USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 831 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 52 THR OG1 : rot -170:sc= 0.0314 USER MOD Set 1.2: A 55 CYS SG : rot 17:sc= 0.15 USER MOD Set 2.1: A 5 LYS NZ :NH3+ -176:sc= 2.03 (180deg=0.801) USER MOD Set 2.2: A 42 ASN : amide:sc= 0.82 K(o=2.8,f=-9.4!) USER MOD Single : A 2 MET CE :methyl -143:sc=-0.00799 (180deg=-0.373) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0409 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= -0.0562 X(o=-0.056,f=-0.22) USER MOD Single : A 16 LYS NZ :NH3+ -138:sc= 1.06 (180deg=-1.75!) USER MOD Single : A 17 ASN : amide:sc= -0.17 K(o=-0.17,f=-2.5) USER MOD Single : A 29 SER OG : rot 94:sc= 0.118 USER MOD Single : A 34 TYR OH : rot -5:sc= 0.627 USER MOD Single : A 37 GLN : amide:sc= 0.623 K(o=0.62,f=-0.043) USER MOD Single : A 41 GLN : amide:sc= -0.54 X(o=-0.54,f=-0.54) USER MOD Single : A 43 ASN : amide:sc= -0.303 X(o=-0.3,f=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -177:sc= 0 (180deg=-0.0122) USER MOD Single : A 49 THR OG1 : rot -70:sc= 1.2 USER MOD Single : A 50 MET CE :methyl -166:sc=-0.00351 (180deg=-0.328) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.00815 USER MOD Single : A 54 MET CE :methyl -173:sc= 0 (180deg=-0.038) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 68:sc= 1.3 USER MOD Single : A 70 LYS NZ :NH3+ 146:sc= 0.26 (180deg=0.000909) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 ASN :FLIP amide:sc= -0.149 F(o=-1.7,f=-0.15) USER MOD Single : A 77 ASN :FLIP amide:sc= -0.0139 F(o=-1.3,f=-0.014) USER MOD Single : A 83 THR OG1 : rot 82:sc= 1.23 USER MOD Single : A 89 THR OG1 : rot 74:sc= 1.23 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0.0429 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 2 22.526 -2.379 -17.093 1.00 0.00 N ATOM 2 CA MET A 2 23.039 -2.795 -15.787 1.00 0.00 C ATOM 3 C MET A 2 22.827 -1.661 -14.792 1.00 0.00 C ATOM 4 O MET A 2 23.774 -0.989 -14.384 1.00 0.00 O ATOM 5 CB MET A 2 24.499 -3.253 -15.913 1.00 0.00 C ATOM 6 CG MET A 2 24.987 -4.141 -14.762 1.00 0.00 C ATOM 7 SD MET A 2 25.679 -3.313 -13.306 1.00 0.00 S ATOM 8 CE MET A 2 24.306 -3.456 -12.127 1.00 0.00 C ATOM 0 HA MET A 2 22.493 -3.659 -15.407 1.00 0.00 H new ATOM 0 HB2 MET A 2 24.617 -3.797 -16.850 1.00 0.00 H new ATOM 0 HB3 MET A 2 25.139 -2.373 -15.973 1.00 0.00 H new ATOM 0 HG2 MET A 2 24.150 -4.757 -14.433 1.00 0.00 H new ATOM 0 HG3 MET A 2 25.745 -4.818 -15.157 1.00 0.00 H new ATOM 0 HE1 MET A 2 24.248 -2.550 -11.524 1.00 0.00 H new ATOM 0 HE2 MET A 2 23.371 -3.590 -12.672 1.00 0.00 H new ATOM 0 HE3 MET A 2 24.473 -4.314 -11.476 1.00 0.00 H new ATOM 18 N SER A 3 21.581 -1.444 -14.371 1.00 0.00 N ATOM 19 CA SER A 3 21.262 -0.655 -13.198 1.00 0.00 C ATOM 20 C SER A 3 19.898 -1.067 -12.657 1.00 0.00 C ATOM 21 O SER A 3 19.029 -1.476 -13.431 1.00 0.00 O ATOM 22 CB SER A 3 21.335 0.834 -13.534 1.00 0.00 C ATOM 23 OG SER A 3 20.315 1.289 -14.410 1.00 0.00 O ATOM 0 H SER A 3 20.760 -1.819 -14.846 1.00 0.00 H new ATOM 0 HA SER A 3 21.993 -0.841 -12.412 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.283 1.406 -12.608 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.305 1.045 -13.985 1.00 0.00 H new ATOM 0 HG SER A 3 20.429 2.248 -14.575 1.00 0.00 H new ATOM 29 N LYS A 4 19.706 -0.941 -11.345 1.00 0.00 N ATOM 30 CA LYS A 4 18.446 -1.133 -10.642 1.00 0.00 C ATOM 31 C LYS A 4 18.395 -0.098 -9.531 1.00 0.00 C ATOM 32 O LYS A 4 19.034 -0.300 -8.499 1.00 0.00 O ATOM 33 CB LYS A 4 18.378 -2.542 -10.034 1.00 0.00 C ATOM 34 CG LYS A 4 18.013 -3.630 -11.051 1.00 0.00 C ATOM 35 CD LYS A 4 18.474 -5.008 -10.569 1.00 0.00 C ATOM 36 CE LYS A 4 19.998 -5.098 -10.730 1.00 0.00 C ATOM 37 NZ LYS A 4 20.611 -5.939 -9.693 1.00 0.00 N ATOM 0 H LYS A 4 20.467 -0.689 -10.714 1.00 0.00 H new ATOM 0 HA LYS A 4 17.607 -1.022 -11.328 1.00 0.00 H new ATOM 0 HB2 LYS A 4 19.342 -2.783 -9.586 1.00 0.00 H new ATOM 0 HB3 LYS A 4 17.643 -2.547 -9.229 1.00 0.00 H new ATOM 0 HG2 LYS A 4 16.935 -3.638 -11.209 1.00 0.00 H new ATOM 0 HG3 LYS A 4 18.474 -3.404 -12.012 1.00 0.00 H new ATOM 0 HD2 LYS A 4 18.194 -5.157 -9.526 1.00 0.00 H new ATOM 0 HD3 LYS A 4 17.986 -5.794 -11.146 1.00 0.00 H new ATOM 0 HE2 LYS A 4 20.236 -5.504 -11.713 1.00 0.00 H new ATOM 0 HE3 LYS A 4 20.427 -4.097 -10.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 21.640 -5.974 -9.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 20.406 -5.538 -8.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 20.221 -6.901 -9.751 1.00 0.00 H new ATOM 51 N LYS A 5 17.639 0.988 -9.690 1.00 0.00 N ATOM 52 CA LYS A 5 17.441 1.958 -8.609 1.00 0.00 C ATOM 53 C LYS A 5 15.975 2.373 -8.603 1.00 0.00 C ATOM 54 O LYS A 5 15.618 3.385 -9.203 1.00 0.00 O ATOM 55 CB LYS A 5 18.475 3.104 -8.662 1.00 0.00 C ATOM 56 CG LYS A 5 19.064 3.516 -7.296 1.00 0.00 C ATOM 57 CD LYS A 5 18.527 4.844 -6.736 1.00 0.00 C ATOM 58 CE LYS A 5 17.043 4.837 -6.359 1.00 0.00 C ATOM 59 NZ LYS A 5 16.713 3.889 -5.274 1.00 0.00 N ATOM 0 H LYS A 5 17.153 1.220 -10.556 1.00 0.00 H new ATOM 0 HA LYS A 5 17.641 1.511 -7.635 1.00 0.00 H new ATOM 0 HB2 LYS A 5 19.293 2.805 -9.318 1.00 0.00 H new ATOM 0 HB3 LYS A 5 18.005 3.976 -9.116 1.00 0.00 H new ATOM 0 HG2 LYS A 5 18.860 2.725 -6.575 1.00 0.00 H new ATOM 0 HG3 LYS A 5 20.147 3.589 -7.391 1.00 0.00 H new ATOM 0 HD2 LYS A 5 19.109 5.110 -5.854 1.00 0.00 H new ATOM 0 HD3 LYS A 5 18.694 5.627 -7.476 1.00 0.00 H new ATOM 0 HE2 LYS A 5 16.749 5.842 -6.054 1.00 0.00 H new ATOM 0 HE3 LYS A 5 16.454 4.586 -7.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 15.685 3.886 -5.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 17.025 2.933 -5.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 17.197 4.179 -4.400 1.00 0.00 H new ATOM 73 N VAL A 6 15.160 1.545 -7.954 1.00 0.00 N ATOM 74 CA VAL A 6 13.719 1.678 -7.778 1.00 0.00 C ATOM 75 C VAL A 6 13.393 3.010 -7.088 1.00 0.00 C ATOM 76 O VAL A 6 14.176 3.478 -6.257 1.00 0.00 O ATOM 77 CB VAL A 6 13.241 0.440 -6.977 1.00 0.00 C ATOM 78 CG1 VAL A 6 11.804 0.544 -6.452 1.00 0.00 C ATOM 79 CG2 VAL A 6 13.346 -0.826 -7.829 1.00 0.00 C ATOM 0 H VAL A 6 15.518 0.702 -7.505 1.00 0.00 H new ATOM 0 HA VAL A 6 13.191 1.703 -8.732 1.00 0.00 H new ATOM 0 HB VAL A 6 13.903 0.394 -6.112 1.00 0.00 H new ATOM 0 HG11 VAL A 6 11.550 -0.363 -5.904 1.00 0.00 H new ATOM 0 HG12 VAL A 6 11.721 1.404 -5.788 1.00 0.00 H new ATOM 0 HG13 VAL A 6 11.118 0.665 -7.291 1.00 0.00 H new ATOM 0 HG21 VAL A 6 13.006 -1.684 -7.249 1.00 0.00 H new ATOM 0 HG22 VAL A 6 12.724 -0.719 -8.718 1.00 0.00 H new ATOM 0 HG23 VAL A 6 14.383 -0.978 -8.128 1.00 0.00 H new ATOM 89 N THR A 7 12.230 3.597 -7.381 1.00 0.00 N ATOM 90 CA THR A 7 11.806 4.891 -6.858 1.00 0.00 C ATOM 91 C THR A 7 10.446 4.798 -6.170 1.00 0.00 C ATOM 92 O THR A 7 9.723 3.806 -6.286 1.00 0.00 O ATOM 93 CB THR A 7 11.760 5.922 -8.007 1.00 0.00 C ATOM 94 OG1 THR A 7 10.613 5.712 -8.811 1.00 0.00 O ATOM 95 CG2 THR A 7 13.003 5.923 -8.896 1.00 0.00 C ATOM 0 H THR A 7 11.543 3.172 -8.004 1.00 0.00 H new ATOM 0 HA THR A 7 12.529 5.213 -6.109 1.00 0.00 H new ATOM 0 HB THR A 7 11.720 6.897 -7.522 1.00 0.00 H new ATOM 0 HG1 THR A 7 10.595 6.373 -9.534 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.891 6.675 -9.677 1.00 0.00 H new ATOM 0 HG22 THR A 7 13.881 6.154 -8.293 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.125 4.941 -9.352 1.00 0.00 H new ATOM 103 N LYS A 8 10.047 5.880 -5.496 1.00 0.00 N ATOM 104 CA LYS A 8 8.726 6.023 -4.913 1.00 0.00 C ATOM 105 C LYS A 8 7.634 5.920 -5.964 1.00 0.00 C ATOM 106 O LYS A 8 6.554 5.419 -5.669 1.00 0.00 O ATOM 107 CB LYS A 8 8.648 7.349 -4.145 1.00 0.00 C ATOM 108 CG LYS A 8 9.291 8.552 -4.860 1.00 0.00 C ATOM 109 CD LYS A 8 8.819 9.913 -4.341 1.00 0.00 C ATOM 110 CE LYS A 8 8.864 10.040 -2.816 1.00 0.00 C ATOM 111 NZ LYS A 8 8.974 11.449 -2.385 1.00 0.00 N ATOM 0 H LYS A 8 10.648 6.690 -5.342 1.00 0.00 H new ATOM 0 HA LYS A 8 8.560 5.202 -4.215 1.00 0.00 H new ATOM 0 HB2 LYS A 8 7.600 7.578 -3.951 1.00 0.00 H new ATOM 0 HB3 LYS A 8 9.131 7.220 -3.176 1.00 0.00 H new ATOM 0 HG2 LYS A 8 10.374 8.489 -4.751 1.00 0.00 H new ATOM 0 HG3 LYS A 8 9.073 8.486 -5.926 1.00 0.00 H new ATOM 0 HD2 LYS A 8 9.439 10.694 -4.780 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.798 10.087 -4.681 1.00 0.00 H new ATOM 0 HE2 LYS A 8 7.964 9.598 -2.388 1.00 0.00 H new ATOM 0 HE3 LYS A 8 9.712 9.474 -2.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 9.002 11.493 -1.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 9.846 11.864 -2.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 8.152 11.983 -2.732 1.00 0.00 H new ATOM 125 N GLU A 9 7.913 6.378 -7.177 1.00 0.00 N ATOM 126 CA GLU A 9 6.946 6.369 -8.254 1.00 0.00 C ATOM 127 C GLU A 9 6.723 4.947 -8.750 1.00 0.00 C ATOM 128 O GLU A 9 5.575 4.564 -8.975 1.00 0.00 O ATOM 129 CB GLU A 9 7.427 7.305 -9.359 1.00 0.00 C ATOM 130 CG GLU A 9 6.240 8.023 -10.011 1.00 0.00 C ATOM 131 CD GLU A 9 6.723 9.222 -10.820 1.00 0.00 C ATOM 132 OE1 GLU A 9 6.373 9.330 -12.019 1.00 0.00 O ATOM 133 OE2 GLU A 9 7.423 10.089 -10.252 1.00 0.00 O ATOM 0 H GLU A 9 8.820 6.766 -7.437 1.00 0.00 H new ATOM 0 HA GLU A 9 5.981 6.732 -7.901 1.00 0.00 H new ATOM 0 HB2 GLU A 9 8.120 8.038 -8.946 1.00 0.00 H new ATOM 0 HB3 GLU A 9 7.974 6.737 -10.112 1.00 0.00 H new ATOM 0 HG2 GLU A 9 5.701 7.332 -10.659 1.00 0.00 H new ATOM 0 HG3 GLU A 9 5.540 8.352 -9.243 1.00 0.00 H new ATOM 141 N ASP A 10 7.787 4.139 -8.809 1.00 0.00 N ATOM 142 CA ASP A 10 7.711 2.751 -9.250 1.00 0.00 C ATOM 143 C ASP A 10 6.835 2.011 -8.253 1.00 0.00 C ATOM 144 O ASP A 10 5.960 1.240 -8.635 1.00 0.00 O ATOM 145 CB ASP A 10 9.100 2.085 -9.278 1.00 0.00 C ATOM 146 CG ASP A 10 10.138 2.728 -10.197 1.00 0.00 C ATOM 147 OD1 ASP A 10 11.347 2.588 -9.900 1.00 0.00 O ATOM 148 OD2 ASP A 10 9.769 3.423 -11.164 1.00 0.00 O ATOM 0 H ASP A 10 8.728 4.436 -8.550 1.00 0.00 H new ATOM 0 HA ASP A 10 7.305 2.716 -10.261 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.498 2.079 -8.263 1.00 0.00 H new ATOM 0 HB3 ASP A 10 8.975 1.044 -9.577 1.00 0.00 H new ATOM 154 N VAL A 11 7.039 2.281 -6.964 1.00 0.00 N ATOM 155 CA VAL A 11 6.300 1.714 -5.845 1.00 0.00 C ATOM 156 C VAL A 11 4.846 2.206 -5.819 1.00 0.00 C ATOM 157 O VAL A 11 3.958 1.469 -5.383 1.00 0.00 O ATOM 158 CB VAL A 11 7.107 2.006 -4.561 1.00 0.00 C ATOM 159 CG1 VAL A 11 6.414 1.533 -3.276 1.00 0.00 C ATOM 160 CG2 VAL A 11 8.485 1.319 -4.619 1.00 0.00 C ATOM 0 H VAL A 11 7.761 2.934 -6.661 1.00 0.00 H new ATOM 0 HA VAL A 11 6.200 0.633 -5.941 1.00 0.00 H new ATOM 0 HB VAL A 11 7.199 3.092 -4.524 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.040 1.772 -2.416 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.452 2.035 -3.175 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.258 0.455 -3.323 1.00 0.00 H new ATOM 0 HG21 VAL A 11 9.039 1.536 -3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.351 0.241 -4.714 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.042 1.692 -5.478 1.00 0.00 H new ATOM 170 N LEU A 12 4.550 3.404 -6.324 1.00 0.00 N ATOM 171 CA LEU A 12 3.187 3.896 -6.461 1.00 0.00 C ATOM 172 C LEU A 12 2.509 3.209 -7.620 1.00 0.00 C ATOM 173 O LEU A 12 1.327 2.888 -7.532 1.00 0.00 O ATOM 174 CB LEU A 12 3.193 5.410 -6.688 1.00 0.00 C ATOM 175 CG LEU A 12 3.333 6.164 -5.367 1.00 0.00 C ATOM 176 CD1 LEU A 12 3.896 7.565 -5.624 1.00 0.00 C ATOM 177 CD2 LEU A 12 1.983 6.290 -4.650 1.00 0.00 C ATOM 0 H LEU A 12 5.258 4.062 -6.651 1.00 0.00 H new ATOM 0 HA LEU A 12 2.640 3.678 -5.544 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.015 5.678 -7.352 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.271 5.710 -7.185 1.00 0.00 H new ATOM 0 HG LEU A 12 4.013 5.598 -4.731 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.993 8.097 -4.678 1.00 0.00 H new ATOM 0 HD12 LEU A 12 4.875 7.483 -6.096 1.00 0.00 H new ATOM 0 HD13 LEU A 12 3.221 8.113 -6.281 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.117 6.831 -3.714 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.283 