USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 798 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 Single : A 1 GLY N :NH3+ -115:sc= 0.113 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 54:sc= 1.07 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.207 K(o=-0.21,f=-2.4!) USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.0464 USER MOD Single : A 20 GLN : amide:sc= -0.0963 X(o=-0.096,f=-0.51) USER MOD Single : A 33 SER OG : rot 180:sc= -0.0124 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.0213 USER MOD Single : A 38 LYS NZ :NH3+ 163:sc= 0.979 (180deg=0.348) USER MOD Single : A 41 GLN : amide:sc= -0.355 X(o=-0.35,f=0) USER MOD Single : A 45 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.6) USER MOD Single : A 50 LYS NZ :NH3+ -160:sc= 1 (180deg=0.509) USER MOD Single : A 51 HIS : no HE2:sc= -1.65 K(o=-1.7,f=-8.1!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -1.55 K(o=-1.5,f=-4.3!) USER MOD Single : A 61 HIS : no HE2:sc= -0.434 K(o=-0.43,f=-1.5) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 MET CE :methyl -116:sc= -1.14 (180deg=-2.85) USER MOD Single : A 73 ASN : amide:sc= -0.312 K(o=-0.31,f=-1.1) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.1!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -167:sc= -0.101 (180deg=-0.412) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 16:sc= 0.855 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -32.372 -11.059 -6.284 1.00 0.00 N ATOM 2 CA GLY A 1 -31.578 -12.113 -5.676 1.00 0.00 C ATOM 3 C GLY A 1 -30.112 -11.691 -5.550 1.00 0.00 C ATOM 4 O GLY A 1 -29.699 -10.688 -6.129 1.00 0.00 O ATOM 0 H1 GLY A 1 -33.066 -10.706 -5.595 1.00 0.00 H new ATOM 0 H2 GLY A 1 -31.749 -10.280 -6.577 1.00 0.00 H new ATOM 0 H3 GLY A 1 -32.870 -11.435 -7.116 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -31.978 -12.352 -4.690 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -31.649 -13.020 -6.277 1.00 0.00 H new ATOM 8 N SER A 2 -29.367 -12.479 -4.789 1.00 0.00 N ATOM 9 CA SER A 2 -27.957 -12.200 -4.579 1.00 0.00 C ATOM 10 C SER A 2 -27.293 -13.373 -3.854 1.00 0.00 C ATOM 11 O SER A 2 -27.977 -14.226 -3.290 1.00 0.00 O ATOM 12 CB SER A 2 -27.763 -10.907 -3.784 1.00 0.00 C ATOM 13 OG SER A 2 -28.005 -11.095 -2.392 1.00 0.00 O ATOM 0 H SER A 2 -29.713 -13.310 -4.310 1.00 0.00 H new ATOM 0 HA SER A 2 -27.486 -12.070 -5.553 1.00 0.00 H new ATOM 0 HB2 SER A 2 -26.747 -10.541 -3.929 1.00 0.00 H new ATOM 0 HB3 SER A 2 -28.436 -10.140 -4.169 1.00 0.00 H new ATOM 0 HG SER A 2 -27.869 -10.248 -1.919 1.00 0.00 H new ATOM 19 N SER A 3 -25.969 -13.379 -3.893 1.00 0.00 N ATOM 20 CA SER A 3 -25.206 -14.433 -3.247 1.00 0.00 C ATOM 21 C SER A 3 -23.734 -14.028 -3.148 1.00 0.00 C ATOM 22 O SER A 3 -23.290 -13.112 -3.840 1.00 0.00 O ATOM 23 CB SER A 3 -25.342 -15.755 -4.005 1.00 0.00 C ATOM 24 OG SER A 3 -25.150 -15.590 -5.407 1.00 0.00 O ATOM 0 H SER A 3 -25.405 -12.670 -4.362 1.00 0.00 H new ATOM 0 HA SER A 3 -25.605 -14.578 -2.243 1.00 0.00 H new ATOM 0 HB2 SER A 3 -24.614 -16.469 -3.621 1.00 0.00 H new ATOM 0 HB3 SER A 3 -26.330 -16.178 -3.822 1.00 0.00 H new ATOM 0 HG SER A 3 -25.243 -16.457 -5.854 1.00 0.00 H new ATOM 30 N GLY A 4 -23.017 -14.730 -2.283 1.00 0.00 N ATOM 31 CA GLY A 4 -21.604 -14.455 -2.085 1.00 0.00 C ATOM 32 C GLY A 4 -20.818 -15.750 -1.872 1.00 0.00 C ATOM 33 O GLY A 4 -21.236 -16.816 -2.322 1.00 0.00 O ATOM 0 H GLY A 4 -23.388 -15.489 -1.711 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.209 -13.924 -2.951 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.475 -13.801 -1.223 1.00 0.00 H new ATOM 37 N SER A 5 -19.692 -15.616 -1.186 1.00 0.00 N ATOM 38 CA SER A 5 -18.844 -16.762 -0.908 1.00 0.00 C ATOM 39 C SER A 5 -17.625 -16.326 -0.092 1.00 0.00 C ATOM 40 O SER A 5 -17.327 -15.136 -0.004 1.00 0.00 O ATOM 41 CB SER A 5 -18.399 -17.445 -2.202 1.00 0.00 C ATOM 42 OG SER A 5 -19.223 -18.561 -2.528 1.00 0.00 O ATOM 0 H SER A 5 -19.348 -14.731 -0.815 1.00 0.00 H new ATOM 0 HA SER A 5 -19.422 -17.482 -0.329 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.425 -16.724 -3.019 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.365 -17.775 -2.101 1.00 0.00 H new ATOM 0 HG SER A 5 -20.161 -18.280 -2.549 1.00 0.00 H new ATOM 48 N SER A 6 -16.954 -17.312 0.483 1.00 0.00 N ATOM 49 CA SER A 6 -15.774 -17.045 1.288 1.00 0.00 C ATOM 50 C SER A 6 -14.894 -18.295 1.359 1.00 0.00 C ATOM 51 O SER A 6 -15.343 -19.393 1.036 1.00 0.00 O ATOM 52 CB SER A 6 -16.161 -16.588 2.697 1.00 0.00 C ATOM 53 OG SER A 6 -15.210 -15.678 3.242 1.00 0.00 O ATOM 0 H SER A 6 -17.205 -18.298 0.408 1.00 0.00 H new ATOM 0 HA SER A 6 -15.212 -16.240 0.815 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.142 -16.113 2.668 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.247 -17.457 3.349 1.00 0.00 H new ATOM 0 HG SER A 6 -15.493 -15.408 4.141 1.00 0.00 H new ATOM 59 N GLY A 7 -13.656 -18.085 1.782 1.00 0.00 N ATOM 60 CA GLY A 7 -12.710 -19.181 1.899 1.00 0.00 C ATOM 61 C GLY A 7 -11.523 -18.789 2.782 1.00 0.00 C ATOM 62 O GLY A 7 -11.207 -17.607 2.914 1.00 0.00 O ATOM 0 H GLY A 7 -13.287 -17.172 2.048 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -13.209 -20.053 2.321 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.353 -19.465 0.909 1.00 0.00 H new ATOM 66 N ASP A 8 -10.899 -19.802 3.363 1.00 0.00 N ATOM 67 CA ASP A 8 -9.754 -19.578 4.230 1.00 0.00 C ATOM 68 C ASP A 8 -8.879 -20.833 4.246 1.00 0.00 C ATOM 69 O ASP A 8 -9.303 -21.896 3.794 1.00 0.00 O ATOM 70 CB ASP A 8 -10.198 -19.292 5.666 1.00 0.00 C ATOM 71 CG ASP A 8 -11.261 -20.245 6.216 1.00 0.00 C ATOM 72 OD1 ASP A 8 -10.861 -21.335 6.679 1.00 0.00 O ATOM 73 OD2 ASP A 8 -12.450 -19.862 6.160 1.00 0.00 O ATOM 0 H ASP A 8 -11.164 -20.781 3.251 1.00 0.00 H new ATOM 0 HA ASP A 8 -9.203 -18.720 3.846 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -9.324 -19.333 6.316 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -10.584 -18.274 5.715 1.00 0.00 H new ATOM 78 N GLN A 9 -7.674 -20.669 4.772 1.00 0.00 N ATOM 79 CA GLN A 9 -6.736 -21.775 4.853 1.00 0.00 C ATOM 80 C GLN A 9 -5.562 -21.410 5.765 1.00 0.00 C ATOM 81 O GLN A 9 -5.454 -20.272 6.217 1.00 0.00 O ATOM 82 CB GLN A 9 -6.244 -22.181 3.462 1.00 0.00 C ATOM 83 CG GLN A 9 -5.425 -21.058 2.821 1.00 0.00 C ATOM 84 CD GLN A 9 -4.090 -21.586 2.294 1.00 0.00 C ATOM 85 OE1 GLN A 9 -3.105 -21.683 3.007 1.00 0.00 O ATOM 86 NE2 GLN A 9 -4.111 -21.922 1.007 1.00 0.00 N ATOM 0 H GLN A 9 -7.326 -19.786 5.146 1.00 0.00 H new ATOM 0 HA GLN A 9 -7.253 -22.633 5.284 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -5.636 -23.083 3.536 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -7.096 -22.423 2.827 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -5.991 -20.611 2.004 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -5.245 -20.271 3.553 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -4.969 -21.816 0.466 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -3.269 -22.286 0.561 1.00 0.00 H new ATOM 95 N GLU A 10 -4.713 -22.398 6.006 1.00 0.00 N ATOM 96 CA GLU A 10 -3.551 -22.195 6.856 1.00 0.00 C ATOM 97 C GLU A 10 -2.780 -23.506 7.023 1.00 0.00 C ATOM 98 O GLU A 10 -2.976 -24.224 8.002 1.00 0.00 O ATOM 99 CB GLU A 10 -3.959 -21.621 8.214 1.00 0.00 C ATOM 100 CG GLU A 10 -5.119 -22.414 8.818 1.00 0.00 C ATOM 101 CD GLU A 10 -4.880 -22.689 10.305 1.00 0.00 C ATOM 102 OE1 GLU A 10 -5.070 -21.739 11.095 1.00 0.00 O ATOM 103 OE2 GLU A 10 -4.514 -23.842 10.617 1.00 0.00 O ATOM 0 H GLU A 10 -4.806 -23.341 5.628 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.895 -21.470 6.375 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.107 -21.643 8.893 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.249 -20.576 8.099 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.048 -21.859 8.692 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.236 -23.357 8.284 1.00 0.00 H new ATOM 110 N VAL A 11 -1.921 -23.778 6.052 1.00 0.00 N ATOM 111 CA VAL A 11 -1.120 -24.990 6.080 1.00 0.00 C ATOM 112 C VAL A 11 0.352 -24.628 5.872 1.00 0.00 C ATOM 113 O VAL A 11 1.177 -24.832 6.762 1.00 0.00 O ATOM 114 CB VAL A 11 -1.642 -25.986 5.043 1.00 0.00 C ATOM 115 CG1 VAL A 11 -0.779 -27.249 5.013 1.00 0.00 C ATOM 116 CG2 VAL A 11 -3.110 -26.331 5.305 1.00 0.00 C ATOM 0 H VAL A 11 -1.762 -23.180 5.241 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.201 -25.479 7.051 1.00 0.00 H new ATOM 0 HB VAL A 11 -1.578 -25.514 4.063 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.172 -27.940 4.268 1.00 0.00 H new ATOM 0 HG12 VAL A 11 0.246 -26.983 4.757 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.796 -27.725 5.994 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -3.457 -27.041 4.554 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -3.208 -26.774 6.296 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -3.712 -25.424 5.252 1.00 0.00 H new ATOM 126 N ARG A 12 0.637 -24.097 4.692 1.00 0.00 N ATOM 127 CA ARG A 12 1.996 -23.705 4.357 1.00 0.00 