678 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.809 -1.230 -8.735 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -11.391 -0.745 -10.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -12.127 -3.037 -10.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.498 -2.966 -10.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.904 -3.436 -9.189 1.00 0.00 H new ATOM 308 N VAL A 21 -8.652 1.568 -4.571 1.00 0.00 N ATOM 309 CA VAL A 21 -8.810 1.914 -3.163 1.00 0.00 C ATOM 310 C VAL A 21 -9.226 3.372 -2.999 1.00 0.00 C ATOM 311 O VAL A 21 -9.705 3.776 -1.940 1.00 0.00 O ATOM 312 CB VAL A 21 -7.510 1.671 -2.376 1.00 0.00 C ATOM 313 CG1 VAL A 21 -7.247 0.180 -2.228 1.00 0.00 C ATOM 314 CG2 VAL A 21 -6.338 2.363 -3.055 1.00 0.00 C ATOM 0 H VAL A 21 -7.684 1.449 -4.870 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.593 1.269 -2.764 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.624 2.097 -1.379 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.324 0.027 -1.669 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -8.076 -0.284 -1.694 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -7.153 -0.273 -3.215 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.427 2.180 -2.485 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -6.219 1.970 -4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.527 3.435 -3.103 1.00 0.00 H new ATOM 324 N ASP A 22 -9.040 4.157 -4.055 1.00 0.00 N ATOM 325 CA ASP A 22 -9.396 5.571 -4.028 1.00 0.00 C ATOM 326 C ASP A 22 -10.901 5.749 -3.857 1.00 0.00 C ATOM 327 O ASP A 22 -11.666 5.622 -4.814 1.00 0.00 O ATOM 328 CB ASP A 22 -8.932 6.260 -5.313 1.00 0.00 C ATOM 329 CG ASP A 22 -7.447 6.563 -5.303 1.00 0.00 C ATOM 330 OD1 ASP A 22 -6.841 6.597 -6.395 1.00 0.00 O ATOM 331 OD2 ASP A 22 -6.891 6.767 -4.204 1.00 0.00 O ATOM 0 H ASP A 22 -8.645 3.838 -4.940 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.894 6.030 -3.176 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -9.164 5.624 -6.167 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.488 7.188 -5.446 1.00 0.00 H new ATOM 336 N THR A 23 -11.322 6.041 -2.630 1.00 0.00 N ATOM 337 CA THR A 23 -12.735 6.233 -2.332 1.00 0.00 C ATOM 338 C THR A 23 -13.240 7.557 -2.895 1.00 0.00 C ATOM 339 O THR A 23 -14.186 7.587 -3.682 1.00 0.00 O ATOM 340 CB THR A 23 -12.999 6.199 -0.815 1.00 0.00 C ATOM 341 OG1 THR A 23 -11.768 6.352 -0.100 1.00 0.00 O ATOM 342 CG2 THR A 23 -13.668 4.895 -0.411 1.00 0.00 C ATOM 0 H THR A 23 -10.703 6.150 -1.826 1.00 0.00 H new ATOM 0 HA THR A 23 -13.273 5.411 -2.805 1.00 0.00 H new ATOM 0 HB THR A 23 -13.668 7.023 -0.566 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.303 5.490 -0.061 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.844 4.894 0.665 1.00 0.00 H new ATOM 0 HG22 THR A 23 -14.619 4.796 -0.935 1.00 0.00 H new ATOM 0 HG23 THR A 23 -13.021 4.058 -0.673 1.00 0.00 H new ATOM 350 N ASP A 24 -12.604 8.650 -2.486 1.00 0.00 N ATOM 351 CA ASP A 24 -12.988 9.977 -2.952 1.00 0.00 C ATOM 352 C ASP A 24 -12.483 10.223 -4.370 1.00 0.00 C ATOM 353 O ASP A 24 -12.871 11.193 -5.019 1.00 0.00 O ATOM 354 CB ASP A 24 -12.442 11.049 -2.008 1.00 0.00 C ATOM 355 CG ASP A 24 -10.930 11.156 -2.066 1.00 0.00 C ATOM 356 OD1 ASP A 24 -10.406 12.273 -1.875 1.00 0.00 O ATOM 357 OD2 ASP A 24 -10.272 10.121 -2.301 1.00 0.00 O ATOM 0 H ASP A 24 -11.821 8.643 -1.833 1.00 0.00 H new ATOM 0 HA ASP A 24 -14.077 10.032 -2.960 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -12.882 12.013 -2.264 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.748 10.820 -0.987 1.00 0.00 H new ATOM 362 N GLY A 25 -11.609 9.339 -4.843 1.00 0.00 N ATOM 363 CA GLY A 25 -11.063 9.479 -6.180 1.00 0.00 C ATOM 364 C GLY A 25 -10.207 10.721 -6.329 1.00 0.00 C ATOM 365 O GLY A 25 -10.484 11.576 -7.171 1.00 0.00 O ATOM 0 H GLY A 25 -11.270 8.529 -4.324 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.466 8.599 -6.419 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.880 9.516 -6.901 1.00 0.00 H new ATOM 369 N ASN A 26 -9.166 10.822 -5.511 1.00 0.00 N ATOM 370 CA ASN A 26 -8.268 11.971 -5.554 1.00 0.00 C ATOM 371 C ASN A 26 -6.964 11.614 -6.262 1.00 0.00 C ATOM 372 O ASN A 26 -6.200 12.494 -6.658 1.00 0.00 O ATOM 373 CB ASN A 26 -7.973 12.468 -4.138 1.00 0.00 C ATOM 374 CG ASN A 26 -7.198 11.454 -3.319 1.00 0.00 C ATOM 375 OD1 ASN A 26 -7.058 10.297 -3.714 1.00 0.00 O ATOM 376 ND2 ASN A 26 -6.690 11.885 -2.170 1.00 0.00 N ATOM 0 H ASN A 26 -8.922 10.122 -4.810 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.761 12.766 -6.115 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.405 13.397 -4.193 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.912 12.697 -3.633 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.159 11.248 -1.576 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -6.831 12.853 -1.881 1.00 0.00 H new ATOM 383 N GLY A 27 -6.716 10.318 -6.418 1.00 0.00 N ATOM 384 CA GLY A 27 -5.505 9.869 -7.079 1.00 0.00 C ATOM 385 C GLY A 27 -4.326 9.777 -6.129 1.00 0.00 C ATOM 386 O GLY A 27 -3.174 9.750 -6.560 1.00 0.00 O ATOM 0 H GLY A 27 -7.332 9.571 -6.098 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.681 8.892 -7.530 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.262 10.555 -7.890 1.00 0.00 H new ATOM 390 N TYR A 28 -4.615 9.731 -4.833 1.00 0.00 N ATOM 391 CA TYR A 28 -3.570 9.646 -3.820 1.00 0.00 C ATOM 392 C TYR A 28 -3.853 8.512 -2.840 1.00 0.00 C ATOM 393 O TYR A 28 -5.009 8.199 -2.551 1.00 0.00 O ATOM 394 CB TYR A 28 -3.456 10.971 -3.065 1.00 0.00 C ATOM 395 CG TYR A 28 -2.529 11.967 -3.726 1.00 0.00 C ATOM 396 CD1 TYR A 28 -3.034 13.045 -4.443 1.00 0.00 C ATOM 397 CD2 TYR A 28 -1.150 11.829 -3.635 1.00 0.00 C ATOM 398 CE1 TYR A 28 -2.192 13.956 -5.050 1.00 0.00 C ATOM 399 CE2 TYR A 28 -0.300 12.737 -4.238 1.00 0.00 C ATOM 400 CZ TYR A 28 -0.826 13.798 -4.944 1.00 0.00 C ATOM 401 OH TYR A 28 0.017 14.704 -5.547 1.00 0.00 O ATOM 0 H TYR A 28 -5.564 9.751 -4.460 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.626 9.439 -4.324 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.448 11.415 -2.975 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -3.102 10.774 -2.053 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.103 13.173 -4.527 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -0.735 10.998 -3.084 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -2.601 14.788 -5.605 1.00 0.00 H new ATOM 0 HE2 TYR A 28 0.770 12.616 -4.157 1.00 0.00 H new ATOM 0 HH TYR A 28 0.948 14.449 -5.375 1.00 0.00 H new ATOM 411 N ILE A 29 -2.789 7.900 -2.331 1.00 0.00 N ATOM 412 CA ILE A 29 -2.921 6.802 -1.382 1.00 0.00 C ATOM 413 C ILE A 29 -2.053 7.032 -0.149 1.00 0.00 C ATOM 414 O ILE A 29 -0.840 7.206 -0.256 1.00 0.00 O ATOM 415 CB ILE A 29 -2.537 5.455 -2.022 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.564 5.060 -3.085 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.428 4.374 -0.956 1.00 0.00 C ATOM 418 CD1 ILE A 29 -3.330 3.684 -3.669 1.00 0.00 C ATOM 0 H ILE A 29 -1.826 8.146 -2.560 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.969 6.768 -1.084 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.565 5.562 -2.504 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.561 5.095 -2.646 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.544 5.795 -3.889 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.156 3.428 -1.424 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.663 4.654 -0.231 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.387 4.265 -0.449 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -4.095 3.471 -4.415 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.346 3.650 -4.138 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.380 2.939 -2.875 1.00 0.00 H new ATOM 430 N SER A 30 -2.684 7.032 1.021 1.00 0.00 N ATOM 431 CA SER A 30 -1.969 7.242 2.274 1.00 0.00 C ATOM 432 C SER A 30 -1.604 5.910 2.923 1.00 0.00 C ATOM 433 O SER A 30 -1.774 4.848 2.324 1.00 0.00 O ATOM 434 CB SER A 30 -2.819 8.075 3.237 1.00 0.00 C ATOM 435 OG SER A 30 -3.345 9.221 2.591 1.00 0.00 O ATOM 0 H SER A 30 -3.688 6.889 1.127 1.00 0.00 H new ATOM 0 HA SER A 30 -1.048 7.782 2.052 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.635 7.466 3.626 1.00 0.00 H new ATOM 0 HB3 SER A 30 -2.214 8.380 4.090 1.00 0.00 H new ATOM 0 HG SER A 30 -3.885 9.736 3.226 1.00 0.00 H new ATOM 441 N PHE A 31 -1.100 5.976 4.151 1.00 0.00 N ATOM 442 CA PHE A 31 -0.710 4.775 4.882 1.00 0.00 C ATOM 443 C PHE A 31 -1.937 4.026 5.391 1.00 0.00 C ATOM 444 O PHE A 31 -1.899 2.811 5.584 1.00 0.00 O ATOM 445 CB PHE A 31 0.201 5.142 6.055 1.00 0.00 C ATOM 446 CG PHE A 31 0.276 4.077 7.112 1.00 0.00 C ATOM 447 CD1 PHE A 31 1.239 3.083 7.046 1.00 0.00 C ATOM 448 CD2 PHE A 31 -0.620 4.069 8.169 1.00 0.00 C ATOM 449 CE1 PHE A 31 1.310 2.102 8.018 1.00 0.00 C ATOM 450 CE2 PHE A 31 -0.553 3.091 9.144 1.00 0.00 C ATOM 451 CZ PHE A 31 0.412 2.106 9.067 1.00 0.00 C ATOM 0 H PHE A 31 -0.952 6.847 4.661 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.167 4.123 4.198 1.00 0.00 H new ATOM 0 HB2 PHE A 31 1.204 5.339 5.678 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.157 6.067 6.507 1.00 0.00 H new ATOM 0 HD1 PHE A 31 1.942 3.074 6.226 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.379 4.835 