6.832 -5.285 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.588 5.296 -4.441 1.00 0.00 H new ATOM 189 N ASN A 13 3.220 3.001 -8.721 1.00 0.00 N ATOM 190 CA ASN A 13 2.682 2.326 -9.882 1.00 0.00 C ATOM 191 C ASN A 13 2.469 0.846 -9.592 1.00 0.00 C ATOM 192 O ASN A 13 1.461 0.267 -9.987 1.00 0.00 O ATOM 193 CB ASN A 13 3.630 2.539 -11.071 1.00 0.00 C ATOM 194 CG ASN A 13 3.009 3.485 -12.088 1.00 0.00 C ATOM 195 OD1 ASN A 13 1.850 3.351 -12.482 1.00 0.00 O ATOM 196 ND2 ASN A 13 3.737 4.524 -12.452 1.00 0.00 N ATOM 0 H ASN A 13 4.189 3.299 -8.828 1.00 0.00 H new ATOM 0 HA ASN A 13 1.708 2.746 -10.133 1.00 0.00 H new ATOM 0 HB2 ASN A 13 4.578 2.946 -10.719 1.00 0.00 H new ATOM 0 HB3 ASN A 13 3.850 1.582 -11.544 1.00 0.00 H new ATOM 0 HD21 ASN A 13 3.341 5.233 -13.070 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.695 4.618 -12.116 1.00 0.00 H new ATOM 203 N ALA A 14 3.395 0.232 -8.858 1.00 0.00 N ATOM 204 CA ALA A 14 3.453 -1.192 -8.652 1.00 0.00 C ATOM 205 C ALA A 14 2.355 -1.644 -7.716 1.00 0.00 C ATOM 206 O ALA A 14 1.870 -2.766 -7.853 1.00 0.00 O ATOM 207 CB ALA A 14 4.793 -1.558 -8.024 1.00 0.00 C ATOM 0 H ALA A 14 4.142 0.737 -8.381 1.00 0.00 H new ATOM 0 HA ALA A 14 3.331 -1.681 -9.618 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.839 -2.636 -7.867 1.00 0.00 H new ATOM 0 HB2 ALA A 14 5.602 -1.253 -8.688 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.898 -1.047 -7.067 1.00 0.00 H new ATOM 213 N LEU A 15 1.999 -0.821 -6.730 1.00 0.00 N ATOM 214 CA LEU A 15 1.026 -1.226 -5.738 1.00 0.00 C ATOM 215 C LEU A 15 -0.409 -1.225 -6.295 1.00 0.00 C ATOM 216 O LEU A 15 -1.307 -1.786 -5.669 1.00 0.00 O ATOM 217 CB LEU A 15 1.188 -0.385 -4.460 1.00 0.00 C ATOM 218 CG LEU A 15 2.161 -0.985 -3.422 1.00 0.00 C ATOM 219 CD1 LEU A 15 2.225 -0.082 -2.189 1.00 0.00 C ATOM 220 CD2 LEU A 15 1.761 -2.392 -2.960 1.00 0.00 C ATOM 0 H LEU A 15 2.371 0.120 -6.604 1.00 0.00 H new ATOM 0 HA LEU A 15 1.220 -2.264 -5.466 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.538 0.610 -4.736 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.210 -0.261 -3.995 1.00 0.00 H new ATOM 0 HG LEU A 15 3.129 -1.055 -3.918 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.913 -0.510 -1.460 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.575 0.908 -2.481 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.232 0.000 -1.746 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.486 -2.756 -2.232 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.772 -2.357 -2.502 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.740 -3.064 -3.818 1.00 0.00 H new ATOM 232 N LYS A 16 -0.638 -0.681 -7.500 1.00 0.00 N ATOM 233 CA LYS A 16 -1.941 -0.601 -8.174 1.00 0.00 C ATOM 234 C LYS A 16 -2.446 -1.969 -8.682 1.00 0.00 C ATOM 235 O LYS A 16 -3.007 -2.049 -9.775 1.00 0.00 O ATOM 236 CB LYS A 16 -1.856 0.415 -9.333 1.00 0.00 C ATOM 237 CG LYS A 16 -1.608 1.869 -8.913 1.00 0.00 C ATOM 238 CD LYS A 16 -1.266 2.719 -10.148 1.00 0.00 C ATOM 239 CE LYS A 16 -1.307 4.226 -9.877 1.00 0.00 C ATOM 240 NZ LYS A 16 -0.245 4.699 -8.970 1.00 0.00 N ATOM 0 H LYS A 16 0.112 -0.268 -8.054 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.671 -0.266 -7.437 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.056 0.107 -10.006 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.785 0.372 -9.901 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.493 2.270 -8.418 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.792 1.914 -8.192 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -0.272 2.448 -10.503 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -1.966 2.482 -10.949 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -1.225 4.758 -10.825 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -2.277 4.482 -9.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -0.642 5.387 -8.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 0.148 3.892 -8.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 0.509 5.152 -9.525 1.00 0.00 H new ATOM 254 N ASN A 17 -2.223 -3.074 -7.969 1.00 0.00 N ATOM 255 CA ASN A 17 -2.854 -4.374 -8.206 1.00 0.00 C ATOM 256 C ASN A 17 -3.226 -5.055 -6.898 1.00 0.00 C ATOM 257 O ASN A 17 -3.904 -6.083 -6.886 1.00 0.00 O ATOM 258 CB ASN A 17 -1.911 -5.308 -8.957 1.00 0.00 C ATOM 259 CG ASN A 17 -0.606 -5.611 -8.252 1.00 0.00 C ATOM 260 OD1 ASN A 17 -0.554 -6.320 -7.256 1.00 0.00 O ATOM 261 ND2 ASN A 17 0.481 -5.095 -8.785 1.00 0.00 N ATOM 0 H ASN A 17 -1.574 -3.089 -7.182 1.00 0.00 H new ATOM 0 HA ASN A 17 -3.750 -4.182 -8.796 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -2.430 -6.248 -9.145 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.687 -4.867 -9.928 1.00 0.00 H new ATOM 0 HD21 ASN A 17 1.392 -5.283 -8.368 1.00 0.00 H new ATOM 0 HD22 ASN A 17 0.412 -4.507 -9.616 1.00 0.00 H new ATOM 268 N VAL A 18 -2.740 -4.503 -5.797 1.00 0.00 N ATOM 269 CA VAL A 18 -2.805 -5.111 -4.496 1.00 0.00 C ATOM 270 C VAL A 18 -4.167 -4.755 -3.928 1.00 0.00 C ATOM 271 O VAL A 18 -4.372 -3.672 -3.374 1.00 0.00 O ATOM 272 CB VAL A 18 -1.612 -4.629 -3.667 1.00 0.00 C ATOM 273 CG1 VAL A 18 -1.507 -5.519 -2.445 1.00 0.00 C ATOM 274 CG2 VAL A 18 -0.301 -4.849 -4.417 1.00 0.00 C ATOM 0 H VAL A 18 -2.278 -3.594 -5.794 1.00 0.00 H new ATOM 0 HA VAL A 18 -2.724 -6.198 -4.508 1.00 0.00 H new ATOM 0 HB VAL A 18 -1.762 -3.574 -3.438 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.664 -5.199 -1.833 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.426 -5.447 -1.863 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -1.356 -6.552 -2.759 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.531 -4.498 -3.806 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.175 -5.911 -4.626 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.321 -4.295 -5.355 1.00 0.00 H new ATOM 284 N ILE A 19 -5.129 -5.629 -4.192 1.00 0.00 N ATOM 285 CA ILE A 19 -6.533 -5.305 -4.097 1.00 0.00 C ATOM 286 C ILE A 19 -7.113 -6.008 -2.895 1.00 0.00 C ATOM 287 O ILE A 19 -6.891 -7.188 -2.640 1.00 0.00 O ATOM 288 CB ILE A 19 -7.233 -5.575 -5.438 1.00 0.00 C ATOM 289 CG1 ILE A 19 -6.901 -4.364 -6.341 1.00 0.00 C ATOM 290 CG2 ILE A 19 -8.748 -5.777 -5.318 1.00 0.00 C ATOM 291 CD1 ILE A 19 -7.123 -4.544 -7.834 1.00 0.00 C ATOM 0 H ILE A 19 -4.948 -6.590 -4.480 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.695 -4.241 -3.923 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.872 -6.515 -5.855 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -7.500 -3.517 -6.008 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -5.856 -4.098 -6.182 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -9.170 -5.962 -6.306 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -8.951 -6.630 -4.671 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -9.202 -4.882 -4.892 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.854 -3.625 -8.355 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.503 -5.363 -8.198 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -8.172 -4.773 -8.021 1.00 0.00 H new ATOM 303 N ASP A 20 -7.863 -5.208 -2.166 1.00 0.00 N ATOM 304 CA ASP A 20 -8.638 -5.557 -0.999 1.00 0.00 C ATOM 305 C ASP A 20 -9.823 -6.355 -1.500 1.00 0.00 C ATOM 306 O ASP A 20 -10.678 -5.791 -2.189 1.00 0.00 O ATOM 307 CB ASP A 20 -9.124 -4.264 -0.340 1.00 0.00 C ATOM 308 CG ASP A 20 -9.883 -4.492 0.967 1.00 0.00 C ATOM 309 OD1 ASP A 20 -10.174 -5.657 1.298 1.00 0.00 O ATOM 310 OD2 ASP A 20 -10.130 -3.479 1.673 1.00 0.00 O ATOM 0 H ASP A 20 -7.952 -4.218 -2.395 1.00 0.00 H new ATOM 0 HA ASP A 20 -8.061 -6.130 -0.273 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.266 -3.621 -0.145 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.770 -3.731 -1.038 1.00 0.00 H new ATOM 316 N PHE A 21 -9.861 -7.663 -1.243 1.00 0.00 N ATOM 317 CA PHE A 21 -10.977 -8.466 -1.713 1.00 0.00 C ATOM 318 C PHE A 21 -12.306 -8.027 -1.082 1.00 0.00 C ATOM 319 O PHE A 21 -13.352 -8.385 -1.626 1.00 0.00 O ATOM 320 CB PHE A 21 -10.714 -9.967 -1.492 1.00 0.00 C ATOM 321 CG PHE A 21 -10.474 -10.734 -2.774 1.00 0.00 C ATOM 322 CD1 PHE A 21 -9.314 -10.493 -3.535 1.00 0.00 C ATOM 323 CD2 PHE A 21 -11.416 -11.682 -3.221 1.00 0.00 C ATOM 324 CE1 PHE A 21 -9.098 -11.196 -4.732 1.00 0.00 C ATOM 325 CE2 PHE A 21 -11.198 -12.383 -4.419 1.00 0.00 C ATOM 326 CZ PHE A 21 -10.041 -12.140 -5.176 1.00 0.00 C ATOM 0 H PHE A 21 -9.147 -8.174 -0.724 1.00 0.00 H new ATOM 0 HA PHE A 21 -11.067 -8.299 -2.786 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -9.848 -10.084 -0.841 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -11.566 -10.404 -0.971 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -8.589 -9.767 -3.198 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -12.308 -11.870 -2.641 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.206 -11.011 -5.312 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -11.921 -13.110 -4.758 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.875 -12.677 -6.098 1.00 0.00 H new ATOM 336 N GLU A 22 -12.296 -7.272 0.025 1.00 0.00 N ATOM 337 CA GLU A 22 -13.485 -6.829 0.754 1.00 0.00 C ATOM 338 C GLU A 22 -14.319 -5.876 -0.121 1.00 0.00 C ATOM 339 O GLU A 22 -15.548 -5.914 -0.029 1.00 0.00 O ATOM 340 CB GLU A 22 -13.035 -6.224 2.110 1.00 0.00 C ATOM 341 CG GLU A 22 -13.948 -6.363 3.340 1.00 0.00 C ATOM 342 CD GLU A 22 -15.132 -5.397 3.458 1.00 0.00 C ATOM 343 OE1 GLU A 22 -16.262 -5.765 3.045 1.00 0.00 O ATOM 344 OE2 GLU A 22 -14.984 -4.325 4.099 1.00 0.00 O ATOM 0 H GLU A 22 -11.429 -6.943 0.449 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.148 -7.664 0.982 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -12.074 -6.671 2.364 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -12.860 -5.160 1.951 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.341 -7.380 3.353 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.331 -6.248 4.231 1.00 0.00 H new ATOM 352 N LEU A 23 -13.694 -5.092 -1.021 1.00 0.00 N ATOM 353 CA LEU A 23 -14.394 -4.118 -1.881 1.00 0.00 C ATOM 354 C LEU A 23 -13.950 -4.158 -3.344 1.00 0.00 C ATOM 355 O LEU A 23 -14.718 -3.783 -4.236 1.00 0.00 O ATOM 356 CB LEU A 23 -14.239 -2.679 -1.376 1.00 0.00 C ATOM 357 CG LEU A 23 -14.919 -2.452 -0.012 1.00 0.00 C ATOM 358 CD1 LEU A 23 -13.895 -2.602 1.108 1.00 0.00 C ATOM 359 CD2 LEU A 23 -15.577 -1.075 0.077 1.00 0.00 C ATOM 0 H LEU A 23 -12.686 -5.117 -1.172 1.00 0.00 H new ATOM 0 HA LEU A 23 -15.439 -4.423 -1.827 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -13.179 -2.439 -1.293 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -14.665 -1.993 -2.108 1.00 0.00 H new ATOM 0 HG LEU A 23 -15.702 -3.203 0.094 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.382 -2.440 2.070 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.470 -3.605 1.080 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -13.101 -1.868 0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -16.044 -0.957 1.055 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -14.822 -0.301 -0.060 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -16.335 -0.983 -0.701 1.00 0.00 H new ATOM 371 N GLY A 24 -12.723 -4.594 -3.622 1.00 0.00 N ATOM 372 CA GLY A 24 -12.182 -4.747 -4.960 1.00 0.00 C ATOM 373 C GLY A 24 -11.385 -3.516 -5.370 1.00 0.00 C ATOM 374 O GLY A 24 -11.445 -3.110 -6.533 1.00 0.00 O ATOM 0 H GLY A 24 -12.060 -4.858 -2.893 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.542 -5.629 -4.999 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -12.994 -4.911 -5.668 1.00 0.00 H new ATOM 378 N LEU A 25 -10.668 -2.891 -4.432 1.00 0.00 N ATOM 379 CA LEU A 25 -9.985 -1.615 -4.613 1.00 0.00 C ATOM 380 C LEU A 25 -8.526 -1.748 -4.191 1.00 0.00 C ATOM 381 O LEU A 25 -8.207 -2.533 -3.293 1.00 0.00 O ATOM 382 CB LEU A 25 -10.694 -0.561 -3.756 1.00 0.00 C ATOM 383 CG LEU A 25 -12.118 -0.216 -4.226 1.00 0.00 C ATOM 384 CD1 LEU A 25 -12.765 0.727 -3.216 1.00 0.00 C ATOM 385 CD2 LEU A 25 -12.117 0.459 -5.602 1.00 0.00 C ATOM 0 H LEU A 25 -10.545 -3.276 -3.495 1.00 0.00 H new ATOM 0 HA LEU A 25 -10.013 -1.316 -5.661 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.740 -0.917 -2.727 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -10.095 0.350 -3.751 1.00 0.00 H new ATOM 0 HG LEU A 25 -12.679 -1.148 -4.304 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -13.774 0.975 -3.544 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -12.809 0.241 -2.241 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.174 1.640 -3.140 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -13.142 0.686 -5.897 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -11.540 1.383 -5.554 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -11.668 -0.211 -6.336 1.00 0.00 H new ATOM 397 N ASP A 26 -7.623 -1.018 -4.855 1.00 0.00 N ATOM 398 CA ASP A 26 -6.192 -1.177 -4.643 1.00 0.00 C ATOM 399 C ASP A 26 -5.701 -0.201 -3.572 1.00 0.00 C ATOM 400 O ASP A 26 -6.311 0.847 -3.342 1.00 0.00 O ATOM 401 CB ASP A 26 -5.408 -1.070 -5.963 1.00 0.00 C ATOM 402 CG ASP A 26 -5.087 0.347 -6.439 1.00 0.00 C ATOM 403 OD1 ASP A 26 -4.296 1.022 -5.752 1.00 0.00 O ATOM 404 OD2 ASP A 26 -5.554 0.729 -7.536 1.00 0.00 O ATOM 0 H ASP A 26 -7.867 -0.309 -5.546 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.004 -2.183 -4.269 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -4.471 -1.615 -5.851 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.979 -1.574 -6.743 1.00 0.00 H new ATOM 410 N VAL A 27 -4.588 -0.522 -2.910 1.00 0.00 N ATOM 411 CA VAL A 27 -4.067 0.253 -1.792 1.00 0.00 C ATOM 412 C VAL A 27 -3.751 1.706 -2.145 1.00 0.00 C ATOM 413 O VAL A 27 -3.852 2.586 -1.285 1.00 0.00 O ATOM 414 CB VAL A 27 -2.794 -0.399 -1.231 1.00 0.00 C ATOM 415 CG1 VAL A 27 -3.032 -1.770 -0.608 1.00 0.00 C ATOM 416 CG2 VAL A 27 -1.685 -0.567 -2.270 1.00 0.00 C ATOM 0 H VAL A 27 -4.020 -1.337 -3.141 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.863 0.260 -1.048 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.481 0.308 -0.462 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.089 -2.168 -0.234 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.739 -1.677 0.216 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.438 -2.446 -1.360 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.817 -1.033 -1.804 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.042 -1.197 -3.084 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.404 0.410 -2.664 1.00 0.00 H new ATOM 426 N VAL A 28 -3.313 1.974 -3.373 1.00 0.00 N ATOM 427 CA VAL A 28 -2.908 3.286 -3.849 1.00 0.00 C ATOM 428 C VAL A 28 -4.175 4.127 -4.008 1.00 0.00 C ATOM 429 O VAL A 28 -4.176 5.288 -3.593 1.00 0.00 O ATOM 430 CB VAL A 28 -2.100 3.154 -5.162 1.00 0.00 C ATOM 431 CG1 VAL A 28 -1.413 4.472 -5.520 1.00 0.00 C ATOM 432 CG2 VAL A 28 -1.012 2.077 -5.039 1.00 0.00 C ATOM 0 H VAL A 28 -3.229 1.252 -4.088 1.00 0.00 H new ATOM 0 HA VAL A 28 -2.245 3.783 -3.141 1.00 0.00 H new ATOM 0 HB VAL A 28 -2.812 2.878 -5.940 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.852 4.350 -6.447 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.165 5.250 -5.650 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.731 4.756 -4.718 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.461 2.007 -5.977 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.326 2.343 -4.234 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.475 1.115 -4.818 1.00 0.00 H new ATOM 442 N SER A 29 -5.264 3.524 -4.497 1.00 0.00 N ATOM 443 CA SER A 29 -6.584 4.149 -4.510 1.00 0.00 C ATOM 444 C SER A 29 -7.044 4.462 -3.090 1.00 0.00 C ATOM 445 O SER A 29 -7.550 5.553 -2.816 1.00 0.00 O ATOM 446 CB SER A 29 -7.639 3.255 -5.164 1.00 0.00 C ATOM 447 OG SER A 29 -7.391 3.093 -6.541 1.00 0.00 O ATOM 0 H SER A 29 -5.251 2.585 -4.896 1.00 0.00 H new ATOM 0 HA SER A 29 -6.485 5.065 -5.092 1.00 0.00 H new ATOM 0 HB2 SER A 29 -7.645 2.280 -4.676 1.00 0.00 H new ATOM 0 HB3 SER A 29 -8.628 3.690 -5.019 1.00 0.00 H new ATOM 0 HG SER A 29 -6.872 2.275 -6.686 1.00 0.00 H new ATOM 453 N LEU A 30 -6.893 3.485 -2.194 1.00 0.00 N ATOM 454 CA LEU A 30 -7.358 3.533 -0.814 1.00 0.00 C ATOM 455 C LEU A 30 -6.534 4.523 0.024 1.00 0.00 C ATOM 456 O LEU A 30 -6.986 4.965 1.075 1.00 0.00 O ATOM 457 CB LEU A 30 -7.314 2.089 -0.261 1.00 0.00 C ATOM 458 CG LEU A 30 -8.508 1.701 0.628 1.00 0.00 C ATOM 459 CD1 LEU A 30 -8.804 0.211 0.457 1.00 0.00 C ATOM 460 CD2 LEU A 30 -8.281 1.943 2.116 1.00 0.00 C ATOM 0 H LEU A 30 -6.426 2.608 -2.422 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.381 3.906 -0.763 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.263 1.395 -1.100 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -6.396 1.963 0.313 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.333 2.337 0.305 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.650 -0.066 1.086 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.045 0.005 -0.586 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.929 -0.370 0.749 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -9.169 1.644 2.673 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -7.426 1.357 2.454 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.085 3.002 2.287 1.00 0.00 H new ATOM 472 N GLY A 31 -5.338 4.905 -0.434 1.00 0.00 N ATOM 473 CA GLY A 31 -4.460 5.836 0.263 1.00 0.00 C ATOM 474 C GLY A 31 -4.019 5.304 1.628 1.00 0.00 C ATOM 475 O GLY A 31 -3.980 6.055 2.599 1.00 0.00 O ATOM 0 H GLY A 31 -4.951 4.567 -1.315 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -3.580 6.031 -0.350 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -4.974 6.788 0.395 1.00 0.00 H new ATOM 479 N LEU A 32 -3.737 3.997 1.718 1.00 0.00 N ATOM 480 CA LEU A 32 -3.262 3.330 2.936 1.00 0.00 C ATOM 481 C LEU A 32 -1.811 3.681 3.279 1.00 0.00 C ATOM 482 O LEU A 32 -1.410 3.609 4.441 1.00 0.00 O ATOM 483 CB LEU A 32 -3.388 1.808 2.767 1.00 0.00 C ATOM 484 CG LEU A 32 -4.842 1.317 2.849 1.00 0.00 C ATOM 485 CD1 LEU A 32 -4.970 -0.051 2.174 1.00 0.00 C ATOM 486 CD2 LEU A 32 -5.340 1.226 4.295 1.00 0.00 C ATOM 0 H LEU A 32 -3.835 3.360 0.927 1.00 0.00 H new ATOM 0 HA LEU A 32 -3.884 3.683 3.759 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.965 1.518 1.805 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.798 1.312 3.537 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.462 2.048 2.330 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.003 -0.392 2.236 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.677 0.031 1.127 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.320 -0.767 2.677 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.372 0.875 4.303 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.715 0.528 4.852 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.288 2.210 4.760 1.00 0.00 H new ATOM 498 N VAL A 33 -1.010 4.041 2.283 1.00 0.00 N ATOM 499 CA VAL A 33 0.381 4.451 2.434 1.00 0.00 C ATOM 500 C VAL A 33 0.441 5.804 3.148 1.00 0.00 C ATOM 501 O VAL A 33 -0.201 6.766 2.722 1.00 0.00 O ATOM 502 CB VAL A 33 1.036 4.469 1.043 1.00 0.00 C ATOM 503 CG1 VAL A 33 2.475 4.975 1.103 1.00 0.00 C ATOM 504 CG2 VAL A 33 1.053 3.068 0.391 1.00 0.00 C ATOM 0 H VAL A 33 -1.323 4.056 1.312 1.00 0.00 H new ATOM 0 HA VAL A 33 0.940 3.749 3.053 1.00 0.00 H new ATOM 0 HB VAL A 33 0.428 5.145 0.442 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.903 4.973 0.101 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.488 5.990 1.501 1.00 0.00 H new ATOM 0 HG13 VAL A 33 3.063 4.324 1.750 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.525 3.129 -0.590 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.615 2.380 1.022 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.031 2.706 0.280 1.00 0.00 H new ATOM 514 N TYR A 34 1.200 5.866 4.242 1.00 0.00 N ATOM 515 CA TYR A 34 1.606 7.095 4.903 1.00 0.00 C ATOM 516 C TYR A 34 2.866 7.644 4.225 1.00 0.00 C ATOM 517 O TYR A 34 2.894 8.823 3.874 1.00 0.00 O ATOM 518 CB TYR A 34 1.889 6.822 6.388 1.00 0.00 C ATOM 519 CG TYR A 34 0.698 6.475 7.269 1.00 0.00 C ATOM 520 CD1 TYR A 34 -0.450 7.294 7.281 1.00 0.00 C ATOM 521 CD2 TYR A 34 0.774 5.384 8.154 1.00 0.00 C ATOM 522 CE1 TYR A 34 -1.518 7.031 8.161 1.00 0.00 C ATOM 523 CE2 TYR A 34 -0.285 5.115 9.035 1.00 0.00 C ATOM 524 CZ TYR A 34 -1.432 5.938 9.052 1.00 0.00 C ATOM 525 OH TYR A 34 -2.429 5.658 9.933 1.00 0.00 O ATOM 0 H TYR A 34 1.559 5.030 4.704 1.00 0.00 H new ATOM 0 HA TYR A 34 0.804 7.829 4.826 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.606 6.003 6.451 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.374 7.703 6.807 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.511 8.135 6.606 1.00 0.00 H new ATOM 0 HD2 TYR A 34 1.650 4.752 8.155 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -2.396 7.660 8.155 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -0.222 4.271 9.706 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.114 6.358 9.886 1.00 0.00 H new ATOM 535 N ASP A 35 3.904 6.826 4.003 1.00 0.00 N ATOM 536 CA ASP A 35 5.198 7.291 3.477 1.00 0.00 C ATOM 537 C ASP A 35 5.819 6.272 2.532 1.00 0.00 C ATOM 538 O ASP A 35 5.549 5.084 2.682 1.00 0.00 O ATOM 539 CB ASP A 35 6.183 7.494 4.629 1.00 0.00 C ATOM 540 CG ASP A 35 7.286 8.476 4.257 1.00 0.00 C ATOM 541 OD1 ASP A 35 8.470 8.180 4.541 1.00 0.00 O ATOM 542 OD2 ASP A 35 6.975 9.599 3.797 1.00 0.00 O ATOM 0 H ASP A 35 3.872 5.822 4.183 1.00 0.00 H new ATOM 0 HA ASP A 35 5.009 8.222 2.942 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.648 7.861 5.505 1.00 0.00 H new ATOM 0 HB3 ASP A 35 6.625 6.536 4.904 1.00 0.00 H new ATOM 548 N ILE A 36 6.682 6.716 1.610 1.00 0.00 N ATOM 549 CA ILE A 36 7.464 5.888 0.698 1.00 0.00 C ATOM 550 C ILE A 36 8.837 6.546 0.612 1.00 0.00 C ATOM 551 O ILE A 36 8.938 7.731 0.278 1.00 0.00 O ATOM 552 CB ILE A 36 6.826 5.846 -0.714 1.00 0.00 C ATOM 553 CG1 ILE A 36 5.313 5.572 -0.706 1.00 0.00 C ATOM 554 CG2 ILE A 36 7.530 4.782 -1.573 1.00 0.00 C ATOM 555 CD1 ILE A 36 4.670 5.792 -2.073 1.00 0.00 C ATOM 0 H ILE A 36 6.859 7.712 1.477 1.00 0.00 H new ATOM 0 HA ILE A 36 7.514 4.861 1.060 1.00 0.00 H new ATOM 0 HB ILE A 36 6.961 6.842 -1.136 1.00 0.00 H new ATOM 0 HG12 ILE A 36 5.135 4.545 -0.386 1.00 0.00 H new ATOM 0 HG13 ILE A 36 4.834 6.222 0.026 1.00 0.00 H new ATOM 0 HG21 ILE A 36 7.077 4.757 -2.564 1.00 0.00 H new ATOM 0 HG22 ILE A 36 8.588 5.029 -1.663 1.00 0.00 H new ATOM 0 HG23 ILE A 36 7.424 3.805 -1.101 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.602 5.585 -2.010 1.00 0.00 H new ATOM 0 HD12 ILE A 36 4.821 6.826 -2.384 1.00 0.00 H new ATOM 0 HD13 ILE A 36 5.127 5.123 -2.802 1.00 0.00 H new ATOM 567 N GLN A 37 9.886 5.774 0.873 1.00 0.00 N ATOM 568 CA GLN A 37 11.262 6.199 0.703 1.00 0.00 C ATOM 569 C GLN A 37 12.121 5.006 0.298 1.00 0.00 C ATOM 570 O GLN A 37 11.896 3.899 0.780 1.00 0.00 O ATOM 571 CB GLN A 37 11.764 6.845 1.991 1.00 0.00 C ATOM 572 CG GLN A 37 11.647 5.997 3.253 1.00 0.00 C ATOM 573 CD GLN A 37 12.041 6.815 4.477 1.00 0.00 C ATOM 574 OE1 GLN A 37 13.067 6.563 5.101 1.00 0.00 O ATOM 575 NE2 GLN A 37 11.273 7.829 4.848 1.00 0.00 N ATOM 0 H GLN A 37 9.797 4.817 1.215 1.00 0.00 H new ATOM 0 HA GLN A 37 11.327 6.943 -0.091 1.00 0.00 H new ATOM 0 HB2 GLN A 37 12.811 7.115 1.854 1.00 0.00 H new ATOM 0 HB3 GLN A 37 11.213 7.772 2.148 1.00 0.00 H new ATOM 0 HG2 GLN A 37 10.625 5.635 3.363 1.00 0.00 H new ATOM 0 HG3 GLN A 37 12.289 5.120 3.171 1.00 0.00 H new ATOM 0 HE21 GLN A 37 10.420 8.039 4.330 1.00 0.00 H new ATOM 0 HE22 GLN A 37 11.535 8.400 5.652 1.00 0.00 H new ATOM 584 N ILE A 38 13.069 5.203 -0.618 1.00 0.00 N ATOM 585 CA ILE A 38 13.884 4.132 -1.165 1.00 0.00 C ATOM 586 C ILE A 38 15.354 4.539 -1.120 1.00 0.00 C ATOM 587 O ILE A 38 15.762 5.492 -1.794 1.00 0.00 O ATOM 588 CB ILE A 38 13.418 3.754 -2.587 1.00 0.00 C ATOM 589 CG1 ILE A 38 11.927 3.382 -2.681 1.00 0.00 C ATOM 590 CG2 ILE A 38 14.214 2.538 -3.075 1.00 0.00 C ATOM 591 CD1 ILE A 38 11.001 4.569 -2.820 1.00 0.00 C ATOM 0 H ILE A 38 13.291 6.122 -1.001 1.00 0.00 H new ATOM 0 HA ILE A 38 13.765 3.236 -0.556 1.00 0.00 H new ATOM 0 HB ILE A 38 13.584 4.642 -3.197 1.00 0.00 H new ATOM 0 