USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 748 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 1 MET N :NH3+ -155:sc= 0.0195 (180deg=0) USER MOD Set 1.2: B 35 ASN : amide:sc= 0.0208 K(o=0.04,f=-2.8!) USER MOD Set 2.1: A 7 LYS NZ :NH3+ 154:sc= 0.533 (180deg=0) USER MOD Set 2.2: B 29 GLN : amide:sc= 0.469 K(o=1,f=-3.4) USER MOD Set 3.1: B 13 ASN : amide:sc= 0.163 K(o=0.16,f=1.2) USER MOD Set 3.2: B 19 THR OG1 : rot 180:sc=-0.00309 USER MOD Set 4.1: B 11 SER OG : rot -101:sc= 0.0311 USER MOD Set 4.2: B 21 THR OG1 : rot 180:sc= 0.0299 USER MOD Set 5.1: A 13 ASN : amide:sc= 0 K(o=0,f=1.1) USER MOD Set 5.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 11 SER OG : rot -100:sc= -0.0828 USER MOD Set 6.2: A 21 THR OG1 : rot -26:sc= 0.0128 USER MOD Single : A 1 MET CE :methyl -173:sc= -0.244 (180deg=-0.397) USER MOD Single : A 5 THR OG1 : rot 120:sc= 0.246 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.192 K(o=-0.19,f=-1.4) USER MOD Single : A 29 GLN : amide:sc= -0.67 K(o=-0.67,f=-3.5!) USER MOD Single : A 35 ASN : amide:sc= 0.318 K(o=0.32,f=-0.33) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.774 K(o=-0.77,f=-0.12) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -177:sc= -0.577 (180deg=-0.588) USER MOD Single : B 1 MET N :NH3+ 138:sc= 0.0244 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 120:sc= 0.225 USER MOD Single : B 7 LYS NZ :NH3+ -160:sc= -0.034 (180deg=-0.378) USER MOD Single : B 26 SER OG : rot 180:sc= 0 USER MOD Single : B 28 GLN : amide:sc= -0.274 X(o=-0.27,f=-0.53) USER MOD Single : B 38 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.108) USER MOD Single : B 43 HIS : no HD1:sc= -0.955 K(o=-0.95,f=-0.24) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.297 -2.288 -6.645 1.00 0.00 N ATOM 2 CA MET A 1 22.257 -1.481 -7.311 1.00 0.00 C ATOM 3 C MET A 1 22.893 -0.438 -8.217 1.00 0.00 C ATOM 4 O MET A 1 23.949 0.096 -7.888 1.00 0.00 O ATOM 5 CB MET A 1 21.354 -0.821 -6.265 1.00 0.00 C ATOM 6 CG MET A 1 20.185 -0.074 -6.901 1.00 0.00 C ATOM 7 SD MET A 1 18.809 0.239 -5.761 1.00 0.00 S ATOM 8 CE MET A 1 19.634 1.272 -4.523 1.00 0.00 C ATOM 0 H1 MET A 1 22.905 -3.216 -6.388 1.00 0.00 H new ATOM 0 H2 MET A 1 24.101 -2.419 -7.291 1.00 0.00 H new ATOM 0 H3 MET A 1 23.619 -1.798 -5.786 1.00 0.00 H new ATOM 0 HA MET A 1 21.644 -2.136 -7.930 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.970 -1.583 -5.586 1.00 0.00 H new ATOM 0 HB3 MET A 1 21.943 -0.127 -5.665 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.544 0.878 -7.292 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.817 -0.650 -7.750 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.957 1.448 -3.687 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.530 0.765 -4.165 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.912 2.226 -4.972 1.00 0.00 H new ATOM 20 N LEU A 2 22.253 -0.147 -9.355 1.00 0.00 N ATOM 21 CA LEU A 2 22.717 0.859 -10.296 1.00 0.00 C ATOM 22 C LEU A 2 21.778 2.060 -10.236 1.00 0.00 C ATOM 23 O LEU A 2 20.736 2.084 -10.890 1.00 0.00 O ATOM 24 CB LEU A 2 22.771 0.268 -11.714 1.00 0.00 C ATOM 25 CG LEU A 2 23.834 0.907 -12.621 1.00 0.00 C ATOM 26 CD1 LEU A 2 23.393 0.868 -14.073 1.00 0.00 C ATOM 27 CD2 LEU A 2 24.187 2.350 -12.288 1.00 0.00 C ATOM 0 H LEU A 2 21.392 -0.611 -9.644 1.00 0.00 H new ATOM 0 HA LEU A 2 23.724 1.183 -10.032 1.00 0.00 H new ATOM 0 HB2 LEU A 2 22.966 -0.802 -11.643 1.00 0.00 H new ATOM 0 HB3 LEU A 2 21.793 0.384 -12.181 1.00 0.00 H new ATOM 0 HG LEU A 2 24.726 0.305 -12.446 1.00 0.00 H new ATOM 0 HD11 LEU A 2 24.160 1.325 -14.699 1.00 0.00 H new ATOM 0 HD12 LEU A 2 23.244 -0.167 -14.380 1.00 0.00 H new ATOM 0 HD13 LEU A 2 22.458 1.418 -14.184 1.00 0.00 H new ATOM 0 HD21 LEU A 2 24.945 2.709 -12.984 1.00 0.00 H new ATOM 0 HD22 LEU A 2 23.295 2.971 -12.370 1.00 0.00 H new ATOM 0 HD23 LEU A 2 24.574 2.404 -11.271 1.00 0.00 H new ATOM 39 N ILE A 3 22.147 3.065 -9.444 1.00 0.00 N ATOM 40 CA ILE A 3 21.349 4.265 -9.275 1.00 0.00 C ATOM 41 C ILE A 3 21.568 5.183 -10.473 1.00 0.00 C ATOM 42 O ILE A 3 22.678 5.275 -10.992 1.00 0.00 O ATOM 43 CB ILE A 3 21.748 4.963 -7.967 1.00 0.00 C ATOM 44 CG1 ILE A 3 21.380 4.117 -6.740 1.00 0.00 C ATOM 45 CG2 ILE A 3 21.005 6.293 -7.839 1.00 0.00 C ATOM 46 CD1 ILE A 3 22.389 3.017 -6.419 1.00 0.00 C ATOM 0 H ILE A 3 23.011 3.064 -8.902 1.00 0.00 H new ATOM 0 HA ILE A 3 20.291 4.010 -9.219 1.00 0.00 H new ATOM 0 HB ILE A 3 22.827 5.112 -8.001 1.00 0.00 H new ATOM 0 HG12 ILE A 3 21.285 4.773 -5.874 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.403 3.663 -6.904 1.00 0.00 H new ATOM 0 HG21 ILE A 3 21.293 6.783 -6.909 1.00 0.00 H new ATOM 0 HG22 ILE A 3 21.261 6.935 -8.682 1.00 0.00 H new ATOM 0 HG23 ILE A 3 19.930 6.111 -7.835 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.058 2.465 -5.540 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.467 2.336 -7.267 1.00 0.00 H new ATOM 0 HD13 ILE A 3 23.363 3.464 -6.221 1.00 0.00 H new ATOM 58 N LEU A 4 20.507 5.865 -10.909 1.00 0.00 N ATOM 59 CA LEU A 4 20.556 6.835 -11.994 1.00 0.00 C ATOM 60 C LEU A 4 19.606 7.985 -11.655 1.00 0.00 C ATOM 61 O LEU A 4 18.767 7.843 -10.767 1.00 0.00 O ATOM 62 CB LEU A 4 20.119 6.172 -13.307 1.00 0.00 C ATOM 63 CG LEU A 4 21.065 5.063 -13.779 1.00 0.00 C ATOM 64 CD1 LEU A 4 20.454 4.364 -14.990 1.00 0.00 C ATOM 65 CD2 LEU A 4 22.415 5.630 -14.215 1.00 0.00 C ATOM 0 H LEU A 4 19.576 5.754 -10.508 1.00 0.00 H new ATOM 0 HA LEU A 4 21.572 7.210 -12.114 1.00 0.00 H new ATOM 0 HB2 LEU A 4 19.120 5.756 -13.179 1.00 0.00 H new ATOM 0 HB3 LEU A 4 20.050 6.934 -14.083 1.00 0.00 H new ATOM 0 HG LEU A 4 21.210 4.375 -12.946 1.00 0.00 H new ATOM 0 HD11 LEU A 4 21.123 3.574 -15.330 1.00 0.00 H new ATOM 0 HD12 LEU A 4 19.493 3.931 -14.714 1.00 0.00 H new ATOM 0 HD13 LEU A 4 20.309 5.087 -15.793 1.00 0.00 H new ATOM 0 HD21 LEU A 4 23.062 4.817 -14.544 1.00 0.00 H new ATOM 0 HD22 LEU A 4 22.267 6.331 -15.037 1.00 0.00 H new ATOM 0 HD23 LEU A 4 22.880 6.147 -13.376 1.00 0.00 H new ATOM 77 N THR A 5 19.728 9.118 -12.351 1.00 0.00 N ATOM 78 CA THR A 5 18.852 10.268 -12.135 1.00 0.00 C ATOM 79 C THR A 5 18.292 10.746 -13.472 1.00 0.00 C ATOM 80 O THR A 5 18.867 11.620 -14.118 1.00 0.00 O ATOM 81 CB THR A 5 19.604 11.375 -11.387 1.00 0.00 C ATOM 82 OG1 THR A 5 20.091 10.878 -10.160 1.00 0.00 O ATOM 83 CG2 THR A 5 18.687 12.553 -11.078 1.00 0.00 C ATOM 0 H THR A 5 20.432 9.262 -13.075 1.00 0.00 H new ATOM 0 HA THR A 5 18.008 9.978 -11.509 1.00 0.00 H new ATOM 0 HB THR A 5 20.422 11.705 -12.027 1.00 0.00 H new ATOM 0 HG1 THR A 5 21.068 10.955 -10.140 1.00 0.00 H new ATOM 0 HG21 THR A 5 19.249 13.322 -10.547 1.00 0.00 H new ATOM 0 HG22 THR A 5 18.298 12.965 -12.009 1.00 0.00 H new ATOM 0 HG23 THR A 5 17.858 12.215 -10.456 1.00 0.00 H new ATOM 91 N ARG A 6 17.163 10.168 -13.890 1.00 0.00 N ATOM 92 CA ARG A 6 16.544 10.455 -15.179 1.00 0.00 C ATOM 93 C ARG A 6 15.610 11.657 -15.087 1.00 0.00 C ATOM 94 O ARG A 6 15.205 12.042 -13.994 1.00 0.00 O ATOM 95 CB ARG A 6 15.732 9.228 -15.612 1.00 0.00 C ATOM 96 CG ARG A 6 16.639 8.051 -15.984 1.00 0.00 C ATOM 97 CD ARG A 6 16.924 8.026 -17.488 1.00 0.00 C ATOM 98 NE ARG A 6 17.488 9.290 -17.970 1.00 0.00 N ATOM 99 CZ ARG A 6 18.781 9.617 -17.965 1.00 0.00 C ATOM 100 NH1 ARG A 6 19.696 8.803 -17.445 1.00 0.00 N ATOM 101 NH2 ARG A 6 19.156 10.779 -18.488 1.00 0.00 N ATOM 0 H ARG A 6 16.651 9.482 -13.335 1.00 0.00 H new ATOM 0 HA ARG A 6 17.327 10.683 -15.902 1.00 0.00 H new ATOM 0 HB2 ARG A 6 15.063 8.931 -14.804 1.00 0.00 H new ATOM 0 HB3 ARG A 6 15.106 9.489 -16.465 1.00 0.00 H new ATOM 0 HG2 ARG A 6 17.578 8.124 -15.434 1.00 0.00 H new ATOM 0 HG3 ARG A 6 16.166 7.115 -15.685 1.00 0.00 H new ATOM 0 HD2 ARG A 6 17.616 7.214 -17.711 1.00 0.00 H new ATOM 0 HD3 ARG A 6 16.000 7.814 -18.027 1.00 0.00 H new ATOM 0 HE ARG A 6 16.835 9.980 -18.342 1.00 0.00 H new ATOM 0 HH11 ARG A 6 19.413 7.910 -17.040 1.00 0.00 H new ATOM 0 HH12 ARG A 6 20.680 9.072 -17.451 1.00 0.00 H new ATOM 0 HH21 ARG A 6 18.459 11.408 -18.886 1.00 0.00 H new ATOM 0 HH22 ARG A 6 20.141 11.043 -18.491 1.00 0.00 H new ATOM 115 N LYS A 7 15.268 12.251 -16.235 1.00 0.00 N ATOM 116 CA LYS A 7 14.244 13.286 -16.308 1.00 0.00 C ATOM 117 C LYS A 7 12.907 12.625 -16.637 1.00 0.00 C ATOM 118 O LYS A 7 12.874 11.508 -17.151 1.00 0.00 O ATOM 119 CB LYS A 7 14.571 14.305 -17.407 1.00 0.00 C ATOM 120 CG LYS A 7 15.683 15.297 -17.050 1.00 0.00 C ATOM 121 CD LYS A 7 17.072 14.660 -17.010 1.00 0.00 C ATOM 122 CE LYS A 7 18.117 15.773 -16.937 1.00 0.00 C ATOM 123 NZ LYS A 7 19.480 15.224 -16.822 1.00 0.00 N ATOM 0 H LYS A 7 15.694 12.026 -17.134 1.00 0.00 H new ATOM 0 HA LYS A 7 14.200 13.805 -15.351 1.00 0.00 H new ATOM 0 HB2 LYS A 7 14.860 13.766 -18.309 1.00 0.00 H new ATOM 0 HB3 LYS A 7 13.666 14.864 -17.646 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.684 16.108 -17.778 1.00 0.00 H new ATOM 0 HG3 LYS A 7 15.466 15.741 -16.078 1.00 0.00 H new ATOM 0 HD2 LYS A 7 17.161 14.000 -16.147 1.00 0.00 H new ATOM 0 HD3 LYS A 7 17.233 14.048 -17.897 1.00 0.00 H new ATOM 0 HE2 LYS A 7 18.049 16.397 -17.828 1.00 0.00 H new ATOM 0 HE3 LYS A 7 17.908 16.415 -16.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 20.163 15.908 -17.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 19.697 15.041 -15.