8.232 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.067 1.334 7.957 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.255 3.097 9.965 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.464 1.340 9.826 1.00 0.00 H new ATOM 461 N ASN A 32 -3.024 4.759 5.608 1.00 0.00 N ATOM 462 CA ASN A 32 -4.262 4.164 6.097 1.00 0.00 C ATOM 463 C ASN A 32 -4.888 3.263 5.036 1.00 0.00 C ATOM 464 O ASN A 32 -5.318 2.149 5.330 1.00 0.00 O ATOM 465 CB ASN A 32 -5.253 5.258 6.502 1.00 0.00 C ATOM 466 CG ASN A 32 -4.687 6.188 7.558 1.00 0.00 C ATOM 467 OD1 ASN A 32 -4.792 5.923 8.755 1.00 0.00 O ATOM 468 ND2 ASN A 32 -4.082 7.285 7.116 1.00 0.00 N ATOM 0 H ASN A 32 -3.073 5.766 5.453 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.024 3.557 6.970 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -5.530 5.838 5.622 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -6.165 4.796 6.879 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -3.681 7.948 7.779 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -4.018 7.464 6.114 1.00 0.00 H new ATOM 475 N GLU A 33 -4.936 3.755 3.802 1.00 0.00 N ATOM 476 CA GLU A 33 -5.509 2.994 2.699 1.00 0.00 C ATOM 477 C GLU A 33 -4.654 1.771 2.379 1.00 0.00 C ATOM 478 O GLU A 33 -5.174 0.676 2.160 1.00 0.00 O ATOM 479 CB GLU A 33 -5.640 3.876 1.455 1.00 0.00 C ATOM 480 CG GLU A 33 -5.953 5.329 1.770 1.00 0.00 C ATOM 481 CD GLU A 33 -6.476 6.088 0.566 1.00 0.00 C ATOM 482 OE1 GLU A 33 -7.517 5.678 0.013 1.00 0.00 O ATOM 483 OE2 GLU A 33 -5.843 7.092 0.177 1.00 0.00 O ATOM 0 H GLU A 33 -4.585 4.677 3.542 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.500 2.655 3.002 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.711 3.828 0.886 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.426 3.474 0.816 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.691 5.372 2.571 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.052 5.819 2.140 1.00 0.00 H new ATOM 490 N LEU A 34 -3.340 1.964 2.354 1.00 0.00 N ATOM 491 CA LEU A 34 -2.412 0.878 2.061 1.00 0.00 C ATOM 492 C LEU A 34 -2.514 -0.223 3.111 1.00 0.00 C ATOM 493 O LEU A 34 -2.829 -1.370 2.795 1.00 0.00 O ATOM 494 CB LEU A 34 -0.979 1.408 1.999 1.00 0.00 C ATOM 495 CG LEU A 34 -0.014 0.629 1.105 1.00 0.00 C ATOM 496 CD1 LEU A 34 -0.555 0.539 -0.314 1.00 0.00 C ATOM 497 CD2 LEU A 34 1.362 1.280 1.112 1.00 0.00 C ATOM 0 H LEU A 34 -2.893 2.863 2.533 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.679 0.456 1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.010 2.441 1.653 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.574 1.423 3.011 1.00 0.00 H new ATOM 0 HG LEU A 34 0.081 -0.382 1.500 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.145 -0.019 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.518 0.029 -0.305 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.680 1.543 -0.720 1.00 0.00 H new ATOM 0 HD21 LEU A 34 2.036 0.713 0.471 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.283 2.302 0.741 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.754 1.292 2.129 1.00 0.00 H new ATOM 509 N ASN A 35 -2.248 0.134 4.364 1.00 0.00 N ATOM 510 CA ASN A 35 -2.312 -0.824 5.462 1.00 0.00 C ATOM 511 C ASN A 35 -3.667 -1.521 5.498 1.00 0.00 C ATOM 512 O ASN A 35 -3.746 -2.745 5.610 1.00 0.00 O ATOM 513 CB ASN A 35 -2.051 -0.120 6.795 1.00 0.00 C ATOM 514 CG ASN A 35 -2.241 -1.044 7.983 1.00 0.00 C ATOM 515 OD1 ASN A 35 -1.319 -1.752 8.386 1.00 0.00 O ATOM 516 ND2 ASN A 35 -3.441 -1.039 8.550 1.00 0.00 N ATOM 0 H ASN A 35 -1.986 1.079 4.644 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.541 -1.578 5.300 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.034 0.273 6.802 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -2.723 0.733 6.890 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.628 -1.639 9.354 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -4.176 -0.435 8.182 1.00 0.00 H new ATOM 523 N ASP A 36 -4.734 -0.734 5.402 1.00 0.00 N ATOM 524 CA ASP A 36 -6.088 -1.275 5.422 1.00 0.00 C ATOM 525 C ASP A 36 -6.315 -2.214 4.242 1.00 0.00 C ATOM 526 O ASP A 36 -6.886 -3.294 4.395 1.00 0.00 O ATOM 527 CB ASP A 36 -7.113 -0.140 5.394 1.00 0.00 C ATOM 528 CG ASP A 36 -8.514 -0.617 5.727 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.155 -1.236 4.852 1.00 0.00 O ATOM 530 OD2 ASP A 36 -8.967 -0.373 6.865 1.00 0.00 O ATOM 0 H ASP A 36 -4.687 0.281 5.310 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.213 -1.844 6.343 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -6.816 0.631 6.105 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.114 0.320 4.406 1.00 0.00 H new ATOM 535 N LEU A 37 -5.867 -1.794 3.064 1.00 0.00 N ATOM 536 CA LEU A 37 -6.022 -2.597 1.856 1.00 0.00 C ATOM 537 C LEU A 37 -5.349 -3.956 2.015 1.00 0.00 C ATOM 538 O LEU A 37 -5.870 -4.976 1.562 1.00 0.00 O ATOM 539 CB LEU A 37 -5.432 -1.861 0.652 1.00 0.00 C ATOM 540 CG LEU A 37 -5.609 -2.545 -0.705 1.00 0.00 C ATOM 541 CD1 LEU A 37 -4.503 -3.562 -0.938 1.00 0.00 C ATOM 542 CD2 LEU A 37 -6.975 -3.209 -0.793 1.00 0.00 C ATOM 0 H LEU A 37 -5.394 -0.902 2.920 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.087 -2.757 1.690 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.884 -0.871 0.599 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.366 -1.715 0.827 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.546 -1.786 -1.485 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.645 -4.038 -1.908 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.536 -3.059 -0.919 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.534 -4.319 -0.154 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.084 -3.691 -1.765 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.068 -3.957 -0.005 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.754 -2.456 -0.672 1.00 0.00 H new ATOM 554 N PHE A 38 -4.188 -3.964 2.663 1.00 0.00 N ATOM 555 CA PHE A 38 -3.444 -5.199 2.884 1.00 0.00 C ATOM 556 C PHE A 38 -4.112 -6.052 3.959 1.00 0.00 C ATOM 557 O PHE A 38 -4.097 -7.281 3.890 1.00 0.00 O ATOM 558 CB PHE A 38 -2.003 -4.884 3.289 1.00 0.00 C ATOM 559 CG PHE A 38 -1.241 -4.116 2.247 1.00 0.00 C ATOM 560 CD1 PHE A 38 -1.754 -3.961 0.969 1.00 0.00 C ATOM 561 CD2 PHE A 38 -0.013 -3.549 2.544 1.00 0.00 C ATOM 562 CE1 PHE A 38 -1.056 -3.253 0.008 1.00 0.00 C ATOM 563 CE2 PHE A 38 0.690 -2.840 1.587 1.00 0.00 C ATOM 564 CZ PHE A 38 0.168 -2.693 0.317 1.00 0.00 C ATOM 0 H PHE A 38 -3.742 -3.129 3.044 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.438 -5.762 1.951 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.012 -4.312 4.217 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.480 -5.818 3.496 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -2.710 -4.398 0.721 1.00 0.00 H new ATOM 0 HD2 PHE A 38 0.401 -3.662 3.535 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.468 -3.138 -0.984 1.00 0.00 H new ATOM 0 HE2 PHE A 38 1.646 -2.402 1.833 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.716 -2.141 -0.433 1.00 0.00 H new ATOM 574 N LYS A 39 -4.696 -5.390 4.952 1.00 0.00 N ATOM 575 CA LYS A 39 -5.370 -6.085 6.042 1.00 0.00 C ATOM 576 C LYS A 39 -6.680 -6.704 5.566 1.00 0.00 C ATOM 577 O LYS A 39 -7.018 -7.826 5.938 1.00 0.00 O ATOM 578 CB LYS A 39 -5.640 -5.120 7.199 1.00 0.00 C ATOM 579 CG LYS A 39 -5.104 -5.606 8.535 1.00 0.00 C ATOM 580 CD LYS A 39 -4.480 -4.473 9.330 1.00 0.00 C ATOM 581 CE LYS A 39 -5.465 -3.883 10.328 1.00 0.00 C ATOM 582 NZ LYS A 39 -6.165 -2.690 9.776 1.00 0.00 N ATOM 0 H LYS A 39 -4.716 -4.373 5.024 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.716 -6.885 6.389 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.192 -4.154 6.967 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.715 -4.961 7.285 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -5.913 -6.054 9.112 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -4.362 -6.387 8.368 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -3.600 -4.840 9.859 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -4.140 -3.693 8.649 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.199 -4.640 10.604 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -4.936 -3.604 11.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.039 -2.521 10.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -5.545 -1.858 9.