HG12 ILE A 38 11.782 2.720 -3.535 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.647 2.819 -1.790 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.887 2.268 -4.079 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.276 2.782 -3.092 1.00 0.00 H new ATOM 0 HG23 ILE A 38 14.045 1.698 -2.401 1.00 0.00 H new ATOM 0 HD11 ILE A 38 9.970 4.221 -2.880 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.114 5.222 -1.955 1.00 0.00 H new ATOM 0 HD13 ILE A 38 11.251 5.121 -3.726 1.00 0.00 H new ATOM 603 N ASP A 39 16.158 3.775 -0.376 1.00 0.00 N ATOM 604 CA ASP A 39 17.612 3.941 -0.315 1.00 0.00 C ATOM 605 C ASP A 39 18.236 3.764 -1.704 1.00 0.00 C ATOM 606 O ASP A 39 17.642 3.186 -2.620 1.00 0.00 O ATOM 607 CB ASP A 39 18.236 2.913 0.653 1.00 0.00 C ATOM 608 CG ASP A 39 18.354 3.429 2.087 1.00 0.00 C ATOM 609 OD1 ASP A 39 19.496 3.669 2.538 1.00 0.00 O ATOM 610 OD2 ASP A 39 17.321 3.571 2.773 1.00 0.00 O ATOM 0 H ASP A 39 15.813 3.014 0.209 1.00 0.00 H new ATOM 0 HA ASP A 39 17.816 4.949 0.046 1.00 0.00 H new ATOM 0 HB2 ASP A 39 17.631 2.006 0.649 1.00 0.00 H new ATOM 0 HB3 ASP A 39 19.226 2.637 0.291 1.00 0.00 H new ATOM 616 N ASP A 40 19.504 4.147 -1.847 1.00 0.00 N ATOM 617 CA ASP A 40 20.347 3.813 -2.999 1.00 0.00 C ATOM 618 C ASP A 40 20.392 2.297 -3.213 1.00 0.00 C ATOM 619 O ASP A 40 20.274 1.814 -4.342 1.00 0.00 O ATOM 620 CB ASP A 40 21.760 4.369 -2.778 1.00 0.00 C ATOM 621 CG ASP A 40 22.595 4.326 -4.058 1.00 0.00 C ATOM 622 OD1 ASP A 40 23.094 3.245 -4.440 1.00 0.00 O ATOM 623 OD2 ASP A 40 22.780 5.405 -4.667 1.00 0.00 O ATOM 0 H ASP A 40 19.987 4.712 -1.149 1.00 0.00 H new ATOM 0 HA ASP A 40 19.922 4.266 -3.895 1.00 0.00 H new ATOM 0 HB2 ASP A 40 21.694 5.397 -2.422 1.00 0.00 H new ATOM 0 HB3 ASP A 40 22.259 3.793 -1.999 1.00 0.00 H new ATOM 629 N GLN A 41 20.420 1.528 -2.116 1.00 0.00 N ATOM 630 CA GLN A 41 20.442 0.070 -2.123 1.00 0.00 C ATOM 631 C GLN A 41 19.116 -0.497 -2.614 1.00 0.00 C ATOM 632 O GLN A 41 19.038 -1.687 -2.895 1.00 0.00 O ATOM 633 CB GLN A 41 20.764 -0.474 -0.714 1.00 0.00 C ATOM 634 CG GLN A 41 22.255 -0.383 -0.340 1.00 0.00 C ATOM 635 CD GLN A 41 22.809 1.038 -0.386 1.00 0.00 C ATOM 636 OE1 GLN A 41 23.584 1.389 -1.270 1.00 0.00 O ATOM 637 NE2 GLN A 41 22.397 1.901 0.524 1.00 0.00 N ATOM 0 H GLN A 41 20.428 1.921 -1.175 1.00 0.00 H new ATOM 0 HA GLN A 41 21.225 -0.249 -2.811 1.00 0.00 H new ATOM 0 HB2 GLN A 41 20.180 0.079 0.021 1.00 0.00 H new ATOM 0 HB3 GLN A 41 20.447 -1.515 -0.655 1.00 0.00 H new ATOM 0 HG2 GLN A 41 22.395 -0.787 0.663 1.00 0.00 H new ATOM 0 HG3 GLN A 41 22.831 -1.011 -1.020 1.00 0.00 H new ATOM 0 HE21 GLN A 41 21.753 1.602 1.256 1.00 0.00 H new ATOM 0 HE22 GLN A 41 22.723 2.867 0.495 1.00 0.00 H new ATOM 646 N ASN A 42 18.080 0.330 -2.758 1.00 0.00 N ATOM 647 CA ASN A 42 16.682 -0.035 -2.932 1.00 0.00 C ATOM 648 C ASN A 42 16.174 -0.814 -1.737 1.00 0.00 C ATOM 649 O ASN A 42 15.414 -1.779 -1.871 1.00 0.00 O ATOM 650 CB ASN A 42 16.414 -0.801 -4.227 1.00 0.00 C ATOM 651 CG ASN A 42 16.885 -0.098 -5.448 1.00 0.00 C ATOM 652 OD1 ASN A 42 16.859 1.122 -5.550 1.00 0.00 O ATOM 653 ND2 ASN A 42 17.239 -0.891 -6.423 1.00 0.00 N ATOM 0 H ASN A 42 18.209 1.342 -2.755 1.00 0.00 H new ATOM 0 HA ASN A 42 16.131 0.902 -3.007 1.00 0.00 H new ATOM 0 HB2 ASN A 42 16.900 -1.775 -4.169 1.00 0.00 H new ATOM 0 HB3 ASN A 42 15.343 -0.984 -4.315 1.00 0.00 H new ATOM 0 HD21 ASN A 42 17.512 -0.500 -7.325 1.00 0.00 H new ATOM 0 HD22 ASN A 42 17.243 -1.901 -6.283 1.00 0.00 H new ATOM 660 N ASN A 43 16.587 -0.404 -0.541 1.00 0.00 N ATOM 661 CA ASN A 43 15.775 -0.675 0.630 1.00 0.00 C ATOM 662 C ASN A 43 14.497 0.137 0.423 1.00 0.00 C ATOM 663 O ASN A 43 14.497 1.339 0.675 1.00 0.00 O ATOM 664 CB ASN A 43 16.479 -0.318 1.952 1.00 0.00 C ATOM 665 CG ASN A 43 17.927 -0.768 2.116 1.00 0.00 C ATOM 666 OD1 ASN A 43 18.663 -0.173 2.889 1.00 0.00 O ATOM 667 ND2 ASN A 43 18.391 -1.791 1.418 1.00 0.00 N ATOM 0 H ASN A 43 17.454 0.102 -0.364 1.00 0.00 H new ATOM 0 HA ASN A 43 15.572 -1.742 0.724 1.00 0.00 H new ATOM 0 HB2 ASN A 43 16.447 0.765 2.070 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.898 -0.745 2.770 1.00 0.00 H new ATOM 0 HD21 ASN A 43 19.362 -2.083 1.525 1.00 0.00 H new ATOM 0 HD22 ASN A 43 17.777 -2.288 0.773 1.00 0.00 H new ATOM 674 N VAL A 44 13.473 -0.459 -0.187 1.00 0.00 N ATOM 675 CA VAL A 44 12.187 0.177 -0.390 1.00 0.00 C ATOM 676 C VAL A 44 11.475 0.155 0.961 1.00 0.00 C ATOM 677 O VAL A 44 11.225 -0.941 1.470 1.00 0.00 O ATOM 678 CB VAL A 44 11.459 -0.605 -1.505 1.00 0.00 C ATOM 679 CG1 VAL A 44 9.973 -0.229 -1.617 1.00 0.00 C ATOM 680 CG2 VAL A 44 12.131 -0.373 -2.869 1.00 0.00 C ATOM 0 H VAL A 44 13.521 -1.409 -0.556 1.00 0.00 H new ATOM 0 HA VAL A 44 12.241 1.215 -0.717 1.00 0.00 H new ATOM 0 HB VAL A 44 11.527 -1.657 -1.228 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.510 -0.808 -2.416 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.471 -0.446 -0.674 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.883 0.834 -1.840 1.00 0.00 H new ATOM 0 HG21 VAL A 44 11.599 -0.935 -3.637 1.00 0.00 H new ATOM 0 HG22 VAL A 44 12.104 0.689 -3.112 1.00 0.00 H new ATOM 0 HG23 VAL A 44 13.167 -0.709 -2.826 1.00 0.00 H new ATOM 690 N LYS A 45 11.173 1.312 1.567 1.00 0.00 N ATOM 691 CA LYS A 45 10.622 1.389 2.891 1.00 0.00 C ATOM 692 C LYS A 45 9.331 2.166 2.762 1.00 0.00 C ATOM 693 O LYS A 45 9.305 3.237 2.152 1.00 0.00 O ATOM 694 CB LYS A 45 11.654 2.073 3.781 1.00 0.00 C ATOM 695 CG LYS A 45 11.155 2.169 5.217 1.00 0.00 C ATOM 696 CD LYS A 45 11.926 3.217 6.013 1.00 0.00 C ATOM 697 CE LYS A 45 11.101 3.555 7.247 1.00 0.00 C ATOM 698 NZ LYS A 45 11.121 2.468 8.254 1.00 0.00 N ATOM 0 H LYS A 45 11.313 2.223 1.130 1.00 0.00 H new ATOM 0 HA LYS A 45 10.402 0.421 3.342 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.590 1.516 3.754 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.866 3.071 3.398 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.094 2.419 5.218 1.00 0.00 H new ATOM 0 HG3 LYS A 45 11.254 1.198 5.702 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.906 2.836 6.300 1.00 0.00 H new ATOM 0 HD3 LYS A 45 12.095 4.109 5.409 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.484 4.471 7.697 1.00 0.00 H new ATOM 0 HE3 LYS A 45 10.071 3.752 6.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.546 2.745 9.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 10.731 1.600 7.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 12.100 2.296 8.560 1.00 0.00 H new ATOM 712 N VAL A 46 8.261 1.605 3.304 1.00 0.00 N ATOM 713 CA VAL A 46 6.924 2.135 3.135 1.00 0.00 C ATOM 714 C VAL A 46 6.238 2.029 4.485 1.00 0.00 C ATOM 715 O VAL A 46 6.078 0.928 5.014 1.00 0.00 O ATOM 716 CB VAL A 46 6.179 1.377 2.015 1.00 0.00 C ATOM 717 CG1 VAL A 46 4.843 2.069 1.718 1.00 0.00 C ATOM 718 CG2 VAL A 46 7.017 1.323 0.725 1.00 0.00 C ATOM 0 H VAL A 46 8.300 0.762 3.877 1.00 0.00 H new ATOM 0 HA VAL A 46 6.937 3.178 2.819 1.00 0.00 H new ATOM 0 HB VAL A 46 6.004 0.358 2.359 1.00 0.00 H new ATOM 0 HG11 VAL A 46 4.322 1.530 0.927 1.00 0.00 H new ATOM 0 HG12 VAL A 46 4.229 2.076 2.618 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.028 3.094 1.397 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.466 0.783 -0.045 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.221 2.337 0.381 1.00 0.00 H new ATOM 0 HG23 VAL A 46 7.958 0.811 0.924 1.00 0.00 H new ATOM 728 N LEU A 47 5.865 3.167 5.065 1.00 0.00 N ATOM 729 CA LEU A 47 4.981 3.181 6.217 1.00 0.00 C ATOM 730 C LEU A 47 3.567 3.034 5.670 1.00 0.00 C ATOM 731 O LEU A 47 3.111 3.897 4.913 1.00 0.00 O ATOM 732 CB LEU A 47 5.169 4.462 7.058 1.00 0.00 C ATOM 733 CG LEU A 47 5.737 4.147 8.451 1.00 0.00 C ATOM 734 CD1 LEU A 47 7.221 3.761 8.388 1.00 0.00 C ATOM 735 CD2 LEU A 47 5.568 5.340 9.391 1.00 0.00 C ATOM 0 H LEU A 47 6.164 4.091 4.752 1.00 0.00 H new ATOM 0 HA LEU A 47 5.204 2.364 6.903 1.00 0.00 H new ATOM 0 HB2 LEU A 47 5.840 5.145 6.537 1.00 0.00 H new ATOM 0 HB3 LEU A 47 4.212 4.973 7.162 1.00 0.00 H new ATOM 0 HG LEU A 47 5.173 3.297 8.836 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.584 3.546 9.393 1.00 0.00 H new ATOM 0 HD12 LEU A 47 7.341 2.877 7.762 1.00 0.00 H new ATOM 0 HD13 LEU A 47 7.794 4.586 7.964 1.00 0.00 H new ATOM 0 HD21 LEU A 47 5.978 5.092 10.370 1.00 0.00 H new ATOM 0 HD22 LEU A 47 6.097 6.202 8.984 1.00 0.00 H new ATOM 0 HD23 LEU A 47 4.509 5.578 9.490 1.00 0.00 H new ATOM 747 N MET A 48 2.884 1.943 6.013 1.00 0.00 N ATOM 748 CA MET A 48 1.499 1.681 5.634 1.00 0.00 C ATOM 749 C MET A 48 0.691 1.324 6.889 1.00 0.00 C ATOM 750 O MET A 48 1.219 1.313 8.001 1.00 0.00 O ATOM 751 CB MET A 48 1.439 0.595 4.533 1.00 0.00 C ATOM 752 CG MET A 48 0.265 0.871 3.582 1.00 0.00 C ATOM 753 SD MET A 48 0.003 -0.237 2.178 1.00 0.00 S ATOM 754 CE MET A 48 -1.079 -1.464 2.959 1.00 0.00 C ATOM 0 H MET A 48 3.291 1.197 6.578 1.00 0.00 H new ATOM 0 HA MET A 48 1.046 2.573 5.202 1.00 0.00 H new ATOM 0 HB2 MET A 48 2.374 0.581 3.974 1.00 0.00 H new ATOM 0 HB3 MET A 48 1.325 -0.389 4.988 1.00 0.00 H new ATOM 0 HG2 MET A 48 -0.648 0.872 4.177 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.390 1.880 3.188 1.00 0.00 H new ATOM 0 HE1 MET A 48 -1.300 -2.259 2.247 1.00 0.00 H new ATOM 0 HE2 MET A 48 -0.580 -1.886 3.831 1.00 0.00 H new ATOM 0 HE3 MET A 48 -2.008 -0.985 3.268 1.00 0.00 H new ATOM 764 N THR A 49 -0.597 1.071 6.715 1.00 0.00 N ATOM 765 CA THR A 49 -1.566 0.594 7.688 1.00 0.00 C ATOM 766 C THR A 49 -2.569 -0.234 6.879 1.00 0.00 C ATOM 767 O THR A 49 -2.567 -0.179 5.647 1.00 0.00 O ATOM 768 CB THR A 49 -2.206 1.804 8.430 1.00 0.00 C ATOM 769 OG1 THR A 49 -3.360 1.460 9.186 1.00 0.00 O ATOM 770 CG2 THR A 49 -2.624 2.952 7.502 1.00 0.00 C ATOM 0 H THR A 49 -1.030 1.208 5.802 1.00 0.00 H new ATOM 0 HA THR A 49 -1.130 -0.022 8.475 1.00 0.00 H new ATOM 0 HB THR A 49 -1.400 2.128 9.088 1.00 0.00 H new ATOM 0 HG1 THR A 49 -4.097 1.244 8.578 1.00 0.00 H new ATOM 0 HG21 THR A 49 -3.061 3.757 8.093 1.00 0.00 H new ATOM 0 HG22 THR A 49 -1.750 3.326 6.970 1.00 0.00 H new ATOM 0 HG23 THR A 49 -3.359 2.590 6.783 1.00 0.00 H new ATOM 778 N MET A 50 -3.445 -0.965 7.562 1.00 0.00 N ATOM 779 CA MET A 50 -4.686 -1.484 6.988 1.00 0.00 C ATOM 780 C MET A 50 -5.818 -0.480 7.250 1.00 0.00 C ATOM 781 O MET A 50 -5.600 0.538 7.915 1.00 0.00 O ATOM 782 CB MET A 50 -4.954 -2.887 7.569 1.00 0.00 C ATOM 783 CG MET A 50 -4.643 -4.002 6.565 1.00 0.00 C ATOM 784 SD MET A 50 -3.178 -3.778 5.528 1.00 0.00 S ATOM 785 CE MET A 50 -3.562 -5.006 4.257 1.00 0.00 C ATOM 0 H MET A 50 -3.313 -1.218 8.541 1.00 0.00 H new ATOM 0 HA MET A 50 -4.614 -1.598 5.906 1.00 0.00 H new ATOM 0 HB2 MET A 50 -4.349 -3.028 8.465 1.00 0.00 H new ATOM 0 HB3 MET A 50 -5.998 -2.958 7.875 1.00 0.00 H new ATOM 0 HG2 MET A 50 -4.529 -4.935 7.117 1.00 0.00 H new ATOM 0 HG3 MET A 50 -5.507 -4.122 5.911 1.00 0.00 H new ATOM 0 HE1 MET A 50 -2.672 -5.201 3.659 1.00 0.00 H new ATOM 0 HE2 MET A 50 -3.890 -5.931 4.732 1.00 0.00 H new ATOM 0 HE3 MET A 50 -4.356 -4.627 3.613 1.00 0.00 H new ATOM 795 N THR A 51 -7.019 -0.749 6.727 1.00 0.00 N ATOM 796 CA THR A 51 -8.219 0.070 6.951 1.00 0.00 C ATOM 797 C THR A 51 -8.512 0.168 8.454 1.00 0.00 C ATOM 798 O THR A 51 -8.875 1.230 8.967 1.00 0.00 O ATOM 799 CB THR A 51 -9.446 -0.553 6.237 1.00 0.00 C ATOM 800 OG1 THR A 51 -9.137 -1.025 4.944 1.00 0.00 O ATOM 801 CG2 THR A 51 -10.605 0.424 6.062 1.00 0.00 C ATOM 0 H THR A 51 -7.189 -1.555 6.126 1.00 0.00 H new ATOM 0 HA THR A 51 -8.035 1.064 6.544 1.00 0.00 H new ATOM 0 HB THR A 51 -9.736 -1.371 6.897 1.00 0.00 H new ATOM 0 HG1 THR A 51 -9.940 -1.410 4.536 1.00 0.00 H new ATOM 0 HG21 THR A 51 -11.430 -0.077 5.556 1.00 0.00 H new ATOM 0 HG22 THR A 51 -10.938 0.773 7.040 1.00 0.00 H new ATOM 0 HG23 THR A 51 -10.277 1.275 5.465 1.00 0.00 H new ATOM 809 N THR A 52 -8.401 -0.975 9.128 1.00 0.00 N ATOM 810 CA THR A 52 -8.861 -1.305 10.467 1.00 0.00 C ATOM 811 C THR A 52 -8.057 -2.548 10.908 1.00 0.00 C ATOM 812 O THR A 52 -7.442 -3.201 10.062 1.00 0.00 O ATOM 813 CB THR A 52 -10.363 -1.664 10.385 1.00 0.00 C ATOM 814 OG1 THR A 52 -10.523 -2.617 9.351 1.00 0.00 O ATOM 815 CG2 THR A 52 -11.286 -0.467 10.136 1.00 0.00 C ATOM 0 H THR A 52 -7.936 -1.775 8.699 1.00 0.00 H new ATOM 0 HA THR A 52 -8.724 -0.481 11.167 1.00 0.00 H new ATOM 0 HB THR A 52 -10.659 -2.058 11.357 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.477 -2.746 9.169 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.320 -0.808 10.093 1.00 0.00 H new ATOM 0 HG22 THR A 52 -11.175 0.253 10.947 1.00 0.00 H new ATOM 0 HG23 THR A 52 -11.020 0.007 9.191 1.00 0.00 H new ATOM 823 N PRO A 53 -8.086 -2.959 12.185 1.00 0.00 N ATOM 824 CA PRO A 53 -7.487 -4.216 12.650 1.00 0.00 C ATOM 825 C PRO A 53 -8.333 -5.471 12.345 1.00 0.00 C ATOM 826 O PRO A 53 -8.169 -6.489 13.022 1.00 0.00 O ATOM 827 CB PRO A 53 -7.277 -4.001 14.153 1.00 0.00 C ATOM 828 CG PRO A 53 -8.441 -3.093 14.534 1.00 0.00 C ATOM 829 CD PRO A 53 -8.578 -2.184 13.315 1.00 0.00 C ATOM 0 HA PRO A 53 -6.557 -4.425 12.121 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -7.302 -4.942 14.703 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -6.315 -3.534 14.364 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -9.353 -3.661 14.719 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -8.230 -2.525 15.440 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.616 -1.887 13.163 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -8.000 -1.269 13.443 1.00 0.00 H new ATOM 837 N MET A 54 -9.325 -5.399 11.447 1.00 0.00 N ATOM 838 CA MET A 54 -10.419 -6.376 11.408 1.00 0.00 C ATOM 839 C MET A 54 -10.848 -6.803 9.997 1.00 0.00 C ATOM 840 O MET A 54 -11.912 -7.407 9.855 1.00 0.00 O ATOM 841 CB MET A 54 -11.584 -5.829 12.243 1.00 0.00 C ATOM 842 CG MET A 54 -12.295 -4.651 11.581 1.00 0.00 C ATOM 843 SD MET A 54 -13.250 -3.617 12.717 1.00 0.00 S ATOM 844 CE MET A 54 -14.407 -2.911 11.511 1.00 0.00 C ATOM 0 H MET A 54 -9.391 -4.671 10.736 1.00 0.00 H new ATOM 0 HA MET A 54 -10.053 -7.306 11.843 1.00 0.00 H new ATOM 0 HB2 MET A 54 -12.304 -6.628 12.418 1.00 0.00 H new ATOM 0 HB3 MET A 54 -11.209 -5.518 13.218 1.00 0.00 H new ATOM 0 HG2 MET A 54 -11.552 -4.029 11.081 1.00 0.00 H new ATOM 0 HG3 MET A 54 -12.963 -5.033 10.809 1.00 0.00 H new ATOM 0 HE1 MET A 54 -15.011 -2.142 11.993 1.00 0.00 H new ATOM 0 HE2 MET A 54 -13.848 -2.469 10.686 1.00 0.00 H new ATOM 0 HE3 MET A 54 -15.058 -3.697 11.128 1.00 0.00 H new ATOM 854 N CYS A 55 -10.068 -6.502 8.952 1.00 0.00 N ATOM 855 CA CYS A 55 -10.421 -6.949 7.605 1.00 0.00 C ATOM 856 C CYS A 55 -10.347 -8.487 7.521 1.00 0.00 C ATOM 857 O CYS A 55 -9.559 -9.118 8.234 1.00 0.00 O ATOM 858 CB CYS A 55 -9.536 -6.287 6.542 1.00 0.00 C ATOM 859 SG CYS A 55 -9.554 -4.482 6.714 1.00 0.00 S ATOM 0 H CYS A 55 -9.205 -5.961 9.013 1.00 0.00 H new ATOM 0 HA CYS A 55 -11.446 -6.641 7.400 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -8.514 -6.655 6.634 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -9.886 -6.565 5.548 1.00 0.00 H new ATOM 0 HG CYS A 55 -10.003 -4.163 7.892 1.00 0.00 H new ATOM 865 N PRO A 56 -11.115 -9.114 6.623 1.00 0.00 N ATOM 866 CA PRO A 56 -11.648 -10.454 6.838 1.00 0.00 C ATOM 867 C PRO A 56 -10.613 -11.560 6.632 1.00 0.00 C ATOM 868 O PRO A 56 -10.750 -12.680 7.121 1.00 0.00 O ATOM 869 CB PRO A 56 -12.782 -10.585 5.820 1.00 0.00 C ATOM 870 CG PRO A 56 -12.346 -9.672 4.679 1.00 0.00 C ATOM 871 CD PRO A 56 -11.537 -8.570 5.350 1.00 0.00 C ATOM 0 HA PRO A 56 -11.976 -10.574 7.871 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -12.903 -11.615 5.485 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -13.737 -10.272 6.241 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.747 -10.213 3.947 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -13.206 -9.264 4.148 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -10.678 -8.288 4.741 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -12.138 -7.671 5.488 1.00 0.00 H new ATOM 879 N LEU A 57 -9.587 -11.254 5.854 1.00 0.00 N ATOM 880 CA LEU A 57 -8.467 -12.110 5.529 1.00 0.00 C ATOM 881 C LEU A 57 -7.258 -11.191 5.412 1.00 0.00 C ATOM 882 O LEU A 57 -6.494 -11.297 4.455 1.00 0.00 O ATOM 883 CB LEU A 57 -8.762 -12.967 4.274 1.00 0.00 C ATOM 884 CG LEU A 57 -9.558 -12.320 3.117 1.00 0.00 C ATOM 885 CD1 LEU A 57 -8.857 -11.122 2.468 1.00 0.00 C ATOM 886 CD2 LEU A 57 -9.854 -13.373 2.047 1.00 0.00 C ATOM 0 H LEU A 57 -9.514 -10.341 5.406 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.268 -12.855 6.299 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.808 -13.308 3.872 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -9.307 -13.854 4.597 1.00 0.00 H new ATOM 0 HG LEU A 57 -10.478 -11.937 3.559 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.480 -10.726 1.666 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -8.693 -10.347 3.217 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -7.898 -11.440 2.059 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -10.415 -12.916 1.232 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.916 -13.774 1.662 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -10.442 -14.180 2.484 1.00 0.00 H new ATOM 898 N ALA A 58 -7.119 -10.237 6.351 1.00 0.00 N ATOM 899 CA ALA A 58 -6.157 -9.151 6.205 1.00 0.00 C ATOM 900 C ALA A 58 -4.756 -9.705 5.921 1.00 0.00 C ATOM 901 O ALA A 58 -4.069 -9.176 5.061 1.00 0.00 O ATOM 902 CB ALA A 58 -6.081 -8.257 7.443 1.00 0.00 C ATOM 0 H ALA A 58 -7.663 -10.204 7.213 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.508 -8.548 5.367 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -5.349 -7.467 7.277 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -7.058 -7.813 7.632 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.781 -8.853 8.305 1.00 0.00 H new ATOM 908 N GLY A 59 -4.352 -10.786 6.598 1.00 0.00 N ATOM 909 CA GLY A 59 -3.083 -11.480 6.409 1.00 0.00 C ATOM 910 C GLY A 59 -2.818 -11.910 4.968 1.00 0.00 C ATOM 911 O GLY A 59 -1.655 -11.963 4.554 1.00 0.00 O ATOM 0 H GLY A 59 -4.928 -11.215 7.322 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -2.273 -10.830 6.738 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.064 -12.362 7.050 1.00 0.00 H new ATOM 915 N MET A 60 -3.865 -12.214 4.205 1.00 0.00 N ATOM 916 CA MET A 60 -3.804 -12.543 2.793 1.00 0.00 C ATOM 917 C MET A 60 -3.525 -11.264 2.006 1.00 0.00 C ATOM 918 O MET A 60 -2.570 -11.236 1.237 1.00 0.00 O ATOM 919 CB MET A 60 -5.119 -13.215 2.361 1.00 0.00 C ATOM 920 CG MET A 60 -4.897 -14.410 1.432 1.00 0.00 C ATOM 921 SD MET A 60 -3.920 -14.081 -0.057 1.00 0.00 S ATOM 922 CE MET A 60 -4.136 -15.672 -0.893 1.00 0.00 C ATOM 0 H MET A 60 -4.816 -12.237 4.574 1.00 0.00 H new ATOM 0 HA MET A 60 -2.999 -13.250 2.593 1.00 0.00 H new ATOM 0 HB2 MET A 60 -5.661 -13.545 3.247 1.00 0.00 H new ATOM 0 HB3 MET A 60 -5.748 -12.481 1.857 1.00 0.00 H new ATOM 0 HG2 MET A 60 -4.405 -15.200 1.999 1.00 0.00 H new ATOM 0 HG3 MET A 60 -5.870 -14.795 1.127 1.00 0.00 H new ATOM 0 HE1 MET A 60 -3.599 -15.661 -1.841 1.00 0.00 H new ATOM 0 HE2 MET A 60 -3.743 -16.470 -0.263 1.00 0.00 H new ATOM 0 HE3 MET A 60 -5.196 -15.845 -1.078 1.00 0.00 H new ATOM 932 N ILE A 61 -4.274 -10.188 2.254 1.00 0.00 N ATOM 933 CA ILE A 61 -4.040 -8.884 1.620 1.00 0.00 C ATOM 934 C ILE A 61 -2.602 -8.397 1.917 1.00 0.00 C ATOM 935 O ILE A 61 -1.889 -7.959 1.017 1.00 0.00 O ATOM 936 CB ILE A 61 -5.102 -7.824 2.028 1.00 0.00 C ATOM 937 CG1 ILE A 61 -6.506 -8.388 2.363 1.00 0.00 C ATOM 938 CG2 ILE A 61 -5.212 -6.802 0.884 1.00 0.00 C ATOM 939 CD1 ILE A 61 -7.534 -7.333 2.802 1.00 0.00 C ATOM 0 H ILE A 61 -5.062 -10.194 2.901 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.146 -9.016 0.543 1.00 0.00 H new ATOM 0 HB ILE A 61 -4.755 -7.375 2.959 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.892 -8.909 1.487 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.405 -9.129 3.156 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -5.952 -6.044 1.143 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.244 -6.326 0.727 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.518 -7.311 -0.030 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.486 -7.819 3.015 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -7.176 -6.827 3.699 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -7.670 -6.603 2.004 1.00 0.00 H new ATOM 951 N LEU A 62 -2.144 -8.538 3.167 1.00 0.00 N ATOM 952 CA LEU A 62 -0.787 -8.225 3.619 1.00 0.00 C ATOM 953 C LEU A 62 0.254 -9.075 2.889 1.00 0.00 C ATOM 954 O LEU A 62 1.364 -8.607 2.638 1.00 0.00 O ATOM 955 CB LEU A 62 -0.648 -8.482 5.136 1.00 0.00 C ATOM 956 CG LEU A 62 -1.412 -7.510 6.053 1.00 0.00 C ATOM 957 CD1 LEU A 62 -1.406 -7.993 7.508 1.00 0.00 C ATOM 958 CD2 LEU A 62 -0.807 -6.115 6.030 1.00 0.00 C ATOM 0 H LEU A 62 -2.735 -8.888 3.921 1.00 0.00 H new ATOM 0 HA LEU A 62 -0.611 -7.172 3.399 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.990 -9.495 5.347 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.410 -8.442 5.397 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.432 -7.477 5.669 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.954 -7.284 8.129 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.882 -8.972 7.568 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.378 -8.067 7.863 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.376 -5.461 6.690 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.228 -6.162 6.369 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.839 -5.721 5.014 1.00 0.00 H new ATOM 970 N SER A 63 -0.085 -10.326 2.561 1.00 0.00 N ATOM 971 CA SER A 63 0.771 -11.171 1.746 1.00 0.00 C ATOM 972 C SER A 63 0.827 -10.602 0.334 1.00 0.00 C ATOM 973 O SER A 63 1.928 -10.366 -0.143 1.00 0.00 O ATOM 974 CB SER A 63 0.303 -12.631 1.750 1.00 0.00 C ATOM 975 OG SER A 63 0.238 -13.111 3.081 1.00 0.00 O ATOM 0 H SER A 63 -0.955 -10.772 2.854 1.00 0.00 H new ATOM 0 HA SER A 63 1.775 -11.174 2.171 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.676 -12.710 1.277 1.00 0.00 H new ATOM 0 HB3 SER A 63 0.989 -13.244 1.166 1.00 0.00 H new ATOM 0 HG SER A 63 -0.487 -12.656 3.558 1.00 0.00 H new ATOM 981 N ASP A 64 -0.330 -10.350 -0.299 1.00 0.00 N ATOM 982 CA ASP A 64 -0.459 -9.860 -1.675 1.00 0.00 C ATOM 983 C ASP A 64 0.344 -8.580 -1.888 1.00 0.00 C ATOM 984 O ASP A 64 0.907 -8.382 -2.965 1.00 0.00 O ATOM 985 CB ASP A 64 -1.925 -9.592 -2.036 1.00 0.00 C ATOM 986 CG ASP A 64 -2.194 -9.591 -3.550 1.00 0.00 C ATOM 987 OD1 ASP A 64 -1.524 -10.315 -4.323 1.00 0.00 O ATOM 988 OD2 ASP A 64 -3.179 -8.941 -3.966 1.00 0.00 O ATOM 0 H ASP A 64 -1.234 -10.488 0.153 1.00 0.00 H new ATOM 0 HA ASP A 64 -0.065 -10.642 -2.324 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -2.551 -10.349 -1.564 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -2.223 -8.629 -1.622 1.00 0.00 H new ATOM 994 N ALA A 65 0.408 -7.734 -0.849 1.00 0.00 N ATOM 995 CA ALA A 65 1.210 -6.525 -0.802 1.00 0.00 C ATOM 996 C ALA A 65 2.673 -6.871 -0.978 1.00 0.00 C ATOM 997 O ALA A 65 3.243 -6.535 -2.014 1.00 0.00 O ATOM 998 CB ALA A 65 0.935 -5.738 0.486 1.00 0.00 C ATOM 0 H ALA A 65 -0.121 -7.889 0.009 1.00 0.00 H new ATOM 0 HA ALA A 65 0.930 -5.870 -1.627 1.00 0.00 H new ATOM 0 HB1 ALA A 65 1.547 -4.836 0.499 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -0.119 -5.462 0.526 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.181 -6.356 1.350 1.00 0.00 H new ATOM 1004 N GLU A 66 3.288 -7.558 -0.014 1.00 0.00 N ATOM 1005 CA GLU A 66 4.686 -7.941 -0.102 1.00 0.00 C ATOM 1006 C GLU A 66 4.961 -8.676 -1.426 1.00 0.00 C ATOM 1007 O GLU A 66 5.976 -8.437 -2.073 1.00 0.00 O ATOM 1008 CB GLU A 66 5.033 -8.804 1.119 1.00 0.00 C ATOM 1009 CG GLU A 66 6.523 -8.687 1.445 1.00 0.00 C ATOM 1010 CD GLU A 66 7.015 -9.916 2.203 1.00 0.00 C ATOM 1011 OE1 GLU A 66 6.761 -10.025 3.426 1.00 0.00 O ATOM 1012 OE2 GLU A 66 7.588 -10.818 1.555 1.00 0.00 O ATOM 0 H GLU A 66 2.827 -7.861 0.844 1.00 0.00 H new ATOM 0 HA GLU A 66 5.322 -7.056 -0.097 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.440 -8.487 1.977 