C ATOM 128 C ARG A 12 2.616 -22.906 5.504 1.00 0.00 C ATOM 129 O ARG A 12 1.906 -22.247 6.262 1.00 0.00 O ATOM 130 CB ARG A 12 2.026 -22.861 3.081 1.00 0.00 C ATOM 131 CG ARG A 12 1.655 -23.701 1.858 1.00 0.00 C ATOM 132 CD ARG A 12 2.890 -24.382 1.265 1.00 0.00 C ATOM 133 NE ARG A 12 2.924 -24.181 -0.201 1.00 0.00 N ATOM 134 CZ ARG A 12 2.003 -24.663 -1.046 1.00 0.00 C ATOM 135 NH1 ARG A 12 0.971 -25.376 -0.577 1.00 0.00 N ATOM 136 NH2 ARG A 12 2.115 -24.432 -2.362 1.00 0.00 N ATOM 0 H ARG A 12 -0.049 -23.929 3.956 1.00 0.00 H new ATOM 0 HA ARG A 12 2.573 -24.615 4.191 1.00 0.00 H new ATOM 0 HB2 ARG A 12 1.332 -22.026 3.177 1.00 0.00 H new ATOM 0 HB3 ARG A 12 3.020 -22.435 2.946 1.00 0.00 H new ATOM 0 HG2 ARG A 12 0.920 -24.455 2.140 1.00 0.00 H new ATOM 0 HG3 ARG A 12 1.188 -23.066 1.105 1.00 0.00 H new ATOM 0 HD2 ARG A 12 3.793 -23.973 1.717 1.00 0.00 H new ATOM 0 HD3 ARG A 12 2.873 -25.448 1.494 1.00 0.00 H new ATOM 0 HE ARG A 12 3.697 -23.642 -0.592 1.00 0.00 H new ATOM 0 HH11 ARG A 12 0.886 -25.552 0.424 1.00 0.00 H new ATOM 0 HH12 ARG A 12 0.270 -25.743 -1.221 1.00 0.00 H new ATOM 0 HH21 ARG A 12 2.901 -23.889 -2.719 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.414 -24.799 -3.006 1.00 0.00 H new ATOM 150 N LEU A 13 3.935 -22.991 5.596 1.00 0.00 N ATOM 151 CA LEU A 13 4.660 -22.284 6.639 1.00 0.00 C ATOM 152 C LEU A 13 4.320 -20.793 6.569 1.00 0.00 C ATOM 153 O LEU A 13 4.535 -20.151 5.542 1.00 0.00 O ATOM 154 CB LEU A 13 6.158 -22.577 6.543 1.00 0.00 C ATOM 155 CG LEU A 13 6.771 -23.330 7.726 1.00 0.00 C ATOM 156 CD1 LEU A 13 6.834 -24.833 7.446 1.00 0.00 C ATOM 157 CD2 LEU A 13 8.142 -22.757 8.091 1.00 0.00 C ATOM 0 H LEU A 13 4.521 -23.539 4.966 1.00 0.00 H new ATOM 0 HA LEU A 13 4.352 -22.637 7.623 1.00 0.00 H new ATOM 0 HB2 LEU A 13 6.338 -23.156 5.637 1.00 0.00 H new ATOM 0 HB3 LEU A 13 6.686 -21.631 6.427 1.00 0.00 H new ATOM 0 HG LEU A 13 6.123 -23.190 8.592 1.00 0.00 H new ATOM 0 HD11 LEU A 13 7.274 -25.345 8.302 1.00 0.00 H new ATOM 0 HD12 LEU A 13 5.827 -25.214 7.274 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.446 -25.013 6.562 1.00 0.00 H new ATOM 0 HD21 LEU A 13 8.555 -23.310 8.934 1.00 0.00 H new ATOM 0 HD22 LEU A 13 8.812 -22.845 7.236 1.00 0.00 H new ATOM 0 HD23 LEU A 13 8.037 -21.707 8.363 1.00 0.00 H new ATOM 169 N GLU A 14 3.794 -20.287 7.675 1.00 0.00 N ATOM 170 CA GLU A 14 3.422 -18.884 7.752 1.00 0.00 C ATOM 171 C GLU A 14 4.673 -18.005 7.790 1.00 0.00 C ATOM 172 O GLU A 14 5.441 -18.051 8.750 1.00 0.00 O ATOM 173 CB GLU A 14 2.529 -18.620 8.966 1.00 0.00 C ATOM 174 CG GLU A 14 1.248 -17.891 8.556 1.00 0.00 C ATOM 175 CD GLU A 14 0.105 -18.206 9.523 1.00 0.00 C ATOM 176 OE1 GLU A 14 0.203 -17.755 10.684 1.00 0.00 O ATOM 177 OE2 GLU A 14 -0.841 -18.891 9.078 1.00 0.00 O ATOM 0 H GLU A 14 3.617 -20.823 8.525 1.00 0.00 H new ATOM 0 HA GLU A 14 2.850 -18.630 6.859 1.00 0.00 H new ATOM 0 HB2 GLU A 14 2.276 -19.564 9.448 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.072 -18.024 9.699 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.427 -16.816 8.537 1.00 0.00 H new ATOM 0 HG3 GLU A 14 0.966 -18.185 7.545 1.00 0.00 H new ATOM 184 N ASN A 15 4.840 -17.223 6.733 1.00 0.00 N ATOM 185 CA ASN A 15 5.985 -16.334 6.633 1.00 0.00 C ATOM 186 C ASN A 15 5.528 -14.980 6.087 1.00 0.00 C ATOM 187 O ASN A 15 5.640 -14.719 4.890 1.00 0.00 O ATOM 188 CB ASN A 15 7.039 -16.898 5.677 1.00 0.00 C ATOM 189 CG ASN A 15 8.446 -16.470 6.098 1.00 0.00 C ATOM 190 OD1 ASN A 15 8.695 -16.094 7.232 1.00 0.00 O ATOM 191 ND2 ASN A 15 9.349 -16.549 5.125 1.00 0.00 N ATOM 0 H ASN A 15 4.201 -17.187 5.939 1.00 0.00 H new ATOM 0 HA ASN A 15 6.419 -16.230 7.628 1.00 0.00 H new ATOM 0 HB2 ASN A 15 6.976 -17.986 5.661 1.00 0.00 H new ATOM 0 HB3 ASN A 15 6.838 -16.552 4.663 1.00 0.00 H new ATOM 0 HD21 ASN A 15 10.318 -16.286 5.306 1.00 0.00 H new ATOM 0 HD22 ASN A 15 9.073 -16.872 4.198 1.00 0.00 H new ATOM 198 N ARG A 16 5.022 -14.154 6.991 1.00 0.00 N ATOM 199 CA ARG A 16 4.548 -12.833 6.615 1.00 0.00 C ATOM 200 C ARG A 16 5.529 -12.173 5.644 1.00 0.00 C ATOM 201 O ARG A 16 6.730 -12.130 5.903 1.00 0.00 O ATOM 202 CB ARG A 16 4.378 -11.938 7.844 1.00 0.00 C ATOM 203 CG ARG A 16 3.055 -12.229 8.556 1.00 0.00 C ATOM 204 CD ARG A 16 3.294 -12.642 10.010 1.00 0.00 C ATOM 205 NE ARG A 16 2.152 -12.218 10.850 1.00 0.00 N ATOM 206 CZ ARG A 16 2.075 -12.422 12.172 1.00 0.00 C ATOM 207 NH1 ARG A 16 3.074 -13.045 12.813 1.00 0.00 N ATOM 208 NH2 ARG A 16 1.001 -12.003 12.854 1.00 0.00 N ATOM 0 H ARG A 16 4.930 -14.374 7.983 1.00 0.00 H new ATOM 0 HA ARG A 16 3.579 -12.954 6.131 1.00 0.00 H new ATOM 0 HB2 ARG A 16 5.208 -12.098 8.532 1.00 0.00 H new ATOM 0 HB3 ARG A 16 4.410 -10.891 7.543 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.419 -11.344 8.525 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.523 -13.022 8.032 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.422 -13.723 10.074 1.00 0.00 H new ATOM 0 HD3 ARG A 16 4.215 -12.190 10.379 1.00 0.00 H new ATOM 0 HE ARG A 16 1.375 -11.740 10.394 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.892 -13.364 12.294 1.00 0.00 H new ATOM 0 HH12 ARG A 16 3.016 -13.200 13.819 1.00 0.00 H new ATOM 0 HH21 ARG A 16 0.241 -11.528 12.367 1.00 0.00 H new ATOM 0 HH22 ARG A 16 0.943 -12.159 13.860 1.00 0.00 H new ATOM 222 N ILE A 17 4.980 -11.675 4.545 1.00 0.00 N ATOM 223 CA ILE A 17 5.791 -11.019 3.534 1.00 0.00 C ATOM 224 C ILE A 17 5.775 -9.509 3.774 1.00 0.00 C ATOM 225 O ILE A 17 4.809 -8.973 4.314 1.00 0.00 O ATOM 226 CB ILE A 17 5.331 -11.424 2.132 1.00 0.00 C ATOM 227 CG1 ILE A 17 3.938 -10.868 1.831 1.00 0.00 C ATOM 228 CG2 ILE A 17 5.394 -12.942 1.951 1.00 0.00 C ATOM 229 CD1 ILE A 17 3.990 -9.358 1.590 1.00 0.00 C ATOM 0 H ILE A 17 3.983 -11.713 4.333 1.00 0.00 H new ATOM 0 HA ILE A 17 6.829 -11.343 3.610 1.00 0.00 H new ATOM 0 HB ILE A 17 6.017 -10.985 1.407 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.526 -11.366 0.953 1.00 0.00 H new ATOM 0 HG13 ILE A 17 3.269 -11.084 2.664 1.00 0.00 H new ATOM 0 HG21 ILE A 17 5.062 -13.203 0.946 1.00 0.00 H new ATOM 0 HG22 ILE A 17 6.419 -13.283 2.094 1.00 0.00 H new ATOM 0 HG23 ILE A 17 4.746 -13.423 2.684 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.987 -8.989 1.378 1.00 0.00 H new ATOM 0 HD12 ILE A 17 4.380 -8.861 2.478 1.00 0.00 H new ATOM 0 HD13 ILE A 17 4.641 -9.147 0.741 1.00 0.00 H new ATOM 241 N THR A 18 6.857 -8.864 3.362 1.00 0.00 N ATOM 242 CA THR A 18 6.979 -7.426 3.525 1.00 0.00 C ATOM 243 C THR A 18 7.366 -6.769 2.199 1.00 0.00 C ATOM 244 O THR A 18 7.987 -7.402 1.346 1.00 0.00 O ATOM 245 CB THR A 18 7.983 -7.162 4.650 1.00 0.00 C ATOM 246 OG1 THR A 18 7.697 -8.170 5.615 1.00 0.00 O ATOM 247 CG2 THR A 18 7.704 -5.850 5.387 1.00 0.00 C ATOM 0 H THR A 18 7.657 -9.312 2.915 1.00 0.00 H new ATOM 0 HA THR A 18 6.026 -6.978 3.807 1.00 0.00 H new ATOM 0 HB THR A 18 8.992 -7.140 4.238 1.00 0.00 H new ATOM 0 HG1 THR A 18 8.304 -8.074 6.378 1.00 0.00 H new ATOM 0 HG21 THR A 18 8.444 -5.711 6.175 1.00 0.00 H new ATOM 0 HG22 THR A 18 7.761 -5.019 4.684 1.00 0.00 H new ATOM 0 HG23 THR A 18 6.708 -5.885 5.828 1.00 0.00 H new ATOM 255 N PHE A 19 6.983 -5.508 2.066 1.00 0.00 N ATOM 256 CA PHE A 19 7.283 -4.758 0.857 1.00 0.00 C ATOM 257 C PHE A 19 7.418 -3.264 1.158 1.00 0.00 C ATOM 258 O PHE A 19 7.001 -2.801 2.219 1.00 0.00 O ATOM 259 CB PHE A 19 6.109 -4.970 -0.102 1.00 0.00 C ATOM 260 CG PHE A 19 4.753 -4.560 0.475 1.00 0.00 C ATOM 261 CD1 PHE A 19 4.332 -3.270 0.373 1.00 0.00 C ATOM 262 CD2 PHE A 19 3.967 -5.484 1.089 1.00 0.00 C ATOM 263 CE1 PHE A 19 3.073 -2.890 0.908 1.00 0.00 C ATOM 264 CE2 PHE A 19 2.708 -5.104 1.624 1.00 0.00 C ATOM 265 CZ PHE A 19 2.288 -3.814 1.522 1.00 0.00 C ATOM 0 H PHE A 19 6.468 -4.986 2.775 1.00 0.00 H new ATOM 0 HA PHE A 19 8.225 -5.101 0.429 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.291 -4.402 -1.014 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.069 -6.022 -0.384 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.955 -2.535 -0.115 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.301 -6.508 1.170 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.739 -1.866 0.827 1.00 0.00 H new ATOM 0 HE2 PHE A 19 2.084 -5.838 2.112 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.331 -3.524 1.929 1.00 0.00 H new ATOM 275 N GLN A 20 8.001 -2.552 0.205 1.00 0.00 N ATOM 276 CA GLN A 20 8.196 -1.120 0.355 1.00 0.00 C ATOM 277 C GLN A 20 7.129 -0.354 -0.429 1.00 0.00 C ATOM 278 O GLN A 20 6.540 -0.888 -1.368 1.00 0.00 O ATOM 279 CB GLN A 20 9.602 -0.709 -0.087 1.00 0.00 C ATOM 280 CG GLN A 20 10.651 -1.165 0.928 1.00 0.00 C ATOM 281 CD GLN A 20 12.063 -1.044 0.350 1.00 0.00 C ATOM 282 OE1 GLN A 20 12.865 -0.225 0.768 1.00 0.00 O ATOM 283 NE2 GLN A 20 12.321 -1.903 -0.632 1.00 0.00 N ATOM 0 H GLN A 20 8.345 -2.940 -0.674 1.00 0.00 H new ATOM 0 HA GLN A 20 8.094 -0.868 1.411 1.00 0.00 H new ATOM 0 HB2 GLN A 20 9.822 -1.143 -1.062 1.00 0.00 H new ATOM 0 HB3 GLN A 20 9.649 