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -6.400 -2.857 8.777 1.00 0.00 H new ATOM 596 N ALA A 40 -7.411 -5.965 4.737 1.00 0.00 N ATOM 597 CA ALA A 40 -8.682 -6.443 4.208 1.00 0.00 C ATOM 598 C ALA A 40 -8.521 -7.804 3.538 1.00 0.00 C ATOM 599 O ALA A 40 -9.464 -8.591 3.473 1.00 0.00 O ATOM 600 CB ALA A 40 -9.258 -5.434 3.224 1.00 0.00 C ATOM 0 H ALA A 40 -7.144 -5.034 4.418 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.374 -6.557 5.042 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.207 -5.804 2.837 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.419 -4.483 3.731 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.560 -5.292 2.399 1.00 0.00 H new ATOM 606 N ALA A 41 -7.318 -8.074 3.040 1.00 0.00 N ATOM 607 CA ALA A 41 -7.033 -9.340 2.376 1.00 0.00 C ATOM 608 C ALA A 41 -7.233 -10.516 3.327 1.00 0.00 C ATOM 609 O ALA A 41 -7.377 -11.659 2.892 1.00 0.00 O ATOM 610 CB ALA A 41 -5.614 -9.339 1.826 1.00 0.00 C ATOM 0 H ALA A 41 -6.526 -7.433 3.084 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.732 -9.453 1.548 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.414 -10.290 1.333 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.503 -8.527 1.107 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.907 -9.199 2.644 1.00 0.00 H new ATOM 616 N CYS A 42 -7.240 -10.227 4.623 1.00 0.00 N ATOM 617 CA CYS A 42 -7.422 -11.261 5.636 1.00 0.00 C ATOM 618 C CYS A 42 -6.408 -12.385 5.451 1.00 0.00 C ATOM 619 O CYS A 42 -6.693 -13.548 5.743 1.00 0.00 O ATOM 620 CB CYS A 42 -8.843 -11.825 5.570 1.00 0.00 C ATOM 621 SG CYS A 42 -10.137 -10.599 5.875 1.00 0.00 S ATOM 0 H CYS A 42 -7.122 -9.286 4.998 1.00 0.00 H new ATOM 0 HA CYS A 42 -7.264 -10.809 6.615 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -9.001 -12.268 4.587 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -8.938 -12.628 6.301 1.00 0.00 H new ATOM 0 HG CYS A 42 -10.068 -9.662 4.976 1.00 0.00 H new ATOM 627 N LEU A 43 -5.223 -12.032 4.965 1.00 0.00 N ATOM 628 CA LEU A 43 -4.165 -13.012 4.741 1.00 0.00 C ATOM 629 C LEU A 43 -3.827 -13.753 6.030 1.00 0.00 C ATOM 630 O LEU A 43 -4.091 -13.279 7.135 1.00 0.00 O ATOM 631 CB LEU A 43 -2.915 -12.324 4.191 1.00 0.00 C ATOM 632 CG LEU A 43 -2.916 -12.029 2.691 1.00 0.00 C ATOM 633 CD1 LEU A 43 -1.657 -11.273 2.295 1.00 0.00 C ATOM 634 CD2 LEU A 43 -3.039 -13.318 1.893 1.00 0.00 C ATOM 0 H LEU A 43 -4.970 -11.075 4.718 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.524 -13.738 4.011 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.777 -11.384 4.726 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.051 -12.949 4.417 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.778 -11.402 2.465 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -1.675 -11.072 1.224 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.612 -10.330 2.841 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.780 -11.874 2.536 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.038 -13.088 0.828 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.197 -13.971 2.124 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.970 -13.821 2.155 1.00 0.00 H new ATOM 646 N PRO A 44 -3.225 -14.943 5.889 1.00 0.00 N ATOM 647 CA PRO A 44 -2.835 -15.774 7.031 1.00 0.00 C ATOM 648 C PRO A 44 -1.674 -15.172 7.816 1.00 0.00 C ATOM 649 O PRO A 44 -1.296 -15.680 8.873 1.00 0.00 O ATOM 650 CB PRO A 44 -2.414 -17.096 6.383 1.00 0.00 C ATOM 651 CG PRO A 44 -2.001 -16.723 5.000 1.00 0.00 C ATOM 652 CD PRO A 44 -2.881 -15.571 4.602 1.00 0.00 C ATOM 0 HA PRO A 44 -3.644 -15.878 7.754 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.594 -17.562 6.929 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.236 -17.811 6.372 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -0.949 -16.439 4.970 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -2.124 -17.563 4.316 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -2.360 -14.877 3.943 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -3.770 -15.910 4.070 1.00 0.00 H new ATOM 660 N LEU A 45 -1.112 -14.088 7.293 1.00 0.00 N ATOM 661 CA LEU A 45 0.006 -13.416 7.945 1.00 0.00 C ATOM 662 C LEU A 45 -0.458 -12.676 9.196 1.00 0.00 C ATOM 663 O LEU A 45 -1.620 -12.289 9.324 1.00 0.00 O ATOM 664 CB LEU A 45 0.672 -12.436 6.978 1.00 0.00 C ATOM 665 CG LEU A 45 1.405 -13.060 5.790 1.00 0.00 C ATOM 666 CD1 LEU A 45 1.555 -12.050 4.663 1.00 0.00 C ATOM 667 CD2 LEU A 45 2.767 -13.587 6.221 1.00 0.00 C ATOM 0 H LEU A 45 -1.412 -13.656 6.419 1.00 0.00 H new ATOM 0 HA LEU A 45 0.731 -14.175 8.241 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.092 -11.760 6.594 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.382 -11.829 7.539 1.00 0.00 H new ATOM 0 HG LEU A 45 0.812 -13.898 5.422 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.079 -12.513 3.827 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.569 -11.721 4.336 1.00 0.00 H new ATOM 0 HD13 LEU A 45 2.125 -11.191 5.018 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.275 -14.028 5.363 1.00 0.00 H new ATOM 0 HD22 LEU A 45 3.366 -12.766 6.615 1.00 0.00 H new ATOM 0 HD23 LEU A 45 2.636 -14.345 6.994 1.00 0.00 H new ATOM 679 N PRO A 46 0.471 -12.471 10.141 1.00 0.00 N ATOM 680 CA PRO A 46 0.181 -11.774 11.398 1.00 0.00 C ATOM 681 C PRO A 46 -0.075 -10.285 11.189 1.00 0.00 C ATOM 682 O PRO A 46 -0.230 -9.825 10.059 1.00 0.00 O ATOM 683 CB PRO A 46 1.453 -11.987 12.224 1.00 0.00 C ATOM 684 CG PRO A 46 2.528 -12.200 11.214 1.00 0.00 C ATOM 685 CD PRO A 46 1.875 -12.905 10.057 1.00 0.00 C ATOM 0 HA PRO A 46 -0.722 -12.154 11.876 1.00 0.00 H new ATOM 0 HB2 PRO A 46 1.666 -11.123 12.853 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.356 -12.847 12.886 1.00 0.00 H new ATOM 0 HG2 PRO A 46 2.961 -11.251 10.899 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.340 -12.798 11.628 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.327 -12.621 9.107 1.00 0.00 H new ATOM 0 HD3 PRO A 46 1.967 -13.988 10.143 1.00 0.00 H new ATOM 693 N GLY A 47 -0.117 -9.536 12.287 1.00 0.00 N ATOM 694 CA GLY A 47 -0.355 -8.107 12.202 1.00 0.00 C ATOM 695 C GLY A 47 0.893 -7.334 11.827 1.00 0.00 C ATOM 696 O GLY A 47 0.862 -6.485 10.935 1.00 0.00 O ATOM 0 H GLY A 47 0.010 -9.894 13.234 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.134 -7.915 11.464 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.728 -7.746 13.160 1.00 0.00 H new ATOM 700 N TYR A 48 1.996 -7.626 12.508 1.00 0.00 N ATOM 701 CA TYR A 48 3.260 -6.948 12.244 1.00 0.00 C ATOM 702 C TYR A 48 3.680 -7.128 10.788 1.00 0.00 C ATOM 703 O TYR A 48 4.346 -6.268 10.211 1.00 0.00 O ATOM 704 CB TYR A 48 4.352 -7.481 13.172 1.00 0.00 C ATOM 705 CG TYR A 48 5.053 -8.710 12.640 1.00 0.00 C ATOM 706 CD1 TYR A 48 6.178 -8.598 11.832 1.00 0.00 C ATOM 707 CD2 TYR A 48 4.590 -9.985 12.942 1.00 0.00 C ATOM 708 CE1 TYR A 48 6.822 -9.718 11.343 1.00 0.00 C ATOM 709 CE2 TYR A 48 5.227 -11.110 12.458 1.00 0.00 C ATOM 710 CZ TYR A 48 6.342 -10.972 11.659 1.00 0.00 C ATOM 711 OH TYR A 48 6.980 -12.090 11.174 1.00 0.00 O ATOM 0 H TYR A 48 2.040 -8.328 13.247 1.00 0.00 H new ATOM 0 HA TYR A 48 3.120 -5.884 12.434 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.090 -6.696 13.339 1.00 0.00 H new ATOM 0 HB3 TYR A 48 3.911 -7.716 14.141 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.556 -7.618 11.582 1.00 0.00 H new ATOM 0 HD2 TYR A 48 3.716 -10.098 13.567 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.696 -9.612 10.717 1.00 0.00 H new ATOM 0 HE2 TYR A 48 4.854 -12.093 12.704 1.00 0.00 H new ATOM 0 HH TYR A 48 6.517 -12.894 11.490 1.00 0.00 H new ATOM 721 N ARG A 49 3.288 -8.254 10.201 1.00 0.00 N ATOM 722 CA ARG A 49 3.624 -8.549 8.813 1.00 0.00 C ATOM 723 C ARG A 49 3.015 -7.512 7.873 1.00 0.00 C ATOM 724 O ARG A 49 3.733 -6.791 7.182 1.00 0.00 O ATOM 725 CB ARG A 49 3.132 -9.948 8.433 1.00 0.00 C ATOM 726 CG ARG A 49 4.252 -10.962 8.262 1.00 0.00 C ATOM 727 CD ARG A 49 5.226 -10.536 7.174 1.00 0.00 C ATOM 728 NE ARG A 49 5.593 -11.649 6.303 1.00 0.00 N ATOM 729 CZ ARG A 49 6.314 -11.509 5.196 1.00 0.00 C ATOM 730 NH1 ARG A 49 6.741 -10.309 4.826 1.00 0.00 N ATOM 731 NH2 ARG A 49 6.608 -12.570 4.455 1.00 0.00 N ATOM 0 H ARG A 49 2.738 -8.977 10.665 1.00 0.00 H new ATOM 0 HA ARG A 49 4.709 -8.512 8.713 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.446 -10.304 9.201 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.566 -9.885 7.504 1.00 0.00 H new ATOM 0 HG2 ARG A 49 4.786 -11.079 9.205 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.829 -11.935 8.013 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.778 -9.741 6.578 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.124 -10.123 7.633 1.00 0.00 H new ATOM 0 HE ARG A 49 5.279 -12.585 6.558 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.516 -9.491 5.392 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.294 -10.204 3.976 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.280 -13.494 4.735 1.00 0.00 H new ATOM 0 HH22 ARG A 49 7.162 -12.461 3.605 1.00 0.00 H new ATOM 745 N VAL A 50 1.688 -7.445 7.855 1.00 0.00 N ATOM 746 CA VAL A 50 0.983 -6.496 7.002 1.00 0.00 C ATOM 747 C VAL A 50 1.396 -5.062 7.315 1.00 0.00 C ATOM 748 O VAL A 50 1.547 -4.238 6.413 1.00 0.00 O ATOM 749 CB VAL A 50 -0.544 -6.625 7.160 1.00 0.00 C ATOM 750 CG1 VAL A 50 -0.940 -6.509 8.624 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.257 -5.576 6.322 1.00 0.00 C ATOM 0 H VAL A 50 1.080 -8.036 8.421 1.00 0.00 H new ATOM 0 HA VAL A 50 1.256 -6.733 5.974 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.847 -7.609 6.803 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.022 -6.602 8.717 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.457 -7.302 9.195 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.625 -5.540 9.010 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.335 -5.682 6.446 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.951 -4.581 6.646 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.998 -5.711 5.272 1.00 0.00 H new ATOM 761 N ARG A 51 1.577 -4.773 8.599 1.00 0.00 N ATOM 762 CA ARG A 51 1.972 -3.437 9.032 1.00 0.00 C ATOM 763 C ARG A 51 3.398 -3.123 8.591 1.00 0.00 C ATOM 764 O ARG A 51 3.750 -1.963 