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 19.543 14.335 -17.358 1.00 0.00 H new ATOM 137 N VAL A 8 11.801 13.310 -16.344 1.00 0.00 N ATOM 138 CA VAL A 8 10.468 12.847 -16.713 1.00 0.00 C ATOM 139 C VAL A 8 10.381 12.740 -18.232 1.00 0.00 C ATOM 140 O VAL A 8 10.731 13.679 -18.947 1.00 0.00 O ATOM 141 CB VAL A 8 9.436 13.844 -16.179 1.00 0.00 C ATOM 142 CG1 VAL A 8 8.043 13.515 -16.715 1.00 0.00 C ATOM 143 CG2 VAL A 8 9.424 13.793 -14.651 1.00 0.00 C ATOM 0 H VAL A 8 11.807 14.200 -15.845 1.00 0.00 H new ATOM 0 HA VAL A 8 10.268 11.866 -16.283 1.00 0.00 H new ATOM 0 HB VAL A 8 9.709 14.845 -16.513 1.00 0.00 H new ATOM 0 HG11 VAL A 8 7.324 14.235 -16.324 1.00 0.00 H new ATOM 0 HG12 VAL A 8 8.051 13.565 -17.804 1.00 0.00 H new ATOM 0 HG13 VAL A 8 7.760 12.511 -16.400 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.690 14.502 -14.269 1.00 0.00 H new ATOM 0 HG22 VAL A 8 9.162 12.787 -14.323 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.412 14.053 -14.271 1.00 0.00 H new ATOM 153 N GLY A 9 9.910 11.590 -18.723 1.00 0.00 N ATOM 154 CA GLY A 9 9.730 11.336 -20.144 1.00 0.00 C ATOM 155 C GLY A 9 10.883 10.532 -20.742 1.00 0.00 C ATOM 156 O GLY A 9 10.764 10.031 -21.858 1.00 0.00 O ATOM 0 H GLY A 9 9.641 10.803 -18.132 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.796 10.796 -20.298 1.00 0.00 H new ATOM 0 HA3 GLY A 9 9.641 12.286 -20.672 1.00 0.00 H new ATOM 160 N GLU A 10 11.998 10.403 -20.015 1.00 0.00 N ATOM 161 CA GLU A 10 13.117 9.575 -20.448 1.00 0.00 C ATOM 162 C GLU A 10 12.861 8.123 -20.041 1.00 0.00 C ATOM 163 O GLU A 10 11.800 7.806 -19.501 1.00 0.00 O ATOM 164 CB GLU A 10 14.424 10.092 -19.841 1.00 0.00 C ATOM 165 CG GLU A 10 14.711 11.512 -20.336 1.00 0.00 C ATOM 166 CD GLU A 10 16.098 11.981 -19.905 1.00 0.00 C ATOM 167 OE1 GLU A 10 16.471 11.696 -18.745 1.00 0.00 O ATOM 168 OE2 GLU A 10 16.775 12.622 -20.738 1.00 0.00 O ATOM 0 H GLU A 10 12.145 10.867 -19.119 1.00 0.00 H new ATOM 0 HA GLU A 10 13.209 9.624 -21.533 1.00 0.00 H new ATOM 0 HB2 GLU A 10 14.356 10.085 -18.753 1.00 0.00 H new ATOM 0 HB3 GLU A 10 15.247 9.431 -20.113 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.636 11.542 -21.423 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.956 12.195 -19.945 1.00 0.00 H new ATOM 175 N SER A 11 13.822 7.229 -20.293 1.00 0.00 N ATOM 176 CA SER A 11 13.646 5.827 -19.951 1.00 0.00 C ATOM 177 C SER A 11 14.963 5.137 -19.622 1.00 0.00 C ATOM 178 O SER A 11 16.043 5.716 -19.728 1.00 0.00 O ATOM 179 CB SER A 11 12.952 5.117 -21.112 1.00 0.00 C ATOM 180 OG SER A 11 12.611 3.793 -20.769 1.00 0.00 O ATOM 0 H SER A 11 14.717 7.454 -20.727 1.00 0.00 H new ATOM 0 HA SER A 11 13.032 5.773 -19.052 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.053 5.666 -21.392 1.00 0.00 H new ATOM 0 HB3 SER A 11 13.607 5.113 -21.983 1.00 0.00 H new ATOM 0 HG SER A 11 13.275 3.177 -21.143 1.00 0.00 H new ATOM 186 N ILE A 12 14.830 3.875 -19.217 1.00 0.00 N ATOM 187 CA ILE A 12 15.895 2.971 -18.836 1.00 0.00 C ATOM 188 C ILE A 12 15.617 1.629 -19.515 1.00 0.00 C ATOM 189 O ILE A 12 14.496 1.379 -19.956 1.00 0.00 O ATOM 190 CB ILE A 12 15.878 2.849 -17.304 1.00 0.00 C ATOM 191 CG1 ILE A 12 16.267 4.156 -16.601 1.00 0.00 C ATOM 192 CG2 ILE A 12 16.787 1.719 -16.833 1.00 0.00 C ATOM 193 CD1 ILE A 12 17.689 4.613 -16.929 1.00 0.00 C ATOM 0 H ILE A 12 13.912 3.436 -19.144 1.00 0.00 H new ATOM 0 HA ILE A 12 16.880 3.324 -19.143 1.00 0.00 H new ATOM 0 HB ILE A 12 14.848 2.621 -17.029 1.00 0.00 H new ATOM 0 HG12 ILE A 12 15.565 4.939 -16.888 1.00 0.00 H new ATOM 0 HG13 ILE A 12 16.174 4.024 -15.523 1.00 0.00 H new ATOM 0 HG21 ILE A 12 16.755 1.656 -15.745 1.00 0.00 H new ATOM 0 HG22 ILE A 12 16.447 0.776 -17.261 1.00 0.00 H new ATOM 0 HG23 ILE A 12 17.809 1.916 -17.155 1.00 0.00 H new ATOM 0 HD11 ILE A 12 17.903 5.542 -16.401 1.00 0.00 H new ATOM 0 HD12 ILE A 12 18.399 3.847 -16.617 1.00 0.00 H new ATOM 0 HD13 ILE A 12 17.780 4.776 -18.003 1.00 0.00 H new ATOM 205 N ASN A 13 16.622 0.754 -19.609 1.00 0.00 N ATOM 206 CA ASN A 13 16.448 -0.549 -20.225 1.00 0.00 C ATOM 207 C ASN A 13 17.135 -1.624 -19.386 1.00 0.00 C ATOM 208 O ASN A 13 18.155 -1.355 -18.754 1.00 0.00 O ATOM 209 CB ASN A 13 17.013 -0.492 -21.646 1.00 0.00 C ATOM 210 CG ASN A 13 16.405 -1.582 -22.512 1.00 0.00 C ATOM 211 OD1 ASN A 13 16.986 -2.648 -22.692 1.00 0.00 O ATOM 212 ND2 ASN A 13 15.221 -1.307 -23.052 1.00 0.00 N ATOM 0 H ASN A 13 17.565 0.932 -19.263 1.00 0.00 H new ATOM 0 HA ASN A 13 15.391 -0.809 -20.276 1.00 0.00 H new ATOM 0 HB2 ASN A 13 16.808 0.484 -22.085 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.097 -0.607 -21.616 1.00 0.00 H new ATOM 0 HD21 ASN A 13 14.758 -1.997 -23.644 1.00 0.00 H new ATOM 0 HD22 ASN A 13 14.776 -0.407 -22.874 1.00 0.00 H new ATOM 219 N ILE A 14 16.577 -2.840 -19.377 1.00 0.00 N ATOM 220 CA ILE A 14 17.096 -3.947 -18.583 1.00 0.00 C ATOM 221 C ILE A 14 16.927 -5.257 -19.350 1.00 0.00 C ATOM 222 O ILE A 14 15.958 -5.429 -20.086 1.00 0.00 O ATOM 223 CB ILE A 14 16.342 -4.034 -17.244 1.00 0.00 C ATOM 224 CG1 ILE A 14 16.364 -2.691 -16.500 1.00 0.00 C ATOM 225 CG2 ILE A 14 16.968 -5.125 -16.369 1.00 0.00 C ATOM 226 CD1 ILE A 14 15.531 -2.736 -15.217 1.00 0.00 C ATOM 0 H ILE A 14 15.750 -3.079 -19.924 1.00 0.00 H new ATOM 0 HA ILE A 14 18.155 -3.776 -18.387 1.00 0.00 H new ATOM 0 HB ILE A 14 15.302 -4.284 -17.455 1.00 0.00 H new ATOM 0 HG12 ILE A 14 17.393 -2.428 -16.256 1.00 0.00 H new ATOM 0 HG13 ILE A 14 15.982 -1.907 -17.154 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.432 -5.184 -15.422 1.00 0.00 H new ATOM 0 HG22 ILE A 14 16.904 -6.084 -16.882 1.00 0.00 H new ATOM 0 HG23 ILE A 14 18.014 -4.884 -16.179 1.00 0.00 H new ATOM 0 HD11 ILE A 14 15.573 -1.766 -14.721 1.00 0.00 H new ATOM 0 HD12 ILE A 14 14.496 -2.973 -15.463 1.00 0.00 H new ATOM 0 HD13 ILE A 14 15.930 -3.501 -14.551 1.00 0.00 H new ATOM 238 N GLY A 15 17.874 -6.184 -19.174 1.00 0.00 N ATOM 239 CA GLY A 15 17.789 -7.533 -19.720 1.00 0.00 C ATOM 240 C GLY A 15 17.655 -7.590 -21.243 1.00 0.00 C ATOM 241 O GLY A 15 17.416 -8.666 -21.786 1.00 0.00 O ATOM 0 H GLY A 15 18.728 -6.013 -18.643 1.00 0.00 H new ATOM 0 HA2 GLY A 15 18.679 -8.088 -19.425 1.00 0.00 H new ATOM 0 HA3 GLY A 15 16.934 -8.040 -19.273 1.00 0.00 H new ATOM 245 N ASP A 16 17.806 -6.451 -21.930 1.00 0.00 N ATOM 246 CA ASP A 16 17.666 -6.327 -23.377 1.00 0.00 C ATOM 247 C ASP A 16 16.252 -6.658 -23.880 1.00 0.00 C ATOM 248 O ASP A 16 16.020 -6.678 -25.088 1.00 0.00 O ATOM 249 CB ASP A 16 18.753 -7.156 -24.071 1.00 0.00 C ATOM 250 CG ASP A 16 18.851 -6.843 -25.564 1.00 0.00 C ATOM 251 OD1 ASP A 16 19.018 -5.647 -25.894 1.00 0.00 O ATOM 252 OD2 ASP A 16 18.759 -7.801 -26.364 1.00 0.00 O ATOM 0 H ASP A 16 18.036 -5.567 -21.476 1.00 0.00 H new ATOM 0 HA ASP A 16 17.809 -5.279 -23.641 1.00 0.00 H new ATOM 0 HB2 ASP A 16 19.715 -6.961 -23.597 1.00 0.00 H new ATOM 0 HB3 ASP A 16 18.540 -8.217 -23.937 1.00 0.00 H new ATOM 257 N ASP A 17 15.301 -6.919 -22.973 1.00 0.00 N ATOM 258 CA ASP A 17 13.915 -7.212 -23.332 1.00 0.00 C ATOM 259 C ASP A 17 12.932 -6.401 -22.490 1.00 0.00 C ATOM 260 O ASP A 17 11.721 -6.527 -22.670 1.00 0.00 O ATOM 261 CB ASP A 17 13.611 -8.701 -23.145 1.00 0.00 C ATOM 262 CG ASP A 17 14.510 -9.596 -23.995 1.00 0.00 C ATOM 263 OD1 ASP A 17 14.417 -9.495 -25.239 1.00 0.00 O ATOM 264 OD2 ASP A 17 15.283 -10.378 -23.397 1.00 0.00 O ATOM 0 H ASP A 17 15.476 -6.932 -21.968 1.00 0.00 H new ATOM 0 HA ASP A 17 13.794 -6.937 -24.380 1.00 0.00 H new ATOM 0 HB2 ASP A 17 13.733 -8.964 -22.094 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.569 -8.890 -23.402 1.00 0.00 H new ATOM 269 N ILE A 18 13.437 -5.568 -21.575 1.00 0.00 N ATOM 270 CA ILE A 18 12.597 -4.809 -20.661 1.00 0.00 C ATOM 271 C ILE A 18 12.960 -3.332 -20.741 1.00 0.00 C ATOM 272 O ILE A 18 14.131 -2.985 -20.876 1.00 0.00 O ATOM 273 CB ILE A 18 12.774 -5.353 -19.237 1.00 0.00 C ATOM 274 CG1 ILE A 18 12.410 -6.843 -19.200 1.00 0.00 C ATOM 275 CG2 ILE A 18 11.911 -4.557 -18.255 1.00 0.00 C ATOM 276 CD1 ILE A 18 12.683 -7.456 -17.828 1.00 0.00 C ATOM 0 H ILE A 18 14.436 -5.405 -21.452 1.00 0.00 H new ATOM 0 HA ILE A 18 11.548 -4.914 -20.939 1.00 0.00 H new ATOM 0 HB ILE A 18 13.817 -5.243 -18.939 1.00 0.00 H new ATOM 0 HG12 ILE A 18 11.357 -6.967 -19.451 1.00 0.00 H new ATOM 0 HG13 ILE A 18 12.983 -7.377 -19.958 1.00 0.00 H new ATOM 0 HG21 ILE A 18 12.046 -4.953 -17.248 1.00 0.00 H new ATOM 0 HG22 ILE A 18 12.209 -3.509 -18.275 1.00 0.00 H new ATOM 0 HG23 ILE A 18 10.863 -4.642 -18.541 1.00 0.00 H new ATOM 0 HD11 ILE A 18 12.413 -8.512 -17.841 1.00 0.00 H new ATOM 0 HD12 ILE A 18 13.742 -7.355 -17.589 1.00 0.00 H new ATOM 0 HD13 ILE A 18 12.090 -6.939 -17.074 1.00 0.00 H new ATOM 288 N THR A 19 11.950 -2.462 -20.656 1.00 0.00 N ATOM 289 CA THR A 19 12.135 -1.020 -20.728 1.00 0.00 C ATOM 290 C THR A 19 11.358 -0.358 -19.597 1.00 0.00 C ATOM 291 O THR A 19 10.197 -0.688 -19.365 1.00 0.00 O ATOM 292 CB THR A 19 11.661 -0.504 -22.089 1.00 0.00 C ATOM 293 OG1 THR A 19 12.256 -1.249 -23.128 1.00 0.00 O ATOM 294 CG2 THR A 19 12.036 0.962 -22.272 1.00 0.00 C ATOM 0 H THR A 19 10.978 -2.745 -20.535 1.00 0.00 H new ATOM 0 HA THR A 19 13.192 -0.776 -20.619 1.00 0.00 H new ATOM 0 HB THR A 19 10.577 -0.611 -22.125 1.00 0.00 H new ATOM 0 HG1 THR A 19 11.944 -0.911 -23.993 1.00 0.00 H new ATOM 0 HG21 THR A 19 11.689 1.307 -23.246 1.00 0.00 H new ATOM 0 HG22 THR A 19 11.568 1.558 -21.488 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.119 1.071 -22.213 1.00 0.00 H new ATOM 302 N ILE A 20 11.999 0.575 -18.893 1.00 0.00 N ATOM 303 CA ILE A 20 11.434 1.194 -17.700 1.00 0.00 C ATOM 304 C ILE A 20 11.368 2.709 -17.881 1.00 0.00 C ATOM 305 O ILE A 20 12.319 3.423 -17.560 1.00 0.00 O ATOM 306 CB ILE A 20 12.254 0.817 -16.456 1.00 0.00 C ATOM 307 CG1 ILE A 20 12.587 -0.681 -16.369 1.00 0.00 C ATOM 308 CG2 ILE A 20 11.492 1.257 -15.204 1.00 0.00 C ATOM 309 CD1 ILE A 20 11.352 -1.572 -16.241 1.00 0.00 C ATOM 0 H ILE A 20 12.927 0.922 -19.137 1.00 0.00 H new ATOM 0 HA ILE A 20 10.420 0.822 -17.553 1.00 0.00 H new ATOM 0 HB ILE A 20 13.210 1.335 -16.533 1.00 0.00 H new ATOM 0 HG12 ILE A 20 13.146 -0.973 -17.258 1.00 0.00 H new ATOM 0 HG13 ILE A 20 13.239 -0.851 -15.512 1.00 0.00 H new ATOM 0 HG21 ILE A 20 12.067 0.993 -14.316 1.00 0.00 H new ATOM 0 HG22 ILE A 20 11.341 2.336 -15.231 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.525 0.756 -15.172 1.00 0.00 H new ATOM 0 HD11 ILE A 20 11.661 -2.616 -16.184 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.804 -1.306 -15.337 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.709 -1.430 -17.110 1.00 0.00 H new ATOM 321 N THR A 21 10.240 3.205 -18.397 1.00 0.00 N ATOM 322 CA THR A 21 10.053 4.629 -18.639 1.00 0.00 C ATOM 323 C THR A 21 9.647 5.331 -17.344 1.00 0.00 C ATOM 324 O THR A 21 9.068 4.705 -16.456 1.00 0.00 O ATOM 325 CB THR A 21 8.971 4.811 -19.710 1.00 0.00 C ATOM 326 OG1 THR A 21 9.307 4.059 -20.856 1.00 0.00 O ATOM 327 CG2 THR A 21 8.835 6.271 -20.143 1.00 0.00 C ATOM 0 H THR A 21 9.438 2.630 -18.656 1.00 0.00 H new ATOM 0 HA THR A 21 10.986 5.071 -18.988 1.00 0.00 H new ATOM 0 HB THR A 21 8.030 4.477 -19.273 1.00 0.00 H new ATOM 0 HG1 THR A 21 10.279 3.941 -20.896 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.058 6.354 -20.903 1.00 0.00 H new ATOM 0 HG22 THR A 21 8.567 6.883 -19.281 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.783 6.618 -20.554 1.00 0.00 H new ATOM 335 N ILE A 22 9.946 6.629 -17.230 1.00 0.00 N ATOM 336 CA ILE A 22 9.554 7.450 -16.092 1.00 0.00 C ATOM 337 C ILE A 22 8.497 8.441 -16.575 1.00 0.00 C ATOM 338 O ILE A 22 8.812 9.471 -17.168 1.00 0.00 O ATOM 339 CB ILE A 22 10.788 8.103 -15.443 1.00 0.00 C ATOM 340 CG1 ILE A 22 10.405 9.189 -14.431 