0.374 -0.202 1.00 0.00 H new ATOM 0 HG2 GLN A 20 10.572 -0.563 1.833 1.00 0.00 H new ATOM 0 HG3 GLN A 20 10.459 -2.199 1.215 1.00 0.00 H new ATOM 0 HE21 GLN A 20 11.604 -2.563 -0.934 1.00 0.00 H new ATOM 0 HE22 GLN A 20 13.236 -1.902 -1.083 1.00 0.00 H new ATOM 292 N LEU A 21 6.911 0.886 -0.015 1.00 0.00 N ATOM 293 CA LEU A 21 5.925 1.730 -0.667 1.00 0.00 C ATOM 294 C LEU A 21 6.559 3.081 -1.004 1.00 0.00 C ATOM 295 O LEU A 21 7.325 3.626 -0.210 1.00 0.00 O ATOM 296 CB LEU A 21 4.663 1.840 0.190 1.00 0.00 C ATOM 297 CG LEU A 21 3.347 1.478 -0.503 1.00 0.00 C ATOM 298 CD1 LEU A 21 2.146 1.928 0.331 1.00 0.00 C ATOM 299 CD2 LEU A 21 3.302 2.045 -1.924 1.00 0.00 C ATOM 0 H LEU A 21 7.401 1.326 0.764 1.00 0.00 H new ATOM 0 HA LEU A 21 5.605 1.284 -1.609 1.00 0.00 H new ATOM 0 HB2 LEU A 21 4.782 1.195 1.060 1.00 0.00 H new ATOM 0 HB3 LEU A 21 4.587 2.863 0.559 1.00 0.00 H new ATOM 0 HG LEU A 21 3.292 0.393 -0.587 1.00 0.00 H new ATOM 0 HD11 LEU A 21 1.224 1.659 -0.184 1.00 0.00 H new ATOM 0 HD12 LEU A 21 2.175 1.438 1.304 1.00 0.00 H new ATOM 0 HD13 LEU A 21 2.183 3.009 0.468 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.357 1.774 -2.394 1.00 0.00 H new ATOM 0 HD22 LEU A 21 3.390 3.131 -1.885 1.00 0.00 H new ATOM 0 HD23 LEU A 21 4.128 1.635 -2.506 1.00 0.00 H new ATOM 311 N GLU A 22 6.217 3.583 -2.181 1.00 0.00 N ATOM 312 CA GLU A 22 6.744 4.860 -2.632 1.00 0.00 C ATOM 313 C GLU A 22 5.731 5.975 -2.367 1.00 0.00 C ATOM 314 O GLU A 22 4.646 5.984 -2.948 1.00 0.00 O ATOM 315 CB GLU A 22 7.123 4.804 -4.113 1.00 0.00 C ATOM 316 CG GLU A 22 8.527 5.369 -4.342 1.00 0.00 C ATOM 317 CD GLU A 22 9.170 4.753 -5.585 1.00 0.00 C ATOM 318 OE1 GLU A 22 9.638 3.599 -5.470 1.00 0.00 O ATOM 319 OE2 GLU A 22 9.180 5.449 -6.623 1.00 0.00 O ATOM 0 H GLU A 22 5.581 3.129 -2.837 1.00 0.00 H new ATOM 0 HA GLU A 22 7.650 5.077 -2.067 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.080 3.773 -4.464 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.399 5.370 -4.699 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.473 6.452 -4.455 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.150 5.170 -3.470 1.00 0.00 H new ATOM 326 N LEU A 23 6.120 6.888 -1.490 1.00 0.00 N ATOM 327 CA LEU A 23 5.259 8.006 -1.141 1.00 0.00 C ATOM 328 C LEU A 23 5.511 9.161 -2.112 1.00 0.00 C ATOM 329 O LEU A 23 6.044 10.199 -1.723 1.00 0.00 O ATOM 330 CB LEU A 23 5.446 8.387 0.329 1.00 0.00 C ATOM 331 CG LEU A 23 4.520 7.686 1.326 1.00 0.00 C ATOM 332 CD1 LEU A 23 5.102 7.733 2.740 1.00 0.00 C ATOM 333 CD2 LEU A 23 3.108 8.270 1.267 1.00 0.00 C ATOM 0 H LEU A 23 7.020 6.877 -1.010 1.00 0.00 H new ATOM 0 HA LEU A 23 4.211 7.726 -1.243 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.478 8.175 0.610 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.304 9.463 0.426 1.00 0.00 H new ATOM 0 HG LEU A 23 4.445 6.636 1.043 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.425 7.228 3.429 1.00 0.00 H new ATOM 0 HD12 LEU A 23 6.071 7.233 2.752 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.226 8.771 3.048 1.00 0.00 H new ATOM 0 HD21 LEU A 23 2.471 7.754 1.985 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.143 9.332 1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.702 8.141 0.264 1.00 0.00 H new ATOM 345 N VAL A 24 5.115 8.941 -3.358 1.00 0.00 N ATOM 346 CA VAL A 24 5.291 9.951 -4.388 1.00 0.00 C ATOM 347 C VAL A 24 4.991 11.331 -3.799 1.00 0.00 C ATOM 348 O VAL A 24 3.984 11.513 -3.117 1.00 0.00 O ATOM 349 CB VAL A 24 4.422 9.617 -5.602 1.00 0.00 C ATOM 350 CG1 VAL A 24 4.491 10.731 -6.649 1.00 0.00 C ATOM 351 CG2 VAL A 24 4.822 8.270 -6.208 1.00 0.00 C ATOM 0 H VAL A 24 4.673 8.079 -3.677 1.00 0.00 H new ATOM 0 HA VAL A 24 6.323 9.964 -4.738 1.00 0.00 H new ATOM 0 HB VAL A 24 3.389 9.539 -5.263 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.864 10.468 -7.501 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.136 11.664 -6.211 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.522 10.855 -6.981 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.189 8.056 -7.069 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.864 8.309 -6.524 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.698 7.484 -5.463 1.00 0.00 H new ATOM 361 N GLY A 25 5.883 12.268 -4.086 1.00 0.00 N ATOM 362 CA GLY A 25 5.726 13.626 -3.594 1.00 0.00 C ATOM 363 C GLY A 25 6.557 13.851 -2.329 1.00 0.00 C ATOM 364 O GLY A 25 6.755 14.989 -1.906 1.00 0.00 O ATOM 0 H GLY A 25 6.717 12.113 -4.653 1.00 0.00 H new ATOM 0 HA2 GLY A 25 6.032 14.333 -4.365 1.00 0.00 H new ATOM 0 HA3 GLY A 25 4.675 13.820 -3.382 1.00 0.00 H new ATOM 368 N LEU A 26 7.021 12.748 -1.761 1.00 0.00 N ATOM 369 CA LEU A 26 7.827 12.810 -0.553 1.00 0.00 C ATOM 370 C LEU A 26 9.198 12.190 -0.828 1.00 0.00 C ATOM 371 O LEU A 26 9.577 11.998 -1.982 1.00 0.00 O ATOM 372 CB LEU A 26 7.084 12.165 0.619 1.00 0.00 C ATOM 373 CG LEU A 26 6.574 13.123 1.698 1.00 0.00 C ATOM 374 CD1 LEU A 26 5.165 12.736 2.152 1.00 0.00 C ATOM 375 CD2 LEU A 26 7.553 13.201 2.870 1.00 0.00 C ATOM 0 H LEU A 26 6.854 11.806 -2.115 1.00 0.00 H new ATOM 0 HA LEU A 26 7.998 13.846 -0.261 1.00 0.00 H new ATOM 0 HB2 LEU A 26 6.234 11.609 0.223 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.748 11.440 1.089 1.00 0.00 H new ATOM 0 HG LEU A 26 6.511 14.122 1.266 1.00 0.00 H new ATOM 0 HD11 LEU A 26 4.826 13.432 2.919 1.00 0.00 H new ATOM 0 HD12 LEU A 26 4.485 12.774 1.301 1.00 0.00 H new ATOM 0 HD13 LEU A 26 5.179 11.725 2.560 1.00 0.00 H new ATOM 0 HD21 LEU A 26 7.166 13.889 3.622 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.673 12.211 3.311 1.00 0.00 H new ATOM 0 HD23 LEU A 26 8.519 13.559 2.514 1.00 0.00 H new ATOM 387 N GLU A 27 9.906 11.895 0.253 1.00 0.00 N ATOM 388 CA GLU A 27 11.227 11.301 0.143 1.00 0.00 C ATOM 389 C GLU A 27 11.446 10.282 1.263 1.00 0.00 C ATOM 390 O GLU A 27 12.306 10.472 2.121 1.00 0.00 O ATOM 391 CB GLU A 27 12.315 12.377 0.161 1.00 0.00 C ATOM 392 CG GLU A 27 12.169 13.284 1.385 1.00 0.00 C ATOM 393 CD GLU A 27 11.595 14.646 0.992 1.00 0.00 C ATOM 394 OE1 GLU A 27 10.792 14.669 0.034 1.00 0.00 O ATOM 395 OE2 GLU A 27 11.971 15.634 1.659 1.00 0.00 O ATOM 0 H GLU A 27 9.589 12.056 1.209 1.00 0.00 H new ATOM 0 HA GLU A 27 11.291 10.781 -0.813 1.00 0.00 H new ATOM 0 HB2 GLU A 27 13.298 11.905 0.168 1.00 0.00 H new ATOM 0 HB3 GLU A 27 12.255 12.975 -0.748 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.518 12.809 2.119 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.141 13.418 1.861 1.00 0.00 H new ATOM 402 N ARG A 28 10.653 9.221 1.217 1.00 0.00 N ATOM 403 CA ARG A 28 10.749 8.172 2.217 1.00 0.00 C ATOM 404 C ARG A 28 10.085 6.891 1.708 1.00 0.00 C ATOM 405 O ARG A 28 8.951 6.923 1.232 1.00 0.00 O ATOM 406 CB ARG A 28 10.084 8.597 3.528 1.00 0.00 C ATOM 407 CG ARG A 28 8.562 8.484 3.432 1.00 0.00 C ATOM 408 CD ARG A 28 7.891 9.011 4.702 1.00 0.00 C ATOM 409 NE ARG A 28 8.274 10.423 4.928 1.00 0.00 N ATOM 410 CZ ARG A 28 9.372 10.806 5.595 1.00 0.00 C ATOM 411 NH1 ARG A 28 10.201 9.886 6.105 1.00 0.00 N ATOM 412 NH2 ARG A 28 9.640 12.110 5.751 1.00 0.00 N ATOM 0 H ARG A 28 9.942 9.066 0.503 1.00 0.00 H new ATOM 0 HA ARG A 28 11.807 7.988 2.403 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.448 7.972 4.344 1.00 0.00 H new ATOM 0 HB3 ARG A 28 10.362 9.624 3.765 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.206 9.046 2.569 1.00 0.00 H new ATOM 0 HG3 ARG A 28 8.281 7.443 3.273 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.808 8.929 4.612 1.00 0.00 H new ATOM 0 HD3 ARG A 28 8.186 8.404 5.558 1.00 0.00 H new ATOM 0 HE ARG A 28 7.664 11.150 4.553 1.00 0.00 H new ATOM 0 HH11 ARG A 28 9.997 8.894 5.986 1.00 0.00 H new ATOM 0 HH12 ARG A 28 11.036 10.178 6.612 1.00 0.00 H new ATOM 0 HH21 ARG A 28 9.009 12.810 5.362 1.00 0.00 H new ATOM 0 HH22 ARG A 28 10.475 12.402 6.258 1.00 0.00 H new ATOM 426 N VAL A 29 10.819 5.794 1.826 1.00 0.00 N ATOM 427 CA VAL A 29 10.315 4.505 1.383 1.00 0.00 C ATOM 428 C VAL A 29 9.720 3.758 2.578 1.00 0.00 C ATOM 429 O VAL A 29 10.440 3.087 3.316 1.00 0.00 O ATOM 430 CB VAL A 29 11.426 3.722 0.681 1.00 0.00 C ATOM 431 CG1 VAL A 29 10.952 2.317 0.305 1.00 0.00 C ATOM 432 CG2 VAL A 29 11.935 4.476 -0.549 1.00 0.00 C ATOM 0 H VAL A 29 11.759 5.771 2.222 1.00 0.00 H new ATOM 0 HA VAL A 29 9.517 4.637 0.652 1.00 0.00 H new ATOM 0 HB VAL A 29 12.257 3.620 1.379 1.00 0.00 H new ATOM 0 HG11 VAL A 29 11.760 1.781 -0.193 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.660 1.778 1.206 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.097 2.389 -0.367 1.00 0.00 H new ATOM 0 HG21 VAL A 29 12.724 3.898 -1.029 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.114 4.623 -1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.330 5.445 -0.244 1.00 0.00 H new ATOM 442 N VAL A 30 8.411 3.898 2.732 1.00 0.00 N ATOM 443 CA VAL A 30 7.712 3.245 3.824 1.00 0.00 C ATOM 444 C VAL A 30 7.653 1.739 3.558 1.00 0.00 C ATOM 445 O VAL A 30 7.586 1.311 2.407 1.00 0.00 O ATOM 446 CB