8.380 1.00 0.00 O ATOM 765 CB ARG A 51 1.860 -3.317 10.553 1.00 0.00 C ATOM 766 CG ARG A 51 1.943 -1.886 11.059 1.00 0.00 C ATOM 767 CD ARG A 51 1.155 -1.705 12.348 1.00 0.00 C ATOM 768 NE ARG A 51 1.617 -2.602 13.402 1.00 0.00 N ATOM 769 CZ ARG A 51 2.715 -2.389 14.120 1.00 0.00 C ATOM 770 NH1 ARG A 51 3.460 -1.315 13.897 1.00 0.00 N ATOM 771 NH2 ARG A 51 3.069 -3.252 15.064 1.00 0.00 N ATOM 0 H ARG A 51 1.457 -5.444 9.357 1.00 0.00 H new ATOM 0 HA ARG A 51 1.298 -2.717 8.567 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.914 -3.753 10.875 1.00 0.00 H new ATOM 0 HB3 ARG A 51 2.654 -3.903 11.015 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.986 -1.618 11.228 1.00 0.00 H new ATOM 0 HG3 ARG A 51 1.559 -1.207 10.298 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.245 -0.672 12.686 1.00 0.00 H new ATOM 0 HD3 ARG A 51 0.098 -1.887 12.155 1.00 0.00 H new ATOM 0 HE ARG A 51 1.067 -3.438 13.599 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.191 -0.649 13.173 1.00 0.00 H new ATOM 0 HH12 ARG A 51 4.302 -1.155 14.450 1.00 0.00 H new ATOM 0 HH21 ARG A 51 2.498 -4.079 15.239 1.00 0.00 H new ATOM 0 HH22 ARG A 51 3.912 -3.088 15.615 1.00 0.00 H new ATOM 785 N GLU A 52 4.214 -4.164 8.454 1.00 0.00 N ATOM 786 CA GLU A 52 5.602 -3.996 8.040 1.00 0.00 C ATOM 787 C GLU A 52 5.691 -3.701 6.546 1.00 0.00 C ATOM 788 O GLU A 52 6.380 -2.770 6.126 1.00 0.00 O ATOM 789 CB GLU A 52 6.411 -5.253 8.371 1.00 0.00 C ATOM 790 CG GLU A 52 7.813 -5.245 7.787 1.00 0.00 C ATOM 791 CD GLU A 52 8.670 -4.122 8.340 1.00 0.00 C ATOM 792 OE1 GLU A 52 9.678 -4.423 9.012 1.00 0.00 O ATOM 793 OE2 GLU A 52 8.332 -2.945 8.101 1.00 0.00 O ATOM 0 H GLU A 52 3.938 -5.131 8.623 1.00 0.00 H new ATOM 0 HA GLU A 52 6.018 -3.149 8.586 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.478 -5.357 9.454 1.00 0.00 H new ATOM 0 HB3 GLU A 52 5.877 -6.127 7.999 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.295 -6.200 7.995 1.00 0.00 H new ATOM 0 HG3 GLU A 52 7.750 -5.149 6.703 1.00 0.00 H new ATOM 800 N ILE A 53 4.990 -4.500 5.747 1.00 0.00 N ATOM 801 CA ILE A 53 4.989 -4.324 4.300 1.00 0.00 C ATOM 802 C ILE A 53 4.396 -2.974 3.911 1.00 0.00 C ATOM 803 O ILE A 53 4.879 -2.313 2.992 1.00 0.00 O ATOM 804 CB ILE A 53 4.198 -5.443 3.597 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.777 -5.522 4.158 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.912 -6.777 3.757 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.939 -6.611 3.528 1.00 0.00 C ATOM 0 H ILE A 53 4.416 -5.275 6.078 1.00 0.00 H new ATOM 0 HA ILE A 53 6.029 -4.368 3.976 1.00 0.00 H new ATOM 0 HB ILE A 53 4.136 -5.212 2.534 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.829 -5.691 5.234 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.282 -4.562 4.009 1.00 0.00 H new ATOM 0 HG21 ILE A 53 4.341 -7.558 3.255 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.906 -6.713 3.314 1.00 0.00 H new ATOM 0 HG23 ILE A 53 5.001 -7.017 4.816 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.944 -6.609 3.974 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.857 -6.432 2.456 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.411 -7.578 3.699 1.00 0.00 H new ATOM 819 N THR A 54 3.344 -2.570 4.618 1.00 0.00 N ATOM 820 CA THR A 54 2.684 -1.300 4.347 1.00 0.00 C ATOM 821 C THR A 54 3.528 -0.127 4.834 1.00 0.00 C ATOM 822 O THR A 54 3.589 0.917 4.185 1.00 0.00 O ATOM 823 CB THR A 54 1.299 -1.233 5.016 1.00 0.00 C ATOM 824 OG1 THR A 54 0.597 -0.065 4.576 1.00 0.00 O ATOM 825 CG2 THR A 54 1.430 -1.212 6.532 1.00 0.00 C ATOM 0 H THR A 54 2.932 -3.105 5.382 1.00 0.00 H new ATOM 0 HA THR A 54 2.561 -1.232 3.266 1.00 0.00 H new ATOM 0 HB THR A 54 0.738 -2.122 4.728 1.00 0.00 H new ATOM 0 HG1 THR A 54 0.529 0.574 5.316 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.438 -1.165 6.982 1.00 0.00 H new ATOM 0 HG22 THR A 54 1.937 -2.117 6.866 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.008 -0.339 6.835 1.00 0.00 H new ATOM 833 N GLU A 55 4.178 -0.306 5.979 1.00 0.00 N ATOM 834 CA GLU A 55 5.018 0.739 6.552 1.00 0.00 C ATOM 835 C GLU A 55 6.208 1.038 5.644 1.00 0.00 C ATOM 836 O GLU A 55 6.511 2.197 5.364 1.00 0.00 O ATOM 837 CB GLU A 55 5.513 0.323 7.939 1.00 0.00 C ATOM 838 CG GLU A 55 4.573 0.720 9.065 1.00 0.00 C ATOM 839 CD GLU A 55 5.067 0.267 10.425 1.00 0.00 C ATOM 840 OE1 GLU A 55 4.934 1.045 11.393 1.00 0.00 O ATOM 841 OE2 GLU A 55 5.588 -0.863 10.522 1.00 0.00 O ATOM 0 H GLU A 55 4.139 -1.165 6.528 1.00 0.00 H new ATOM 0 HA GLU A 55 4.417 1.643 6.645 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.652 -0.758 7.957 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.490 0.773 8.117 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.454 1.803 9.068 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.588 0.291 8.879 1.00 0.00 H new ATOM 848 N ASN A 56 6.877 -0.016 5.188 1.00 0.00 N ATOM 849 CA ASN A 56 8.034 0.133 4.313 1.00 0.00 C ATOM 850 C ASN A 56 7.616 0.663 2.945 1.00 0.00 C ATOM 851 O ASN A 56 8.235 1.583 2.407 1.00 0.00 O ATOM 852 CB ASN A 56 8.756 -1.205 4.156 1.00 0.00 C ATOM 853 CG ASN A 56 9.505 -1.611 5.411 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.628 -0.828 6.353 1.00 0.00 O ATOM 855 ND2 ASN A 56 10.009 -2.838 5.428 1.00 0.00 N ATOM 0 H ASN A 56 6.638 -0.982 5.410 1.00 0.00 H new ATOM 0 HA ASN A 56 8.714 0.853 4.769 1.00 0.00 H new ATOM 0 HB2 ASN A 56 8.031 -1.978 3.903 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.456 -1.141 3.323 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.523 -3.167 6.245 1.00 0.00 H new ATOM 0 HD22 ASN A 56 9.882 -3.453 4.624 1.00 0.00 H new ATOM 862 N LEU A 57 6.563 0.078 2.386 1.00 0.00 N ATOM 863 CA LEU A 57 6.061 0.490 1.080 1.00 0.00 C ATOM 864 C LEU A 57 5.753 1.984 1.062 1.00 0.00 C ATOM 865 O LEU A 57 6.086 2.685 0.107 1.00 0.00 O ATOM 866 CB LEU A 57 4.805 -0.306 0.720 1.00 0.00 C ATOM 867 CG LEU A 57 4.019 0.194 -0.492 1.00 0.00 C ATOM 868 CD1 LEU A 57 4.938 0.359 -1.693 1.00 0.00 C ATOM 869 CD2 LEU A 57 2.879 -0.759 -0.819 1.00 0.00 C ATOM 0 H LEU A 57 6.040 -0.684 2.817 1.00 0.00 H new ATOM 0 HA LEU A 57 6.836 0.288 0.340 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.095 -1.341 0.538 1.00 0.00 H new ATOM 0 HB3 LEU A 57 4.140 -0.308 1.584 1.00 0.00 H new ATOM 0 HG LEU A 57 3.594 1.168 -0.248 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.361 0.716 -2.546 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.720 1.081 -1.456 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.392 -0.601 -1.938 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.331 -0.387 -1.684 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.283 -1.746 -1.042 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.206 -0.827 0.035 1.00 0.00 H new ATOM 881 N MET A 58 5.118 2.465 2.126 1.00 0.00 N ATOM 882 CA MET A 58 4.770 3.877 2.234 1.00 0.00 C ATOM 883 C MET A 58 6.018 4.732 2.423 1.00 0.00 C ATOM 884 O MET A 58 6.168 5.777 1.790 1.00 0.00 O ATOM 885 CB MET A 58 3.804 4.098 3.400 1.00 0.00 C ATOM 886 CG MET A 58 2.606 4.962 3.041 1.00 0.00 C ATOM 887 SD MET A 58 3.050 6.690 2.774 1.00 0.00 S ATOM 888 CE MET A 58 1.485 7.360 2.220 1.00 0.00 C ATOM 0 H MET A 58 4.834 1.898 2.925 1.00 0.00 H new ATOM 0 HA MET A 58 4.283 4.178 1.306 1.00 0.00 H new ATOM 0 HB2 MET A 58 3.450 3.131 3.756 1.00 0.00 H new ATOM 0 HB3 MET A 58 4.343 4.564 4.225 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.136 4.568 2.140 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.866 4.900 3.839 1.00 0.00 H new ATOM 0 HE1 MET A 58 1.664 8.133 1.473 1.00 0.00 H new ATOM 0 HE2 MET A 58 0.883 6.564 1.781 1.00 0.00 H new ATOM 0 HE3 MET A 58 0.953 7.791 3.068 1.00 0.00 H new ATOM 898 N ALA A 59 6.912 4.283 3.298 1.00 0.00 N ATOM 899 CA ALA A 59 8.148 5.007 3.568 1.00 0.00 C ATOM 900 C ALA A 59 9.006 5.117 2.313 1.00 0.00 C ATOM 901 O ALA A 59 9.638 6.144 2.067 1.00 0.00 O ATOM 902 CB ALA A 59 8.926 4.323 4.683 1.00 0.00 C ATOM 0 H ALA A 59 6.803 3.421 3.832 1.00 0.00 H new ATOM 0 HA ALA A 59 7.887 6.016 3.887 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.847 4.874 4.875 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.320 4.302 5.589 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.169 3.303 4.385 1.00 0.00 H new ATOM 908 N THR A 60 9.023 4.051 1.518 1.00 0.00 N ATOM 909 CA THR A 60 9.805 4.027 0.289 1.00 0.00 C ATOM 910 C THR A 60 8.940 4.370 -0.919 1.00 0.00 C ATOM 911 O THR A 60 9.389 4.285 -2.061 1.00 0.00 O ATOM 912 CB THR A 60 10.457 2.650 0.064 1.00 0.00 C ATOM 913 OG1 THR A 60 11.387 2.720 -1.023 1.00 0.00 O ATOM 914 CG2 THR A 60 9.404 1.594 -0.232 1.00 0.00 C ATOM 0 H THR A 60 8.504 3.193 1.704 1.00 0.00 H new ATOM 0 HA THR A 60 10.588 4.778 0.398 1.00 0.00 H new ATOM 0 HB THR A 60 10.984 2.369 0.976 1.00 0.00 H new ATOM 0 HG1 THR A 60 11.020 3.289 -1.731 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.889 0.630 -0.387 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.714 1.522 0.609 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.853 1.872 -1.130 1.00 0.00 H new ATOM 922 N GLY A 61 7.695 4.758 -0.659 1.00 0.00 N ATOM 923 CA GLY A 61 6.787 5.109 -1.736 1.00 0.00 C ATOM 924 C GLY A 61 6.531 6.600 -1.816 1.00 0.00 C ATOM 925 O GLY A 61 5.995 7.092 -2.809 1.00 0.00 O ATOM 0 H GLY