1.00 0.00 C ATOM 341 CG2 ILE A 22 11.740 8.709 -16.474 1.00 0.00 C ATOM 342 CD1 ILE A 22 9.585 8.611 -13.280 1.00 0.00 C ATOM 0 H ILE A 22 10.474 7.141 -17.937 1.00 0.00 H new ATOM 0 HA ILE A 22 9.109 6.851 -15.297 1.00 0.00 H new ATOM 0 HB ILE A 22 11.299 7.292 -14.924 1.00 0.00 H new ATOM 0 HG12 ILE A 22 11.307 9.657 -14.038 1.00 0.00 H new ATOM 0 HG13 ILE A 22 9.833 9.970 -14.932 1.00 0.00 H new ATOM 0 HG21 ILE A 22 12.593 9.156 -15.963 1.00 0.00 H new ATOM 0 HG22 ILE A 22 12.090 7.928 -17.149 1.00 0.00 H new ATOM 0 HG23 ILE A 22 11.217 9.475 -17.046 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.329 9.406 -12.580 1.00 0.00 H new ATOM 0 HD12 ILE A 22 8.671 8.165 -13.672 1.00 0.00 H new ATOM 0 HD13 ILE A 22 10.168 7.848 -12.765 1.00 0.00 H new ATOM 354 N LEU A 23 7.227 8.118 -16.316 1.00 0.00 N ATOM 355 CA LEU A 23 6.104 8.873 -16.851 1.00 0.00 C ATOM 356 C LEU A 23 5.960 10.216 -16.145 1.00 0.00 C ATOM 357 O LEU A 23 5.420 11.157 -16.726 1.00 0.00 O ATOM 358 CB LEU A 23 4.807 8.075 -16.694 1.00 0.00 C ATOM 359 CG LEU A 23 4.906 6.647 -17.240 1.00 0.00 C ATOM 360 CD1 LEU A 23 3.520 6.005 -17.188 1.00 0.00 C ATOM 361 CD2 LEU A 23 5.402 6.630 -18.684 1.00 0.00 C ATOM 0 H LEU A 23 6.955 7.328 -15.731 1.00 0.00 H new ATOM 0 HA LEU A 23 6.297 9.053 -17.909 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.538 8.035 -15.638 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.001 8.599 -17.209 1.00 0.00 H new ATOM 0 HG LEU A 23 5.619 6.095 -16.628 1.00 0.00 H new ATOM 0 HD11 LEU A 23 3.576 4.987 -17.574 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.168 5.983 -16.157 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.827 6.586 -17.796 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.459 5.600 -19.037 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.711 7.191 -19.313 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.391 7.086 -18.735 1.00 0.00 H new ATOM 373 N GLY A 24 6.436 10.315 -14.900 1.00 0.00 N ATOM 374 CA GLY A 24 6.420 11.588 -14.200 1.00 0.00 C ATOM 375 C GLY A 24 6.455 11.442 -12.685 1.00 0.00 C ATOM 376 O GLY A 24 6.627 10.345 -12.156 1.00 0.00 O ATOM 0 H GLY A 24 6.830 9.538 -14.369 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.276 12.182 -14.521 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.524 12.140 -14.484 1.00 0.00 H new ATOM 380 N VAL A 25 6.288 12.573 -11.996 1.00 0.00 N ATOM 381 CA VAL A 25 6.325 12.657 -10.545 1.00 0.00 C ATOM 382 C VAL A 25 5.012 13.243 -10.030 1.00 0.00 C ATOM 383 O VAL A 25 4.343 13.995 -10.739 1.00 0.00 O ATOM 384 CB VAL A 25 7.547 13.489 -10.130 1.00 0.00 C ATOM 385 CG1 VAL A 25 7.499 14.899 -10.721 1.00 0.00 C ATOM 386 CG2 VAL A 25 7.658 13.604 -8.611 1.00 0.00 C ATOM 0 H VAL A 25 6.120 13.472 -12.447 1.00 0.00 H new ATOM 0 HA VAL A 25 6.427 11.667 -10.100 1.00 0.00 H new ATOM 0 HB VAL A 25 8.418 12.963 -10.520 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.381 15.456 -10.404 1.00 0.00 H new ATOM 0 HG12 VAL A 25 7.480 14.837 -11.809 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.602 15.410 -10.371 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.534 14.199 -8.354 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.763 14.086 -8.216 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.756 12.609 -8.177 1.00 0.00 H new ATOM 396 N SER A 26 4.645 12.895 -8.793 1.00 0.00 N ATOM 397 CA SER A 26 3.414 13.346 -8.162 1.00 0.00 C ATOM 398 C SER A 26 3.659 13.561 -6.671 1.00 0.00 C ATOM 399 O SER A 26 3.181 12.792 -5.838 1.00 0.00 O ATOM 400 CB SER A 26 2.304 12.317 -8.387 1.00 0.00 C ATOM 401 OG SER A 26 2.065 12.141 -9.768 1.00 0.00 O ATOM 0 H SER A 26 5.206 12.284 -8.199 1.00 0.00 H new ATOM 0 HA SER A 26 3.099 14.290 -8.606 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.586 11.365 -7.936 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.390 12.646 -7.893 1.00 0.00 H new ATOM 0 HG SER A 26 1.354 11.479 -9.895 1.00 0.00 H new ATOM 407 N GLY A 27 4.409 14.615 -6.338 1.00 0.00 N ATOM 408 CA GLY A 27 4.755 14.931 -4.963 1.00 0.00 C ATOM 409 C GLY A 27 5.575 13.806 -4.341 1.00 0.00 C ATOM 410 O GLY A 27 6.648 13.470 -4.838 1.00 0.00 O ATOM 0 H GLY A 27 4.791 15.270 -7.021 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.322 15.862 -4.930 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.847 15.090 -4.382 1.00 0.00 H new ATOM 414 N GLN A 28 5.066 13.225 -3.252 1.00 0.00 N ATOM 415 CA GLN A 28 5.721 12.131 -2.552 1.00 0.00 C ATOM 416 C GLN A 28 5.674 10.824 -3.353 1.00 0.00 C ATOM 417 O GLN A 28 6.169 9.797 -2.888 1.00 0.00 O ATOM 418 CB GLN A 28 5.046 11.967 -1.185 1.00 0.00 C ATOM 419 CG GLN A 28 5.917 11.208 -0.180 1.00 0.00 C ATOM 420 CD GLN A 28 7.209 11.959 0.125 1.00 0.00 C ATOM 421 OE1 GLN A 28 8.301 11.475 -0.158 1.00 0.00 O ATOM 422 NE2 GLN A 28 7.094 13.152 0.704 1.00 0.00 N ATOM 0 H GLN A 28 4.180 13.507 -2.832 1.00 0.00 H new ATOM 0 HA GLN A 28 6.777 12.368 -2.424 1.00 0.00 H new ATOM 0 HB2 GLN A 28 4.808 12.951 -0.782 1.00 0.00 H new ATOM 0 HB3 GLN A 28 4.101 11.438 -1.312 1.00 0.00 H new ATOM 0 HG2 GLN A 28 5.358 11.055 0.743 1.00 0.00 H new ATOM 0 HG3 GLN A 28 6.155 10.221 -0.577 1.00 0.00 H new ATOM 0 HE21 GLN A 28 6.171 13.524 0.926 1.00 0.00 H new ATOM 0 HE22 GLN A 28 7.929 13.694 0.926 1.00 0.00 H new ATOM 431 N GLN A 29 5.083 10.843 -4.553 1.00 0.00 N ATOM 432 CA GLN A 29 4.977 9.653 -5.386 1.00 0.00 C ATOM 433 C GLN A 29 5.645 9.864 -6.741 1.00 0.00 C ATOM 434 O GLN A 29 5.994 10.985 -7.109 1.00 0.00 O ATOM 435 CB GLN A 29 3.507 9.287 -5.604 1.00 0.00 C ATOM 436 CG GLN A 29 2.715 9.194 -4.302 1.00 0.00 C ATOM 437 CD GLN A 29 1.255 8.902 -4.599 1.00 0.00 C ATOM 438 OE1 GLN A 29 0.794 7.772 -4.464 1.00 0.00 O ATOM 439 NE2 GLN A 29 0.509 9.920 -5.008 1.00 0.00 N ATOM 0 H GLN A 29 4.670 11.679 -4.966 1.00 0.00 H new ATOM 0 HA GLN A 29 5.487 8.842 -4.866 1.00 0.00 H new ATOM 0 HB2 GLN A 29 3.045 10.033 -6.251 1.00 0.00 H new ATOM 0 HB3 GLN A 29 3.450 8.332 -6.126 1.00 0.00 H new ATOM 0 HG2 GLN A 29 3.130 8.408 -3.670 1.00 0.00 H new ATOM 0 HG3 GLN A 29 2.801 10.128 -3.747 1.00 0.00 H new ATOM 0 HE21 GLN A 29 0.923 10.847 -5.110 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -0.478 9.776 -5.220 1.00 0.00 H new ATOM 448 N VAL A 30 5.817 8.767 -7.478 1.00 0.00 N ATOM 449 CA VAL A 30 6.395 8.757 -8.812 1.00 0.00 C ATOM 450 C VAL A 30 5.636 7.739 -9.654 1.00 0.00 C ATOM 451 O VAL A 30 5.174 6.731 -9.125 1.00 0.00 O ATOM 452 CB VAL A 30 7.877 8.375 -8.714 1.00 0.00 C ATOM 453 CG1 VAL A 30 8.501 8.235 -10.102 1.00 0.00 C ATOM 454 CG2 VAL A 30 8.660 9.439 -7.945 1.00 0.00 C ATOM 0 H VAL A 30 5.550 7.839 -7.151 1.00 0.00 H new ATOM 0 HA VAL A 30 6.319 9.741 -9.275 1.00 0.00 H new ATOM 0 HB VAL A 30 7.928 7.421 -8.190 1.00 0.00 H new ATOM 0 HG11 VAL A 30 9.552 7.964 -10.003 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.977 7.459 -10.660 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.420 9.182 -10.635 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.709 9.148 -7.887 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.577 10.396 -8.461 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.254 9.533 -6.938 1.00 0.00 H new ATOM 464 N ARG A 31 5.504 7.994 -10.959 1.00 0.00 N ATOM 465 CA ARG A 31 4.826 7.079 -11.866 1.00 0.00 C ATOM 466 C ARG A 31 5.812 6.533 -12.887 1.00 0.00 C ATOM 467 O ARG A 31 6.346 7.278 -13.711 1.00 0.00 O ATOM 468 CB ARG A 31 3.625 7.754 -12.532 1.00 0.00 C ATOM 469 CG ARG A 31 2.936 6.749 -13.453 1.00 0.00 C ATOM 470 CD ARG A 31 1.599 7.294 -13.956 1.00 0.00 C ATOM 471 NE ARG A 31 0.599 7.271 -12.882 1.00 0.00 N ATOM 472 CZ ARG A 31 -0.722 7.388 -13.048 1.00 0.00 C ATOM 473 NH1 ARG A 31 -1.259 7.558 -14.253 1.00 0.00 N ATOM 474 NH2 ARG A 31 -1.517 7.333 -11.983 1.00 0.00 N ATOM 0 H ARG A 31 5.863 8.836 -11.409 1.00 0.00 H new ATOM 0 HA ARG A 31 4.436 6.238 -11.293 1.00 0.00 H new ATOM 0 HB2 ARG A 31 2.927 8.111 -11.775 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.951 8.625 -13.101 1.00 0.00 H new ATOM 0 HG2 ARG A 31 3.583 6.524 -14.301 1.00 0.00 H new ATOM 0 HG3 ARG A 31 2.773 5.813 -12.919 1.00 0.00 H new ATOM 0 HD2 ARG A 31 1.728 8.314 -14.319 1.00 0.00 H new ATOM 0 HD3 ARG A 31 1.250 6.697 -14.799 1.00 0.00 H new ATOM 0 HE ARG A 31 0.941 7.156 -11.928 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.659 7.602 -15.077 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.270 7.645 -14.353 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.117 7.203 -11.054 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.527 7.421 -12.095 1.00 0.00 H new ATOM 488 N ILE A 32 6.037 5.219 -12.811 1.00 0.00 N ATOM 489 CA ILE A 32 6.954 4.480 -13.664 1.00 0.00 C ATOM 490 C ILE A 32 6.143 3.522 -14.536 1.00 0.00 C ATOM 491 O ILE A 32 5.038 3.127 -14.167 1.00 0.00 O ATOM 492 CB ILE A 32 7.962 3.733 -12.771 1.00 0.00 C ATOM 493 CG1 ILE A 32 8.707 4.743 -11.884 1.00 0.00 C ATOM 494 CG2 ILE A 32 8.962 2.937 -13.611 1.00 0.00 C ATOM 495 CD1 ILE A 32 9.678 4.066 -10.913 1.00 0.00 C ATOM 0 H ILE A 32 5.566 4.625 -12.128 1.00 0.00 H new ATOM 0 HA ILE A 32 7.513 5.146 -14.321 1.00 0.00 H new ATOM 0 HB ILE A 32 7.414 3.029 -12.146 1.00 0.00 H new ATOM 0 HG12 ILE A 32 9.257 5.440 -12.516 1.00 0.00 H new ATOM 0 HG13 ILE A 32 7.982 5.329 -11.319 1.00 0.00 H new ATOM 0 HG21 ILE A 32 9.661 2.421 -12.953 1.00 0.00 H new ATOM 0 HG22 ILE A 32 8.427 2.206 -14.218 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.512 3.616 -14.262 1.00 0.00 H new ATOM 0 HD11 ILE A 32 10.178 4.824 -10.310 1.00 0.00 H new ATOM 0 HD12 ILE A 32 9.127 3.389 -10.260 1.00 0.00 H new ATOM 0 HD13 ILE A 32 10.422 3.502 -11.476 1.00 0.00 H new ATOM 507 N GLY A 33 6.691 3.147 -15.694 1.00 0.00 N ATOM 508 CA GLY A 33 6.038 2.253 -16.637 1.00 0.00 C ATOM 509 C GLY A 33 6.942 1.069 -16.959 1.00 0.00 C ATOM 510 O GLY A 33 7.889 1.207 -17.731 1.00 0.00 O ATOM 0 H GLY A 33 7.611 3.462 -16.001 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.097 1.897 -16.218 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.796 2.793 -17.552 1.00 0.00 H new ATOM 514 N ILE A 34 6.651 -0.093 -16.369 1.00 0.00 N ATOM 515 CA ILE A 34 7.436 -1.298 -16.588 1.00 0.00 C ATOM 516 C ILE A 34 6.956 -1.994 -17.864 1.00 0.00 C ATOM 517 O ILE A 34 5.836 -2.499 -17.913 1.00 0.00 O ATOM 518 CB ILE A 34 7.326 -2.249 -15.385 1.00 0.00 C ATOM 519 CG1 ILE A 34 7.882 -1.637 -14.093 1.00 0.00 C ATOM 520 CG2 ILE A 34 8.138 -3.511 -15.690 1.00 0.00 C ATOM 521 CD1 ILE A 34 6.887 -0.711 -13.390 1.00 0.00 C ATOM 0 H ILE A 34 5.867 -0.219 -15.729 1.00 0.00 H new