VAL A 30 6.329 3.873 4.011 1.00 0.00 C ATOM 447 CG1 VAL A 30 6.445 5.310 4.526 1.00 0.00 C ATOM 448 CG2 VAL A 30 5.523 3.819 2.712 1.00 0.00 C ATOM 0 H VAL A 30 7.817 4.455 2.118 1.00 0.00 H new ATOM 0 HA VAL A 30 8.249 3.389 4.761 1.00 0.00 H new ATOM 0 HB VAL A 30 5.794 3.291 4.761 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.448 5.733 4.650 1.00 0.00 H new ATOM 0 HG12 VAL A 30 6.962 5.312 5.485 1.00 0.00 H new ATOM 0 HG13 VAL A 30 7.007 5.909 3.809 1.00 0.00 H new ATOM 0 HG21 VAL A 30 4.544 4.272 2.872 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.053 4.366 1.932 1.00 0.00 H new ATOM 0 HG23 VAL A 30 5.397 2.781 2.405 1.00 0.00 H new ATOM 458 N ARG A 31 7.679 0.978 4.642 1.00 0.00 N ATOM 459 CA ARG A 31 7.630 -0.471 4.540 1.00 0.00 C ATOM 460 C ARG A 31 6.327 -1.001 5.143 1.00 0.00 C ATOM 461 O ARG A 31 5.785 -0.410 6.076 1.00 0.00 O ATOM 462 CB ARG A 31 8.816 -1.115 5.261 1.00 0.00 C ATOM 463 CG ARG A 31 8.987 -2.576 4.839 1.00 0.00 C ATOM 464 CD ARG A 31 9.663 -2.676 3.471 1.00 0.00 C ATOM 465 NE ARG A 31 11.131 -2.555 3.622 1.00 0.00 N ATOM 466 CZ ARG A 31 11.926 -3.546 4.049 1.00 0.00 C ATOM 467 NH1 ARG A 31 11.401 -4.736 4.370 1.00 0.00 N ATOM 468 NH2 ARG A 31 13.247 -3.345 4.155 1.00 0.00 N ATOM 0 H ARG A 31 7.733 1.337 5.595 1.00 0.00 H new ATOM 0 HA ARG A 31 7.678 -0.731 3.482 1.00 0.00 H new ATOM 0 HB2 ARG A 31 9.727 -0.559 5.038 1.00 0.00 H new ATOM 0 HB3 ARG A 31 8.665 -1.059 6.339 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.583 -3.106 5.582 1.00 0.00 H new ATOM 0 HG3 ARG A 31 8.013 -3.064 4.804 1.00 0.00 H new ATOM 0 HD2 ARG A 31 9.415 -3.628 3.002 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.291 -1.890 2.814 1.00 0.00 H new ATOM 0 HE ARG A 31 11.564 -1.662 3.386 1.00 0.00 H new ATOM 0 HH11 ARG A 31 10.396 -4.888 4.289 1.00 0.00 H new ATOM 0 HH12 ARG A 31 12.007 -5.490 4.695 1.00 0.00 H new ATOM 0 HH21 ARG A 31 13.646 -2.439 3.911 1.00 0.00 H new ATOM 0 HH22 ARG A 31 13.853 -4.098 4.480 1.00 0.00 H new ATOM 482 N ILE A 32 5.863 -2.110 4.586 1.00 0.00 N ATOM 483 CA ILE A 32 4.635 -2.727 5.057 1.00 0.00 C ATOM 484 C ILE A 32 4.860 -4.229 5.237 1.00 0.00 C ATOM 485 O ILE A 32 5.508 -4.867 4.409 1.00 0.00 O ATOM 486 CB ILE A 32 3.472 -2.387 4.123 1.00 0.00 C ATOM 487 CG1 ILE A 32 3.404 -0.881 3.858 1.00 0.00 C ATOM 488 CG2 ILE A 32 2.152 -2.933 4.669 1.00 0.00 C ATOM 489 CD1 ILE A 32 2.093 -0.506 3.164 1.00 0.00 C ATOM 0 H ILE A 32 6.316 -2.597 3.813 1.00 0.00 H new ATOM 0 HA ILE A 32 4.358 -2.327 6.032 1.00 0.00 H new ATOM 0 HB ILE A 32 3.650 -2.875 3.165 1.00 0.00 H new ATOM 0 HG12 ILE A 32 3.490 -0.338 4.799 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.248 -0.579 3.238 1.00 0.00 H new ATOM 0 HG21 ILE A 32 1.342 -2.677 3.986 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.218 -4.017 4.764 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.954 -2.495 5.647 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.070 0.569 2.987 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.022 -1.032 2.212 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.252 -0.788 3.798 1.00 0.00 H new ATOM 501 N SER A 33 4.311 -4.751 6.325 1.00 0.00 N ATOM 502 CA SER A 33 4.444 -6.167 6.624 1.00 0.00 C ATOM 503 C SER A 33 3.068 -6.773 6.907 1.00 0.00 C ATOM 504 O SER A 33 2.314 -6.253 7.728 1.00 0.00 O ATOM 505 CB SER A 33 5.379 -6.393 7.814 1.00 0.00 C ATOM 506 OG SER A 33 6.092 -5.211 8.165 1.00 0.00 O ATOM 0 H SER A 33 3.774 -4.219 7.010 1.00 0.00 H new ATOM 0 HA SER A 33 4.880 -6.661 5.756 1.00 0.00 H new ATOM 0 HB2 SER A 33 4.799 -6.734 8.671 1.00 0.00 H new ATOM 0 HB3 SER A 33 6.087 -7.186 7.573 1.00 0.00 H new ATOM 0 HG SER A 33 6.676 -5.396 8.930 1.00 0.00 H new ATOM 512 N ALA A 34 2.783 -7.865 6.212 1.00 0.00 N ATOM 513 CA ALA A 34 1.511 -8.547 6.379 1.00 0.00 C ATOM 514 C ALA A 34 1.566 -9.900 5.665 1.00 0.00 C ATOM 515 O ALA A 34 2.319 -10.070 4.708 1.00 0.00 O ATOM 516 CB ALA A 34 0.382 -7.657 5.856 1.00 0.00 C ATOM 0 H ALA A 34 3.411 -8.294 5.532 1.00 0.00 H new ATOM 0 HA ALA A 34 1.313 -8.738 7.434 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.572 -8.169 5.981 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.368 -6.721 6.415 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.545 -7.446 4.799 1.00 0.00 H new ATOM 522 N LYS A 35 0.758 -10.826 6.159 1.00 0.00 N ATOM 523 CA LYS A 35 0.705 -12.158 5.581 1.00 0.00 C ATOM 524 C LYS A 35 0.628 -12.045 4.057 1.00 0.00 C ATOM 525 O LYS A 35 0.110 -11.062 3.529 1.00 0.00 O ATOM 526 CB LYS A 35 -0.441 -12.964 6.196 1.00 0.00 C ATOM 527 CG LYS A 35 -1.679 -12.089 6.400 1.00 0.00 C ATOM 528 CD LYS A 35 -1.894 -11.780 7.883 1.00 0.00 C ATOM 529 CE LYS A 35 -2.020 -10.274 8.117 1.00 0.00 C ATOM 530 NZ LYS A 35 -1.414 -9.897 9.413 1.00 0.00 N ATOM 0 H LYS A 35 0.135 -10.680 6.953 1.00 0.00 H new ATOM 0 HA LYS A 35 1.615 -12.711 5.815 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -0.688 -13.804 5.547 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -0.125 -13.381 7.152 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -1.567 -11.158 5.844 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -2.557 -12.596 6.000 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.794 -12.283 8.236 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.060 -12.173 8.465 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.529 -9.732 7.308 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -3.071 -9.985 8.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.509 -8.871 9.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -1.900 -10.400 10.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -0.406 -10.155 9.413 1.00 0.00 H new ATOM 544 N PRO A 36 1.164 -13.092 3.375 1.00 0.00 N ATOM 545 CA PRO A 36 1.161 -13.119 1.922 1.00 0.00 C ATOM 546 C PRO A 36 -0.234 -13.439 1.383 1.00 0.00 C ATOM 547 O PRO A 36 -0.809 -12.651 0.632 1.00 0.00 O ATOM 548 CB PRO A 36 2.197 -14.166 1.546 1.00 0.00 C ATOM 549 CG PRO A 36 2.406 -15.012 2.792 1.00 0.00 C ATOM 550 CD PRO A 36 1.786 -14.273 3.966 1.00 0.00 C ATOM 0 HA PRO A 36 1.412 -12.153 1.483 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.850 -14.777 0.713 1.00 0.00 H new ATOM 0 HB3 PRO A 36 3.129 -13.697 1.231 1.00 0.00 H new ATOM 0 HG2 PRO A 36 1.944 -15.992 2.670 1.00 0.00 H new ATOM 0 HG3 PRO A 36 3.469 -15.180 2.965 1.00 0.00 H new ATOM 0 HD2 PRO A 36 1.051 -14.892 4.480 1.00 0.00 H new ATOM 0 HD3 PRO A 36 2.540 -13.996 4.703 1.00 0.00 H new ATOM 558 N THR A 37 -0.739 -14.595 1.786 1.00 0.00 N ATOM 559 CA THR A 37 -2.057 -15.028 1.353 1.00 0.00 C ATOM 560 C THR A 37 -3.021 -13.841 1.310 1.00 0.00 C ATOM 561 O THR A 37 -3.713 -13.634 0.314 1.00 0.00 O ATOM 562 CB THR A 37 -2.516 -16.151 2.285 1.00 0.00 C ATOM 563 OG1 THR A 37 -2.061 -15.741 3.572 1.00 0.00 O ATOM 564 CG2 THR A 37 -1.775 -17.465 2.029 1.00 0.00 C ATOM 0 H THR A 37 -0.259 -15.246 2.408 1.00 0.00 H new ATOM 0 HA THR A 37 -2.030 -15.421 0.337 1.00 0.00 H new ATOM 0 HB THR A 37 -3.587 -16.309 2.162 1.00 0.00 H new ATOM 0 HG1 THR A 37 -2.318 -16.412 4.239 1.00 0.00 H new ATOM 0 HG21 THR A 37 -2.139 -18.228 2.717 1.00 0.00 H new ATOM 0 HG22 THR A 37 -1.951 -17.788 1.003 1.00 0.00 H new ATOM 0 HG23 THR A 37 -0.706 -17.316 2.184 1.00 0.00 H new ATOM 572 N LYS A 38 -3.037 -13.093 2.403 1.00 0.00 N ATOM 573 CA LYS A 38 -3.905 -11.932 2.503 1.00 0.00 C ATOM 574 C LYS A 38 -3.814 -11.120 1.209 1.00 0.00 C ATOM 575 O LYS A 38 -2.917 -11.339 0.396 1.00 0.00 O ATOM 576 CB LYS A 38 -3.577 -11.124 3.760 1.00 0.00 C ATOM 577 CG LYS A 38 -4.791 -11.037 4.688 1.00 0.00 C ATOM 578 CD LYS A 38 -4.876 -9.661 5.351 1.00 0.00 C ATOM 579 CE LYS A 38 -5.671 -9.730 6.657 1.00 0.00 C ATOM 580 NZ LYS A 38 -5.818 -8.380 7.246 1.00 0.00 N ATOM 0 H LYS A 38 -2.463 -13.268 3.227 1.00 0.00 H new ATOM 0 HA LYS A 38 -4.944 -12.242 2.614 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.744 -11.588 4.288 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -3.257 -10.121 3.479 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.702 -11.228 4.120 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.724 -11.810 5.453 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -3.872 -9.287 5.552 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -5.349 -8.954 4.670 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -6.655 -10.160 6.469 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.165 -10.388 7.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.581 -8.391 7.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.926 -8.102 7.