A 61 7.299 4.836 0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.201 4.763 -2.683 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.840 4.588 -1.593 1.00 0.00 H new ATOM 929 N ASP A 62 6.913 7.322 -0.768 1.00 0.00 N ATOM 930 CA ASP A 62 6.722 8.766 -0.724 1.00 0.00 C ATOM 931 C ASP A 62 8.049 9.496 -0.906 1.00 0.00 C ATOM 932 O ASP A 62 8.946 9.397 -0.067 1.00 0.00 O ATOM 933 CB ASP A 62 6.079 9.176 0.602 1.00 0.00 C ATOM 934 CG ASP A 62 5.172 10.383 0.457 1.00 0.00 C ATOM 935 OD1 ASP A 62 5.573 11.347 -0.228 1.00 0.00 O ATOM 936 OD2 ASP A 62 4.061 10.362 1.026 1.00 0.00 O ATOM 0 H ASP A 62 7.357 6.930 0.062 1.00 0.00 H new ATOM 0 HA ASP A 62 6.059 9.045 -1.543 1.00 0.00 H new ATOM 0 HB2 ASP A 62 5.504 8.339 0.998 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.861 9.398 1.328 1.00 0.00 H new ATOM 941 N LEU A 63 8.169 10.229 -2.007 1.00 0.00 N ATOM 942 CA LEU A 63 9.387 10.976 -2.302 1.00 0.00 C ATOM 943 C LEU A 63 9.566 12.132 -1.324 1.00 0.00 C ATOM 944 O LEU A 63 10.529 12.168 -0.557 1.00 0.00 O ATOM 945 CB LEU A 63 9.350 11.506 -3.735 1.00 0.00 C ATOM 946 CG LEU A 63 9.369 10.451 -4.842 1.00 0.00 C ATOM 947 CD1 LEU A 63 8.371 10.805 -5.934 1.00 0.00 C ATOM 948 CD2 LEU A 63 10.769 10.311 -5.422 1.00 0.00 C ATOM 0 H LEU A 63 7.437 10.322 -2.711 1.00 0.00 H new ATOM 0 HA LEU A 63 10.234 10.299 -2.195 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.452 12.112 -3.854 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.203 12.169 -3.878 1.00 0.00 H new ATOM 0 HG LEU A 63 9.079 9.493 -4.409 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.399 10.043 -6.713 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.368 10.853 -5.509 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.630 11.773 -6.364 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.763 9.556 -6.208 1.00 0.00 H new ATOM 0 HD22 LEU A 63 11.087 11.267 -5.839 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.460 10.010 -4.635 1.00 0.00 H new ATOM 960 N ASP A 64 8.632 13.076 -1.354 1.00 0.00 N ATOM 961 CA ASP A 64 8.683 14.233 -0.468 1.00 0.00 C ATOM 962 C ASP A 64 8.286 13.848 0.954 1.00 0.00 C ATOM 963 O ASP A 64 8.487 14.615 1.893 1.00 0.00 O ATOM 964 CB ASP A 64 7.765 15.341 -0.986 1.00 0.00 C ATOM 965 CG ASP A 64 6.352 14.851 -1.235 1.00 0.00 C ATOM 966 OD1 ASP A 64 5.745 15.278 -2.240 1.00 0.00 O ATOM 967 OD2 ASP A 64 5.853 14.041 -0.427 1.00 0.00 O ATOM 0 H ASP A 64 7.829 13.063 -1.983 1.00 0.00 H new ATOM 0 HA ASP A 64 9.709 14.601 -0.452 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.742 16.157 -0.264 1.00 0.00 H new ATOM 0 HB3 ASP A 64 8.175 15.746 -1.911 1.00 0.00 H new ATOM 972 N GLN A 65 7.718 12.655 1.101 1.00 0.00 N ATOM 973 CA GLN A 65 7.290 12.169 2.407 1.00 0.00 C ATOM 974 C GLN A 65 6.184 13.050 2.980 1.00 0.00 C ATOM 975 O GLN A 65 6.303 13.567 4.090 1.00 0.00 O ATOM 976 CB GLN A 65 8.476 12.125 3.372 1.00 0.00 C ATOM 977 CG GLN A 65 9.720 11.484 2.780 1.00 0.00 C ATOM 978 CD GLN A 65 10.917 11.563 3.707 1.00 0.00 C ATOM 979 OE1 GLN A 65 11.098 10.713 4.579 1.00 0.00 O ATOM 980 NE2 GLN A 65 11.740 12.589 3.524 1.00 0.00 N ATOM 0 H GLN A 65 7.544 12.008 0.332 1.00 0.00 H new ATOM 0 HA GLN A 65 6.897 11.160 2.281 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.716 13.141 3.686 1.00 0.00 H new ATOM 0 HB3 GLN A 65 8.185 11.575 4.267 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.511 10.439 2.551 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.963 11.974 1.837 1.00 0.00 H new ATOM 0 HE21 GLN A 65 11.551 13.270 2.788 1.00 0.00 H new ATOM 0 HE22 GLN A 65 12.562 12.696 4.119 1.00 0.00 H new ATOM 989 N ASP A 66 5.111 13.217 2.215 1.00 0.00 N ATOM 990 CA ASP A 66 3.984 14.035 2.646 1.00 0.00 C ATOM 991 C ASP A 66 2.887 13.170 3.258 1.00 0.00 C ATOM 992 O ASP A 66 1.954 13.679 3.877 1.00 0.00 O ATOM 993 CB ASP A 66 3.424 14.833 1.467 1.00 0.00 C ATOM 994 CG ASP A 66 2.905 13.938 0.358 1.00 0.00 C ATOM 995 OD1 ASP A 66 3.061 12.703 0.470 1.00 0.00 O ATOM 996 OD2 ASP A 66 2.344 14.472 -0.620 1.00 0.00 O ATOM 0 H ASP A 66 4.998 12.796 1.293 1.00 0.00 H new ATOM 0 HA ASP A 66 4.341 14.729 3.407 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.618 15.477 1.818 1.00 0.00 H new ATOM 0 HB3 ASP A 66 4.203 15.485 1.070 1.00 0.00 H new ATOM 1001 N GLY A 67 3.007 11.858 3.081 1.00 0.00 N ATOM 1002 CA GLY A 67 2.019 10.943 3.621 1.00 0.00 C ATOM 1003 C GLY A 67 1.011 10.498 2.580 1.00 0.00 C ATOM 1004 O GLY A 67 -0.057 9.985 2.918 1.00 0.00 O ATOM 0 H GLY A 67 3.771 11.412 2.573 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.524 10.068 4.031 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.495 11.425 4.447 1.00 0.00 H new ATOM 1008 N ARG A 68 1.347 10.698 1.309 1.00 0.00 N ATOM 1009 CA ARG A 68 0.461 10.317 0.215 1.00 0.00 C ATOM 1010 C ARG A 68 1.263 9.886 -1.009 1.00 0.00 C ATOM 1011 O ARG A 68 2.317 10.452 -1.304 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.462 11.481 -0.150 1.00 0.00 C ATOM 1013 CG ARG A 68 -1.130 12.130 1.051 1.00 0.00 C ATOM 1014 CD ARG A 68 -2.327 12.971 0.637 1.00 0.00 C ATOM 1015 NE ARG A 68 -1.921 14.229 0.015 1.00 0.00 N ATOM 1016 CZ ARG A 68 -2.757 15.027 -0.640 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -4.036 14.700 -0.758 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -2.312 16.155 -1.179 1.00 0.00 N ATOM 0 H ARG A 68 2.226 11.122 1.012 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.144 9.473 0.547 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.114 12.235 -0.686 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.232 11.122 -0.833 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.451 11.358 1.751 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -0.408 12.756 1.576 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -2.945 12.405 -0.060 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -2.943 13.181 1.511 1.00 0.00 H new ATOM 0 HE ARG A 68 -0.943 14.510 0.088 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -4.381 13.833 -0.345 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -4.675 15.315 -1.262 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -1.328 16.409 -1.090 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -2.954 16.768 -1.682 1.00 0.00 H new ATOM 1032 N ILE A 69 0.759 8.881 -1.716 1.00 0.00 N ATOM 1033 CA ILE A 69 1.428 8.376 -2.908 1.00 0.00 C ATOM 1034 C ILE A 69 0.601 8.647 -4.161 1.00 0.00 C ATOM 1035 O ILE A 69 -0.603 8.396 -4.188 1.00 0.00 O ATOM 1036 CB ILE A 69 1.699 6.864 -2.803 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.322 6.527 -1.447 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.607 6.408 -3.936 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.665 5.063 -1.285 1.00 0.00 C ATOM 0 H ILE A 69 -0.110 8.400 -1.484 1.00 0.00 H new ATOM 0 HA ILE A 69 2.379 8.904 -2.983 1.00 0.00 H new ATOM 0 HB ILE A 69 0.750 6.334 -2.887 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.227 7.120 -1.315 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.631 6.819 -0.656 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.789 5.337 -3.848 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.128 6.617 -4.893 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.555 6.943 -3.880 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.102 4.899 -0.300 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.760 4.464 -1.385 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.380 4.770 -2.053 1.00 0.00 H new ATOM 1051 N SER A 70 1.256 9.160 -5.197 1.00 0.00 N ATOM 1052 CA SER A 70 0.581 9.466 -6.452 1.00 0.00 C ATOM 1053 C SER A 70 0.768 8.337 -7.460 1.00 0.00 C ATOM 1054 O SER A 70 1.622 7.468 -7.285 1.00 0.00 O ATOM 1055 CB SER A 70 1.114 10.777 -7.035 1.00 0.00 C ATOM 1056 OG SER A 70 0.364 11.172 -8.172 1.00 0.00 O ATOM 0 H SER A 70 2.254 9.372 -5.192 1.00 0.00 H new ATOM 0 HA SER A 70 -0.484 9.573 -6.246 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.071 11.560 -6.277 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.162 10.657 -7.310 1.00 0.00 H new ATOM 0 HG SER A 70 0.723 12.013 -8.525 1.00 0.00 H new ATOM 1062 N PHE A 71 -0.039 8.355 -8.517 1.00 0.00 N ATOM 1063 CA PHE A 71 0.035 7.332 -9.552 1.00 0.00 C ATOM 1064 C PHE A 71 1.472 7.143 -10.028 1.00 0.00 C ATOM 1065 O PHE A 71 2.001 6.032 -10.014 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.860 7.708 -10.735 1.00 0.00 C ATOM 1067 CG PHE A 71 -2.299 7.321 -10.545 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -3.028 6.777 -11.589 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.923 7.503 -9.321 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.352 6.419 -11.418 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.246 7.148 -9.143 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.962 6.606 -10.193 1.00 0.00 C ATOM 0 H PHE A 71 -0.751 9.067 -8.678 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.314 6.392 -9.125 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.800 8.784 -10.898 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.479 7.227 -11.636 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.556 6.631 -12.549 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.369 7.927 -8.497 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.908 5.994 -12.240 