ATOM 0 HA ILE A 34 8.484 -1.020 -16.701 1.00 0.00 H new ATOM 0 HB ILE A 34 6.268 -2.461 -15.232 1.00 0.00 H new ATOM 0 HG12 ILE A 34 8.167 -2.439 -13.412 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.789 -1.078 -14.324 1.00 0.00 H new ATOM 0 HG21 ILE A 34 8.072 -4.199 -14.847 1.00 0.00 H new ATOM 0 HG22 ILE A 34 7.740 -3.993 -16.583 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.181 -3.241 -15.857 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.341 -0.311 -12.483 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.621 0.110 -14.056 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.990 -1.272 -13.129 1.00 0.00 H new ATOM 533 N ASN A 35 7.803 -2.020 -18.896 1.00 0.00 N ATOM 534 CA ASN A 35 7.506 -2.688 -20.156 1.00 0.00 C ATOM 535 C ASN A 35 8.313 -3.978 -20.247 1.00 0.00 C ATOM 536 O ASN A 35 9.503 -3.949 -20.552 1.00 0.00 O ATOM 537 CB ASN A 35 7.848 -1.790 -21.346 1.00 0.00 C ATOM 538 CG ASN A 35 7.144 -0.444 -21.312 1.00 0.00 C ATOM 539 OD1 ASN A 35 6.128 -0.258 -21.972 1.00 0.00 O ATOM 540 ND2 ASN A 35 7.677 0.500 -20.543 1.00 0.00 N ATOM 0 H ASN A 35 8.720 -1.573 -18.876 1.00 0.00 H new ATOM 0 HA ASN A 35 6.439 -2.910 -20.186 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.925 -1.627 -21.370 1.00 0.00 H new ATOM 0 HB3 ASN A 35 7.583 -2.306 -22.269 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.239 1.419 -20.487 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.524 0.305 -20.009 1.00 0.00 H new ATOM 547 N ALA A 36 7.658 -5.108 -19.983 1.00 0.00 N ATOM 548 CA ALA A 36 8.256 -6.433 -20.052 1.00 0.00 C ATOM 549 C ALA A 36 7.243 -7.385 -20.685 1.00 0.00 C ATOM 550 O ALA A 36 6.039 -7.141 -20.594 1.00 0.00 O ATOM 551 CB ALA A 36 8.606 -6.885 -18.634 1.00 0.00 C ATOM 0 H ALA A 36 6.675 -5.124 -19.710 1.00 0.00 H new ATOM 0 HA ALA A 36 9.164 -6.424 -20.654 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.056 -7.877 -18.669 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.312 -6.182 -18.192 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.700 -6.918 -18.029 1.00 0.00 H new ATOM 557 N PRO A 37 7.702 -8.467 -21.326 1.00 0.00 N ATOM 558 CA PRO A 37 6.814 -9.443 -21.925 1.00 0.00 C ATOM 559 C PRO A 37 6.092 -10.191 -20.811 1.00 0.00 C ATOM 560 O PRO A 37 6.596 -10.283 -19.693 1.00 0.00 O ATOM 561 CB PRO A 37 7.725 -10.361 -22.740 1.00 0.00 C ATOM 562 CG PRO A 37 9.060 -10.277 -22.001 1.00 0.00 C ATOM 563 CD PRO A 37 9.094 -8.828 -21.517 1.00 0.00 C ATOM 0 HA PRO A 37 6.046 -9.006 -22.564 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.345 -11.382 -22.769 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.815 -10.025 -23.773 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.107 -10.981 -21.170 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.900 -10.503 -22.658 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.658 -8.734 -20.589 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.574 -8.178 -22.248 1.00 0.00 H new ATOM 571 N LYS A 38 4.907 -10.734 -21.099 1.00 0.00 N ATOM 572 CA LYS A 38 4.141 -11.442 -20.083 1.00 0.00 C ATOM 573 C LYS A 38 4.810 -12.771 -19.718 1.00 0.00 C ATOM 574 O LYS A 38 4.321 -13.501 -18.859 1.00 0.00 O ATOM 575 CB LYS A 38 2.694 -11.595 -20.551 1.00 0.00 C ATOM 576 CG LYS A 38 1.762 -11.719 -19.345 1.00 0.00 C ATOM 577 CD LYS A 38 0.313 -11.498 -19.778 1.00 0.00 C ATOM 578 CE LYS A 38 -0.611 -11.636 -18.569 1.00 0.00 C ATOM 579 NZ LYS A 38 -2.016 -11.379 -18.941 1.00 0.00 N ATOM 0 H LYS A 38 4.465 -10.696 -22.017 1.00 0.00 H new ATOM 0 HA LYS A 38 4.122 -10.862 -19.160 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.406 -10.735 -21.156 1.00 0.00 H new ATOM 0 HB3 LYS A 38 2.600 -12.476 -21.185 1.00 0.00 H new ATOM 0 HG2 LYS A 38 1.869 -12.705 -18.893 1.00 0.00 H new ATOM 0 HG3 LYS A 38 2.038 -10.988 -18.585 1.00 0.00 H new ATOM 0 HD2 LYS A 38 0.202 -10.508 -20.222 1.00 0.00 H new ATOM 0 HD3 LYS A 38 0.037 -12.223 -20.544 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.520 -12.638 -18.151 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -0.304 -10.937 -17.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -2.621 -11.479 -18.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -2.104 -10.414 -19.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -2.314 -12.062 -19.666 1.00 0.00 H new ATOM 593 N ASP A 39 5.935 -13.080 -20.374 1.00 0.00 N ATOM 594 CA ASP A 39 6.767 -14.237 -20.074 1.00 0.00 C ATOM 595 C ASP A 39 7.450 -14.087 -18.715 1.00 0.00 C ATOM 596 O ASP A 39 7.951 -15.065 -18.163 1.00 0.00 O ATOM 597 CB ASP A 39 7.842 -14.352 -21.157 1.00 0.00 C ATOM 598 CG ASP A 39 8.609 -15.668 -21.051 1.00 0.00 C ATOM 599 OD1 ASP A 39 7.954 -16.728 -21.169 1.00 0.00 O ATOM 600 OD2 ASP A 39 9.844 -15.606 -20.853 1.00 0.00 O ATOM 0 H ASP A 39 6.295 -12.516 -21.144 1.00 0.00 H new ATOM 0 HA ASP A 39 6.138 -15.127 -20.047 1.00 0.00 H new ATOM 0 HB2 ASP A 39 7.378 -14.279 -22.140 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.537 -13.517 -21.070 1.00 0.00 H new ATOM 605 N VAL A 40 7.471 -12.863 -18.174 1.00 0.00 N ATOM 606 CA VAL A 40 8.105 -12.569 -16.897 1.00 0.00 C ATOM 607 C VAL A 40 7.126 -11.814 -16.005 1.00 0.00 C ATOM 608 O VAL A 40 6.114 -11.301 -16.483 1.00 0.00 O ATOM 609 CB VAL A 40 9.401 -11.772 -17.113 1.00 0.00 C ATOM 610 CG1 VAL A 40 10.318 -12.496 -18.102 1.00 0.00 C ATOM 611 CG2 VAL A 40 9.131 -10.376 -17.671 1.00 0.00 C ATOM 0 H VAL A 40 7.045 -12.049 -18.617 1.00 0.00 H new ATOM 0 HA VAL A 40 8.374 -13.501 -16.400 1.00 0.00 H new ATOM 0 HB VAL A 40 9.874 -11.685 -16.135 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.231 -11.917 -18.243 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.570 -13.481 -17.710 1.00 0.00 H new ATOM 0 HG13 VAL A 40 9.807 -12.606 -19.059 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.076 -9.850 -17.807 1.00 0.00 H new ATOM 0 HG22 VAL A 40 8.621 -10.460 -18.630 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.504 -9.821 -16.974 1.00 0.00 H new ATOM 621 N ALA A 41 7.422 -11.743 -14.706 1.00 0.00 N ATOM 622 CA ALA A 41 6.524 -11.114 -13.754 1.00 0.00 C ATOM 623 C ALA A 41 7.014 -9.723 -13.362 1.00 0.00 C ATOM 624 O ALA A 41 8.187 -9.393 -13.526 1.00 0.00 O ATOM 625 CB ALA A 41 6.406 -12.010 -12.523 1.00 0.00 C ATOM 0 H ALA A 41 8.278 -12.115 -14.296 1.00 0.00 H new ATOM 0 HA ALA A 41 5.545 -10.991 -14.217 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.734 -11.548 -11.800 1.00 0.00 H new ATOM 0 HB2 ALA A 41 6.010 -12.982 -12.817 1.00 0.00 H new ATOM 0 HB3 ALA A 41 7.390 -12.140 -12.072 1.00 0.00 H new ATOM 631 N VAL A 42 6.093 -8.911 -12.837 1.00 0.00 N ATOM 632 CA VAL A 42 6.385 -7.594 -12.285 1.00 0.00 C ATOM 633 C VAL A 42 5.334 -7.274 -11.227 1.00 0.00 C ATOM 634 O VAL A 42 4.142 -7.206 -11.521 1.00 0.00 O ATOM 635 CB VAL A 42 6.445 -6.519 -13.384 1.00 0.00 C ATOM 636 CG1 VAL A 42 5.447 -6.782 -14.509 1.00 0.00 C ATOM 637 CG2 VAL A 42 6.192 -5.122 -12.808 1.00 0.00 C ATOM 0 H VAL A 42 5.105 -9.159 -12.785 1.00 0.00 H new ATOM 0 HA VAL A 42 7.372 -7.600 -11.822 1.00 0.00 H new ATOM 0 HB VAL A 42 7.452 -6.567 -13.799 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.529 -5.996 -15.259 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.663 -7.746 -14.969 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.435 -6.792 -14.103 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.241 -4.384 -13.609 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.205 -5.092 -12.347 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.950 -4.895 -12.058 1.00 0.00 H new ATOM 647 N HIS A 43 5.789 -7.074 -9.988 1.00 0.00 N ATOM 648 CA HIS A 43 4.919 -6.727 -8.876 1.00 0.00 C ATOM 649 C HIS A 43 5.613 -5.726 -7.960 1.00 0.00 C ATOM 650 O HIS A 43 6.838 -5.665 -7.902 1.00 0.00 O ATOM 651 CB HIS A 43 4.551 -7.986 -8.085 1.00 0.00 C ATOM 652 CG HIS A 43 3.664 -8.942 -8.837 1.00 0.00 C ATOM 653 ND1 HIS A 43 2.311 -9.114 -8.642 1.00 0.00 N ATOM 654 CD2 HIS A 43 4.053 -9.798 -9.833 1.00 0.00 C ATOM 655 CE1 HIS A 43 1.893 -10.042 -9.521 1.00 0.00 C ATOM 656 NE2 HIS A 43 2.918 -10.491 -10.265 1.00 0.00 N ATOM 0 H HIS A 43 6.774 -7.150 -9.733 1.00 0.00 H new ATOM 0 HA HIS A 43 4.009 -6.275 -9.271 1.00 0.00 H new ATOM 0 HB2 HIS A 43 5.466 -8.504 -7.799 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.051 -7.690 -7.163 1.00 0.00 H new ATOM 0 HD2 HIS A 43 5.056 -9.916 -10.216 1.00 0.00 H new ATOM 0 HE1 HIS A 43 0.872 -10.381 -9.616 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.876 -11.198 -11.000 1.00 0.00 H new ATOM 664 N ARG A 44 4.813 -4.937 -7.239 1.00 0.00 N ATOM 665 CA ARG A 44 5.282 -3.979 -6.249 1.00 0.00 C ATOM 666 C ARG A 44 5.731 -4.707 -4.981 1.00 0.00 C ATOM 667 O ARG A 44 5.322 -5.839 -4.731 1.00 0.00 O ATOM 668 CB ARG A 44 4.140 -2.998 -5.963 1.00 0.00 C ATOM 669 CG ARG A 44 2.906 -3.761 -5.477 1.00 0.00 C ATOM 670 CD ARG A 44 1.606 -3.132 -5.977 1.00 0.00 C ATOM 671 NE ARG A 44 1.212 -1.989 -5.157 1.00 0.00 N ATOM 672 CZ ARG A 44 0.119 -1.254 -5.362 1.00 0.00 C ATOM 673 NH1 ARG A 44 -0.689 -1.506 -6.388 1.00 0.00 N ATOM 674 NH2 ARG A 44 -0.162 -0.258 -4.527 1.00 0.00 N ATOM 0 H ARG A 44 3.797 -4.951 -7.334 1.00 0.00 H new ATOM 0 HA ARG A 44 6.145 -3.428 -6.623 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.451 -2.275 -5.209 1.00 0.00 H new ATOM 0 HB3 ARG A 44 3.898 -2.435 -6.865 1.00 0.00 H new ATOM 0 HG2 ARG A 44 2.962 -4.795 -5.818 1.00 0.00 H new ATOM 0 HG3 ARG A 44 2.901 -3.784 -4.387 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.730 -2.813 -7.012 1.00 0.00 H new ATOM 0 HD3 ARG A 44 0.812 -3.879 -5.967 1.00 0.00 H new ATOM 0 HE ARG A 44 1.815 -1.736 -4.374 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -0.476 -2.270 -7.030 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -1.522 -0.936 -6.533 1.00 0.00 H new ATOM 0 HH21 ARG A 44 0.456 -0.063 -3.739 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -0.996 0.311 -4.674 1.00 0.00 H new ATOM 688 N GLU A 45 6.575 -4.058 -4.177 1.00 0.00 N ATOM 689 CA GLU A 45 7.133 -4.674 -2.977 1.00 0.00 C ATOM 690 C GLU A 45 6.060 -4.926 -1.916 1.00 0.00 C ATOM 691 O GLU A 45 6.178 -5.862 -1.126 1.00 0.00 O ATOM 692 CB GLU A 45 8.227 -3.752 -2.430 1.00 0.00 C ATOM 693 CG GLU A 45 8.983 -4.368 -1.248 1.00 0.00 C ATOM 694 CD GLU A 45 9.787 -5.599 -1.664 1.00 0.00 C ATOM 695 OE1 GLU A 45 10.912 -5.407 -2.177 1.00 0.00 O ATOM 696 OE2 GLU A 45 9.272 -6.723 -1.469 1.00 0.00 O ATOM 0 H GLU A 45 6.887 -3.100 -4.339 1.00 0.00 H new ATOM 0 HA GLU A 45 7.551 -5.647 -3.236 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.934 -3.521 -3.227 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.779 -2.809 -2.118 1.00 0.00 H new ATOM 0 HG2 GLU A 45 9.654 -3.624 -0.819 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.274 -4.644 -0.468 1.00 0.00 H new ATOM 703 N GLU A 46 5.007 -4.102 -1.883 1.00 0.00 N ATOM 704 CA GLU A 46 3.968 -4.211 -0.868 1.00 0.00 C ATOM 705 C GLU A 46 2.938 -5.289 -1.212 1.00 0.00 C ATOM 706 O GLU A 46 2.026 -5.539 -0.425 1.00 0.00 O ATOM 707 CB GLU A 46 3.292 -2.851 -0.674 1.00 0.00 C ATOM 708 CG GLU A 46 2.600 -2.380 -1.954 1.00 0.00 C ATOM 709 CD GLU A 46 1.962 -1.004 -1.791 1.00 0.00 C ATOM 710 OE1 GLU A 46 1.504 -0.690 -0.670 1.00 0.00 O ATOM 711 OE2 GLU A 46 1.940 -0.274 -2.807 1.00 0.00 O ATOM 0 H GLU A 46 4.857 -3.349 -2.555 1.00 0.00 H new ATOM 0 HA GLU A 46 4.440 -4.515 0.066 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.561 -2.919 0.132 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.035 -2.114 -0.369 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.326 -2.348 -2.767 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.835 -3.102 -2.238 1.00 0.00 H new ATOM 718 N ILE A 47 3.075 -5.929 -2.378 1.00 0.00 N ATOM 719 CA ILE A 47 2.153 -6.964 -2.825 1.00 0.00 C ATOM 720 C ILE A 47 2.890 -8.237 -3.234 1.00 0.00 C ATOM 721 O ILE A 47 2.265 -9.287 -3.367 1.00 0.00 O ATOM 722 CB ILE A 47 1.221 -6.391 -3.894 1.00 0.00 C ATOM 723 CG1 ILE A 47 0.091 -5.703 -3.120 1.00 0.00 C ATOM 724 CG2 ILE A 47 0.676 -7.450 -4.846 1.00 0.00 C ATOM 725 CD1 ILE A 47 -1.053 -5.230 -4.003 1.00 0.00 C ATOM 0 H ILE A 47 3.831 -5.739 -3.035 1.00 0.00 H new ATOM 0 HA ILE A 47 1.518 -7.279 -1.997 1.00 0.00 H new ATOM 0 HB ILE A 47 1.762 -5.700 -4.540 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -0.300 -6.394 -2.373 1.00 0.00 H new ATOM 0 HG13 ILE A 47 0.500 -4.848 -2.581 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.022 -6.978 -5.579 1.00 0.00 H new ATOM 0 HG22 ILE A 47 1.504 -7.939 -5.359 1.00 0.00 H new ATOM 0 HG23 ILE A 47 0.111 -8.191 -4.281 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -1.815 -4.753 -3.387 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.677 -4.514 -4.733 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.488 -6.083 -4.523 1.00 0.00 H new ATOM 737 N TYR A 48 4.209 -8.174 -3.434 1.00 0.00 N ATOM 738 CA TYR A 48 4.969 -9.394 -3.655 1.00 0.00 C ATOM 739 C TYR A 48 4.825 -10.310 -2.439 1.00 0.00 C ATOM 740 O TYR A 48 4.710 -11.525 -2.584 1.00 0.00 O ATOM 741 CB TYR A 48 6.438 -9.054 -3.898 1.00 0.00 C ATOM 742 CG TYR A 48 7.321 -10.279 -3.883 1.00 0.00 C ATOM 743 CD1 TYR A 48 7.117 -11.301 -4.821 1.00 0.00 C ATOM 744 CD2 TYR A 48 8.339 -10.395 -2.924 1.00 0.00 C ATOM 745 CE1 TYR A 48 7.913 -12.455 -4.789 1.00 0.00 C ATOM 746 CE2 TYR A 48 9.141 -11.543 -2.888 1.00 0.00 C ATOM 747 CZ TYR A 48 8.929 -12.580 -3.821 1.00 0.00 C ATOM 748 OH TYR A 48 9.704 -13.701 -3.786 1.00 0.00 O ATOM 0 H TYR A 48 4.756 -7.313 -3.447 1.00 0.00 H new ATOM 0 HA TYR A 48 4.584 -9.910 -4.534 1.00 0.00 H new ATOM 0 HB2 TYR A 48 6.537 -8.549 -4.859 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.778 -8.355 -3.134 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.345 -11.199 -5.570 1.00 0.00 H new ATOM 0 HD2 TYR A 48 8.504 -9.599 -2.213 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.748 -13.246 -5.505 1.00 0.00 H new ATOM 0 HE2 TYR A 48 9.921 -11.634 -2.147 1.00 0.00 H new ATOM 0 HH TYR A 48 10.357 -13.625 -3.059 1.00 0.00 H new ATOM 846 N MET B 1 2.033 -2.738 -20.977 1.00 0.00 N ATOM 847 CA MET B 1 2.847 -2.076 -19.939 1.00 0.00 C ATOM 848 C MET B 1 2.128 -2.106 -18.601 1.00 0.00 C ATOM 849 O MET B 1 0.912 -1.943 -18.555 1.00 0.00 O ATOM 850 CB MET B 1 3.149 -0.627 -20.333 1.00 0.00 C ATOM 851 CG MET B 1 3.922 0.089 -19.227 1.00 0.00 C ATOM 852 SD MET B 1 4.777 1.603 -19.740 1.00 0.00 S ATOM 853 CE MET B 1 3.444 2.445 -20.622 1.00 0.00 C ATOM 0 H1 MET B 1 2.073 -2.183 -21.856 1.00 0.00 H new ATOM 0 H2 MET B 1 2.405 -3.693 -21.153 1.00 0.00 H new ATOM 0 H3 MET B 1 1.047 -2.805 -20.654 1.00 0.00 H new ATOM 0 HA MET B 1 3.788 -2.619 -19.848 1.00 0.00 H new ATOM 0 HB2 MET B 1 3.728 -0.610 -21.256 1.00 0.00 H new ATOM 0 HB3 MET B 1 2.217 -0.098 -20.532 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.229 0.337 -18.423 1.00 0.00 H new ATOM 0 HG3 MET B 1 4.657 -0.602 -18.813 1.00 0.00 H new ATOM 0 HE1 MET B 1 3.821 3.374 -21.049 1.00 0.00 H new ATOM 0 HE2 MET B 1 3.073 1.802 -21.421 1.00 0.00 H new ATOM 0 HE3 MET B 1 2.633 2.667 -19.929 1.00 0.00 H new ATOM 865 N LEU B 2 2.879 -2.311 -17.515 1.00 0.00 N ATOM 866 CA LEU B 2 2.328 -2.270 -16.172 1.00 0.00 C ATOM 867 C LEU B 2 2.736 -0.951 -15.517 1.00 0.00 C ATOM 868 O LEU B 2 3.835 -0.830 -14.978 1.00 0.00 O ATOM 869 CB LEU B 2 2.824 -3.475 -15.360 1.00 0.00 C ATOM 870 CG LEU B 2 1.793 -3.992 -14.345 1.00 0.00 C ATOM 871 CD1 LEU B 2 2.510 -4.679 -13.189 1.00 0.00 C ATOM 872 CD2 LEU B 2 0.875 -2.929 -13.761 1.00 0.00 C ATOM 0 H LEU B 2 3.879 -2.508 -17.549 1.00 0.00 H new ATOM 0 HA LEU B 2 1.240 -2.326 -16.209 1.00 0.00 H new ATOM 0 HB2 LEU B 2 3.086 -4.282 -16.044 1.00 0.00 H new ATOM 0 HB3 LEU B 2 3.736 -3.197 -14.831 1.00 0.00 H new ATOM 0 HG LEU B 2 1.162 -4.678 -14.910 1.00 0.00 H new ATOM 0 HD11 LEU B 2 1.776 -5.044 -12.471 1.00 0.00 H new ATOM 0 HD12 LEU B 2 3.094 -5.517 -13.570 1.00 0.00 H new ATOM 0 HD13 LEU B 2 3.174 -3.967 -12.698 1.00 0.00 H new ATOM 0 HD21 LEU B 2 0.184 -3.392 -13.056 1.00 0.00 H new ATOM 0 HD22 LEU B 2 1.471 -2.177 -13.244 1.00 0.00 H new ATOM 0 HD23 LEU B 2 0.311 -2.455 -14.564 1.00 0.00 H new ATOM 884 N ILE B 3 1.848 0.043 -15.565 1.00 0.00 N ATOM 885 CA ILE B 3 2.103 1.335 -14.953 1.00 0.00 C ATOM 886 C ILE B 3 1.777 1.236 -13.463 1.00 0.00 C ATOM 887 O ILE B 3 0.805 0.587 -13.087 1.00 0.00 O ATOM 888 CB ILE B 3 1.244 2.419 -15.625 1.00 0.00 C ATOM 889 CG1 ILE B 3 1.511 2.547 -17.134 1.00 0.00 C ATOM 890 CG2 ILE B 3 1.568 3.771 -14.985 1.00 0.00 C ATOM 891 CD1 ILE B 3 0.688 1.579 -17.972 1.00 0.00 C ATOM 0 H ILE B 3 0.941 -0.029 -16.026 1.00 0.00 H new ATOM 0 HA ILE B 3 3.150 1.611 -15.082 1.00 0.00 H new ATOM 0 HB ILE B 3 0.202 2.130 -15.486 1.00 0.00 H new ATOM 0 HG12 ILE B 3 1.293 3.567 -17.450 1.00 0.00 H new ATOM 0 HG13 ILE B 3 2.570 2.374 -17.325 1.00 0.00 H new ATOM 0 HG21 ILE B 3 0.965 4.549 -15.453 1.00 0.00 H new ATOM 0 HG22 ILE B 3 1.345 3.732 -13.919 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.625 3.997 -15.127 1.00 0.00 H new ATOM 0 HD11 ILE B 3 0.923 1.720 -19.027 1.00 0.00 H new ATOM 0 HD12 ILE B 3 0.924 0.555 -17.682 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -0.373 1.767 -17.808 1.00 0.00 H new ATOM 903 N LEU B 4 2.585 1.877 -12.613 1.00 0.00 N ATOM 904 CA LEU B 4 2.349 1.934 -11.175 1.00 0.00 C ATOM 905 C LEU B 4 2.721 3.330 -10.675 1.00 0.00 C ATOM 906 O LEU B 4 3.451 4.051 -11.351 1.00 0.00 O ATOM 907 CB LEU B 4 3.212 0.887 -10.456 1.00 0.00 C ATOM 908 CG LEU B 4 2.834 -0.562 -10.785 1.00 0.00 C ATOM 909 CD1 LEU B 4 3.851 -1.508 -10.153 1.00 0.00 C ATOM 910 CD2 LEU B 4 1.470 -0.930 -10.209 1.00 0.00 C ATOM 0 H LEU B 4 3.426 2.373 -12.910 1.00 0.00 H new ATOM 0 HA LEU B 4 1.299 1.725 -10.968 1.00 0.00 H new ATOM 0 HB2 LEU B 4 4.257 1.048 -10.720 1.00 0.00 H new ATOM 0 HB3 LEU B 4 3.128 1.039 -9.380 1.00 0.00 H new ATOM 0 HG LEU B 4 2.814 -0.653 -11.871 1.00 0.00 H new ATOM 0 HD11 LEU B 4 3.583 -2.539 -10.386 1.00 0.00 H new ATOM 0 HD12 LEU B 4 4.843 -1.292 -10.549 1.00 0.00 H new ATOM 0 HD13 LEU B 4 3.854 -1.370 -9.072 1.00 0.00 H new ATOM 0 HD21 LEU B 4 1.235 -1.964 -10.462 1.00 0.00 H new ATOM 0 HD22 LEU B 4 1.490 -0.817 -9.125 1.00 0.00 H new ATOM 0 HD23 LEU B 4 0.709 -0.272 -10.628 1.00 0.00 H new ATOM 922 N THR B 5 2.225 3.714 -9.495 1.00 0.00 N ATOM 923 CA THR B 5 2.561 4.999 -8.889 1.00 0.00 C ATOM 924 C THR B 5 3.183 4.757 -7.516 1.00 0.00 C ATOM 925 O THR B 5 2.510 4.824 -6.488 1.00 0.00 O ATOM 926 CB THR B 5 1.334 5.915 -8.828 1.00 0.00 C ATOM 927 OG1 THR B 5 0.769 6.047 -10.116 1.00 0.00 O ATOM 928 CG2 THR B 5 1.726 7.308 -8.350 1.00 0.00 C ATOM 0 H THR B 5 1.585 3.146 -8.940 1.00 0.00 H new ATOM 0 HA THR B 5 3.295 5.518 -9.506 1.00 0.00 H new ATOM 0 HB THR B 5 0.620 5.470 -8.135 1.00 0.00 H new ATOM 0 HG1 THR B 5 -0.155 5.719 -10.103 1.00 0.00 H new ATOM 0 HG21 THR B 5 0.841 7.943 -8.314 1.00 0.00 H new ATOM 0 HG22 THR B 5 2.165 7.241 -7.355 1.00 0.00 H new ATOM 0 HG23 THR B 5 2.453 7.738 -9.039 1.00 0.00 H new ATOM 936 N ARG B 6 4.487 4.470 -7.508 1.00 0.00 N ATOM 937 CA ARG B 6 5.231 4.073 -6.321 1.00 0.00 C ATOM 938 C ARG B 6 5.581 5.282 -5.453 1.00 0.00 C ATOM 939 O ARG B 6 6.043 6.300 -5.965 1.00 0.00 O ATOM 940 CB ARG B 6 6.502 3.363 -6.800 1.00 0.00 C ATOM 941 CG ARG B 6 7.324 2.719 -5.682 1.00 0.00 C ATOM 942 CD ARG B 6 6.600 1.539 -5.033 1.00 0.00 C ATOM 943 NE ARG B 6 5.718 1.961 -3.936 1.00 0.00 N ATOM 944 CZ ARG B 6 4.532 1.410 -3.663 1.00 0.00 C ATOM 945 NH1 ARG B 6 4.030 0.451 -4.432 1.00 0.00 N ATOM 946 NH2 ARG B 6 3.831 1.815 -2.609 1.00 0.00 N ATOM 0 H ARG B 6 5.064 4.510 -8.348 1.00 0.00 H new ATOM 0 HA ARG B 6 4.626 3.410 -5.702 1.00 0.00 H new ATOM 0 HB2 ARG B 6 6.224 2.593 -7.520 1.00 0.00 H new ATOM 0 HB3 ARG B 6 7.129 4.082 -7.328 1.00 0.00 H new ATOM 0 HG2 ARG B 6 8.278 2.379 -6.085 1.00 0.00 H new ATOM 0 HG3 ARG B 6 7.548 3.467 -4.922 1.00 0.00 H new ATOM 0 HD2 ARG B 6 6.013 1.016 -5.788 1.00 0.00 H new ATOM 0 HD3 ARG B 6 7.335 0.829 -4.653 1.00 0.00 H new ATOM 0 HE ARG B 6 6.033 2.728 -3.342 1.00 0.00 H new ATOM 0 HH11 ARG B 6 4.551 0.124 -5.245 1.00 0.00 H new ATOM 0 HH12 ARG B 6 3.123 0.041 -4.209 1.00 0.00 H new ATOM 0 HH21 ARG B 6 4.198 2.550 -2.004 1.00 0.00 H new ATOM 0 HH22 ARG B 6 2.926 1.391 -2.405 1.00 0.00 H new ATOM 960 N LYS B 7 5.361 5.171 -4.139 1.00 0.00 N ATOM 961 CA LYS B 7 5.786 6.186 -3.179 1.00 0.00 C ATOM 962 C LYS B 7 7.309 6.163 -3.056 1.00 0.00 C ATOM 963 O LYS B 7 7.927 5.106 -3.169 1.00 0.00 O ATOM 964 CB LYS B 7 5.172 5.903 -1.802 1.00 0.00 C ATOM 965 CG LYS B 7 3.715 6.359 -1.646 1.00 0.00 C ATOM 966 CD LYS B 7 2.741 5.596 -2.547 1.00 0.00 C ATOM 967 CE LYS B 7 1.293 5.959 -2.202 1.00 0.00 C ATOM 968 NZ LYS B 7 0.916 5.511 -0.847 1.00 0.00 N ATOM 0 H LYS B 7 4.884 4.375 -3.715 1.00 0.00 H new ATOM 0 HA LYS B 7 5.453 7.163 -3.529 1.00 0.00 H new ATOM 0 HB2 LYS B 7 5.226 4.832 -1.608 1.00 0.00 H new ATOM 0 HB3 LYS B 7 5.777 6.396 -1.041 1.00 0.00 H new ATOM 0 HG2 LYS B 7 3.412 6.233 -0.607 1.00 0.00 H new ATOM 0 HG3 LYS B 7 3.649 7.424 -1.871 1.00 0.00 H new ATOM 0 HD2 LYS B 7 2.942 5.832 -3.592 1.00 0.00 H new ATOM 0 