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.050 -7.698 6.496 1.00 0.00 H new ATOM 594 N ARG A 39 -4.755 -10.199 1.059 1.00 0.00 N ATOM 595 CA ARG A 39 -4.793 -9.354 -0.122 1.00 0.00 C ATOM 596 C ARG A 39 -4.033 -8.051 0.134 1.00 0.00 C ATOM 597 O ARG A 39 -3.420 -7.882 1.187 1.00 0.00 O ATOM 598 CB ARG A 39 -6.233 -9.026 -0.519 1.00 0.00 C ATOM 599 CG ARG A 39 -7.003 -10.296 -0.888 1.00 0.00 C ATOM 600 CD ARG A 39 -8.448 -9.970 -1.270 1.00 0.00 C ATOM 601 NE ARG A 39 -9.181 -11.216 -1.589 1.00 0.00 N ATOM 602 CZ ARG A 39 -10.503 -11.276 -1.801 1.00 0.00 C ATOM 603 NH1 ARG A 39 -11.245 -10.163 -1.729 1.00 0.00 N ATOM 604 NH2 ARG A 39 -11.082 -12.451 -2.084 1.00 0.00 N ATOM 0 H ARG A 39 -5.497 -10.020 1.736 1.00 0.00 H new ATOM 0 HA ARG A 39 -4.320 -9.902 -0.937 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -6.735 -8.519 0.305 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -6.233 -8.338 -1.364 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.508 -10.797 -1.720 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -6.993 -10.989 -0.047 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -8.941 -9.448 -0.450 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -8.463 -9.299 -2.129 1.00 0.00 H new ATOM 0 HE ARG A 39 -8.647 -12.083 -1.651 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -10.804 -9.269 -1.513 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -12.251 -10.209 -1.890 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -10.517 -13.298 -2.138 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -12.088 -12.498 -2.246 1.00 0.00 H new ATOM 618 N LEU A 40 -4.097 -7.163 -0.848 1.00 0.00 N ATOM 619 CA LEU A 40 -3.422 -5.881 -0.742 1.00 0.00 C ATOM 620 C LEU A 40 -4.319 -4.898 0.013 1.00 0.00 C ATOM 621 O LEU A 40 -3.833 -3.932 0.599 1.00 0.00 O ATOM 622 CB LEU A 40 -2.994 -5.385 -2.125 1.00 0.00 C ATOM 623 CG LEU A 40 -1.490 -5.388 -2.403 1.00 0.00 C ATOM 624 CD1 LEU A 40 -1.207 -5.194 -3.894 1.00 0.00 C ATOM 625 CD2 LEU A 40 -0.771 -4.346 -1.543 1.00 0.00 C ATOM 0 H LEU A 40 -4.606 -7.306 -1.720 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.502 -5.981 -0.166 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.484 -6.002 -2.878 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.365 -4.369 -2.255 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.094 -6.364 -2.125 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.130 -5.200 -4.064 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.668 -6.003 -4.460 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.621 -4.240 -4.222 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.297 -4.369 -1.760 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.165 -3.355 -1.767 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.932 -4.571 -0.489 1.00 0.00 H new ATOM 637 N GLN A 41 -5.614 -5.179 -0.025 1.00 0.00 N ATOM 638 CA GLN A 41 -6.583 -4.331 0.649 1.00 0.00 C ATOM 639 C GLN A 41 -6.735 -4.757 2.110 1.00 0.00 C ATOM 640 O GLN A 41 -6.811 -3.913 3.002 1.00 0.00 O ATOM 641 CB GLN A 41 -7.931 -4.359 -0.074 1.00 0.00 C ATOM 642 CG GLN A 41 -8.686 -5.657 0.223 1.00 0.00 C ATOM 643 CD GLN A 41 -9.970 -5.746 -0.604 1.00 0.00 C ATOM 644 OE1 GLN A 41 -11.059 -5.939 -0.088 1.00 0.00 O ATOM 645 NE2 GLN A 41 -9.783 -5.595 -1.912 1.00 0.00 N ATOM 0 H GLN A 41 -6.014 -5.981 -0.512 1.00 0.00 H new ATOM 0 HA GLN A 41 -6.217 -3.304 0.627 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -8.532 -3.505 0.237 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.774 -4.263 -1.148 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.047 -6.512 0.002 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.929 -5.706 1.284 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -8.844 -5.436 -2.278 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.578 -5.638 -2.549 1.00 0.00 H new ATOM 654 N GLU A 42 -6.777 -6.067 2.311 1.00 0.00 N ATOM 655 CA GLU A 42 -6.919 -6.615 3.649 1.00 0.00 C ATOM 656 C GLU A 42 -5.618 -6.439 4.435 1.00 0.00 C ATOM 657 O GLU A 42 -5.628 -6.429 5.665 1.00 0.00 O ATOM 658 CB GLU A 42 -7.334 -8.086 3.597 1.00 0.00 C ATOM 659 CG GLU A 42 -8.660 -8.256 2.853 1.00 0.00 C ATOM 660 CD GLU A 42 -9.842 -7.874 3.746 1.00 0.00 C ATOM 661 OE1 GLU A 42 -9.692 -8.016 4.979 1.00 0.00 O ATOM 662 OE2 GLU A 42 -10.870 -7.448 3.175 1.00 0.00 O ATOM 0 H GLU A 42 -6.715 -6.764 1.569 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.708 -6.067 4.164 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.558 -8.669 3.102 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.429 -8.477 4.610 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.661 -7.635 1.957 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -8.767 -9.290 2.524 1.00 0.00 H new ATOM 669 N ALA A 43 -4.528 -6.306 3.693 1.00 0.00 N ATOM 670 CA ALA A 43 -3.222 -6.132 4.305 1.00 0.00 C ATOM 671 C ALA A 43 -2.992 -4.647 4.590 1.00 0.00 C ATOM 672 O ALA A 43 -2.202 -4.294 5.465 1.00 0.00 O ATOM 673 CB ALA A 43 -2.147 -6.724 3.392 1.00 0.00 C ATOM 0 H ALA A 43 -4.523 -6.315 2.673 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.170 -6.662 5.256 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.167 -6.593 3.851 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -2.340 -7.787 3.244 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -2.167 -6.214 2.429 1.00 0.00 H new ATOM 679 N LEU A 44 -3.696 -3.816 3.836 1.00 0.00 N ATOM 680 CA LEU A 44 -3.578 -2.376 3.997 1.00 0.00 C ATOM 681 C LEU A 44 -4.708 -1.874 4.897 1.00 0.00 C ATOM 682 O LEU A 44 -4.652 -0.754 5.403 1.00 0.00 O ATOM 683 CB LEU A 44 -3.526 -1.687 2.632 1.00 0.00 C ATOM 684 CG LEU A 44 -2.279 -1.961 1.789 1.00 0.00 C ATOM 685 CD1 LEU A 44 -1.340 -0.754 1.790 1.00 0.00 C ATOM 686 CD2 LEU A 44 -1.574 -3.237 2.253 1.00 0.00 C ATOM 0 H LEU A 44 -4.350 -4.112 3.112 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.640 -2.123 4.492 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -4.402 -1.993 2.059 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.606 -0.611 2.787 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.592 -2.123 0.758 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.462 -0.976 1.183 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.858 0.111 1.376 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.029 -0.535 2.812 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.691 -3.409 1.638 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.274 -3.129 3.295 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -2.254 -4.084 2.157 1.00 0.00 H new ATOM 698 N GLN A 45 -5.708 -2.726 5.069 1.00 0.00 N ATOM 699 CA GLN A 45 -6.850 -2.383 5.899 1.00 0.00 C ATOM 700 C GLN A 45 -6.381 -1.908 7.277 1.00 0.00 C ATOM 701 O GLN A 45 -6.810 -0.860 7.755 1.00 0.00 O ATOM 702 CB GLN A 45 -7.812 -3.565 6.025 1.00 0.00 C ATOM 703 CG GLN A 45 -9.100 -3.310 5.240 1.00 0.00 C ATOM 704 CD GLN A 45 -10.284 -3.089 6.184 1.00 0.00 C ATOM 705 OE1 GLN A 45 -10.429 -3.744 7.203 1.00 0.00 O ATOM 706 NE2 GLN A 45 -11.119 -2.132 5.790 1.00 0.00 N ATOM 0 H GLN A 45 -5.751 -3.654 4.647 1.00 0.00 H new ATOM 0 HA GLN A 45 -7.391 -1.567 5.419 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.331 -4.471 5.657 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.050 -3.735 7.075 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.973 -2.437 4.600 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -9.305 -4.158 4.586 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -10.938 -1.622 4.925 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -11.940 -1.908 6.352 1.00 0.00 H new ATOM 715 N PRO A 46 -5.484 -2.725 7.891 1.00 0.00 N ATOM 716 CA PRO A 46 -4.952 -2.400 9.204 1.00 0.00 C ATOM 717 C PRO A 46 -3.919 -1.275 9.113 1.00 0.00 C ATOM 718 O PRO A 46 -3.401 -0.820 10.132 1.00 0.00 O ATOM 719 CB PRO A 46 -4.368 -3.702 9.725 1.00 0.00 C ATOM 720 CG PRO A 46 -4.177 -4.591 8.507 1.00 0.00 C ATOM 721 CD PRO A 46 -4.953 -3.975 7.354 1.00 0.00 C ATOM 0 HA PRO A 46 -5.714 -2.021 9.885 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.420 -3.529 10.234 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -5.037 -4.169 10.448 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.120 -4.672 8.255 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.534 -5.600 8.711 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.308 -3.794 6.494 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.754 -4.634 7.019 1.00 0.00 H new ATOM 729 N ILE A 47 -3.650 -0.859 7.885 1.00 0.00 N ATOM 730 CA ILE A 47 -2.689 0.205 7.648 1.00 0.00 C ATOM 731 C ILE A 47 -3.436 1.516 7.400 1.00 0.00 C ATOM 732 O ILE A 47 -3.081 2.552 7.960 1.00 0.00 O ATOM 733 CB ILE A 47 -1.731 -0.181 6.519 1.00 0.00 C ATOM 734 CG1 ILE A 47 -0.732 -1.242 6.986 1.00 0.00 C ATOM 735 CG2 ILE A 47 -1.031 1.054 5.948 1.00 0.00 C ATOM 736 CD1 ILE A 47 0.013 -0.779 8.240 1.00 0.00 C ATOM 0 H ILE A 47 -4.081 -1.240 7.042 1.00 0.00 H new ATOM 0 HA ILE A 47 -2.064 0.357 8.528 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.315 -0.622 5.711 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -1.257 -2.174 7.194 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -0.017 -1.449 6.190 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -0.356 0.752 5.147 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -1.776 1.745 5.553 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.462 1.546 6.736 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.717 -1.551 8.551 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.556 0.140 8.022 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.703 -0.596 9.042 1.00 0.00 H new ATOM 748 N LEU A 48 -4.456 1.429 6.559 1.00 0.00 N ATOM 749 CA LEU A 48 -5.256 2.596 6.229 1.00 0.00 C ATOM 750 C LEU A 48 -6.060 3.022 7.459 1.00 0.00 C ATOM 751 O LEU A 48 -6.364 4.202 7.629 1.00 0.00 O ATOM 752 CB LEU A 48 -6.118 2.324 4.995 1.00 0.00 C ATOM 753 CG LEU A 48 -5.385 1.761 3.776 1.00 0.00 C ATOM 754 CD1 LEU A 48 -6.354 1.030 2.843 1.00 0.00 C ATOM 755 CD2 LEU A 48 -4.608 2.859 3.048 1.00 0.00 C ATOM 0 H LEU A 48 -4.747 0.568 6.096 1.00 0.00 H new ATOM 0 HA LEU A 48 -4.613 3.435 5.961 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -6.907 1.626 5.274 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -6.605 3.255 4.704 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.657 1.028 4.124 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.808 0.639 1.984 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -6.824 0.206 3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -7.121 1.724 2.500 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -4.096 2.432 2.186 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -5.299 3.633 2.713 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -3.874 3.296 3.726 1.00 0.00 H new ATOM 767 N ALA A 49 -6.382 2.038 8.286 1.00 0.00 N ATOM 768 CA ALA A 49 -7.144 2.296 9.496 1.00 0.00 C ATOM 769 C ALA A 49 -6.233 2.945 10.540 1.00 0.00 C ATOM 770 O ALA A 49 -6.692 3.730 11.367 1.00 0.00 O ATOM 771 CB ALA A 49 -7.767 0.991 9.995 1.00 0.00 C ATOM 0 H ALA A 49 -6.129 1.060 8.142 1.00 0.00 H new ATOM 0 HA ALA A 49 -7.960 2.990 9.295 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -8.339 1.184 10.903 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -8.429 0.587 9.229 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -6.978 0.270 10.210 1.00 0.00 H new ATOM 777 N LYS A 50 -4.958 2.591 10.467 1.00 0.00 N ATOM 778 CA LYS A 50 -3.978 3.129 11.395 1.00 0.00 C ATOM 779 C LYS A 50 -3.376 4.408 10.810 1.00 0.00 C ATOM 780 O LYS A 50 -2.578 5.078 11.464 1.00 0.00 O ATOM 781 CB LYS A 50 -2.937 2.066 11.751 1.00 0.00 C ATOM 782 CG LYS A 50 -2.807 1.912 13.268 1.00 0.00 C ATOM 783 CD LYS A 50 -1.338 1.812 13.685 1.00 0.00 C ATOM 784 CE LYS A 50 -0.766 3.193 14.011 1.00 0.00 C ATOM 785 NZ LYS A 50 -0.313 3.871 12.775 1.00 0.00 N ATOM 0 H LYS A 50 -4.581 1.938 9.780 1.00 0.00 H new ATOM 0 HA LYS A 50 -4.455 3.403 12.336 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -3.221 1.111 11.308 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -1.972 2.340 11.326 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -3.273 2.763 13.765 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -3.343 1.020 13.594 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -1.247 1.162 14.555 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -0.759 1.354 12.883 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -1.523 3.799 14.509 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.069 3.093 14.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 0.360 4.625 13.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.152 3.181 12.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -1.132 4.284 12.285 1.00 0.00 H new ATOM 799 N HIS A 51 -3.781 4.708 9.585 1.00 0.00 N ATOM 800 CA HIS A 51 -3.291 5.894 8.905 1.00 0.00 C ATOM 801 C HIS A 51 -4.463 6.825 8.586 1.00 0.00 C ATOM 802 O HIS A 51 -4.290 7.838 7.911 1.00 0.00 O ATOM 803 CB HIS A 51 -2.482 5.514 7.663 1.00 0.00 C ATOM 804 CG HIS A 51 -1.111 4.959 7.969 1.00 0.00 C ATOM 805 ND1 HIS A 51 -0.813 3.610 7.886 1.00 0.00 N ATOM 806 CD2 HIS A 51 0.037 5.584 8.356 1.00 0.00 C ATOM 807 CE1 HIS A 51 0.460 3.442 8.213 1.00 0.00 C ATOM 808 NE2 HIS A 51 0.985 4.666 8.504 1.00 0.00 N ATOM 0 H HIS A 51 -4.443 4.150 9.046 1.00 0.00 H new ATOM 0 HA HIS A 51 -2.609 6.436 9.560 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -3.042 4.775 7.089 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -2.373 6.394 7.029 1.00 0.00 H new ATOM 0 HD1 HIS A 51 -1.463 2.871 7.619 1.00 0.00 H new ATOM 0 HD2 HIS A 51 0.155 6.646 8.515 1.00 0.00 H new ATOM 0 HE1 HIS A 51 0.989 2.501 8.244 1.00 0.00 H new ATOM 816 N GLY A 52 -5.629 6.447 9.089 1.00 0.00 N ATOM 817 CA GLY A 52 -6.830 7.235 8.866 1.00 0.00 C ATOM 818 C GLY A 52 -7.134 7.362 7.372 1.00 0.00 C ATOM 819 O GLY A 52 -7.869 8.256 6.959 1.00 0.00 O ATOM 0 H GLY A 52 -5.768 5.606 9.650 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -7.674 6.769 9.374 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.704 8.227 9.301 1.00 0.00 H new ATOM 823 N LEU A 53 -6.552 6.453 6.603 1.00 0.00 N ATOM 824 CA LEU A 53 -6.752 6.452 5.164 1.00 0.00 C ATOM 825 C LEU A 53 -7.925 5.533 4.817 1.00 0.00 C ATOM 826 O LEU A 53 -8.689 5.137 5.695 1.00 0.00 O ATOM 827 CB LEU A 53 -5.452 6.089 4.444 1.00 0.00 C ATOM 828 CG LEU A 53 -4.242 6.971 4.757 1.00 0.00 C ATOM 829 CD1 LEU A 53 -2.940 6.284 4.342 1.00 0.00 C ATOM 830 CD2 LEU A 53 -4.390 8.353 4.118 1.00 0.00 C ATOM 0 H LEU A 53 -5.942 5.712 6.950 1.00 0.00 H new ATOM 0 HA LEU A 53 -7.015 7.450 4.815 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -5.199 5.058 4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -5.633 6.123 3.370 1.00 0.00 H new ATOM 0 HG LEU A 53 -4.198 7.119 5.836 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -2.096 6.933 4.576 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.836 5.344 4.884 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.959 6.085 3.270 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.516 8.960 4.356 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.474 8.247 3.036 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.286 8.839 4.505 1.00 0.00 H new ATOM 842 N SER A 54 -8.030 5.220 3.533 1.00 0.00 N ATOM 843 CA SER A 54 -9.097 4.356 3.059 1.00 0.00 C ATOM 844 C SER A 54 -8.615 3.541 1.857 1.00 0.00 C ATOM 845 O SER A 54 -7.516 3.765 1.351 1.00 0.00 O ATOM 846 CB SER A 54 -10.339 5.167 2.686 1.00 0.00 C ATOM 847 OG SER A 54 -10.848 5.905 3.794 1.00 0.00 O ATOM 0 H SER A 54 -7.394 5.550 2.807 1.00 0.00 H new ATOM 0 HA SER A 54 -9.370 3.676 3.866 1.00 0.00 H new ATOM 0 HB2 SER A 54 -10.094 5.853 1.875 1.00 0.00 H new ATOM 0 HB3 SER A 54 -11.112 4.495 2.312 1.00 0.00 H new ATOM 0 HG SER A 54 -11.640 6.411 3.514 1.00 0.00 H new ATOM 853 N LEU A 55 -9.460 2.612 1.435 1.00 0.00 N ATOM 854 CA LEU A 55 -9.134 1.762 0.302 1.00 0.00 C ATOM 855 C LEU A 55 -9.537 2.470 -0.993 1.00 0.00 C ATOM 856 O LEU A 55 -8.999 2.175 -2.059 1.00 0.00 O ATOM 857 CB LEU A 55 -9.766 0.379 0.470 1.00 0.00 C ATOM 858 CG LEU A 55 -9.081 -0.554 1.470 1.00 0.00 C ATOM 859 CD1 LEU A 55 -10.038 -1.653 1.938 1.00 0.00 C ATOM 860 CD2 LEU A 55 -7.789 -1.130 0.887 1.00 0.00 C ATOM 0 H LEU A 55 -10.370 2.429 1.857 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.059 1.591 0.251 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.803 0.510 0.778 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.782 -0.112 -0.503 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.806 0.030 2.348 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.527 -2.303 2.648 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -10.905 -1.200 2.420 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.365 -2.240 1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.322 -1.790 1.618 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.018 -1.694 -0.017 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.105 -0.317 0.644 1.00 0.00 H new ATOM 872 N ASP A 56 -10.481 3.390 -0.858 1.00 0.00 N ATOM 873 CA ASP A 56 -10.963 4.142 -2.004 1.00 0.00 C ATOM 874 C ASP A 56 -10.284 5.512 -2.032 1.00 0.00 C ATOM 875 O ASP A 56 -10.851 6.480 -2.536 1.00 0.00 O ATOM 876 CB ASP A 56 -12.474 4.364 -1.922 1.00 0.00 C ATOM 877 CG ASP A 56 -13.236 4.121 -3.226 1.00 0.00 C ATOM 878 OD1 ASP A 56 -13.136 2.985 -3.738 1.00 0.00 O ATOM 879 OD2 ASP A 56 -13.902 5.076 -3.681 1.00 0.00 O ATOM 0 H ASP A 56 -10.925 3.632 0.028 1.00 0.00 H new ATOM 0 HA ASP A 56 -10.731 3.571 -2.903 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -12.881 3.707 -1.153 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.658 5.388 -1.597 1.00 0.00 H new ATOM 884 N GLN A 57 -9.079 5.551 -1.482 1.00 0.00 N ATOM 885 CA GLN A 57 -8.317 6.788 -1.437 1.00 0.00 C ATOM 886 C GLN A 57 -6.900 6.558 -1.968 1.00 0.00 C ATOM 887 O GLN A 57 -6.519 7.119 -2.994 1.00 0.00 O ATOM 888 CB GLN A 57 -8.284 7.360 -0.019 1.00 0.00 C ATOM 889 CG GLN A 57 -9.548 8.172 0.274 1.00 0.00 C ATOM 890 CD GLN A 57 -9.622 9.411 -0.621 1.00 0.00 C ATOM 891 OE1 GLN A 57 -8.683 10.181 -0.740 1.00 0.00 O ATOM 892 NE2 GLN A 57 -10.789 9.561 -1.242 1.00 0.00 N ATOM 0 H GLN A 57 -8.612 4.746 -1.064 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.810 7.519 -2.077 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -8.194 6.548 0.703 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.405 