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.778 -9.845 0.922 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.093 -8.572 0.523 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.699 -7.792 2.042 1.00 0.00 H new ATOM 1020 N GLU A 67 4.033 -9.532 -1.844 1.00 0.00 N ATOM 1021 CA GLU A 67 3.986 -10.342 -3.054 1.00 0.00 C ATOM 1022 C GLU A 67 3.788 -9.558 -4.362 1.00 0.00 C ATOM 1023 O GLU A 67 3.894 -10.137 -5.448 1.00 0.00 O ATOM 1024 CB GLU A 67 2.848 -11.333 -2.803 1.00 0.00 C ATOM 1025 CG GLU A 67 2.531 -12.307 -3.926 1.00 0.00 C ATOM 1026 CD GLU A 67 2.055 -13.638 -3.353 1.00 0.00 C ATOM 1027 OE1 GLU A 67 0.882 -14.028 -3.569 1.00 0.00 O ATOM 1028 OE2 GLU A 67 2.866 -14.297 -2.660 1.00 0.00 O ATOM 0 H GLU A 67 3.201 -9.691 -1.276 1.00 0.00 H new ATOM 0 HA GLU A 67 4.951 -10.822 -3.219 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.090 -11.910 -1.910 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.945 -10.765 -2.580 1.00 0.00 H new ATOM 0 HG2 GLU A 67 1.763 -11.887 -4.575 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.417 -12.464 -4.541 1.00 0.00 H new ATOM 1036 N ALA A 68 3.542 -8.253 -4.287 1.00 0.00 N ATOM 1037 CA ALA A 68 3.569 -7.322 -5.407 1.00 0.00 C ATOM 1038 C ALA A 68 4.757 -6.383 -5.280 1.00 0.00 C ATOM 1039 O ALA A 68 5.233 -5.852 -6.284 1.00 0.00 O ATOM 1040 CB ALA A 68 2.265 -6.508 -5.421 1.00 0.00 C ATOM 0 H ALA A 68 3.308 -7.797 -3.405 1.00 0.00 H new ATOM 0 HA ALA A 68 3.663 -7.883 -6.337 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.281 -5.810 -6.258 1.00 0.00 H new ATOM 0 HB2 ALA A 68 1.416 -7.183 -5.528 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.172 -5.953 -4.487 1.00 0.00 H new ATOM 1046 N ILE A 69 5.225 -6.124 -4.056 1.00 0.00 N ATOM 1047 CA ILE A 69 6.332 -5.224 -3.800 1.00 0.00 C ATOM 1048 C ILE A 69 7.634 -5.938 -4.147 1.00 0.00 C ATOM 1049 O ILE A 69 8.545 -5.304 -4.691 1.00 0.00 O ATOM 1050 CB ILE A 69 6.281 -4.712 -2.342 1.00 0.00 C ATOM 1051 CG1 ILE A 69 4.966 -3.938 -2.064 1.00 0.00 C ATOM 1052 CG2 ILE A 69 7.465 -3.777 -2.031 1.00 0.00 C ATOM 1053 CD1 ILE A 69 4.633 -3.924 -0.569 1.00 0.00 C ATOM 0 H ILE A 69 4.835 -6.542 -3.211 1.00 0.00 H new ATOM 0 HA ILE A 69 6.265 -4.337 -4.430 1.00 0.00 H new ATOM 0 HB ILE A 69 6.334 -5.593 -1.703 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.060 -2.915 -2.427 1.00 0.00 H new ATOM 0 HG13 ILE A 69 4.147 -4.398 -2.617 1.00 0.00 H new ATOM 0 HG21 ILE A 69 7.398 -3.436 -0.998 1.00 0.00 H new ATOM 0 HG22 ILE A 69 8.402 -4.316 -2.175 1.00 0.00 H new ATOM 0 HG23 ILE A 69 7.435 -2.917 -2.700 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.706 -3.374 -0.408 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.514 -4.947 -0.213 1.00 0.00 H new ATOM 0 HD13 ILE A 69 5.442 -3.441 -0.021 1.00 0.00 H new ATOM 1065 N LYS A 70 7.768 -7.240 -3.871 1.00 0.00 N ATOM 1066 CA LYS A 70 9.047 -7.927 -4.055 1.00 0.00 C ATOM 1067 C LYS A 70 9.374 -8.211 -5.535 1.00 0.00 C ATOM 1068 O LYS A 70 10.459 -8.749 -5.785 1.00 0.00 O ATOM 1069 CB LYS A 70 9.143 -9.160 -3.130 1.00 0.00 C ATOM 1070 CG LYS A 70 8.248 -10.317 -3.578 1.00 0.00 C ATOM 1071 CD LYS A 70 8.207 -11.519 -2.636 1.00 0.00 C ATOM 1072 CE LYS A 70 7.449 -11.194 -1.352 1.00 0.00 C ATOM 1073 NZ LYS A 70 6.781 -12.378 -0.763 1.00 0.00 N ATOM 0 H LYS A 70 7.014 -7.832 -3.523 1.00 0.00 H new ATOM 0 HA LYS A 70 9.841 -7.248 -3.744 1.00 0.00 H new ATOM 0 HB2 LYS A 70 10.178 -9.501 -3.095 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.869 -8.868 -2.116 1.00 0.00 H new ATOM 0 HG2 LYS A 70 7.233 -9.941 -3.703 1.00 0.00 H new ATOM 0 HG3 LYS A 70 8.585 -10.656 -4.557 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.731 -12.361 -3.138 1.00 0.00 H new ATOM 0 HD3 LYS A 70 9.224 -11.827 -2.392 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.142 -10.774 -0.623 1.00 0.00 H new ATOM 0 HE3 LYS A 70 6.702 -10.428 -1.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.791 -12.302 0.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 5.797 -12.424 -1.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.285 -13.241 -1.052 1.00 0.00 H new ATOM 1087 N LYS A 71 8.529 -7.824 -6.514 1.00 0.00 N ATOM 1088 CA LYS A 71 8.828 -7.993 -7.952 1.00 0.00 C ATOM 1089 C LYS A 71 9.116 -6.667 -8.648 1.00 0.00 C ATOM 1090 O LYS A 71 9.325 -6.637 -9.863 1.00 0.00 O ATOM 1091 CB LYS A 71 7.766 -8.829 -8.682 1.00 0.00 C ATOM 1092 CG LYS A 71 6.409 -8.122 -8.747 1.00 0.00 C ATOM 1093 CD LYS A 71 6.030 -7.695 -10.167 1.00 0.00 C ATOM 1094 CE LYS A 71 4.713 -6.921 -10.140 1.00 0.00 C ATOM 1095 NZ LYS A 71 4.175 -6.673 -11.498 1.00 0.00 N ATOM 0 H LYS A 71 7.625 -7.388 -6.331 1.00 0.00 H new ATOM 0 HA LYS A 71 9.752 -8.569 -8.006 1.00 0.00 H new ATOM 0 HB2 LYS A 71 8.109 -9.044 -9.694 1.00 0.00 H new ATOM 0 HB3 LYS A 71 7.650 -9.787 -8.175 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.639 -8.786 -8.355 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.431 -7.244 -8.102 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.819 -7.074 -10.593 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.934 -8.572 -10.807 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.979 -7.478 -9.558 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.865 -5.968 -9.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.282 -6.145 -11.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.862 -6.118 -12.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.003 -7.581 -11.975 1.00 0.00 H new ATOM 1109 N ILE A 72 9.130 -5.572 -7.890 1.00 0.00 N ATOM 1110 CA ILE A 72 9.551 -4.252 -8.333 1.00 0.00 C ATOM 1111 C ILE A 72 11.071 -4.370 -8.481 1.00 0.00 C ATOM 1112 O ILE A 72 11.773 -4.039 -7.537 1.00 0.00 O ATOM 1113 CB ILE A 72 9.110 -3.199 -7.291 1.00 0.00 C ATOM 1114 CG1 ILE A 72 7.609 -3.321 -6.959 1.00 0.00 C ATOM 1115 CG2 ILE A 72 9.479 -1.770 -7.729 1.00 0.00 C ATOM 1116 CD1 ILE A 72 7.179 -2.314 -5.888 1.00 0.00 C ATOM 0 H ILE A 72 8.836 -5.585 -6.913 1.00 0.00 H new ATOM 0 HA ILE A 72 9.106 -3.929 -9.274 1.00 0.00 H new ATOM 0 HB ILE A 72 9.663 -3.406 -6.375 1.00 0.00 H new ATOM 0 HG12 ILE A 72 7.023 -3.162 -7.864 1.00 0.00 H new ATOM 0 HG13 ILE A 72 7.394 -4.332 -6.614 1.00 0.00 H new ATOM 0 HG21 ILE A 72 9.152 -1.061 -6.969 1.00 0.00 H new ATOM 0 HG22 ILE A 72 10.559 -1.695 -7.854 1.00 0.00 H new ATOM 0 HG23 ILE A 72 8.988 -1.541 -8.675 1.00 0.00 H new ATOM 0 HD11 ILE A 72 6.115 -2.433 -5.683 1.00 0.00 H new ATOM 0 HD12 ILE A 72 7.746 -2.490 -4.974 1.00 0.00 H new ATOM 0 HD13 ILE A 72 7.369 -1.301 -6.244 1.00 0.00 H new ATOM 1128 N GLU A 73 11.542 -4.953 -9.586 1.00 0.00 N ATOM 1129 CA GLU A 73 12.759 -5.764 -9.772 1.00 0.00 C ATOM 1130 C GLU A 73 14.131 -5.091 -9.569 1.00 0.00 C ATOM 1131 O GLU A 73 15.128 -5.434 -10.216 1.00 0.00 O ATOM 1132 CB GLU A 73 12.637 -6.436 -11.141 1.00 0.00 C ATOM 1133 CG GLU A 73 12.696 -5.437 -12.309 1.00 0.00 C ATOM 1134 CD GLU A 73 12.114 -6.032 -13.595 1.00 0.00 C ATOM 1135 OE1 GLU A 73 12.844 -6.109 -14.607 1.00 0.00 O ATOM 1136 OE2 GLU A 73 10.912 -6.394 -13.604 1.00 0.00 O ATOM 0 H GLU A 73 11.032 -4.863 -10.465 1.00 0.00 H new ATOM 0 HA GLU A 73 12.779 -6.474 -8.945 1.00 0.00 H new ATOM 0 HB2 GLU A 73 13.439 -7.166 -11.254 1.00 0.00 H new ATOM 0 HB3 GLU A 73 11.697 -6.985 -11.187 1.00 0.00 H new ATOM 0 HG2 GLU A 73 12.145 -4.535 -12.044 1.00 0.00 H new ATOM 0 HG3 GLU A 73 13.730 -5.140 -12.481 1.00 0.00 H new ATOM 1144 N GLY A 74 14.232 -4.313 -8.514 1.00 0.00 N ATOM 1145 CA GLY A 74 15.415 -3.754 -7.899 1.00 0.00 C ATOM 1146 C GLY A 74 15.298 -3.724 -6.372 1.00 0.00 C ATOM 1147 O GLY A 74 16.308 -3.476 -5.732 1.00 0.00 O ATOM 0 H GLY A 74 13.393 -4.025 -8.011 1.00 0.00 H new ATOM 0 HA2 GLY A 74 16.287 -4.342 -8.186 1.00 0.00 H new ATOM 0 HA3 GLY A 74 15.576 -2.742 -8.272 1.00 0.00 H new ATOM 1151 N VAL A 75 14.102 -3.960 -5.808 1.00 0.00 N ATOM 1152 CA VAL A 75 13.635 -4.018 -4.412 1.00 0.00 C ATOM 1153 C VAL A 75 14.401 -4.999 -3.515 1.00 0.00 C ATOM 1154 O VAL A 75 13.892 -5.962 -2.957 1.00 0.00 O ATOM 1155 CB VAL A 75 12.116 -4.222 -4.424 1.00 0.00 C ATOM 1156 CG1 VAL A 75 11.815 -5.621 -4.967 1.00 0.00 C ATOM 1157 CG2 VAL A 75 11.414 -3.962 -3.090 1.00 0.00 C ATOM 0 H VAL A 75 13.312 -4.145 -6.426 1.00 0.00 H new ATOM 0 HA VAL A 75 13.862 -3.067 -3.931 1.00 0.00 H new ATOM 0 HB VAL A 75 11.697 -3.459 -5.080 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.737 -5.781 -4.982 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.209 -5.711 -5.979 1.00 0.00 H new ATOM 0 HG13 VAL A 75 12.284 -6.368 -4.327 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.343 -4.133 -3.203 1.00 0.00 H new ATOM 0 HG22 VAL A 75 11.812 -4.637 -2.332 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.586 -2.930 -2.783 1.00 0.00 H new ATOM 1167 N ASN A 76 15.678 -4.711 -3.390 1.00 0.00 N ATOM 1168 CA ASN A 76 16.656 -5.343 -2.534 1.00 0.00 C ATOM 1169 C ASN A 76 16.057 -5.745 -1.186 1.00 0.00 C ATOM 1170 O ASN A 76 16.098 -6.908 -0.792 1.00 0.00 O ATOM 1171 CB ASN A 76 17.724 -4.277 -2.358 1.00 0.00 C ATOM 1172 CG ASN A 76 18.915 -4.674 -1.500 1.00 0.00 C ATOM 1173 OD1 ASN A 76 18.720 -4.908 -0.215 1.00 0.00 O flip ATOM 1174 ND2 ASN A 76 20.032 -4.749 -1.991 1.00 0.00 N flip ATOM 0 H ASN A 76 16.096 -3.958 -3.937 1.00 0.00 H new ATOM 0 HA ASN A 76 17.042 -6.268 -2.962 1.00 0.00 H new ATOM 0 HB2 ASN A 76 18.089 -3.988 -3.344 1.00 0.00 H new ATOM 0 HB3 ASN A 76 17.261 -3.394 -1.918 1.00 0.00 H new ATOM 0 HD21 ASN A 76 20.165 -4.565 -2.985 1.00 0.00 H new ATOM 0 HD22 ASN A 76 20.831 -4.995 -1.406 1.00 0.00 H new ATOM 1181 N ASN A 77 15.524 -4.759 -0.465 1.00 0.00 N ATOM 1182 CA ASN A 77 14.876 -4.918 0.824 1.00 0.00 C ATOM 1183 C ASN A 77 13.444 -4.401 0.760 1.00 0.00 C ATOM 1184 O ASN A 77 13.166 -3.482 -0.014 1.00 0.00 O ATOM 1185 CB ASN A 77 15.625 -4.105 1.867 1.00 0.00 C ATOM 1186 CG ASN A 77 15.828 -4.880 3.143 1.00 0.00 C ATOM 1187 OD1 ASN A 77 14.803 -4.945 3.951 1.00 0.00 O flip ATOM 1188 ND2 ASN A 77 16.903 -5.417 3.384 1.00 0.00 N flip ATOM 0 H ASN A 77 15.536 -3.790 -0.782 1.00 0.00 H new ATOM 0 HA ASN A 77 14.877 -5.976 1.086 1.00 0.00 H new ATOM 0 HB2 ASN A 77 16.593 -3.805 1.467 1.00 0.00 H new ATOM 0 HB3 ASN A 77 15.071 -3.191 2.081 1.00 0.00 H new ATOM 0 HD21 ASN A 77 17.673 -5.337 2.720 1.00 0.00 H new ATOM 0 HD22 ASN A 77 17.027 -5.944 4.248 1.00 0.00 H new ATOM 1195 N VAL A 78 12.582 -4.902 1.644 1.00 0.00 N ATOM 1196 CA VAL A 78 11.141 -4.699 1.610 1.00 0.00 C ATOM 1197 C VAL A 78 10.715 -4.298 3.024 1.00 0.00 C ATOM 1198 O VAL A 78 10.246 -5.106 3.819 1.00 0.00 O ATOM 1199 CB VAL A 78 10.459 -5.979 1.063 1.00 0.00 C ATOM 1200 CG1 VAL A 78 8.973 -5.724 0.797 1.00 0.00 C ATOM 1201 CG2 VAL A 78 11.130 -6.457 -0.233 1.00 0.00 C ATOM 0 H VAL A 78 12.882 -5.480 2.429 1.00 0.00 H new ATOM 0 HA VAL A 78 10.833 -3.901 0.935 1.00 0.00 H new ATOM 0 HB VAL A 78 10.566 -6.755 1.821 1.00 0.00 H new ATOM 0 HG11 VAL A 78 8.511 -6.634 0.413 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.482 -5.431 1.725 1.00 0.00 H new ATOM 0 HG13 VAL A 78 8.867 -4.926 0.063 1.00 0.00 H new ATOM 0 HG21 VAL A 78 10.629 -7.356 -0.592 1.00 0.00 H new ATOM 0 HG22 VAL A 78 11.058 -5.675 -0.989 1.00 0.00 H new ATOM 0 HG23 VAL A 78 12.179 -6.679 -0.039 1.00 0.00 H new ATOM 1211 N GLU A 79 10.955 -3.037 3.368 1.00 0.00 N ATOM 1212 CA GLU A 79 10.800 -2.500 4.712 1.00 0.00 C ATOM 1213 C GLU A 79 9.393 -1.907 4.839 1.00 0.00 C ATOM 1214 O GLU A 79 9.205 -0.698 4.995 1.00 0.00 O ATOM 1215 CB GLU A 79 11.917 -1.477 4.977 1.00 0.00 C ATOM 1216 CG GLU A 79 13.303 -2.113 5.125 1.00 0.00 C ATOM 1217 CD GLU A 79 13.524 -2.812 6.470 1.00 0.00 C ATOM 1218 OE1 GLU A 79 12.980 -2.344 7.502 1.00 0.00 O ATOM 1219 OE2 GLU A 79 14.275 -3.812 6.488 1.00 0.00 O ATOM 0 H GLU A 79 11.273 -2.339 2.696 1.00 0.00 H new ATOM 0 HA GLU A 79 10.897 -3.276 5.471 1.00 0.00 H new ATOM 0 HB2 GLU A 79 11.941 -0.757 4.159 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.682 -0.921 5.884 1.00 0.00 H new ATOM 0 HG2 GLU A 79 13.448 -2.836 4.323 1.00 0.00 H new ATOM 0 HG3 GLU A 79 14.062 -1.341 4.999 1.00 0.00 H new ATOM 