HD3 LYS B 7 2.891 4.523 -2.428 1.00 0.00 H new ATOM 0 HE2 LYS B 7 1.163 7.039 -2.276 1.00 0.00 H new ATOM 0 HE3 LYS B 7 0.622 5.507 -2.933 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -0.120 5.461 -0.773 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 1.321 4.570 -0.667 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 1.281 6.185 -0.144 1.00 0.00 H new ATOM 982 N VAL B 8 7.919 7.327 -2.821 1.00 0.00 N ATOM 983 CA VAL B 8 9.359 7.435 -2.619 1.00 0.00 C ATOM 984 C VAL B 8 9.771 6.585 -1.419 1.00 0.00 C ATOM 985 O VAL B 8 9.063 6.530 -0.416 1.00 0.00 O ATOM 986 CB VAL B 8 9.720 8.905 -2.394 1.00 0.00 C ATOM 987 CG1 VAL B 8 11.182 9.045 -1.970 1.00 0.00 C ATOM 988 CG2 VAL B 8 9.495 9.686 -3.690 1.00 0.00 C ATOM 0 H VAL B 8 7.426 8.218 -2.766 1.00 0.00 H new ATOM 0 HA VAL B 8 9.892 7.070 -3.497 1.00 0.00 H new ATOM 0 HB VAL B 8 9.086 9.301 -1.601 1.00 0.00 H new ATOM 0 HG11 VAL B 8 11.417 10.098 -1.816 1.00 0.00 H new ATOM 0 HG12 VAL B 8 11.346 8.497 -1.042 1.00 0.00 H new ATOM 0 HG13 VAL B 8 11.827 8.640 -2.750 1.00 0.00 H new ATOM 0 HG21 VAL B 8 9.751 10.734 -3.533 1.00 0.00 H new ATOM 0 HG22 VAL B 8 10.125 9.273 -4.478 1.00 0.00 H new ATOM 0 HG23 VAL B 8 8.448 9.609 -3.984 1.00 0.00 H new ATOM 998 N GLY B 9 10.925 5.924 -1.531 1.00 0.00 N ATOM 999 CA GLY B 9 11.479 5.100 -0.467 1.00 0.00 C ATOM 1000 C GLY B 9 10.993 3.652 -0.542 1.00 0.00 C ATOM 1001 O GLY B 9 11.474 2.807 0.212 1.00 0.00 O ATOM 0 H GLY B 9 11.502 5.949 -2.372 1.00 0.00 H new ATOM 0 HA2 GLY B 9 12.567 5.119 -0.525 1.00 0.00 H new ATOM 0 HA3 GLY B 9 11.204 5.524 0.499 1.00 0.00 H new ATOM 1005 N GLU B 10 10.050 3.358 -1.443 1.00 0.00 N ATOM 1006 CA GLU B 10 9.547 2.008 -1.647 1.00 0.00 C ATOM 1007 C GLU B 10 10.211 1.386 -2.876 1.00 0.00 C ATOM 1008 O GLU B 10 11.109 1.988 -3.466 1.00 0.00 O ATOM 1009 CB GLU B 10 8.026 2.043 -1.799 1.00 0.00 C ATOM 1010 CG GLU B 10 7.343 2.617 -0.554 1.00 0.00 C ATOM 1011 CD GLU B 10 7.661 1.800 0.697 1.00 0.00 C ATOM 1012 OE1 GLU B 10 7.481 0.562 0.644 1.00 0.00 O ATOM 1013 OE2 GLU B 10 8.082 2.420 1.699 1.00 0.00 O ATOM 0 H GLU B 10 9.617 4.055 -2.049 1.00 0.00 H new ATOM 0 HA GLU B 10 9.791 1.391 -0.782 1.00 0.00 H new ATOM 0 HB2 GLU B 10 7.761 2.645 -2.669 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.656 1.035 -1.984 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.665 3.648 -0.406 1.00 0.00 H new ATOM 0 HG3 GLU B 10 6.264 2.639 -0.709 1.00 0.00 H new ATOM 1020 N SER B 11 9.778 0.183 -3.270 1.00 0.00 N ATOM 1021 CA SER B 11 10.375 -0.509 -4.403 1.00 0.00 C ATOM 1022 C SER B 11 9.346 -1.280 -5.225 1.00 0.00 C ATOM 1023 O SER B 11 8.198 -1.452 -4.818 1.00 0.00 O ATOM 1024 CB SER B 11 11.436 -1.489 -3.895 1.00 0.00 C ATOM 1025 OG SER B 11 12.413 -0.814 -3.133 1.00 0.00 O ATOM 0 H SER B 11 9.018 -0.325 -2.818 1.00 0.00 H new ATOM 0 HA SER B 11 10.818 0.249 -5.049 1.00 0.00 H new ATOM 0 HB2 SER B 11 10.964 -2.262 -3.288 1.00 0.00 H new ATOM 0 HB3 SER B 11 11.909 -1.991 -4.739 1.00 0.00 H new ATOM 0 HG SER B 11 13.216 -0.678 -3.678 1.00 0.00 H new ATOM 1031 N ILE B 12 9.793 -1.740 -6.397 1.00 0.00 N ATOM 1032 CA ILE B 12 9.054 -2.602 -7.308 1.00 0.00 C ATOM 1033 C ILE B 12 9.949 -3.809 -7.596 1.00 0.00 C ATOM 1034 O ILE B 12 11.137 -3.777 -7.278 1.00 0.00 O ATOM 1035 CB ILE B 12 8.715 -1.818 -8.590 1.00 0.00 C ATOM 1036 CG1 ILE B 12 7.871 -0.568 -8.306 1.00 0.00 C ATOM 1037 CG2 ILE B 12 7.991 -2.686 -9.626 1.00 0.00 C ATOM 1038 CD1 ILE B 12 6.496 -0.892 -7.722 1.00 0.00 C ATOM 0 H ILE B 12 10.722 -1.508 -6.747 1.00 0.00 H new ATOM 0 HA ILE B 12 8.110 -2.940 -6.881 1.00 0.00 H new ATOM 0 HB ILE B 12 9.676 -1.506 -8.999 1.00 0.00 H new ATOM 0 HG12 ILE B 12 8.410 0.077 -7.613 1.00 0.00 H new ATOM 0 HG13 ILE B 12 7.743 -0.006 -9.231 1.00 0.00 H new ATOM 0 HG21 ILE B 12 7.773 -2.090 -10.512 1.00 0.00 H new ATOM 0 HG22 ILE B 12 8.626 -3.528 -9.902 1.00 0.00 H new ATOM 0 HG23 ILE B 12 7.059 -3.058 -9.201 1.00 0.00 H new ATOM 0 HD11 ILE B 12 5.949 0.034 -7.544 1.00 0.00 H new ATOM 0 HD12 ILE B 12 5.940 -1.513 -8.424 1.00 0.00 H new ATOM 0 HD13 ILE B 12 6.618 -1.428 -6.781 1.00 0.00 H new ATOM 1050 N ASN B 13 9.410 -4.873 -8.192 1.00 0.00 N ATOM 1051 CA ASN B 13 10.190 -6.059 -8.513 1.00 0.00 C ATOM 1052 C ASN B 13 9.867 -6.561 -9.913 1.00 0.00 C ATOM 1053 O ASN B 13 8.807 -6.263 -10.463 1.00 0.00 O ATOM 1054 CB ASN B 13 9.901 -7.154 -7.484 1.00 0.00 C ATOM 1055 CG ASN B 13 10.414 -6.770 -6.108 1.00 0.00 C ATOM 1056 OD1 ASN B 13 9.643 -6.400 -5.227 1.00 0.00 O ATOM 1057 ND2 ASN B 13 11.726 -6.858 -5.922 1.00 0.00 N ATOM 0 H ASN B 13 8.428 -4.933 -8.462 1.00 0.00 H new ATOM 0 HA ASN B 13 11.248 -5.799 -8.483 1.00 0.00 H new ATOM 0 HB2 ASN B 13 8.827 -7.336 -7.436 1.00 0.00 H new ATOM 0 HB3 ASN B 13 10.369 -8.086 -7.801 1.00 0.00 H new ATOM 0 HD21 ASN B 13 12.131 -6.613 -5.018 1.00 0.00 H new ATOM 0 HD22 ASN B 13 12.329 -7.171 -6.683 1.00 0.00 H new ATOM 1064 N ILE B 14 10.800 -7.329 -10.479 1.00 0.00 N ATOM 1065 CA ILE B 14 10.657 -7.940 -11.792 1.00 0.00 C ATOM 1066 C ILE B 14 11.269 -9.339 -11.740 1.00 0.00 C ATOM 1067 O ILE B 14 12.202 -9.583 -10.975 1.00 0.00 O ATOM 1068 CB ILE B 14 11.331 -7.065 -12.864 1.00 0.00 C ATOM 1069 CG1 ILE B 14 10.718 -5.657 -12.872 1.00 0.00 C ATOM 1070 CG2 ILE B 14 11.174 -7.712 -14.244 1.00 0.00 C ATOM 1071 CD1 ILE B 14 11.392 -4.733 -13.888 1.00 0.00 C ATOM 0 H ILE B 14 11.689 -7.544 -10.027 1.00 0.00 H new ATOM 0 HA ILE B 14 9.604 -8.022 -12.062 1.00 0.00 H new ATOM 0 HB ILE B 14 12.392 -6.982 -12.628 1.00 0.00 H new ATOM 0 HG12 ILE B 14 9.654 -5.728 -13.099 1.00 0.00 H new ATOM 0 HG13 ILE B 14 10.803 -5.221 -11.877 1.00 0.00 H new ATOM 0 HG21 ILE B 14 11.654 -7.086 -14.996 1.00 0.00 H new ATOM 0 HG22 ILE B 14 11.641 -8.697 -14.240 1.00 0.00 H new ATOM 0 HG23 ILE B 14 10.115 -7.814 -14.479 1.00 0.00 H new ATOM 0 HD11 ILE B 14 10.922 -3.750 -13.854 1.00 0.00 H new ATOM 0 HD12 ILE B 14 12.451 -4.637 -13.647 1.00 0.00 H new ATOM 0 HD13 ILE B 14 11.284 -5.152 -14.888 1.00 0.00 H new ATOM 1083 N GLY B 15 10.743 -10.255 -12.558 1.00 0.00 N ATOM 1084 CA GLY B 15 11.200 -11.634 -12.597 1.00 0.00 C ATOM 1085 C GLY B 15 11.123 -12.254 -11.207 1.00 0.00 C ATOM 1086 O GLY B 15 10.040 -12.356 -10.630 1.00 0.00 O ATOM 0 H GLY B 15 9.986 -10.054 -13.211 1.00 0.00 H new ATOM 0 HA2 GLY B 15 10.588 -12.208 -13.293 1.00 0.00 H new ATOM 0 HA3 GLY B 15 12.225 -11.675 -12.965 1.00 0.00 H new ATOM 1090 N ASP B 16 12.274 -12.667 -10.672 1.00 0.00 N ATOM 1091 CA ASP B 16 12.370 -13.231 -9.334 1.00 0.00 C ATOM 1092 C ASP B 16 13.666 -12.793 -8.640 1.00 0.00 C ATOM 1093 O ASP B 16 13.947 -13.222 -7.523 1.00 0.00 O ATOM 1094 CB ASP B 16 12.283 -14.757 -9.441 1.00 0.00 C ATOM 1095 CG ASP B 16 12.166 -15.423 -8.071 1.00 0.00 C ATOM 1096 OD1 ASP B 16 11.233 -15.053 -7.325 1.00 0.00 O ATOM 1097 OD2 ASP B 16 13.012 -16.300 -7.781 1.00 0.00 O ATOM 0 H ASP B 16 13.167 -12.617 -11.162 1.00 0.00 H new ATOM 0 HA ASP B 16 11.547 -12.863 -8.722 1.00 0.00 H new ATOM 0 HB2 ASP B 16 11.421 -15.029 -10.051 1.00 0.00 H new ATOM 0 HB3 ASP B 16 13.168 -15.135 -9.953 1.00 0.00 H new ATOM 1102 N ASP B 17 14.462 -11.938 -9.296 1.00 0.00 N ATOM 1103 CA ASP B 17 15.768 -11.528 -8.796 1.00 0.00 C ATOM 1104 C ASP B 17 16.044 -10.038 -9.021 1.00 0.00 C ATOM 1105 O ASP B 17 17.146 -9.576 -8.727 1.00 0.00 O ATOM 1106 CB ASP B 17 16.856 -12.362 -9.479 1.00 0.00 C ATOM 1107 CG ASP B 17 16.720 -13.850 -9.167 1.00 0.00 C ATOM 1108 OD1 ASP B 17 17.150 -14.248 -8.061 1.00 0.00 O ATOM 1109 OD2 ASP B 17 16.188 -14.576 -10.035 1.00 0.00 O ATOM 0 H ASP B 17 14.212 -11.514 -10.189 1.00 0.00 H new ATOM 0 HA ASP B 17 15.774 -11.697 -7.719 1.00 0.00 H new ATOM 0 HB2 ASP B 17 16.804 -12.212 -10.557 1.00 0.00 H new ATOM 0 HB3 ASP B 17 17.837 -12.012 -9.156 1.00 0.00 H new ATOM 1114 N ILE B 18 15.070 -9.279 -9.535 1.00 0.00 N ATOM 1115 CA ILE B 18 15.281 -7.871 -9.846 1.00 0.00 C ATOM 1116 C ILE B 18 14.407 -6.990 -8.957 1.00 0.00 C ATOM 1117 O ILE B 18 13.290 -7.369 -8.603 1.00 0.00 O ATOM 1118 CB ILE B 18 14.994 -7.633 -11.337 1.00 0.00 C ATOM 1119 CG1 ILE B 18 15.948 -8.485 -12.186 1.00 0.00 C ATOM 1120 CG2 ILE B 18 15.149 -6.149 -11.691 1.00 0.00 C ATOM 1121 CD1 ILE B 18 15.606 -8.413 -13.675 1.00 0.00 C ATOM 0 H ILE B 18 14.131 -9.620 -9.742 1.00 0.00 H new ATOM 0 HA ILE B 18 16.318 -7.602 -9.646 1.00 0.00 H new ATOM 0 HB ILE B 18 13.965 -7.925 -11.548 1.00 0.00 H new ATOM 0 HG12 ILE B 18 16.972 -8.145 -12.032 1.00 0.00 H new ATOM 0 HG13 ILE B 18 15.902 -9.522 -11.853 1.00 0.00 H new ATOM 0 HG21 ILE B 18 14.941 -6.004 -12.751 1.00 0.00 H new ATOM 0 HG22 ILE B 18 14.449 -5.559 -11.100 1.00 0.00 H new ATOM 0 HG23 ILE B 18 16.168 -5.828 -11.474 1.00 0.00 H new ATOM 0 HD11 ILE B 18 16.305 -9.030 -14.239 1.00 0.00 H new ATOM 0 HD12 ILE B 18 14.591 -8.778 -13.833 1.00 0.00 H new ATOM 0 HD13 ILE B 18 15.678 -7.380 -14.015 1.00 0.00 H new ATOM 1133 N THR B 19 14.921 -5.811 -8.594 1.00 0.00 N ATOM 1134 CA THR B 19 14.209 -4.837 -7.780 1.00 0.00 C ATOM 1135 C THR B 19 14.454 -3.441 -8.334 1.00 0.00 C ATOM 1136 O THR B 19 15.577 -3.116 -8.712 1.00 0.00 O ATOM 1137 CB THR B 19 14.699 -4.920 -6.333 1.00 0.00 C ATOM 1138 OG1 THR B 19 14.592 -6.241 -5.851 1.00 0.00 O ATOM 1139 CG2 THR B 19 13.884 -4.007 -5.418 1.00 0.00 C ATOM 0 H THR B 19 15.857 -5.508 -8.864 1.00 0.00 H new ATOM 0 HA THR B 19 13.140 -5.050 -7.805 1.00 0.00 H new ATOM 0 HB THR B 19 15.741 -4.600 -6.327 1.00 0.00 H new ATOM 0 HG1 THR B 19 14.910 -6.278 -4.925 1.00 0.00 H new ATOM 0 HG21 THR B 19 14.257 -4.089 -4.397 1.00 0.00 H new ATOM 0 HG22 THR B 19 13.977 -2.975 -5.757 1.00 0.00 H new ATOM 0 HG23 THR B 19 12.836 -4.305 -5.447 1.00 0.00 H new ATOM 1147 N ILE B 20 13.403 -2.618 -8.383 1.00 0.00 N ATOM 1148 CA ILE B 20 13.471 -1.264 -8.911 1.00 0.00 C ATOM 1149 C ILE B 20 13.037 -0.290 -7.817 1.00 0.00 C ATOM 1150 O ILE B 20 11.858 0.044 -7.697 1.00 0.00 O ATOM 1151 CB ILE B 20 12.600 -1.122 -10.168 1.00 0.00 C ATOM 1152 CG1 ILE B 20 12.803 -2.261 -11.179 1.00 0.00 C ATOM 1153 CG2 ILE B 20 12.881 0.229 -10.829 1.00 0.00 C ATOM 1154 CD1 ILE B 20 14.228 -2.355 -11.718 1.00 0.00 C ATOM 0 H ILE B 20 12.475 -2.881 -8.053 1.00 0.00 H new ATOM 0 HA ILE B 20 14.495 -1.035 -9.208 1.00 0.00 H new ATOM 0 HB ILE B 20 11.560 -1.180 -9.848 1.00 0.00 H new ATOM 0 HG12 ILE B 20 12.540 -3.207 -10.705 1.00 0.00 H new ATOM 0 HG13 ILE B 20 12.116 -2.121 -12.014 1.00 0.00 H new ATOM 0 HG21 ILE B 20 12.264 0.333 -11.722 1.00 0.00 H new ATOM 0 HG22 ILE B 20 12.646 1.032 -10.130 1.00 0.00 H new ATOM 0 HG23 ILE B 20 13.933 0.286 -11.107 