7.993 0.101 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -10.429 7.550 0.115 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -9.556 8.474 1.321 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -11.534 8.879 -1.099 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -10.938 10.357 -1.861 1.00 0.00 H new ATOM 901 N VAL A 58 -6.159 5.731 -1.245 1.00 0.00 N ATOM 902 CA VAL A 58 -4.793 5.420 -1.630 1.00 0.00 C ATOM 903 C VAL A 58 -4.806 4.588 -2.914 1.00 0.00 C ATOM 904 O VAL A 58 -5.492 3.569 -2.991 1.00 0.00 O ATOM 905 CB VAL A 58 -4.069 4.724 -0.475 1.00 0.00 C ATOM 906 CG1 VAL A 58 -4.081 5.595 0.783 1.00 0.00 C ATOM 907 CG2 VAL A 58 -4.677 3.349 -0.196 1.00 0.00 C ATOM 0 H VAL A 58 -6.479 5.267 -0.395 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.238 6.335 -1.840 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.030 4.577 -0.771 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -3.560 5.078 1.589 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.580 6.541 0.576 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.111 5.788 1.082 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -4.144 2.876 0.629 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.728 3.463 0.069 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.593 2.726 -1.087 1.00 0.00 H new ATOM 917 N VAL A 59 -4.042 5.054 -3.891 1.00 0.00 N ATOM 918 CA VAL A 59 -3.957 4.366 -5.168 1.00 0.00 C ATOM 919 C VAL A 59 -2.634 3.602 -5.245 1.00 0.00 C ATOM 920 O VAL A 59 -1.578 4.201 -5.439 1.00 0.00 O ATOM 921 CB VAL A 59 -4.139 5.364 -6.313 1.00 0.00 C ATOM 922 CG1 VAL A 59 -3.833 4.711 -7.663 1.00 0.00 C ATOM 923 CG2 VAL A 59 -5.546 5.963 -6.301 1.00 0.00 C ATOM 0 H VAL A 59 -3.476 5.900 -3.824 1.00 0.00 H new ATOM 0 HA VAL A 59 -4.760 3.635 -5.261 1.00 0.00 H new ATOM 0 HB VAL A 59 -3.428 6.177 -6.164 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -3.970 5.442 -8.460 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -2.803 4.355 -7.670 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.508 3.870 -7.822 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -5.648 6.669 -7.125 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.282 5.166 -6.412 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.713 6.481 -5.357 1.00 0.00 H new ATOM 933 N LEU A 60 -2.735 2.290 -5.088 1.00 0.00 N ATOM 934 CA LEU A 60 -1.559 1.438 -5.137 1.00 0.00 C ATOM 935 C LEU A 60 -1.281 1.043 -6.588 1.00 0.00 C ATOM 936 O LEU A 60 -2.205 0.731 -7.338 1.00 0.00 O ATOM 937 CB LEU A 60 -1.723 0.244 -4.194 1.00 0.00 C ATOM 938 CG LEU A 60 -0.449 -0.241 -3.498 1.00 0.00 C ATOM 939 CD1 LEU A 60 0.679 -0.458 -4.508 1.00 0.00 C ATOM 940 CD2 LEU A 60 -0.039 0.716 -2.377 1.00 0.00 C ATOM 0 H LEU A 60 -3.613 1.796 -4.927 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.682 1.978 -4.780 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.453 0.508 -3.429 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.142 -0.587 -4.761 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.658 -1.206 -3.037 1.00 0.00 H new ATOM 0 HD11 LEU A 60 1.572 -0.802 -3.987 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.374 -1.207 -5.239 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.896 0.480 -5.019 1.00 0.00 H new ATOM 0 HD21 LEU A 60 0.869 0.348 -1.899 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.146 1.706 -2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -0.839 0.776 -1.639 1.00 0.00 H new ATOM 952 N HIS A 61 -0.004 1.068 -6.941 1.00 0.00 N ATOM 953 CA HIS A 61 0.407 0.716 -8.289 1.00 0.00 C ATOM 954 C HIS A 61 1.933 0.760 -8.389 1.00 0.00 C ATOM 955 O HIS A 61 2.566 1.684 -7.879 1.00 0.00 O ATOM 956 CB HIS A 61 -0.280 1.615 -9.319 1.00 0.00 C ATOM 957 CG HIS A 61 0.498 2.863 -9.661 1.00 0.00 C ATOM 958 ND1 HIS A 61 1.363 2.936 -10.739 1.00 0.00 N ATOM 959 CD2 HIS A 61 0.531 4.086 -9.058 1.00 0.00 C ATOM 960 CE1 HIS A 61 1.889 4.152 -10.772 1.00 0.00 C ATOM 961 NE2 HIS A 61 1.372 4.863 -9.729 1.00 0.00 N ATOM 0 H HIS A 61 0.760 1.327 -6.316 1.00 0.00 H new ATOM 0 HA HIS A 61 0.092 -0.303 -8.514 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -0.448 1.042 -10.231 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -1.260 1.903 -8.939 1.00 0.00 H new ATOM 0 HD1 HIS A 61 1.562 2.182 -11.396 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -0.032 4.373 -8.182 1.00 0.00 H new ATOM 0 HE1 HIS A 61 2.602 4.516 -11.497 1.00 0.00 H new ATOM 969 N ARG A 62 2.481 -0.250 -9.048 1.00 0.00 N ATOM 970 CA ARG A 62 3.921 -0.339 -9.221 1.00 0.00 C ATOM 971 C ARG A 62 4.428 0.836 -10.059 1.00 0.00 C ATOM 972 O ARG A 62 3.663 1.449 -10.802 1.00 0.00 O ATOM 973 CB ARG A 62 4.314 -1.651 -9.903 1.00 0.00 C ATOM 974 CG ARG A 62 4.351 -2.802 -8.897 1.00 0.00 C ATOM 975 CD ARG A 62 4.267 -4.155 -9.607 1.00 0.00 C ATOM 976 NE ARG A 62 4.279 -5.251 -8.613 1.00 0.00 N ATOM 977 CZ ARG A 62 4.631 -6.513 -8.891 1.00 0.00 C ATOM 978 NH1 ARG A 62 5.004 -6.847 -10.134 1.00 0.00 N ATOM 979 NH2 ARG A 62 4.612 -7.442 -7.925 1.00 0.00 N ATOM 0 H ARG A 62 1.953 -1.015 -9.469 1.00 0.00 H new ATOM 0 HA ARG A 62 4.377 -0.307 -8.231 1.00 0.00 H new ATOM 0 HB2 ARG A 62 3.603 -1.880 -10.697 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.292 -1.542 -10.373 1.00 0.00 H new ATOM 0 HG2 ARG A 62 5.270 -2.750 -8.314 1.00 0.00 H new ATOM 0 HG3 ARG A 62 3.522 -2.703 -8.196 1.00 0.00 H new ATOM 0 HD2 ARG A 62 3.357 -4.205 -10.205 1.00 0.00 H new ATOM 0 HD3 ARG A 62 5.106 -4.267 -10.294 1.00 0.00 H new ATOM 0 HE ARG A 62 4.002 -5.032 -7.656 1.00 0.00 H new ATOM 0 HH11 ARG A 62 5.020 -6.140 -10.869 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.272 -7.808 -10.345 1.00 0.00 H new ATOM 0 HH21 ARG A 62 4.329 -7.188 -6.978 1.00 0.00 H new ATOM 0 HH22 ARG A 62 4.880 -8.403 -8.136 1.00 0.00 H new ATOM 993 N PRO A 63 5.749 1.123 -9.908 1.00 0.00 N ATOM 994 CA PRO A 63 6.367 2.213 -10.642 1.00 0.00 C ATOM 995 C PRO A 63 6.582 1.834 -12.109 1.00 0.00 C ATOM 996 O PRO A 63 7.402 0.970 -12.416 1.00 0.00 O ATOM 997 CB PRO A 63 7.666 2.497 -9.905 1.00 0.00 C ATOM 998 CG PRO A 63 7.951 1.259 -9.071 1.00 0.00 C ATOM 999 CD PRO A 63 6.685 0.418 -9.036 1.00 0.00 C ATOM 0 HA PRO A 63 5.741 3.105 -10.677 1.00 0.00 H new ATOM 0 HB2 PRO A 63 8.478 2.691 -10.606 1.00 0.00 H new ATOM 0 HB3 PRO A 63 7.572 3.380 -9.273 1.00 0.00 H new ATOM 0 HG2 PRO A 63 8.775 0.690 -9.502 1.00 0.00 H new ATOM 0 HG3 PRO A 63 8.251 1.540 -8.061 1.00 0.00 H new ATOM 0 HD2 PRO A 63 6.872 -0.595 -9.392 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.294 0.332 -8.022 1.00 0.00 H new ATOM 1007 N GLY A 64 5.832 2.500 -12.975 1.00 0.00 N ATOM 1008 CA GLY A 64 5.930 2.244 -14.401 1.00 0.00 C ATOM 1009 C GLY A 64 4.556 1.937 -14.999 1.00 0.00 C ATOM 1010 O GLY A 64 4.197 2.472 -16.047 1.00 0.00 O ATOM 0 H GLY A 64 5.154 3.217 -12.716 1.00 0.00 H new ATOM 0 HA2 GLY A 64 6.363 3.111 -14.901 1.00 0.00 H new ATOM 0 HA3 GLY A 64 6.603 1.405 -14.578 1.00 0.00 H new ATOM 1014 N GLU A 65 3.823 1.077 -14.307 1.00 0.00 N ATOM 1015 CA GLU A 65 2.496 0.692 -14.756 1.00 0.00 C ATOM 1016 C GLU A 65 1.673 1.935 -15.102 1.00 0.00 C ATOM 1017 O GLU A 65 2.012 3.043 -14.692 1.00 0.00 O ATOM 1018 CB GLU A 65 1.786 -0.160 -13.703 1.00 0.00 C ATOM 1019 CG GLU A 65 2.352 -1.582 -13.676 1.00 0.00 C ATOM 1020 CD GLU A 65 2.260 -2.235 -15.057 1.00 0.00 C ATOM 1021 OE1 GLU A 65 1.114 -2.448 -15.508 1.00 0.00 O ATOM 1022 OE2 GLU A 65 3.337 -2.506 -15.629 1.00 0.00 O ATOM 0 H GLU A 65 4.123 0.636 -13.438 1.00 0.00 H new ATOM 0 HA GLU A 65 2.599 0.085 -15.656 1.00 0.00 H new ATOM 0 HB2 GLU A 65 1.900 0.299 -12.721 1.00 0.00 H new ATOM 0 HB3 GLU A 65 0.718 -0.194 -13.917 1.00 0.00 H new ATOM 0 HG2 GLU A 65 3.392 -1.557 -13.350 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.804 -2.182 -12.949 1.00 0.00 H new ATOM 1029 N LYS A 66 0.606 1.707 -15.855 1.00 0.00 N ATOM 1030 CA LYS A 66 -0.269 2.794 -16.261 1.00 0.00 C ATOM 1031 C LYS A 66 -1.446 2.886 -15.288 1.00 0.00 C ATOM 1032 O LYS A 66 -1.538 3.832 -14.507 1.00 0.00 O ATOM 1033 CB LYS A 66 -0.690 2.626 -17.722 1.00 0.00 C ATOM 1034 CG LYS A 66 0.528 2.622 -18.647 1.00 0.00 C ATOM 1035 CD LYS A 66 1.031 1.197 -18.886 1.00 0.00 C ATOM 1036 CE LYS A 66 -0.023 0.358 -19.611 1.00 0.00 C ATOM 1037 NZ LYS A 66 0.617 -0.757 -20.345 1.00 0.00 N ATOM 0 H LYS A 66 0.328 0.786 -16.194 1.00 0.00 H new ATOM 0 HA LYS A 66 0.259 3.746 -16.214 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -1.243 1.694 -17.840 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -1.363 3.435 -18.005 1.00 0.00 H new ATOM 0 HG2 LYS A 66 0.267 3.084 -19.599 1.00 0.00 H new ATOM 0 HG3 LYS A 66 1.324 3.224 -18.208 1.00 0.00 H new ATOM 0 HD2 LYS A 66 1.947 1.225 -19.476 1.00 0.00 H new ATOM 0 HD3 LYS A 66 1.280 0.731 -17.933 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -0.740 -0.037 -18.891 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -0.581 0.986 -20.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -0.112 -1.316 -20.