1227 N VAL A 80 8.376 -2.759 4.734 1.00 0.00 N ATOM 1228 CA VAL A 80 6.990 -2.349 4.922 1.00 0.00 C ATOM 1229 C VAL A 80 6.744 -2.281 6.435 1.00 0.00 C ATOM 1230 O VAL A 80 6.725 -3.327 7.093 1.00 0.00 O ATOM 1231 CB VAL A 80 6.023 -3.328 4.217 1.00 0.00 C ATOM 1232 CG1 VAL A 80 4.600 -2.760 4.258 1.00 0.00 C ATOM 1233 CG2 VAL A 80 6.388 -3.576 2.741 1.00 0.00 C ATOM 0 H VAL A 80 8.490 -3.749 4.517 1.00 0.00 H new ATOM 0 HA VAL A 80 6.805 -1.373 4.472 1.00 0.00 H new ATOM 0 HB VAL A 80 6.097 -4.275 4.751 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.918 -3.450 3.761 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.291 -2.628 5.295 1.00 0.00 H new ATOM 0 HG13 VAL A 80 4.578 -1.797 3.747 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.673 -4.271 2.301 1.00 0.00 H new ATOM 0 HG22 VAL A 80 6.359 -2.633 2.196 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.390 -4.000 2.680 1.00 0.00 H new ATOM 1243 N GLU A 81 6.592 -1.090 7.016 1.00 0.00 N ATOM 1244 CA GLU A 81 6.049 -0.965 8.362 1.00 0.00 C ATOM 1245 C GLU A 81 4.537 -1.087 8.248 1.00 0.00 C ATOM 1246 O GLU A 81 3.900 -0.378 7.466 1.00 0.00 O ATOM 1247 CB GLU A 81 6.433 0.357 9.027 1.00 0.00 C ATOM 1248 CG GLU A 81 5.993 0.457 10.502 1.00 0.00 C ATOM 1249 CD GLU A 81 7.178 0.666 11.451 1.00 0.00 C ATOM 1250 OE1 GLU A 81 7.624 -0.323 12.079 1.00 0.00 O ATOM 1251 OE2 GLU A 81 7.678 1.807 11.587 1.00 0.00 O ATOM 0 H GLU A 81 6.837 -0.204 6.575 1.00 0.00 H new ATOM 0 HA GLU A 81 6.464 -1.749 8.995 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.514 0.482 8.970 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.987 1.179 8.467 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.291 1.283 10.614 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.462 -0.453 10.783 1.00 0.00 H new ATOM 1259 N LEU A 82 3.971 -1.995 9.032 1.00 0.00 N ATOM 1260 CA LEU A 82 2.543 -2.125 9.216 1.00 0.00 C ATOM 1261 C LEU A 82 2.195 -1.442 10.518 1.00 0.00 C ATOM 1262 O LEU A 82 2.252 -2.017 11.603 1.00 0.00 O ATOM 1263 CB LEU A 82 2.092 -3.583 9.139 1.00 0.00 C ATOM 1264 CG LEU A 82 0.559 -3.690 9.231 1.00 0.00 C ATOM 1265 CD1 LEU A 82 -0.173 -3.045 8.043 1.00 0.00 C ATOM 1266 CD2 LEU A 82 0.181 -5.164 9.283 1.00 0.00 C ATOM 0 H LEU A 82 4.511 -2.675 9.568 1.00 0.00 H new ATOM 0 HA LEU A 82 1.997 -1.638 8.408 1.00 0.00 H new ATOM 0 HB2 LEU A 82 2.436 -4.025 8.204 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.549 -4.152 9.948 1.00 0.00 H new ATOM 0 HG LEU A 82 0.254 -3.152 10.128 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.249 -3.158 8.174 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.077 -1.985 7.993 1.00 0.00 H new ATOM 0 HD13 LEU A 82 0.133 -3.534 7.118 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.903 -5.260 9.348 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.535 -5.663 8.381 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.639 -5.627 10.157 1.00 0.00 H new ATOM 1278 N THR A 83 1.851 -0.175 10.377 1.00 0.00 N ATOM 1279 CA THR A 83 1.423 0.658 11.464 1.00 0.00 C ATOM 1280 C THR A 83 -0.043 0.308 11.726 1.00 0.00 C ATOM 1281 O THR A 83 -0.849 0.369 10.802 1.00 0.00 O ATOM 1282 CB THR A 83 1.583 2.133 11.059 1.00 0.00 C ATOM 1283 OG1 THR A 83 2.584 2.362 10.080 1.00 0.00 O ATOM 1284 CG2 THR A 83 1.957 2.926 12.295 1.00 0.00 C ATOM 0 H THR A 83 1.865 0.306 9.478 1.00 0.00 H new ATOM 0 HA THR A 83 2.013 0.499 12.366 1.00 0.00 H new ATOM 0 HB THR A 83 0.632 2.440 10.623 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.221 2.170 9.190 1.00 0.00 H new ATOM 0 HG21 THR A 83 2.076 3.977 12.031 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.170 2.827 13.043 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.894 2.546 12.701 1.00 0.00 H new ATOM 1292 N PHE A 84 -0.381 -0.088 12.950 1.00 0.00 N ATOM 1293 CA PHE A 84 -1.727 -0.525 13.304 1.00 0.00 C ATOM 1294 C PHE A 84 -2.393 0.325 14.382 1.00 0.00 C ATOM 1295 O PHE A 84 -3.616 0.282 14.502 1.00 0.00 O ATOM 1296 CB PHE A 84 -1.708 -2.002 13.730 1.00 0.00 C ATOM 1297 CG PHE A 84 -2.324 -2.955 12.727 1.00 0.00 C ATOM 1298 CD1 PHE A 84 -3.586 -2.677 12.167 1.00 0.00 C ATOM 1299 CD2 PHE A 84 -1.659 -4.145 12.389 1.00 0.00 C ATOM 1300 CE1 PHE A 84 -4.137 -3.548 11.215 1.00 0.00 C ATOM 1301 CE2 PHE A 84 -2.240 -5.044 11.479 1.00 0.00 C ATOM 1302 CZ PHE A 84 -3.463 -4.728 10.861 1.00 0.00 C ATOM 0 H PHE A 84 0.277 -0.115 13.729 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.331 -0.399 12.406 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -0.675 -2.302 13.909 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -2.238 -2.100 14.678 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.129 -1.794 12.470 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.699 -4.369 12.830 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -5.083 -3.310 10.753 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.747 -5.978 11.254 1.00 0.00 H new ATOM 0 HZ PHE A 84 -3.882 -5.390 10.117 1.00 0.00 H new ATOM 1312 N ASP A 85 -1.642 1.063 15.189 1.00 0.00 N ATOM 1313 CA ASP A 85 -2.231 1.955 16.185 1.00 0.00 C ATOM 1314 C ASP A 85 -2.903 3.195 15.588 1.00 0.00 C ATOM 1315 O ASP A 85 -3.961 3.580 16.087 1.00 0.00 O ATOM 1316 CB ASP A 85 -1.211 2.407 17.226 1.00 0.00 C ATOM 1317 CG ASP A 85 -1.449 1.714 18.564 1.00 0.00 C ATOM 1318 OD1 ASP A 85 -2.575 1.815 19.112 1.00 0.00 O ATOM 1319 OD2 ASP A 85 -0.502 1.092 19.101 1.00 0.00 O ATOM 0 H ASP A 85 -0.622 1.063 15.175 1.00 0.00 H new ATOM 0 HA ASP A 85 -3.003 1.350 16.660 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -0.204 2.186 16.873 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -1.274 3.487 17.356 1.00 0.00 H new ATOM 1325 N PRO A 86 -2.302 3.919 14.618 1.00 0.00 N ATOM 1326 CA PRO A 86 -2.928 5.120 14.108 1.00 0.00 C ATOM 1327 C PRO A 86 -4.107 4.748 13.214 1.00 0.00 C ATOM 1328 O PRO A 86 -4.043 3.747 12.498 1.00 0.00 O ATOM 1329 CB PRO A 86 -1.847 5.886 13.355 1.00 0.00 C ATOM 1330 CG PRO A 86 -0.882 4.797 12.910 1.00 0.00 C ATOM 1331 CD PRO A 86 -1.006 3.727 13.996 1.00 0.00 C ATOM 0 HA PRO A 86 -3.332 5.745 14.904 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -2.259 6.429 12.504 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -1.356 6.620 13.994 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.149 4.403 11.929 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.138 5.174 12.835 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -0.926 2.728 13.567 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.206 3.824 14.729 1.00 0.00 H new ATOM 1339 N PRO A 87 -5.178 5.552 13.207 1.00 0.00 N ATOM 1340 CA PRO A 87 -6.226 5.434 12.214 1.00 0.00 C ATOM 1341 C PRO A 87 -5.659 5.817 10.844 1.00 0.00 C ATOM 1342 O PRO A 87 -4.847 6.744 10.719 1.00 0.00 O ATOM 1343 CB PRO A 87 -7.339 6.370 12.682 1.00 0.00 C ATOM 1344 CG PRO A 87 -6.614 7.419 13.520 1.00 0.00 C ATOM 1345 CD PRO A 87 -5.376 6.705 14.059 1.00 0.00 C ATOM 0 HA PRO A 87 -6.617 4.422 12.110 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -7.860 6.824 11.839 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -8.087 5.838 13.269 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.340 8.285 12.918 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -7.245 7.782 14.331 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -4.506 7.361 14.036 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -5.520 6.403 15.096 1.00 0.00 H new ATOM 1353 N TRP A 88 -6.101 5.093 9.820 1.00 0.00 N ATOM 1354 CA TRP A 88 -5.771 5.304 8.422 1.00 0.00 C ATOM 1355 C TRP A 88 -6.286 6.686 7.988 1.00 0.00 C ATOM 1356 O TRP A 88 -5.514 7.642 8.071 1.00 0.00 O ATOM 1357 CB TRP A 88 -6.255 4.078 7.629 1.00 0.00 C ATOM 1358 CG TRP A 88 -6.636 4.302 6.208 1.00 0.00 C ATOM 1359 CD1 TRP A 88 -5.842 4.744 5.210 1.00 0.00 C ATOM 1360 CD2 TRP A 88 -7.973 4.212 5.653 1.00 0.00 C ATOM 1361 NE1 TRP A 88 -6.591 4.868 4.057 1.00 0.00 N ATOM 1362 CE2 TRP A 88 -7.925 4.631 4.296 1.00 0.00 C ATOM 1363 CE3 TRP A 88 -9.229 3.895 6.202 1.00 0.00 C ATOM 1364 CZ2 TRP A 88 -9.084 4.749 3.519 1.00 0.00 C ATOM 1365 CZ3 TRP A 88 -10.397 3.989 5.425 1.00 0.00 C ATOM 1366 CH2 TRP A 88 -10.321 4.423 4.089 1.00 0.00 C ATOM 0 H TRP A 88 -6.732 4.303 9.955 1.00 0.00 H new ATOM 0 HA TRP A 88 -4.701 5.357 8.221 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -5.467 3.325 7.654 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -7.116 3.656 8.148 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -4.789 4.965 5.299 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -6.204 5.105 3.143 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -9.297 3.576 7.232 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -9.025 5.087 2.495 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -11.353 3.728 5.854 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -11.222 4.505 3.499 1.00 0.00 H new ATOM 1377 N THR A 89 -7.535 6.803 7.521 1.00 0.00 N ATOM 1378 CA THR A 89 -8.509 7.906 7.542 1.00 0.00 C ATOM 1379 C THR A 89 -9.493 7.626 6.380 1.00 0.00 C ATOM 1380 O THR A 89 -9.037 7.465 5.251 1.00 0.00 O ATOM 1381 CB THR A 89 -7.893 9.323 7.467 1.00 0.00 C ATOM 1382 OG1 THR A 89 -7.056 9.613 8.565 1.00 0.00 O ATOM 1383 CG2 THR A 89 -8.955 10.423 7.479 1.00 0.00 C ATOM 0 H THR A 89 -7.949 6.001 7.046 1.00 0.00 H new ATOM 0 HA THR A 89 -9.013 7.923 8.508 1.00 0.00 H new ATOM 0 HB THR A 89 -7.333 9.313 6.532 1.00 0.00 H new ATOM 0 HG1 THR A 89 -6.214 9.120 8.474 1.00 0.00 H new ATOM 0 HG21 THR A 89 -8.470 11.398 7.425 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.617 10.299 6.622 1.00 0.00 H new ATOM 0 HG23 THR A 89 -9.536 10.358 8.399 1.00 0.00 H new ATOM 1391 N PRO A 90 -10.826 7.627 6.548 1.00 0.00 N ATOM 1392 CA PRO A 90 -11.741 7.287 5.453 1.00 0.00 C ATOM 1393 C PRO A 90 -11.631 8.220 4.247 1.00 0.00 C ATOM 1394 O PRO A 90 -11.827 7.766 3.119 1.00 0.00 O ATOM 1395 CB PRO A 90 -13.141 7.257 6.070 1.00 0.00 C ATOM 1396 CG PRO A 90 -13.008 8.106 7.332 1.00 0.00 C ATOM 1397 CD PRO A 90 -11.565 7.869 7.771 1.00 0.00 C ATOM 0 HA PRO A 90 -11.483 6.317 5.028 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.886 7.669 5.389 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.452 6.239 6.305 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -13.198 9.160 7.128 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -13.717 7.797 8.100 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -11.170 8.733 8.305 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -11.495 7.017 8.448 1.00 0.00 H new ATOM 1405 N GLU A 91 -11.283 9.496 4.435 1.00 0.00 N ATOM 1406 CA GLU A 91 -11.165 10.468 3.344 1.00 0.00 C ATOM 1407 C GLU A 91 -10.035 10.152 2.356 1.00 0.00 C ATOM 1408 O GLU A 91 -9.962 10.794 1.311 1.00 0.00 O ATOM 1409 CB GLU A 91 -11.041 11.899 3.888 1.00 0.00 C ATOM 1410 CG GLU A 91 -9.604 12.248 4.296 1.00 0.00 C ATOM 1411 CD GLU A 91 -9.531 13.509 5.151 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -8.756 14.441 4.805 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -10.251 13.597 6.165 1.00 0.00 O ATOM 0 H GLU A 91 -11.074 9.886 5.354 1.00 0.00 H new ATOM 0 HA GLU A 91 -12.090 10.389 2.773 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -11.382 12.604 3.129 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -11.699 12.015 4.749 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -9.173 11.413 4.848 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -8.998 12.384 3.400 1.00 0.00 H new ATOM 1421 N ARG A 92 -9.133 9.213 2.671 1.00 0.00 N ATOM 1422 CA ARG A 92 -7.962 8.921 1.839 1.00 0.00 C ATOM 1423 C ARG A 92 -8.367 8.294 0.499 1.00 0.00 C ATOM 1424 O ARG A 92 -7.597 8.354 -0.458 1.00 0.00 O ATOM 1425 CB ARG A 92 -7.018 7.965 2.586 1.00 0.00 C ATOM 1426 CG ARG A 92 -6.576 8.403 3.997 1.00 0.00 C ATOM 1427 CD ARG A 92 -5.168 9.004 4.109 1.00 0.00 C ATOM 1428 NE ARG A 92 -5.231 10.441 4.426 1.00 0.00 N ATOM 1429 CZ ARG A 92 -5.312 11.455 3.564 1.00 0.00 C ATOM 1430 NH1 ARG A 92 -5.220 11.235 2.264 1.00 0.00 N ATOM 1431 NH2 ARG A 92 -5.509 12.691 3.990 1.00 0.00 N ATOM 0 H ARG A 92 -9.196 8.636 3.510 1.00 0.00 H new ATOM 0 HA ARG A 92 -7.453 9.863 1.635 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.508 6.995 2.667 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.125 7.821 1.977 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.292 9.136 4.368 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -6.633 7.538 4.658 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.606 8.481 4.883 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -4.631 8.858 3.172 1.00 0.00 H new ATOM 0 HE ARG A 92 -5.210 10.688 5.415 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -5.086 10.286 1.916 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -5.283 12.015 1.609 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -5.601 12.878 4.989 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -5.569 13.458 3.320 1.00 0.00 H new ATOM 1445 N MET A 93 -9.556 7.694 0.426 1.00 0.00 N ATOM 1446 CA MET A 93 -10.121 7.159 -0.805 1.00 0.00 C ATOM 1447 C MET A 93 -10.368 8.289 -1.820 1.00 0.00 C ATOM 1448 O MET A 93 -10.446 9.468 -1.459 1.00 0.00 O ATOM 1449 CB MET A 93 -11.422 6.412 -0.473 1.00 0.00 C ATOM 1450 CG MET A 93 -11.205 5.189 0.426 1.00 0.00 C ATOM 1451 SD MET A 93 -12.599 4.024 0.516 1.00 0.00 S ATOM 1452 CE MET A 93 -13.896 5.018 1.316 1.00 0.00 C ATOM 0 H MET A 93 -10.161 7.566 1.237 1.00 0.00 H new ATOM 0 HA MET A 93 -9.419 6.461 -1.261 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.112 7.098 0.019 1.00 0.00 H new ATOM 0 HB3 MET A 93 -11.897 6.093 -1.401 1.00 0.00 H new ATOM 0 HG2 MET A 93 -10.327 4.650 0.071 1.00 0.00 H new ATOM 0 HG3 MET A 93 -10.979 5.537 1.434 1.00 0.00 H new ATOM 0 HE1 MET A 93 -14.799 4.417 1.427 1.00 0.00 H new ATOM 0 HE2 MET A 93 -13.552 5.342 2.298 1.00 0.00 H new ATOM 0 HE3 MET A 93 -14.115 5.892 0.702 1.00 0.00 H new ATOM 1462 N SER A 94 -10.512 7.926 -3.096 1.00 0.00 N ATOM 1463 CA SER A 94 -10.657 8.860 -4.210 1.00 0.00 C ATOM 1464 C SER A 94 -11.855 9.798 -4.036 1.00 0.00 C ATOM 1465 O SER A 94 -12.873 9.368 -3.490 1.00 0.00 O ATOM 1466 CB SER A 94 -10.861 8.070 -5.503 1.00 0.00 C ATOM 1467 OG SER A 94 -10.039 6.918 -5.554 1.00 0.00 O ATOM 0 H SER A 94 -10.531 6.949 -3.389 1.00 0.00 H new ATOM 0 HA SER A 94 -9.750 9.464 -4.244 1.00 0.00 H new ATOM 0 HB2 SER A 94 -11.907 7.774 -5.586 1.00 0.00 H new ATOM 0 HB3 SER A 94 -10.642 8.710 -6.358 1.00 0.00 H new ATOM 0 HG SER A 94 -10.199 6.439 -6.394 1.00 0.00 H new ATOM 1473 N PRO A 95 -11.824 11.008 -4.616 1.00 0.00 N ATOM 1474 CA PRO A 95 -12.946 11.940 -4.572 1.00 0.00 C ATOM 1475 C PRO A 95 -14.210 11.330 -5.186 1.00 0.00 C ATOM 1476 O PRO A 95 -15.290 11.420 -4.606 1.00 0.00 O ATOM 1477 CB PRO A 95 -12.443 13.206 -5.259 1.00 0.00 C ATOM 1478 CG PRO A 95 -11.345 12.710 -6.193 1.00 0.00 C ATOM 1479 CD PRO A 95 -10.727 11.572 -5.393 1.00 0.00 C ATOM 0 HA PRO A 95 -13.261 12.179 -3.556 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -13.240 13.704 -5.810 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -12.057 13.925 -4.537 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -11.747 12.366 -7.146 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.618 13.491 -6.417 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -10.285 10.823 -6.051 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -9.931 11.935 -4.743 1.00 0.00 H new ATOM 1487 N GLU A 96 -14.076 10.588 -6.288 1.00 0.00 N ATOM 1488 CA GLU A 96 -15.218 9.901 -6.890 1.00 0.00 C ATOM 1489 C GLU A 96 -15.686 8.736 -6.021 1.00 0.00 C ATOM 1490 O GLU A 96 -16.877 8.438 -5.992 1.00 0.00 O ATOM 1491 CB GLU A 96 -14.848 9.416 -8.299 1.00 0.00 C ATOM 1492 CG GLU A 96 -15.240 10.468 -9.342 1.00 0.00 C ATOM 1493 CD GLU A 96 -14.356 10.453 -10.588 1.00 0.00 C ATOM 1494 OE1 GLU A 96 -14.000 11.547 -11.064 1.00 0.00 O ATOM 1495 OE2 GLU A 96 -13.957 9.367 -11.080 1.00 0.00 O ATOM 0 H GLU A 96 -13.193 10.449 -6.778 1.00 0.00 H new ATOM 0 HA GLU A 96 -16.046 10.606 -6.963 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -13.777 9.220 -8.354 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -15.356 8.475 -8.512 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -16.276 10.304 -9.640 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -15.192 11.456 -8.885 1.00 0.00 H new ATOM 1503 N LEU A 97 -14.784 8.100 -5.265 1.00 0.00 N ATOM 1504 CA LEU A 97 -15.184 7.056 -4.336 1.00 0.00 C ATOM 1505 C LEU A 97 -15.988 7.639 -3.183 1.00 0.00 C ATOM 1506 O LEU A 97 -16.881 6.944 -2.701 1.00 0.00 O ATOM 1507 CB LEU A 97 -14.000 6.232 -3.796 1.00 0.00 C ATOM 1508 CG LEU A 97 -13.566 5.062 -4.694 1.00 0.00 C ATOM 1509 CD1 LEU A 97 -12.332 4.405 -4.069 1.00 0.00 C ATOM 1510 CD2 LEU A 97 -14.673 4.021 -4.857 1.00 0.00 C ATOM 0 H LEU A 97 -13.783 8.293 -5.283 1.00 0.00 H new ATOM 0 HA LEU A 97 -15.810 6.369 -4.905 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -13.148 6.897 -3.653 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -14.266 5.839 -2.815 1.00 0.00 H new ATOM 0 HG LEU A 97 -13.341 5.453 -5.686 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -12.009 3.571 -4.692 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -11.528 5.137 -3.996 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -12.580 4.038 -3.073 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -14.321 3.213 -5.499 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -14.940 3.618 -3.880 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -15.548 4.488 -5.308 1.00 0.00 H new ATOM 1522 N ARG A 98 -15.769 8.898 -2.752 1.00 0.00 N ATOM 1523 CA ARG A 98 -16.638 9.488 -1.730 1.00 0.00 C ATOM 1524 C ARG A 98 -18.068 9.647 -2.278 1.00 0.00 C ATOM 1525 O ARG A 98 -18.959 9.951 -1.494 1.00 0.00 O ATOM 1526 CB ARG A 98 -16.167 10.898 -1.300 1.00 0.00 C ATOM 1527 CG ARG A 98 -14.966 11.050 -0.360 1.00 0.00 C ATOM 1528 CD ARG A 98 -13.612 10.792 -1.025 1.00 0.00 C ATOM 1529 NE ARG A 98 -12.462 11.421 -0.353 1.00 0.00 N ATOM 1530 CZ ARG A 98 -12.155 12.725 -0.315 1.00 0.00 C ATOM 1531 NH1 ARG A 98 -12.918 13.644 -0.885 1.00 0.00 N ATOM 1532 NH2 ARG A 98 -11.051 13.124 0.303 1.00 0.00 N ATOM 0 H ARG A 98 -15.021 9.505 -3.087 1.00 0.00 H new ATOM 0 HA ARG A 98 -16.603 8.813 -0.875 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -15.940 11.455 -2.209 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -17.015 11.393 -0.826 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -14.968 12.058 0.054 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -15.084 10.361 0.477 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -13.444 9.716 -1.069 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -13.654 11.151 -2.053 1.00 0.00 H new ATOM 0 HE ARG A 98 -11.827 10.793 0.139 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -13.770 13.368 -1.373 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -12.654 14.628 -0.836 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -10.439 12.439 0.747 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -10.814 14.116 0.334 1.00 0.00 H new ATOM 1546 N GLU A 99 -18.292 9.549 -3.592 1.00 0.00 N ATOM 1547 CA GLU A 99 -19.610 9.544 -4.230 1.00 0.00 C ATOM 1548 C GLU A 99 -20.060 8.138 -4.656 1.00 0.00 C ATOM 1549 O GLU A 99 -21.162 7.966 -5.180 1.00 0.00 O ATOM 1550 CB GLU A 99 -19.582 10.460 -5.465 1.00 0.00 C ATOM 1551 CG GLU A 99 -20.055 11.877 -5.126 1.00 0.00 C ATOM 1552 CD GLU A 99 -20.491 12.639 -6.383 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -21.150 12.046 -7.263 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -20.137 13.830 -6.557 1.00 0.00 O ATOM 0 H GLU A 99 -17.530 9.468 -4.265 1.00 0.00 H new ATOM 0 HA GLU A 99 -20.326 9.906 -3.492 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -18.569 10.500 -5.866 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -20.218 10.040 -6.245 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -20.887 11.826 -4.423 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -19.251 12.421 -4.630 1.00 0.00 H new ATOM 1562 N LYS A 100 -19.228 7.115 -4.490 1.00 0.00 N ATOM 1563 CA LYS A 100 -19.692 5.727 -4.520 1.00 0.00 C ATOM 1564 C LYS A 100 -20.170 5.379 -3.123 1.00 0.00 C ATOM 1565 O LYS A 100 -21.299 4.929 -2.949 1.00 0.00 O ATOM 1566 CB LYS A 100 -18.584 4.782 -5.005 1.00 0.00 C ATOM 1567 CG LYS A 100 -19.121 3.345 -5.132 1.00 0.00 C ATOM 1568 CD LYS A 100 -18.022 2.353 -5.533 1.00 0.00 C ATOM 1569 CE LYS A 100 -18.052 1.863 -6.986 1.00 0.00 C ATOM 1570 NZ LYS A 100 -18.100 2.921 -8.016 1.00 0.00 N ATOM 0 H LYS A 100 -18.226 7.219 -4.333 1.00 0.00 H new ATOM 0 HA LYS A 100 -20.512 5.610 -5.229 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -18.204 5.121 -5.969 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -17.747 4.804 -4.307 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -19.559 3.037 -4.183 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -19.919 3.321 -5.874 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -17.055 2.820 -5.348 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -18.087 1.485 -4.877 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -17.168 1.250 -7.162 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -18.920 1.216 -7.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -18.117 2.486 -8.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -18.957 3.496 -7.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -17.260 3.528 -7.930 1.00 0.00 H new ATOM 1584 N PHE A 101 -19.284 5.525 -2.146 1.00 0.00 N ATOM 1585 CA PHE A 101 -19.508 5.110 -0.782 1.00 0.00 C ATOM 1586 C PHE A 101 -20.200 6.221 -0.005 1.00 0.00 C ATOM 1587 O PHE A 101 -20.073 7.403 -0.318 1.00 0.00 O ATOM 1588 CB PHE A 101 -18.150 4.715 -0.195 1.00 0.00 C ATOM 1589 CG PHE A 101 -17.496 3.532 -0.894 1.00 0.00 C ATOM 1590 CD1 PHE A 101 -18.251 2.426 -1.341 1.00 0.00 C ATOM 1591 CD2 PHE A 101 -16.105 3.540 -1.103 1.00 0.00 C ATOM 1592 CE1 PHE A 101 -17.622 1.344 -1.977 1.00 0.00 C ATOM 1593 CE2 PHE A 101 -15.470 2.441 -1.702 1.00 0.00 C ATOM 1594 CZ PHE A 101 -16.231 1.349 -2.154 1.00 0.00 C ATOM 0 H PHE A 101 -18.367 5.948 -2.293 1.00 0.00 H new ATOM 0 HA PHE A 101 -20.174 4.249 -0.724 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -17.479 5.572 -0.249 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -18.277 4.475 0.861 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -19.321 2.412 -1.193 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -15.522 4.397 -0.801 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -18.209 0.509 -2.330 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -14.396 2.434 -1.816 1.00 0.00 H new ATOM 0 HZ PHE A 101 -15.745 0.514 -2.637 1.00 0.00 H new ATOM 1604 N GLY A 102 -20.909 5.827 1.048 1.00 0.00 N ATOM 1605 CA GLY A 102 -21.748 6.702 1.852 1.00 0.00 C ATOM 1606 C GLY A 102 -20.961 7.077 3.090 1.00 0.00 C ATOM 1607 O GLY A 102 -21.414 6.818 4.206 1.00 0.00 O ATOM 0 H GLY A 102 -20.914 4.860 1.373 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -22.023 7.593 1.288 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -22.675 6.199 2.125 1.00 0.00 H new ATOM 1611 N VAL A 103 -19.747 7.571 2.870 1.00 0.00 N ATOM 1612 CA VAL A 103 -18.754 7.823 3.896 1.00 0.00 C ATOM 1613 C VAL A 103 -19.339 8.814 4.887 1.00 0.00 C ATOM 1614 O VAL A 103 -19.379 8.475 6.086 1.00 0.00 O ATOM 1615 CB VAL A 103 -17.443 8.287 3.232 1.00 0.00 C ATOM 1616 CG1 VAL A 103 -16.323 8.355 4.269 1.00 0.00 C ATOM 1617 CG2 VAL A 103 -17.004 7.321 2.114 1.00 0.00 C ATOM 0 H VAL A 103 -19.420 7.814 1.935 1.00 0.00 H new ATOM 0 HA VAL A 103 -18.501 6.923 4.457 1.00 0.00 H new ATOM 0 HB VAL A 103 -17.629 9.272 2.804 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -15.402 8.684 3.788 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -16.596 9.061 5.053 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -16.172 7.368 4.706 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -16.076 7.679 1.668 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -16.845 6.327 2.533 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -17.779 7.273 1.350 1.00 0.00 H new TER 1627 VAL A 103