1.00 0.00 H new ATOM 0 HD11 ILE B 20 14.296 -3.181 -12.426 1.00 0.00 H new ATOM 0 HD12 ILE B 20 14.489 -1.424 -12.221 1.00 0.00 H new ATOM 0 HD13 ILE B 20 14.919 -2.527 -10.892 1.00 0.00 H new ATOM 1166 N THR B 21 14.000 0.165 -7.015 1.00 0.00 N ATOM 1167 CA THR B 21 13.755 1.087 -5.914 1.00 0.00 C ATOM 1168 C THR B 21 13.543 2.504 -6.448 1.00 0.00 C ATOM 1169 O THR B 21 13.936 2.814 -7.572 1.00 0.00 O ATOM 1170 CB THR B 21 14.963 1.044 -4.970 1.00 0.00 C ATOM 1171 OG1 THR B 21 15.267 -0.298 -4.661 1.00 0.00 O ATOM 1172 CG2 THR B 21 14.700 1.782 -3.659 1.00 0.00 C ATOM 0 H THR B 21 14.980 -0.101 -7.115 1.00 0.00 H new ATOM 0 HA THR B 21 12.854 0.794 -5.374 1.00 0.00 H new ATOM 0 HB THR B 21 15.790 1.534 -5.484 1.00 0.00 H new ATOM 0 HG1 THR B 21 16.040 -0.328 -4.059 1.00 0.00 H new ATOM 0 HG21 THR B 21 15.584 1.723 -3.025 1.00 0.00 H new ATOM 0 HG22 THR B 21 14.473 2.827 -3.869 1.00 0.00 H new ATOM 0 HG23 THR B 21 13.855 1.323 -3.146 1.00 0.00 H new ATOM 1180 N ILE B 22 12.921 3.369 -5.642 1.00 0.00 N ATOM 1181 CA ILE B 22 12.750 4.783 -5.951 1.00 0.00 C ATOM 1182 C ILE B 22 13.317 5.601 -4.793 1.00 0.00 C ATOM 1183 O ILE B 22 12.714 5.689 -3.725 1.00 0.00 O ATOM 1184 CB ILE B 22 11.282 5.108 -6.276 1.00 0.00 C ATOM 1185 CG1 ILE B 22 11.048 6.619 -6.378 1.00 0.00 C ATOM 1186 CG2 ILE B 22 10.309 4.538 -5.244 1.00 0.00 C ATOM 1187 CD1 ILE B 22 11.876 7.234 -7.505 1.00 0.00 C ATOM 0 H ILE B 22 12.518 3.098 -4.745 1.00 0.00 H new ATOM 0 HA ILE B 22 13.303 5.048 -6.852 1.00 0.00 H new ATOM 0 HB ILE B 22 11.088 4.636 -7.239 1.00 0.00 H new ATOM 0 HG12 ILE B 22 9.990 6.814 -6.553 1.00 0.00 H new ATOM 0 HG13 ILE B 22 11.308 7.094 -5.432 1.00 0.00 H new ATOM 0 HG21 ILE B 22 9.288 4.798 -5.524 1.00 0.00 H new ATOM 0 HG22 ILE B 22 10.410 3.453 -5.209 1.00 0.00 H new ATOM 0 HG23 ILE B 22 10.534 4.956 -4.263 1.00 0.00 H new ATOM 0 HD11 ILE B 22 11.688 8.307 -7.551 1.00 0.00 H new ATOM 0 HD12 ILE B 22 12.935 7.059 -7.315 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.597 6.775 -8.454 1.00 0.00 H new ATOM 1199 N LEU B 23 14.488 6.204 -5.009 1.00 0.00 N ATOM 1200 CA LEU B 23 15.202 6.902 -3.952 1.00 0.00 C ATOM 1201 C LEU B 23 14.586 8.274 -3.705 1.00 0.00 C ATOM 1202 O LEU B 23 14.695 8.799 -2.598 1.00 0.00 O ATOM 1203 CB LEU B 23 16.682 7.042 -4.314 1.00 0.00 C ATOM 1204 CG LEU B 23 17.324 5.702 -4.693 1.00 0.00 C ATOM 1205 CD1 LEU B 23 18.837 5.880 -4.767 1.00 0.00 C ATOM 1206 CD2 LEU B 23 17.028 4.621 -3.658 1.00 0.00 C ATOM 0 H LEU B 23 14.959 6.219 -5.913 1.00 0.00 H new ATOM 0 HA LEU B 23 15.120 6.317 -3.036 1.00 0.00 H new ATOM 0 HB2 LEU B 23 16.785 7.738 -5.146 1.00 0.00 H new ATOM 0 HB3 LEU B 23 17.220 7.473 -3.470 1.00 0.00 H new ATOM 0 HG LEU B 23 16.909 5.394 -5.653 1.00 0.00 H new ATOM 0 HD11 LEU B 23 19.302 4.932 -5.036 1.00 0.00 H new ATOM 0 HD12 LEU B 23 19.079 6.629 -5.521 1.00 0.00 H new ATOM 0 HD13 LEU B 23 19.213 6.206 -3.797 1.00 0.00 H new ATOM 0 HD21 LEU B 23 17.500 3.687 -3.962 1.00 0.00 H new ATOM 0 HD22 LEU B 23 17.422 4.928 -2.689 1.00 0.00 H new ATOM 0 HD23 LEU B 23 15.950 4.475 -3.582 1.00 0.00 H new ATOM 1218 N GLY B 24 13.942 8.854 -4.724 1.00 0.00 N ATOM 1219 CA GLY B 24 13.164 10.065 -4.520 1.00 0.00 C ATOM 1220 C GLY B 24 13.235 11.042 -5.684 1.00 0.00 C ATOM 1221 O GLY B 24 13.925 10.814 -6.676 1.00 0.00 O ATOM 0 H GLY B 24 13.948 8.505 -5.682 1.00 0.00 H new ATOM 0 HA2 GLY B 24 12.123 9.792 -4.349 1.00 0.00 H new ATOM 0 HA3 GLY B 24 13.515 10.564 -3.617 1.00 0.00 H new ATOM 1225 N VAL B 25 12.499 12.146 -5.538 1.00 0.00 N ATOM 1226 CA VAL B 25 12.430 13.201 -6.536 1.00 0.00 C ATOM 1227 C VAL B 25 13.753 13.961 -6.609 1.00 0.00 C ATOM 1228 O VAL B 25 14.578 13.879 -5.699 1.00 0.00 O ATOM 1229 CB VAL B 25 11.276 14.156 -6.199 1.00 0.00 C ATOM 1230 CG1 VAL B 25 9.969 13.373 -6.051 1.00 0.00 C ATOM 1231 CG2 VAL B 25 11.536 14.918 -4.899 1.00 0.00 C ATOM 0 H VAL B 25 11.930 12.329 -4.712 1.00 0.00 H new ATOM 0 HA VAL B 25 12.246 12.753 -7.512 1.00 0.00 H new ATOM 0 HB VAL B 25 11.200 14.871 -7.018 1.00 0.00 H new ATOM 0 HG11 VAL B 25 9.158 14.061 -5.812 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.745 12.859 -6.986 1.00 0.00 H new ATOM 0 HG13 VAL B 25 10.072 12.641 -5.250 1.00 0.00 H new ATOM 0 HG21 VAL B 25 10.698 15.584 -4.694 1.00 0.00 H new ATOM 0 HG22 VAL B 25 11.646 14.210 -4.078 1.00 0.00 H new ATOM 0 HG23 VAL B 25 12.449 15.505 -4.998 1.00 0.00 H new ATOM 1241 N SER B 26 13.947 14.704 -7.700 1.00 0.00 N ATOM 1242 CA SER B 26 15.133 15.515 -7.946 1.00 0.00 C ATOM 1243 C SER B 26 14.747 16.691 -8.841 1.00 0.00 C ATOM 1244 O SER B 26 15.451 17.013 -9.798 1.00 0.00 O ATOM 1245 CB SER B 26 16.217 14.659 -8.605 1.00 0.00 C ATOM 1246 OG SER B 26 16.714 13.702 -7.693 1.00 0.00 O ATOM 0 H SER B 26 13.263 14.757 -8.455 1.00 0.00 H new ATOM 0 HA SER B 26 15.530 15.898 -7.006 1.00 0.00 H new ATOM 0 HB2 SER B 26 15.809 14.157 -9.482 1.00 0.00 H new ATOM 0 HB3 SER B 26 17.031 15.296 -8.952 1.00 0.00 H new ATOM 0 HG SER B 26 17.405 13.162 -8.130 1.00 0.00 H new ATOM 1252 N GLY B 27 13.621 17.338 -8.528 1.00 0.00 N ATOM 1253 CA GLY B 27 13.075 18.407 -9.349 1.00 0.00 C ATOM 1254 C GLY B 27 12.365 17.793 -10.546 1.00 0.00 C ATOM 1255 O GLY B 27 11.514 16.920 -10.377 1.00 0.00 O ATOM 0 H GLY B 27 13.067 17.131 -7.697 1.00 0.00 H new ATOM 0 HA2 GLY B 27 12.379 19.012 -8.767 1.00 0.00 H new ATOM 0 HA3 GLY B 27 13.872 19.071 -9.683 1.00 0.00 H new ATOM 1259 N GLN B 28 12.706 18.241 -11.756 1.00 0.00 N ATOM 1260 CA GLN B 28 12.181 17.627 -12.966 1.00 0.00 C ATOM 1261 C GLN B 28 12.827 16.252 -13.179 1.00 0.00 C ATOM 1262 O GLN B 28 12.437 15.517 -14.086 1.00 0.00 O ATOM 1263 CB GLN B 28 12.429 18.562 -14.155 1.00 0.00 C ATOM 1264 CG GLN B 28 11.609 18.165 -15.388 1.00 0.00 C ATOM 1265 CD GLN B 28 10.110 18.224 -15.119 1.00 0.00 C ATOM 1266 OE1 GLN B 28 9.452 17.196 -14.992 1.00 0.00 O ATOM 1267 NE2 GLN B 28 9.555 19.430 -15.029 1.00 0.00 N ATOM 0 H GLN B 28 13.340 19.023 -11.918 1.00 0.00 H new ATOM 0 HA GLN B 28 11.106 17.472 -12.872 1.00 0.00 H new ATOM 0 HB2 GLN B 28 12.180 19.584 -13.869 1.00 0.00 H new ATOM 0 HB3 GLN B 28 13.489 18.552 -14.408 1.00 0.00 H new ATOM 0 HG2 GLN B 28 11.855 18.829 -16.217 1.00 0.00 H new ATOM 0 HG3 GLN B 28 11.883 17.156 -15.696 1.00 0.00 H new ATOM 0 HE21 GLN B 28 10.130 20.265 -15.139 1.00 0.00 H new ATOM 0 HE22 GLN B 28 8.555 19.519 -14.850 1.00 0.00 H new ATOM 1276 N GLN B 29 13.813 15.896 -12.347 1.00 0.00 N ATOM 1277 CA GLN B 29 14.449 14.590 -12.410 1.00 0.00 C ATOM 1278 C GLN B 29 13.903 13.671 -11.320 1.00 0.00 C ATOM 1279 O GLN B 29 13.174 14.106 -10.429 1.00 0.00 O ATOM 1280 CB GLN B 29 15.965 14.720 -12.258 1.00 0.00 C ATOM 1281 CG GLN B 29 16.586 15.584 -13.354 1.00 0.00 C ATOM 1282 CD GLN B 29 18.092 15.674 -13.182 1.00 0.00 C ATOM 1283 OE1 GLN B 29 18.854 15.193 -14.016 1.00 0.00 O ATOM 1284 NE2 GLN B 29 18.536 16.293 -12.096 1.00 0.00 N ATOM 0 H GLN B 29 14.185 16.506 -11.619 1.00 0.00 H new ATOM 0 HA GLN B 29 14.226 14.156 -13.385 1.00 0.00 H new ATOM 0 HB2 GLN B 29 16.194 15.152 -11.284 1.00 0.00 H new ATOM 0 HB3 GLN B 29 16.417 13.728 -12.281 1.00 0.00 H new ATOM 0 HG2 GLN B 29 16.352 15.163 -14.332 1.00 0.00 H new ATOM 0 HG3 GLN B 29 16.152 16.583 -13.325 1.00 0.00 H new ATOM 0 HE21 GLN B 29 17.874 16.681 -11.424 1.00 0.00 H new ATOM 0 HE22 GLN B 29 19.539 16.381 -11.933 1.00 0.00 H new ATOM 1293 N VAL B 30 14.266 12.388 -11.400 1.00 0.00 N ATOM 1294 CA VAL B 30 13.880 11.363 -10.444 1.00 0.00 C ATOM 1295 C VAL B 30 15.043 10.390 -10.275 1.00 0.00 C ATOM 1296 O VAL B 30 15.585 9.899 -11.265 1.00 0.00 O ATOM 1297 CB VAL B 30 12.640 10.622 -10.957 1.00 0.00 C ATOM 1298 CG1 VAL B 30 12.238 9.528 -9.970 1.00 0.00 C ATOM 1299 CG2 VAL B 30 11.452 11.569 -11.122 1.00 0.00 C ATOM 0 H VAL B 30 14.852 12.030 -12.154 1.00 0.00 H new ATOM 0 HA VAL B 30 13.641 11.817 -9.482 1.00 0.00 H new ATOM 0 HB VAL B 30 12.897 10.193 -11.925 1.00 0.00 H new ATOM 0 HG11 VAL B 30 11.356 9.007 -10.343 1.00 0.00 H new ATOM 0 HG12 VAL B 30 13.058 8.819 -9.859 1.00 0.00 H new ATOM 0 HG13 VAL B 30 12.012 9.976 -9.002 1.00 0.00 H new ATOM 0 HG21 VAL B 30 10.590 11.011 -11.487 1.00 0.00 H new ATOM 0 HG22 VAL B 30 11.211 12.021 -10.160 1.00 0.00 H new ATOM 0 HG23 VAL B 30 11.707 12.351 -11.837 1.00 0.00 H new ATOM 1309 N ARG B 31 15.430 10.111 -9.026 1.00 0.00 N ATOM 1310 CA ARG B 31 16.503 9.172 -8.736 1.00 0.00 C ATOM 1311 C ARG B 31 15.925 7.790 -8.455 1.00 0.00 C ATOM 1312 O ARG B 31 15.326 7.558 -7.403 1.00 0.00 O ATOM 1313 CB ARG B 31 17.363 9.677 -7.578 1.00 0.00 C ATOM 1314 CG ARG B 31 18.533 8.716 -7.360 1.00 0.00 C ATOM 1315 CD ARG B 31 19.601 9.358 -6.475 1.00 0.00 C ATOM 1316 NE ARG B 31 20.304 10.410 -7.219 1.00 0.00 N ATOM 1317 CZ ARG B 31 21.495 10.929 -6.905 1.00 0.00 C ATOM 1318 NH1 ARG B 31 22.169 10.531 -5.829 1.00 0.00 N ATOM 1319 NH2 ARG B 31 22.019 11.867 -7.689 1.00 0.00 N ATOM 0 H ARG B 31 15.008 10.530 -8.197 1.00 0.00 H new ATOM 0 HA ARG B 31 17.153 9.091 -9.607 1.00 0.00 H new ATOM 0 HB2 ARG B 31 17.735 10.678 -7.796 1.00 0.00 H new ATOM 0 HB3 ARG B 31 16.764 9.751 -6.670 1.00 0.00 H new ATOM 0 HG2 ARG B 31 18.174 7.797 -6.897 1.00 0.00 H new ATOM 0 HG3 ARG B 31 18.967 8.440 -8.321 1.00 0.00 H new ATOM 0 HD2 ARG B 31 19.140 9.779 -5.582 1.00 0.00 H new ATOM 0 HD3 ARG B 31 20.311 8.601 -6.141 1.00 0.00 H new ATOM 0 HE ARG B 31 19.842 10.778 -8.051 1.00 0.00 H new ATOM 0 HH11 ARG B 31 21.779 9.812 -5.220 1.00 0.00 H new ATOM 0 HH12 ARG B 31 23.076 10.945 -5.614 1.00 0.00 H new ATOM 0 HH21 ARG B 31 21.513 12.181 -8.517 1.00 0.00 H new ATOM 0 HH22 ARG B 31 22.927 12.272 -7.462 1.00 0.00 H new ATOM 1333 N ILE B 32 16.122 6.884 -9.417 1.00 0.00 N ATOM 1334 CA ILE B 32 15.655 5.506 -9.372 1.00 0.00 C ATOM 1335 C ILE B 32 16.850 4.599 -9.071 1.00 0.00 C ATOM 1336 O ILE B 32 17.995 4.995 -9.282 1.00 0.00 O ATOM 1337 CB ILE B 32 14.993 5.163 -10.720 1.00 0.00 C ATOM 1338 CG1 ILE B 32 13.883 6.182 -11.021 1.00 0.00 C ATOM 1339 CG2 ILE B 32 14.407 3.748 -10.712 1.00 0.00 C ATOM 1340 CD1 ILE B 32 13.239 5.958 -12.390 1.00 0.00 C ATOM 0 H ILE B 32 16.629 7.103 -10.275 1.00 0.00 H new ATOM 0 HA ILE B 32 14.912 5.361 -8.588 1.00 0.00 H new ATOM 0 HB ILE B 32 15.758 5.206 -11.495 1.00 0.00 H new ATOM 0 HG12 ILE B 32 13.117 6.119 -10.248 1.00 0.00 H new ATOM 0 HG13 ILE B 32 14.297 7.189 -10.978 1.00 0.00 H new ATOM 0 HG21 ILE B 32 13.948 3.539 -11.678 1.00 0.00 H new ATOM 0 HG22 ILE B 32 15.202 3.026 -10.524 1.00 0.00 H new ATOM 0 HG23 ILE B 32 13.654 3.671 -9.928 1.00 0.00 H new ATOM 0 HD11 ILE B 32 