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.720 7.294 -8.184 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.997 6.329 -10.056 1.00 0.00 H new ATOM 1082 N ASP A 72 2.097 8.236 -10.450 1.00 0.00 N ATOM 1083 CA ASP A 72 3.474 8.192 -10.931 1.00 0.00 C ATOM 1084 C ASP A 72 4.405 7.628 -9.862 1.00 0.00 C ATOM 1085 O ASP A 72 5.318 6.859 -10.163 1.00 0.00 O ATOM 1086 CB ASP A 72 3.938 9.590 -11.341 1.00 0.00 C ATOM 1087 CG ASP A 72 5.073 9.551 -12.346 1.00 0.00 C ATOM 1088 OD1 ASP A 72 5.926 10.463 -12.314 1.00 0.00 O ATOM 1089 OD2 ASP A 72 5.110 8.608 -13.164 1.00 0.00 O ATOM 0 H ASP A 72 1.673 9.163 -10.469 1.00 0.00 H new ATOM 0 HA ASP A 72 3.508 7.536 -11.801 1.00 0.00 H new ATOM 0 HB2 ASP A 72 3.098 10.138 -11.767 1.00 0.00 H new ATOM 0 HB3 ASP A 72 4.260 10.138 -10.455 1.00 0.00 H new ATOM 1094 N GLU A 73 4.167 8.014 -8.613 1.00 0.00 N ATOM 1095 CA GLU A 73 4.986 7.547 -7.500 1.00 0.00 C ATOM 1096 C GLU A 73 4.977 6.023 -7.420 1.00 0.00 C ATOM 1097 O GLU A 73 6.012 5.377 -7.583 1.00 0.00 O ATOM 1098 CB GLU A 73 4.482 8.141 -6.183 1.00 0.00 C ATOM 1099 CG GLU A 73 5.273 9.352 -5.719 1.00 0.00 C ATOM 1100 CD GLU A 73 4.586 10.101 -4.593 1.00 0.00 C ATOM 1101 OE1 GLU A 73 5.036 9.973 -3.435 1.00 0.00 O ATOM 1102 OE2 GLU A 73 3.600 10.817 -4.870 1.00 0.00 O ATOM 0 H GLU A 73 3.414 8.648 -8.346 1.00 0.00 H new ATOM 0 HA GLU A 73 6.010 7.878 -7.671 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.436 8.424 -6.299 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.521 7.374 -5.410 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.261 9.031 -5.387 1.00 0.00 H new ATOM 0 HG3 GLU A 73 5.423 10.028 -6.561 1.00 0.00 H new ATOM 1109 N PHE A 74 3.803 5.457 -7.166 1.00 0.00 N ATOM 1110 CA PHE A 74 3.658 4.010 -7.062 1.00 0.00 C ATOM 1111 C PHE A 74 4.251 3.315 -8.285 1.00 0.00 C ATOM 1112 O PHE A 74 5.121 2.452 -8.161 1.00 0.00 O ATOM 1113 CB PHE A 74 2.183 3.632 -6.913 1.00 0.00 C ATOM 1114 CG PHE A 74 1.843 3.067 -5.563 1.00 0.00 C ATOM 1115 CD1 PHE A 74 2.580 2.023 -5.029 1.00 0.00 C ATOM 1116 CD2 PHE A 74 0.786 3.581 -4.830 1.00 0.00 C ATOM 1117 CE1 PHE A 74 2.269 1.500 -3.787 1.00 0.00 C ATOM 1118 CE2 PHE A 74 0.471 3.064 -3.587 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.213 2.022 -3.065 1.00 0.00 C ATOM 0 H PHE A 74 2.937 5.978 -7.028 1.00 0.00 H new ATOM 0 HA PHE A 74 4.202 3.679 -6.177 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.570 4.515 -7.094 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.924 2.902 -7.680 1.00 0.00 H new ATOM 0 HD1 PHE A 74 3.407 1.613 -5.589 1.00 0.00 H new ATOM 0 HD2 PHE A 74 0.202 4.394 -5.234 1.00 0.00 H new ATOM 0 HE1 PHE A 74 2.851 0.685 -3.382 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -0.355 3.474 -3.024 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.968 1.616 -2.095 1.00 0.00 H new ATOM 1129 N ILE A 75 3.775 3.698 -9.464 1.00 0.00 N ATOM 1130 CA ILE A 75 4.257 3.113 -10.710 1.00 0.00 C ATOM 1131 C ILE A 75 5.774 3.229 -10.819 1.00 0.00 C ATOM 1132 O ILE A 75 6.447 2.303 -11.272 1.00 0.00 O ATOM 1133 CB ILE A 75 3.611 3.786 -11.936 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.086 3.725 -11.833 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.089 3.121 -13.218 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.379 4.666 -12.784 1.00 0.00 C ATOM 0 H ILE A 75 3.056 4.411 -9.584 1.00 0.00 H new ATOM 0 HA ILE A 75 3.975 2.060 -10.695 1.00 0.00 H new ATOM 0 HB ILE A 75 3.913 4.833 -11.959 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.757 2.705 -12.032 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.789 3.962 -10.812 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.624 3.607 -14.075 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.173 3.212 -13.293 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.813 2.066 -13.206 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.301 4.570 -12.657 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.679 5.692 -12.571 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.647 4.415 -13.810 1.00 0.00 H new ATOM 1148 N LYS A 76 6.306 4.372 -10.401 1.00 0.00 N ATOM 1149 CA LYS A 76 7.743 4.610 -10.449 1.00 0.00 C ATOM 1150 C LYS A 76 8.491 3.598 -9.586 1.00 0.00 C ATOM 1151 O LYS A 76 9.608 3.196 -9.913 1.00 0.00 O ATOM 1152 CB LYS A 76 8.062 6.031 -9.979 1.00 0.00 C ATOM 1153 CG LYS A 76 8.045 7.060 -11.096 1.00 0.00 C ATOM 1154 CD LYS A 76 9.249 6.908 -12.012 1.00 0.00 C ATOM 1155 CE LYS A 76 10.504 7.493 -11.384 1.00 0.00 C ATOM 1156 NZ LYS A 76 11.703 7.283 -12.241 1.00 0.00 N ATOM 0 H LYS A 76 5.763 5.149 -10.025 1.00 0.00 H new ATOM 0 HA LYS A 76 8.071 4.494 -11.482 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.340 6.323 -9.217 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.044 6.036 -9.507 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.129 6.953 -11.677 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.036 8.063 -10.668 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.409 5.853 -12.232 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.050 7.405 -12.961 1.00 0.00 H new ATOM 0 HE2 LYS A 76 10.361 8.560 -11.214 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.670 7.035 -10.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.537 7.696 -11.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 11.854 6.264 -12.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 11.556 7.742 -13.162 1.00 0.00 H new ATOM 1170 N ILE A 77 7.868 3.191 -8.486 1.00 0.00 N ATOM 1171 CA ILE A 77 8.475 2.223 -7.579 1.00 0.00 C ATOM 1172 C ILE A 77 8.377 0.809 -8.139 1.00 0.00 C ATOM 1173 O ILE A 77 9.255 -0.023 -7.907 1.00 0.00 O ATOM 1174 CB ILE A 77 7.810 2.261 -6.190 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.469 3.328 -5.314 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.895 0.896 -5.526 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.163 4.743 -5.751 1.00 0.00 C ATOM 0 H ILE A 77 6.944 3.516 -8.201 1.00 0.00 H new ATOM 0 HA ILE A 77 9.525 2.499 -7.478 1.00 0.00 H new ATOM 0 HB ILE A 77 6.758 2.519 -6.313 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.139 3.195 -4.284 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.549 3.179 -5.324 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.421 0.938 -4.545 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.384 0.158 -6.144 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.941 0.612 -5.411 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.663 5.446 -5.085 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.518 4.894 -6.770 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.087 4.911 -5.714 1.00 0.00 H new ATOM 1189 N PHE A 78 7.306 0.543 -8.878 1.00 0.00 N ATOM 1190 CA PHE A 78 7.094 -0.772 -9.473 1.00 0.00 C ATOM 1191 C PHE A 78 8.083 -1.020 -10.608 1.00 0.00 C ATOM 1192 O PHE A 78 8.601 -2.127 -10.763 1.00 0.00 O ATOM 1193 CB PHE A 78 5.661 -0.894 -9.994 1.00 0.00 C ATOM 1194 CG PHE A 78 4.721 -1.538 -9.016 1.00 0.00 C ATOM 1195 CD1 PHE A 78 4.750 -1.193 -7.675 1.00 0.00 C ATOM 1196 CD2 PHE A 78 3.808 -2.492 -9.438 1.00 0.00 C ATOM 1197 CE1 PHE A 78 3.886 -1.784 -6.772 1.00 0.00 C ATOM 1198 CE2 PHE A 78 2.941 -3.087 -8.540 1.00 0.00 C ATOM 1199 CZ PHE A 78 2.981 -2.733 -7.206 1.00 0.00 C ATOM 0 H PHE A 78 6.571 1.220 -9.080 1.00 0.00 H new ATOM 0 HA PHE A 78 7.257 -1.524 -8.701 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.288 0.099 -10.244 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.666 -1.474 -10.917 1.00 0.00 H new ATOM 0 HD1 PHE A 78 5.457 -0.453 -7.330 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.773 -2.774 -10.480 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.919 -1.504 -5.729 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.233 -3.828 -8.882 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.306 -3.197 -6.503 1.00 0.00 H new ATOM 1209 N HIS A 79 8.339 0.016 -11.400 1.00 0.00 N ATOM 1210 CA HIS A 79 9.266 -0.090 -12.521 1.00 0.00 C ATOM 1211 C HIS A 79 10.661 0.377 -12.119 1.00 0.00 C ATOM 1212 O HIS A 79 11.637 0.128 -12.825 1.00 0.00 O ATOM 1213 CB HIS A 79 8.761 0.734 -13.707 1.00 0.00 C ATOM 1214 CG HIS A 79 8.051 -0.080 -14.744 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.696 -0.656 -15.818 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.745 -0.414 -14.867 1.00 0.00 C ATOM 1217 CE1 HIS A 79 7.816 -1.309 -16.558 1.00 0.00 C ATOM 1218 NE2 HIS A 79 6.625 -1.177 -16.002 1.00 0.00 N ATOM 0 H HIS A 79 7.918 0.938 -11.286 1.00 0.00 H new ATOM 0 HA HIS A 79 9.324 -1.138 -12.815 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.087 1.508 -13.340 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.606 1.242 -14.172 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.946 -0.133 -14.197 1.00 0.00 H new ATOM 0 HE1 HIS A 79 8.034 -1.857 -17.463 1.00 0.00 H new ATOM 0 HE2 HIS A 79 5.757 -1.577 -16.358 1.00 0.00 H new ATOM 1226 N GLY A 80 10.746 1.057 -10.980 1.00 0.00 N ATOM 1227 CA GLY A 80 12.027 1.549 -10.504 1.00 0.00 C ATOM 1228 C GLY A 80 12.782 0.512 -9.696 1.00 0.00 C ATOM 1229 O GLY A 80 13.432 -0.370 -10.256 1.00 0.00 O ATOM 0 H GLY A 80 9.952 1.276 -10.378 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.635 1.855 -11.356 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.867 2.437 -9.892 