12.462 6.704 -12.553 1.00 0.00 H new ATOM 0 HD12 ILE B 32 13.997 6.048 -13.168 1.00 0.00 H new ATOM 0 HD13 ILE B 32 12.799 4.962 -12.426 1.00 0.00 H new ATOM 1352 N GLY B 33 16.592 3.385 -8.577 1.00 0.00 N ATOM 1353 CA GLY B 33 17.632 2.429 -8.226 1.00 0.00 C ATOM 1354 C GLY B 33 17.338 1.060 -8.830 1.00 0.00 C ATOM 1355 O GLY B 33 16.539 0.301 -8.285 1.00 0.00 O ATOM 0 H GLY B 33 15.647 3.041 -8.410 1.00 0.00 H new ATOM 0 HA2 GLY B 33 18.597 2.788 -8.582 1.00 0.00 H new ATOM 0 HA3 GLY B 33 17.703 2.345 -7.142 1.00 0.00 H new ATOM 1359 N ILE B 34 17.982 0.743 -9.957 1.00 0.00 N ATOM 1360 CA ILE B 34 17.771 -0.520 -10.648 1.00 0.00 C ATOM 1361 C ILE B 34 18.719 -1.558 -10.055 1.00 0.00 C ATOM 1362 O ILE B 34 19.936 -1.419 -10.168 1.00 0.00 O ATOM 1363 CB ILE B 34 18.025 -0.363 -12.156 1.00 0.00 C ATOM 1364 CG1 ILE B 34 17.035 0.596 -12.831 1.00 0.00 C ATOM 1365 CG2 ILE B 34 17.864 -1.736 -12.815 1.00 0.00 C ATOM 1366 CD1 ILE B 34 17.396 2.069 -12.629 1.00 0.00 C ATOM 0 H ILE B 34 18.660 1.356 -10.410 1.00 0.00 H new ATOM 0 HA ILE B 34 16.738 -0.841 -10.518 1.00 0.00 H new ATOM 0 HB ILE B 34 19.028 0.046 -12.277 1.00 0.00 H new ATOM 0 HG12 ILE B 34 16.999 0.380 -13.899 1.00 0.00 H new ATOM 0 HG13 ILE B 34 16.036 0.415 -12.435 1.00 0.00 H new ATOM 0 HG21 ILE B 34 18.040 -1.648 -13.887 1.00 0.00 H new ATOM 0 HG22 ILE B 34 18.584 -2.433 -12.385 1.00 0.00 H new ATOM 0 HG23 ILE B 34 16.853 -2.106 -12.643 1.00 0.00 H new ATOM 0 HD11 ILE B 34 16.659 2.696 -13.130 1.00 0.00 H new ATOM 0 HD12 ILE B 34 17.404 2.299 -11.564 1.00 0.00 H new ATOM 0 HD13 ILE B 34 18.383 2.263 -13.050 1.00 0.00 H new ATOM 1378 N ASN B 35 18.172 -2.597 -9.424 1.00 0.00 N ATOM 1379 CA ASN B 35 18.974 -3.624 -8.782 1.00 0.00 C ATOM 1380 C ASN B 35 18.743 -4.982 -9.429 1.00 0.00 C ATOM 1381 O ASN B 35 17.671 -5.571 -9.310 1.00 0.00 O ATOM 1382 CB ASN B 35 18.660 -3.664 -7.289 1.00 0.00 C ATOM 1383 CG ASN B 35 19.650 -4.553 -6.549 1.00 0.00 C ATOM 1384 OD1 ASN B 35 20.849 -4.287 -6.556 1.00 0.00 O ATOM 1385 ND2 ASN B 35 19.158 -5.608 -5.908 1.00 0.00 N ATOM 0 H ASN B 35 17.166 -2.745 -9.347 1.00 0.00 H new ATOM 0 HA ASN B 35 20.028 -3.379 -8.911 1.00 0.00 H new ATOM 0 HB2 ASN B 35 18.695 -2.655 -6.879 1.00 0.00 H new ATOM 0 HB3 ASN B 35 17.647 -4.036 -7.136 1.00 0.00 H new ATOM 0 HD21 ASN B 35 19.783 -6.232 -5.397 1.00 0.00 H new ATOM 0 HD22 ASN B 35 18.155 -5.794 -5.927 1.00 0.00 H new ATOM 1392 N ALA B 36 19.775 -5.466 -10.117 1.00 0.00 N ATOM 1393 CA ALA B 36 19.776 -6.750 -10.796 1.00 0.00 C ATOM 1394 C ALA B 36 21.181 -7.349 -10.710 1.00 0.00 C ATOM 1395 O ALA B 36 22.151 -6.611 -10.536 1.00 0.00 O ATOM 1396 CB ALA B 36 19.364 -6.527 -12.251 1.00 0.00 C ATOM 0 H ALA B 36 20.654 -4.959 -10.217 1.00 0.00 H new ATOM 0 HA ALA B 36 19.073 -7.442 -10.332 1.00 0.00 H new ATOM 0 HB1 ALA B 36 19.359 -7.481 -12.778 1.00 0.00 H new ATOM 0 HB2 ALA B 36 18.366 -6.089 -12.284 1.00 0.00 H new ATOM 0 HB3 ALA B 36 20.073 -5.852 -12.730 1.00 0.00 H new ATOM 1402 N PRO B 37 21.314 -8.676 -10.829 1.00 0.00 N ATOM 1403 CA PRO B 37 22.606 -9.334 -10.807 1.00 0.00 C ATOM 1404 C PRO B 37 23.359 -9.041 -12.100 1.00 0.00 C ATOM 1405 O PRO B 37 22.763 -8.641 -13.097 1.00 0.00 O ATOM 1406 CB PRO B 37 22.284 -10.823 -10.668 1.00 0.00 C ATOM 1407 CG PRO B 37 20.923 -10.949 -11.351 1.00 0.00 C ATOM 1408 CD PRO B 37 20.236 -9.634 -10.991 1.00 0.00 C ATOM 0 HA PRO B 37 23.245 -8.989 -9.994 1.00 0.00 H new ATOM 0 HB2 PRO B 37 23.037 -11.445 -11.152 1.00 0.00 H new ATOM 0 HB3 PRO B 37 22.241 -11.130 -9.623 1.00 0.00 H new ATOM 0 HG2 PRO B 37 21.022 -11.071 -12.430 1.00 0.00 H new ATOM 0 HG3 PRO B 37 20.365 -11.810 -10.983 1.00 0.00 H new ATOM 0 HD2 PRO B 37 19.546 -9.322 -11.775 1.00 0.00 H new ATOM 0 HD3 PRO B 37 19.654 -9.731 -10.075 1.00 0.00 H new ATOM 1416 N LYS B 38 24.681 -9.239 -12.090 1.00 0.00 N ATOM 1417 CA LYS B 38 25.511 -9.012 -13.265 1.00 0.00 C ATOM 1418 C LYS B 38 25.213 -10.032 -14.368 1.00 0.00 C ATOM 1419 O LYS B 38 25.815 -9.977 -15.439 1.00 0.00 O ATOM 1420 CB LYS B 38 26.989 -9.035 -12.859 1.00 0.00 C ATOM 1421 CG LYS B 38 27.343 -7.830 -11.974 1.00 0.00 C ATOM 1422 CD LYS B 38 27.311 -6.504 -12.745 1.00 0.00 C ATOM 1423 CE LYS B 38 28.345 -6.461 -13.873 1.00 0.00 C ATOM 1424 NZ LYS B 38 29.723 -6.536 -13.349 1.00 0.00 N ATOM 0 H LYS B 38 25.198 -9.559 -11.271 1.00 0.00 H new ATOM 0 HA LYS B 38 25.277 -8.031 -13.677 1.00 0.00 H new ATOM 0 HB2 LYS B 38 27.207 -9.959 -12.323 1.00 0.00 H new ATOM 0 HB3 LYS B 38 27.614 -9.029 -13.752 1.00 0.00 H new ATOM 0 HG2 LYS B 38 26.643 -7.778 -11.140 1.00 0.00 H new ATOM 0 HG3 LYS B 38 28.336 -7.975 -11.549 1.00 0.00 H new ATOM 0 HD2 LYS B 38 26.315 -6.353 -13.162 1.00 0.00 H new ATOM 0 HD3 LYS B 38 27.495 -5.681 -12.055 1.00 0.00 H new ATOM 0 HE2 LYS B 38 28.170 -7.290 -14.559 1.00 0.00 H new ATOM 0 HE3 LYS B 38 28.222 -5.542 -14.445 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 30.397 -6.335 -14.115 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 29.844 -5.836 -12.589 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 29.900 -7.489 -12.973 1.00 0.00 H new ATOM 1438 N ASP B 39 24.285 -10.960 -14.112 1.00 0.00 N ATOM 1439 CA ASP B 39 23.813 -11.915 -15.105 1.00 0.00 C ATOM 1440 C ASP B 39 23.021 -11.207 -16.205 1.00 0.00 C ATOM 1441 O ASP B 39 22.776 -11.784 -17.264 1.00 0.00 O ATOM 1442 CB ASP B 39 22.913 -12.938 -14.414 1.00 0.00 C ATOM 1443 CG ASP B 39 22.551 -14.094 -15.346 1.00 0.00 C ATOM 1444 OD1 ASP B 39 23.491 -14.780 -15.805 1.00 0.00 O ATOM 1445 OD2 ASP B 39 21.337 -14.283 -15.590 1.00 0.00 O ATOM 0 H ASP B 39 23.840 -11.066 -13.200 1.00 0.00 H new ATOM 0 HA ASP B 39 24.672 -12.408 -15.560 1.00 0.00 H new ATOM 0 HB2 ASP B 39 23.417 -13.328 -13.530 1.00 0.00 H new ATOM 0 HB3 ASP B 39 22.002 -12.448 -14.071 1.00 0.00 H new ATOM 1450 N VAL B 40 22.619 -9.955 -15.955 1.00 0.00 N ATOM 1451 CA VAL B 40 21.841 -9.160 -16.893 1.00 0.00 C ATOM 1452 C VAL B 40 22.435 -7.758 -16.996 1.00 0.00 C ATOM 1453 O VAL B 40 23.324 -7.398 -16.223 1.00 0.00 O ATOM 1454 CB VAL B 40 20.369 -9.112 -16.457 1.00 0.00 C ATOM 1455 CG1 VAL B 40 19.824 -10.522 -16.220 1.00 0.00 C ATOM 1456 CG2 VAL B 40 20.185 -8.324 -15.160 1.00 0.00 C ATOM 0 H VAL B 40 22.831 -9.467 -15.085 1.00 0.00 H new ATOM 0 HA VAL B 40 21.880 -9.622 -17.879 1.00 0.00 H new ATOM 0 HB VAL B 40 19.828 -8.621 -17.265 1.00 0.00 H new ATOM 0 HG11 VAL B 40 18.780 -10.462 -15.912 1.00 0.00 H new ATOM 0 HG12 VAL B 40 19.898 -11.100 -17.141 1.00 0.00 H new ATOM 0 HG13 VAL B 40 20.405 -11.010 -15.438 1.00 0.00 H new ATOM 0 HG21 VAL B 40 19.130 -8.314 -14.887 1.00 0.00 H new ATOM 0 HG22 VAL B 40 20.762 -8.794 -14.364 1.00 0.00 H new ATOM 0 HG23 VAL B 40 20.532 -7.301 -15.304 1.00 0.00 H new ATOM 1466 N ALA B 41 21.948 -6.961 -17.950 1.00 0.00 N ATOM 1467 CA ALA B 41 22.467 -5.621 -18.167 1.00 0.00 C ATOM 1468 C ALA B 41 21.410 -4.568 -17.847 1.00 0.00 C ATOM 1469 O ALA B 41 20.217 -4.863 -17.824 1.00 0.00 O ATOM 1470 CB ALA B 41 22.946 -5.499 -19.614 1.00 0.00 C ATOM 0 H ALA B 41 21.193 -7.227 -18.583 1.00 0.00 H new ATOM 0 HA ALA B 41 23.308 -5.447 -17.496 1.00 0.00 H new ATOM 0 HB1 ALA B 41 23.337 -4.496 -19.785 1.00 0.00 H new ATOM 0 HB2 ALA B 41 23.732 -6.231 -19.800 1.00 0.00 H new ATOM 0 HB3 ALA B 41 22.111 -5.683 -20.290 1.00 0.00 H new ATOM 1476 N VAL B 42 21.866 -3.338 -17.601 1.00 0.00 N ATOM 1477 CA VAL B 42 21.011 -2.192 -17.321 1.00 0.00 C ATOM 1478 C VAL B 42 21.707 -0.923 -17.803 1.00 0.00 C ATOM 1479 O VAL B 42 22.800 -0.593 -17.349 1.00 0.00 O ATOM 1480 CB VAL B 42 20.657 -2.126 -15.826 1.00 0.00 C ATOM 1481 CG1 VAL B 42 21.815 -2.565 -14.934 1.00 0.00 C ATOM 1482 CG2 VAL B 42 20.234 -0.716 -15.412 1.00 0.00 C ATOM 0 H VAL B 42 22.860 -3.111 -17.592 1.00 0.00 H new ATOM 0 HA VAL B 42 20.069 -2.294 -17.859 1.00 0.00 H new ATOM 0 HB VAL B 42 19.825 -2.817 -15.689 1.00 0.00 H new ATOM 0 HG11 VAL B 42 21.514 -2.500 -13.888 1.00 0.00 H new ATOM 0 HG12 VAL B 42 22.086 -3.594 -15.170 1.00 0.00 H new ATOM 0 HG13 VAL B 42 22.673 -1.915 -15.105 1.00 0.00 H new ATOM 0 HG21 VAL B 42 19.991 -0.706 -14.349 1.00 0.00 H new ATOM 0 HG22 VAL B 42 21.051 -0.020 -15.604 1.00 0.00 H new ATOM 0 HG23 VAL B 42 19.358 -0.415 -15.987 1.00 0.00 H new ATOM 1492 N HIS B 43 21.061 -0.211 -18.729 1.00 0.00 N ATOM 1493 CA HIS B 43 21.569 1.040 -19.274 1.00 0.00 C ATOM 1494 C HIS B 43 20.421 2.018 -19.519 1.00 0.00 C ATOM 1495 O HIS B 43 19.258 1.623 -19.535 1.00 0.00 O ATOM 1496 CB HIS B 43 22.320 0.769 -20.582 1.00 0.00 C ATOM 1497 CG HIS B 43 23.561 -0.068 -20.405 1.00 0.00 C ATOM 1498 ND1 HIS B 43 24.856 0.400 -20.379 1.00 0.00 N ATOM 1499 CD2 HIS B 43 23.605 -1.426 -20.239 1.00 0.00 C ATOM 1500 CE1 HIS B 43 25.660 -0.660 -20.173 1.00 0.00 C ATOM 1501 NE2 HIS B 43 24.945 -1.794 -20.089 1.00 0.00 N ATOM 0 H HIS B 43 20.163 -0.493 -19.122 1.00 0.00 H new ATOM 0 HA HIS B 43 22.256 1.486 -18.554 1.00 0.00 H new ATOM 0 HB2 HIS B 43 21.649 0.266 -21.278 1.00 0.00 H new ATOM 0 HB3 HIS B 43 22.596 1.721 -21.036 1.00 0.00 H new ATOM 0 HD2 HIS B 43 22.756 -2.094 -20.226 1.00 0.00 H new ATOM 0 HE1 HIS B 43 26.735 -0.606 -20.087 1.00 0.00 H new ATOM 0 HE2 HIS B 43 25.308 -2.736 -19.944 1.00 0.00 H new ATOM 1509 N ARG B 44 20.752 3.300 -19.710 1.00 0.00 N ATOM 1510 CA ARG B 44 19.767 4.331 -20.015 1.00 0.00 C ATOM 1511 C ARG B 44 19.565 4.440 -21.527 1.00 0.00 C ATOM 1512 O ARG B 44 20.337 3.879 -22.303 1.00 0.00 O ATOM 1513 CB ARG B 44 20.215 5.663 -19.405 1.00 0.00 C ATOM 1514 CG ARG B 44 21.530 6.102 -20.045 1.00 0.00 C ATOM 1515 CD ARG B 44 22.038 7.426 -19.492 1.00 0.00 C ATOM 1516 NE ARG B 44 22.707 7.269 -18.203 1.00 0.00 N ATOM 1517 CZ ARG B 44 23.224 8.291 -17.519 1.00 0.00 C ATOM 1518 NH1 ARG B 44 23.119 9.541 -17.967 1.00 0.00 N ATOM 1519 NH2 ARG B 44 23.853 8.052 -16.375 1.00 0.00 N ATOM 0 H ARG B 44 21.710 3.646 -19.657 1.00 0.00 H new ATOM 0 HA ARG B 44 18.806 4.062 -19.577 1.00 0.00 H new ATOM 0 HB2 ARG B 44 19.450 6.423 -19.564 1.00 0.00 H new ATOM 0 HB3 ARG B 44 20.341 5.557 -18.327 1.00 0.00 H new ATOM 0 HG2 ARG B 44 22.284 5.332 -19.882 1.00 0.00 H new ATOM 0 HG3 ARG B 44 21.393 6.191 -21.123 1.00 0.00 H new ATOM 0 HD2 ARG B 44 22.730 7.874 -20.206 1.00 0.00 H new ATOM 0 HD3 ARG B 44 21.202 8.116 -19.383 1.00 0.00 H new ATOM 0 HE ARG B 44 22.783 6.332 -17.807 1.00 0.00 H new ATOM 0 HH11 ARG B 44 22.637 9.729 -18.846 1.00 0.00 H new ATOM 0 HH12 ARG B 44 23.520 10.310 -17.431 1.00 0.00 H new ATOM 0 HH21 ARG B 44 23.936 7.096 -16.029 1.00 0.00 H new ATOM 0 HH22 ARG B 44 24.253 8.824 -15.842 1.00 0.00 H new