1.00 0.00 H new ATOM 1233 N LEU A 81 12.697 0.619 -8.374 1.00 0.00 N ATOM 1234 CA LEU A 81 13.380 -0.316 -7.486 1.00 0.00 C ATOM 1235 C LEU A 81 13.101 -1.759 -7.896 1.00 0.00 C ATOM 1236 O LEU A 81 12.049 -2.064 -8.457 1.00 0.00 O ATOM 1237 CB LEU A 81 12.938 -0.090 -6.039 1.00 0.00 C ATOM 1238 CG LEU A 81 11.432 0.042 -5.810 1.00 0.00 C ATOM 1239 CD1 LEU A 81 10.769 -1.327 -5.815 1.00 0.00 C ATOM 1240 CD2 LEU A 81 11.153 0.767 -4.501 1.00 0.00 C ATOM 0 H LEU A 81 12.163 1.343 -7.894 1.00 0.00 H new ATOM 0 HA LEU A 81 14.452 -0.137 -7.564 1.00 0.00 H new ATOM 0 HB2 LEU A 81 13.306 -0.919 -5.434 1.00 0.00 H new ATOM 0 HB3 LEU A 81 13.422 0.814 -5.669 1.00 0.00 H new ATOM 0 HG LEU A 81 11.010 0.630 -6.625 1.00 0.00 H new ATOM 0 HD11 LEU A 81 9.698 -1.213 -5.651 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.939 -1.810 -6.777 1.00 0.00 H new ATOM 0 HD13 LEU A 81 11.195 -1.940 -5.021 1.00 0.00 H new ATOM 0 HD21 LEU A 81 10.076 0.852 -4.354 1.00 0.00 H new ATOM 0 HD22 LEU A 81 11.589 0.206 -3.674 1.00 0.00 H new ATOM 0 HD23 LEU A 81 11.594 1.763 -4.536 1.00 0.00 H new ATOM 1252 N LYS A 82 14.050 -2.643 -7.611 1.00 0.00 N ATOM 1253 CA LYS A 82 13.907 -4.055 -7.945 1.00 0.00 C ATOM 1254 C LYS A 82 12.614 -4.623 -7.368 1.00 0.00 C ATOM 1255 O LYS A 82 11.893 -3.937 -6.644 1.00 0.00 O ATOM 1256 CB LYS A 82 15.105 -4.849 -7.419 1.00 0.00 C ATOM 1257 CG LYS A 82 15.478 -6.036 -8.290 1.00 0.00 C ATOM 1258 CD LYS A 82 16.926 -6.447 -8.084 1.00 0.00 C ATOM 1259 CE LYS A 82 17.199 -7.832 -8.648 1.00 0.00 C ATOM 1260 NZ LYS A 82 18.654 -8.145 -8.671 1.00 0.00 N ATOM 0 H LYS A 82 14.928 -2.406 -7.149 1.00 0.00 H new ATOM 0 HA LYS A 82 13.869 -4.143 -9.031 1.00 0.00 H new ATOM 0 HB2 LYS A 82 15.964 -4.183 -7.339 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.882 -5.203 -6.413 1.00 0.00 H new ATOM 0 HG2 LYS A 82 14.824 -6.877 -8.060 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.316 -5.784 -9.338 1.00 0.00 H new ATOM 0 HD2 LYS A 82 17.583 -5.722 -8.564 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.161 -6.434 -7.020 1.00 0.00 H new ATOM 0 HE2 LYS A 82 16.677 -8.578 -8.048 1.00 0.00 H new ATOM 0 HE3 LYS A 82 16.797 -7.898 -9.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 18.798 -9.098 -9.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 19.150 -7.449 -9.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 19.033 -8.107 -7.703 1.00 0.00 H new ATOM 1274 N SER A 83 12.327 -5.879 -7.692 1.00 0.00 N ATOM 1275 CA SER A 83 11.121 -6.537 -7.208 1.00 0.00 C ATOM 1276 C SER A 83 11.071 -6.528 -5.683 1.00 0.00 C ATOM 1277 O SER A 83 12.010 -6.967 -5.017 1.00 0.00 O ATOM 1278 CB SER A 83 11.057 -7.977 -7.723 1.00 0.00 C ATOM 1279 OG SER A 83 11.229 -8.024 -9.129 1.00 0.00 O ATOM 0 H SER A 83 12.914 -6.462 -8.289 1.00 0.00 H new ATOM 0 HA SER A 83 10.260 -5.985 -7.586 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.830 -8.574 -7.239 1.00 0.00 H new ATOM 0 HB3 SER A 83 10.097 -8.420 -7.456 1.00 0.00 H new ATOM 0 HG SER A 83 11.186 -8.955 -9.433 1.00 0.00 H new ATOM 1285 N THR A 84 9.970 -6.024 -5.136 1.00 0.00 N ATOM 1286 CA THR A 84 9.797 -5.956 -3.690 1.00 0.00 C ATOM 1287 C THR A 84 8.573 -6.749 -3.245 1.00 0.00 C ATOM 1288 O THR A 84 7.573 -6.817 -3.958 1.00 0.00 O ATOM 1289 CB THR A 84 9.652 -4.499 -3.211 1.00 0.00 C ATOM 1290 OG1 THR A 84 9.893 -3.599 -4.298 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.622 -4.205 -2.076 1.00 0.00 C ATOM 0 H THR A 84 9.184 -5.657 -5.672 1.00 0.00 H new ATOM 0 HA THR A 84 10.691 -6.391 -3.243 1.00 0.00 H new ATOM 0 HB THR A 84 8.635 -4.359 -2.845 1.00 0.00 H new ATOM 0 HG1 THR A 84 9.163 -2.947 -4.351 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.502 -3.171 -1.754 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.416 -4.872 -1.239 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.644 -4.361 -2.421 1.00 0.00 H new ATOM 1299 N ASP A 85 8.662 -7.347 -2.062 1.00 0.00 N ATOM 1300 CA ASP A 85 7.561 -8.135 -1.520 1.00 0.00 C ATOM 1301 C ASP A 85 6.294 -7.292 -1.403 1.00 0.00 C ATOM 1302 O ASP A 85 5.205 -7.737 -1.763 1.00 0.00 O ATOM 1303 CB ASP A 85 7.938 -8.703 -0.150 1.00 0.00 C ATOM 1304 CG ASP A 85 9.235 -9.488 -0.186 1.00 0.00 C ATOM 1305 OD1 ASP A 85 9.895 -9.592 0.869 1.00 0.00 O ATOM 1306 OD2 ASP A 85 9.591 -9.996 -1.269 1.00 0.00 O ATOM 0 H ASP A 85 9.484 -7.301 -1.460 1.00 0.00 H new ATOM 0 HA ASP A 85 7.365 -8.959 -2.206 1.00 0.00 H new ATOM 0 HB2 ASP A 85 8.031 -7.886 0.566 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.135 -9.349 0.206 1.00 0.00 H new ATOM 1311 N VAL A 86 6.447 -6.072 -0.897 1.00 0.00 N ATOM 1312 CA VAL A 86 5.316 -5.167 -0.733 1.00 0.00 C ATOM 1313 C VAL A 86 4.628 -4.900 -2.067 1.00 0.00 C ATOM 1314 O VAL A 86 3.414 -4.706 -2.123 1.00 0.00 O ATOM 1315 CB VAL A 86 5.756 -3.825 -0.118 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.499 -4.055 1.189 1.00 0.00 C ATOM 1317 CG2 VAL A 86 6.618 -3.046 -1.100 1.00 0.00 C ATOM 0 H VAL A 86 7.342 -5.688 -0.594 1.00 0.00 H new ATOM 0 HA VAL A 86 4.615 -5.656 -0.057 1.00 0.00 H new ATOM 0 HB VAL A 86 4.865 -3.234 0.097 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.802 -3.096 1.609 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.845 -4.569 1.894 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.383 -4.665 1.003 1.00 0.00 H new ATOM 0 HG21 VAL A 86 6.920 -2.101 -0.649 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.505 -3.629 -1.348 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.048 -2.849 -2.008 1.00 0.00 H new ATOM 1327 N ALA A 87 5.411 -4.891 -3.140 1.00 0.00 N ATOM 1328 CA ALA A 87 4.877 -4.651 -4.474 1.00 0.00 C ATOM 1329 C ALA A 87 3.913 -5.758 -4.887 1.00 0.00 C ATOM 1330 O ALA A 87 2.816 -5.488 -5.378 1.00 0.00 O ATOM 1331 CB ALA A 87 6.011 -4.532 -5.484 1.00 0.00 C ATOM 0 H ALA A 87 6.419 -5.047 -3.111 1.00 0.00 H new ATOM 0 HA ALA A 87 4.324 -3.712 -4.453 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.597 -4.353 -6.476 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.660 -3.702 -5.206 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.588 -5.456 -5.493 1.00 0.00 H new ATOM 1337 N LYS A 88 4.328 -7.003 -4.687 1.00 0.00 N ATOM 1338 CA LYS A 88 3.501 -8.152 -5.038 1.00 0.00 C ATOM 1339 C LYS A 88 2.239 -8.194 -4.183 1.00 0.00 C ATOM 1340 O LYS A 88 1.142 -8.437 -4.688 1.00 0.00 O ATOM 1341 CB LYS A 88 4.294 -9.449 -4.861 1.00 0.00 C ATOM 1342 CG LYS A 88 3.518 -10.694 -5.259 1.00 0.00 C ATOM 1343 CD LYS A 88 4.087 -11.939 -4.599 1.00 0.00 C ATOM 1344 CE LYS A 88 5.385 -12.377 -5.259 1.00 0.00 C ATOM 1345 NZ LYS A 88 6.574 -11.750 -4.617 1.00 0.00 N ATOM 0 H LYS A 88 5.233 -7.243 -4.283 1.00 0.00 H new ATOM 0 HA LYS A 88 3.207 -8.053 -6.083 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.205 -9.393 -5.457 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.600 -9.539 -3.819 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.472 -10.577 -4.977 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.545 -10.810 -6.342 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.264 -11.743 -3.541 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.358 -12.747 -4.656 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.472 -13.462 -5.203 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.362 -12.113 -6.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.173 -11.313 -5.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 6.261 -11.021 -3.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.119 -12.477 -4.112 1.00 0.00 H new ATOM 1359 N THR A 89 2.400 -7.957 -2.885 1.00 0.00 N ATOM 1360 CA THR A 89 1.274 -7.966 -1.961 1.00 0.00 C ATOM 1361 C THR A 89 0.241 -6.910 -2.339 1.00 0.00 C ATOM 1362 O THR A 89 -0.963 -7.156 -2.278 1.00 0.00 O ATOM 1363 CB THR A 89 1.734 -7.723 -0.511 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.658 -8.741 -0.112 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.546 -7.708 0.439 1.00 0.00 C ATOM 0 H THR A 89 3.301 -7.756 -2.450 1.00 0.00 H new ATOM 0 HA THR A 89 0.819 -8.954 -2.029 1.00 0.00 H new ATOM 0 HB THR A 89 2.225 -6.751 -0.468 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.524 -8.584 -0.543 1.00 0.00 H new ATOM 0 HG21 THR A 89 0.896 -7.535 1.457 1.00 0.00 H new ATOM 0 HG22 THR A 89 -0.140 -6.912 0.151 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.030 -8.667 0.391 1.00 0.00 H new ATOM 1373 N PHE A 90 0.722 -5.735 -2.730 1.00 0.00 N ATOM 1374 CA PHE A 90 -0.161 -4.640 -3.119 1.00 0.00 C ATOM 1375 C PHE A 90 -0.917 -4.979 -4.400 1.00 0.00 C ATOM 1376 O PHE A 90 -2.148 -5.015 -4.415 1.00 0.00 O ATOM 1377 CB PHE A 90 0.644 -3.354 -3.313 1.00 0.00 C ATOM 1378 CG PHE A 90 -0.117 -2.273 -4.027 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.839 -1.330 -3.315 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.111 -2.201 -5.410 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -1.541 -0.334 -3.968 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -0.809 -1.207 -6.070 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.526 -0.273 -5.347 1.00 0.00 C ATOM 0 H PHE A 90 1.717 -5.516 -2.786 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.887 -4.490 -2.320 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.960 -2.982 -2.338 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.549 -3.583 -3.876 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.854 -1.373 -2.236 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.446 -2.930 -5.980 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -2.100 0.395 -3.400 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.794 -1.161 -7.149 1.00 0.00 H new ATOM 0 HZ PHE A 90 -2.074 0.504 -5.860 1.00 0.00 H new ATOM 1393 N ARG A 91 -0.172 -5.228 -5.472 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.771 -5.562 -6.758 1.00 0.00 C ATOM 1395 C ARG A 91 -1.759 -6.716 -6.614 1.00 0.00 C ATOM 1396 O ARG A 91 -2.806 -6.737 -7.262 1.00 0.00 O ATOM 1397 CB ARG A 91 0.314 -5.930 -7.770 1.00 0.00 C ATOM 1398 CG ARG A 91 0.094 -5.325 -9.146 1.00 0.00 C ATOM 1399 CD ARG A 91 1.116 -5.837 -10.151 1.00 0.00 C ATOM 1400 NE ARG A 91 1.080 -5.083 -11.401 1.00 0.00 N ATOM 1401 CZ ARG A 91 1.633 -5.509 -12.531 1.00 0.00 C ATOM 1402 NH1 ARG A 91 2.261 -6.676 -12.567 1.00 0.00 N ATOM 1403 NH2 ARG A 91 1.559 -4.765 -13.628 1.00 0.00 N ATOM 0 H ARG A 91 0.848 -5.205 -5.475 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.311 -4.686 -7.117 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.281 -5.602 -7.389 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.359 -7.015 -7.863 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.911 -5.565 -9.493 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.158 -4.239 -9.081 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.114 -5.773 -9.718 1.00 0.00 H new ATOM 0 HD3 ARG A 91 0.925 -6.890 -10.357 1.00 0.00 H new ATOM 0 HE ARG A 91 0.605 -4.181 -11.407 1.00 0.00 H new ATOM 0 HH11 ARG A 91 2.320 -7.249 -11.725 1.00 0.00 H new ATOM 0 HH12 ARG A 91 2.685 -7.001 -13.436 1.00 0.00 H new ATOM 0 HH21 ARG A 91 1.077 -3.866 -13.603 1.00 0.00 H new ATOM 0 HH22 ARG A 91 1.984 -5.092 -14.496 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.420 -7.675 -5.758 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.277 -8.832 -5.526 1.00 0.00 C ATOM 1419 C LYS A 92 -3.511 -8.443 -4.717 1.00 0.00 C ATOM 1420 O LYS A 92 -4.639 -8.556 -5.195 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.499 -9.929 -4.796 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.625 -10.767 -5.713 1.00 0.00 C ATOM 1423 CD LYS A 92 -0.207 -12.068 -5.048 1.00 0.00 C ATOM 1424 CE LYS A 92 0.602 -12.942 -5.993 1.00 0.00 C ATOM 1425 NZ LYS A 92 -0.231 -13.472 -7.109 1.00 0.00 N ATOM 0 H LYS A 92 -0.558 -7.674 -5.213 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.605 -9.210 -6.494 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.873 -9.471 -4.030 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.204 -10.583 -4.282 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -1.166 -10.985 -6.634 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.262 -10.198 -5.992 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.383 -11.850 -4.158 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.093 -12.610 -4.718 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.431 -12.364 -6.401 1.00 0.00 H new ATOM 0 HE3 LYS A 92 1.036 -13.773 -5.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.300 -14.205 -7.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -1.105 -13.884 -6.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.470 -12.698 -7.761 1.00 0.00 H new ATOM 1439 N ALA A 93 -3.286 -7.983 -3.491 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.379 -7.575 -2.618 1.00 0.00 C ATOM 1441 C ALA A 93 -5.323 -6.613 -3.331 1.00 0.00 C ATOM 1442 O ALA A 93 -6.538 -6.812 -3.341 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.832 -6.935 -1.350 1.00 0.00 C ATOM 0 H ALA A 93 -2.358 -7.884 -3.080 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.946 -8.466 -2.348 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.660 -6.635 -0.707 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -3.204 -7.653 -0.822 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.240 -6.058 -1.611 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.756 -5.569 -3.928 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.548 -4.577 -4.645 1.00 0.00 C ATOM 1451 C ILE A 94 -6.367 -5.225 -5.756 1.00 0.00 C ATOM 1452 O ILE A 94 -7.403 -4.702 -6.162 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.656 -3.479 -5.254 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.359 -2.121 -5.178 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.304 -3.820 -6.693 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.602 -1.092 -4.367 1.00 0.00 C ATOM 0 H ILE A 94 -3.752 -5.389 -3.929 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.222 -4.125 -3.917 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.732 -3.421 -4.679 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.505 -1.739 -6.189 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.349 -2.258 -4.743 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.673 -3.034 -7.109 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.768 -4.769 -6.721 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.218 -3.902 -7.282 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.159 -0.155 -4.357 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.479 -1.452 -3.346 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.622 -0.926 -4.814 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.894 -6.368 -6.242 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.583 -7.090 -7.305 1.00 0.00 C ATOM 1470 C ASN A 95 -7.480 -8.181 -6.729 1.00 0.00 C ATOM 1471 O ASN A 95 -7.825 -9.144 -7.416 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.570 -7.704 -8.273 1.00 0.00 C ATOM 1473 CG ASN A 95 -5.195 -6.756 -9.396 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -5.925 -5.810 -9.694 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -4.052 -7.006 -10.024 1.00 0.00 N ATOM 0 H ASN A 95 -5.036 -6.814 -5.917 1.00 0.00 H new ATOM 0 HA ASN A 95 -7.208 -6.380 -7.847 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.672 -7.986 -7.724 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.985 -8.619 -8.697 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.747 -6.402 -10.788 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.479 -7.802 -9.743 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.855 -8.025 -5.464 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.713 -8.996 -4.795 1.00 0.00 C ATOM 1484 C LYS A 96 -8.024 -10.351 -4.692 1.00 0.00 C ATOM 1485 O LYS A 96 -8.665 -11.367 -4.421 1.00 0.00 O ATOM 1486 CB LYS A 96 -10.037 -9.141 -5.548 1.00 0.00 C ATOM 1487 CG LYS A 96 -11.185 -8.375 -4.912 1.00 0.00 C ATOM 1488 CD LYS A 96 -12.521 -8.763 -5.525 1.00 0.00 C ATOM 1489 CE LYS A 96 -13.187 -9.886 -4.745 1.00 0.00 C ATOM 1490 NZ LYS A 96 -12.871 -11.223 -5.320 1.00 0.00 N ATOM 0 H LYS A 96 -7.578 -7.235 -4.881 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.913 -8.633 -3.787 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -9.903 -8.794 -6.572 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -10.301 -10.197 -5.602 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -11.205 -8.571 -3.840 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -11.023 -7.304 -5.037 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.179 -7.894 -5.547 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.371 -9.075 -6.558 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.859 -9.851 -3.706 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.267 -9.737 -4.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -13.747 -11.672 -5.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -12.211 -11.111 -6.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -12.434 -11.821 -4.589 1.00 0.00 H new ATOM 1504 N LYS A 97 -6.713 -10.362 -4.908 1.00 0.00 N ATOM 1505 CA LYS A 97 -5.935 -11.593 -4.837 1.00 0.00 C ATOM 1506 C LYS A 97 -6.408 -12.597 -5.884 1.00 0.00 C ATOM 1507 O LYS A 97 -6.634 -13.757 -5.544 1.00 0.00 O ATOM 1508 CB LYS A 97 -6.041 -12.208 -3.440 1.00 0.00 C ATOM 1509 CG LYS A 97 -5.690 -11.242 -2.322 1.00 0.00 C ATOM 1510 CD LYS A 97 -6.216 -11.726 -0.980 1.00 0.00 C ATOM 1511 CE LYS A 97 -7.623 -11.211 -0.716 1.00 0.00 C ATOM 1512 NZ LYS A 97 -8.336 -12.041 0.294 1.00 0.00 N ATOM 0 H LYS A 97 -6.166 -9.531 -5.134 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.893 -11.347 -5.040 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.057 -12.572 -3.289 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.381 -13.073 -3.382 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.608 -11.124 -2.268 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -6.107 -10.260 -2.544 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -6.216 -12.816 -0.959 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -5.550 -11.392 -0.185 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -7.573 -10.179 -0.368 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.189 -11.206 -1.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.362 -11.902 0.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -8.106 -13.044 0.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.039 -11.757 1.249 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.966 8.193 -1.697 1.00 0.00 CA HETATM 1528 CA CA A 102 4.021 12.706 -2.495 1.00 0.00 CA