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 1.284 -0.374 -21.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 1.130 -1.365 -19.675 1.00 0.00 H new ATOM 1051 N GLN A 67 -2.317 1.891 -15.367 1.00 0.00 N ATOM 1052 CA GLN A 67 -3.485 1.848 -14.503 1.00 0.00 C ATOM 1053 C GLN A 67 -3.084 1.418 -13.090 1.00 0.00 C ATOM 1054 O GLN A 67 -2.007 0.858 -12.890 1.00 0.00 O ATOM 1055 CB GLN A 67 -4.557 0.919 -15.076 1.00 0.00 C ATOM 1056 CG GLN A 67 -5.877 1.665 -15.279 1.00 0.00 C ATOM 1057 CD GLN A 67 -6.193 1.826 -16.767 1.00 0.00 C ATOM 1058 OE1 GLN A 67 -6.556 0.886 -17.456 1.00 0.00 O ATOM 1059 NE2 GLN A 67 -6.035 3.065 -17.223 1.00 0.00 N ATOM 0 H GLN A 67 -2.238 1.108 -16.016 1.00 0.00 H new ATOM 0 HA GLN A 67 -3.911 2.850 -14.450 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -4.217 0.509 -16.027 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -4.711 0.076 -14.402 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -6.685 1.122 -14.789 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -5.821 2.646 -14.807 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -5.728 3.805 -16.592 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -6.220 3.275 -18.204 1.00 0.00 H new ATOM 1068 N PRO A 68 -3.996 1.703 -12.122 1.00 0.00 N ATOM 1069 CA PRO A 68 -3.748 1.352 -10.734 1.00 0.00 C ATOM 1070 C PRO A 68 -3.928 -0.151 -10.509 1.00 0.00 C ATOM 1071 O PRO A 68 -4.896 -0.743 -10.985 1.00 0.00 O ATOM 1072 CB PRO A 68 -4.729 2.194 -9.935 1.00 0.00 C ATOM 1073 CG PRO A 68 -5.799 2.635 -10.920 1.00 0.00 C ATOM 1074 CD PRO A 68 -5.281 2.365 -12.323 1.00 0.00 C ATOM 0 HA PRO A 68 -2.723 1.557 -10.424 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.164 1.617 -9.118 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -4.231 3.055 -9.488 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -6.727 2.091 -10.744 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -6.022 3.694 -10.793 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.969 1.733 -12.884 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -5.166 3.290 -12.888 1.00 0.00 H new ATOM 1082 N MET A 69 -2.980 -0.726 -9.783 1.00 0.00 N ATOM 1083 CA MET A 69 -3.021 -2.148 -9.489 1.00 0.00 C ATOM 1084 C MET A 69 -4.270 -2.504 -8.680 1.00 0.00 C ATOM 1085 O MET A 69 -4.950 -1.621 -8.159 1.00 0.00 O ATOM 1086 CB MET A 69 -1.771 -2.542 -8.699 1.00 0.00 C ATOM 1087 CG MET A 69 -0.641 -2.968 -9.639 1.00 0.00 C ATOM 1088 SD MET A 69 -0.168 -4.655 -9.299 1.00 0.00 S ATOM 1089 CE MET A 69 0.317 -4.503 -7.588 1.00 0.00 C ATOM 0 H MET A 69 -2.179 -0.232 -9.390 1.00 0.00 H new ATOM 0 HA MET A 69 -3.053 -2.695 -10.431 1.00 0.00 H new ATOM 0 HB2 MET A 69 -1.443 -1.702 -8.087 1.00 0.00 H new ATOM 0 HB3 MET A 69 -2.009 -3.358 -8.017 1.00 0.00 H new ATOM 0 HG2 MET A 69 -0.964 -2.874 -10.676 1.00 0.00 H new ATOM 0 HG3 MET A 69 0.217 -2.308 -9.512 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.380 -4.721 -7.490 1.00 0.00 H new ATOM 0 HE2 MET A 69 0.122 -3.487 -7.243 1.00 0.00 H new ATOM 0 HE3 MET A 69 -0.255 -5.207 -6.984 1.00 0.00 H new ATOM 1099 N ASP A 70 -4.534 -3.800 -8.600 1.00 0.00 N ATOM 1100 CA ASP A 70 -5.689 -4.284 -7.863 1.00 0.00 C ATOM 1101 C ASP A 70 -5.236 -4.807 -6.498 1.00 0.00 C ATOM 1102 O ASP A 70 -4.259 -5.548 -6.407 1.00 0.00 O ATOM 1103 CB ASP A 70 -6.374 -5.433 -8.605 1.00 0.00 C ATOM 1104 CG ASP A 70 -7.781 -5.123 -9.120 1.00 0.00 C ATOM 1105 OD1 ASP A 70 -8.486 -4.362 -8.423 1.00 0.00 O ATOM 1106 OD2 ASP A 70 -8.120 -5.653 -10.200 1.00 0.00 O ATOM 0 H ASP A 70 -3.968 -4.530 -9.033 1.00 0.00 H new ATOM 0 HA ASP A 70 -6.390 -3.456 -7.754 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -5.750 -5.723 -9.450 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -6.429 -6.294 -7.939 1.00 0.00 H new ATOM 1111 N LEU A 71 -5.968 -4.400 -5.471 1.00 0.00 N ATOM 1112 CA LEU A 71 -5.653 -4.818 -4.116 1.00 0.00 C ATOM 1113 C LEU A 71 -6.085 -6.273 -3.923 1.00 0.00 C ATOM 1114 O LEU A 71 -5.545 -6.976 -3.070 1.00 0.00 O ATOM 1115 CB LEU A 71 -6.271 -3.854 -3.101 1.00 0.00 C ATOM 1116 CG LEU A 71 -6.005 -2.366 -3.341 1.00 0.00 C ATOM 1117 CD1 LEU A 71 -7.236 -1.527 -2.997 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -4.762 -1.902 -2.579 1.00 0.00 C ATOM 0 H LEU A 71 -6.778 -3.785 -5.550 1.00 0.00 H new ATOM 0 HA LEU A 71 -4.577 -4.778 -3.945 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -7.349 -4.013 -3.089 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.899 -4.114 -2.110 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.804 -2.221 -4.402 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.020 -0.474 -3.176 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.074 -1.837 -3.621 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.493 -1.671 -1.948 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.595 -0.841 -2.767 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.909 -2.063 -1.511 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.895 -2.471 -2.916 1.00 0.00 H new ATOM 1130 N GLU A 72 -7.053 -6.682 -4.729 1.00 0.00 N ATOM 1131 CA GLU A 72 -7.563 -8.041 -4.657 1.00 0.00 C ATOM 1132 C GLU A 72 -6.410 -9.045 -4.724 1.00 0.00 C ATOM 1133 O GLU A 72 -6.538 -10.175 -4.255 1.00 0.00 O ATOM 1134 CB GLU A 72 -8.584 -8.303 -5.767 1.00 0.00 C ATOM 1135 CG GLU A 72 -9.976 -7.819 -5.356 1.00 0.00 C ATOM 1136 CD GLU A 72 -10.877 -7.640 -6.580 1.00 0.00 C ATOM 1137 OE1 GLU A 72 -10.451 -6.901 -7.494 1.00 0.00 O ATOM 1138 OE2 GLU A 72 -11.970 -8.245 -6.574 1.00 0.00 O ATOM 0 H GLU A 72 -7.498 -6.096 -5.436 1.00 0.00 H new ATOM 0 HA GLU A 72 -8.073 -8.167 -3.702 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -8.273 -7.795 -6.680 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -8.617 -9.369 -5.991 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -10.427 -8.536 -4.670 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -9.893 -6.874 -4.820 1.00 0.00 H new ATOM 1145 N ASN A 73 -5.311 -8.596 -5.311 1.00 0.00 N ATOM 1146 CA ASN A 73 -4.136 -9.441 -5.446 1.00 0.00 C ATOM 1147 C ASN A 73 -3.473 -9.607 -4.077 1.00 0.00 C ATOM 1148 O ASN A 73 -3.520 -8.701 -3.246 1.00 0.00 O ATOM 1149 CB ASN A 73 -3.112 -8.813 -6.394 1.00 0.00 C ATOM 1150 CG ASN A 73 -3.788 -8.294 -7.664 1.00 0.00 C ATOM 1151 OD1 ASN A 73 -4.865 -8.721 -8.045 1.00 0.00 O ATOM 1152 ND2 ASN A 73 -3.096 -7.350 -8.297 1.00 0.00 N ATOM 0 H ASN A 73 -5.209 -7.658 -5.699 1.00 0.00 H new ATOM 0 HA ASN A 73 -4.456 -10.403 -5.847 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -2.599 -7.994 -5.890 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -2.354 -9.551 -6.657 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.462 -6.939 -9.156 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.200 -7.038 -7.923 1.00 0.00 H new ATOM 1159 N PRO A 74 -2.854 -10.801 -3.879 1.00 0.00 N ATOM 1160 CA PRO A 74 -2.182 -11.098 -2.625 1.00 0.00 C ATOM 1161 C PRO A 74 -0.850 -10.352 -2.527 1.00 0.00 C ATOM 1162 O PRO A 74 -0.093 -10.297 -3.495 1.00 0.00 O ATOM 1163 CB PRO A 74 -2.020 -12.609 -2.614 1.00 0.00 C ATOM 1164 CG PRO A 74 -2.183 -13.057 -4.057 1.00 0.00 C ATOM 1165 CD PRO A 74 -2.778 -11.898 -4.840 1.00 0.00 C ATOM 0 HA PRO A 74 -2.748 -10.766 -1.755 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.043 -12.894 -2.225 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.767 -13.077 -1.973 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -1.220 -13.348 -4.478 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -2.833 -13.930 -4.115 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.153 -11.634 -5.693 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.763 -12.150 -5.232 1.00 0.00 H new ATOM 1173 N VAL A 75 -0.604 -9.797 -1.350 1.00 0.00 N ATOM 1174 CA VAL A 75 0.624 -9.057 -1.113 1.00 0.00 C ATOM 1175 C VAL A 75 1.819 -9.912 -1.537 1.00 0.00 C ATOM 1176 O VAL A 75 2.883 -9.384 -1.857 1.00 0.00 O ATOM 1177 CB VAL A 75 0.694 -8.614 0.350 1.00 0.00 C ATOM 1178 CG1 VAL A 75 -0.280 -7.465 0.622 1.00 0.00 C ATOM 1179 CG2 VAL A 75 0.431 -9.790 1.292 1.00 0.00 C ATOM 0 H VAL A 75 -1.234 -9.845 -0.549 1.00 0.00 H new ATOM 0 HA VAL A 75 0.645 -8.148 -1.715 1.00 0.00 H new ATOM 0 HB VAL A 75 1.703 -8.250 0.542 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.210 -7.169 1.669 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.027 -6.616 -0.013 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.297 -7.791 0.404 1.00 0.00 H new ATOM 0 HG21 VAL A 75 0.487 -9.448 2.325 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.561 -10.197 1.097 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.180 -10.564 1.125 1.00 0.00 H new ATOM 1189 N SER A 76 1.605 -11.219 -1.525 1.00 0.00 N ATOM 1190 CA SER A 76 2.651 -12.153 -1.904 1.00 0.00 C ATOM 1191 C SER A 76 3.271 -11.731 -3.237 1.00 0.00 C ATOM 1192 O SER A 76 4.465 -11.926 -3.460 1.00 0.00 O ATOM 1193 CB SER A 76 2.109 -13.580 -1.998 1.00 0.00 C ATOM 1194 OG SER A 76 3.121 -14.513 -2.368 1.00 0.00 O ATOM 0 H SER A 76 0.722 -11.654 -1.258 1.00 0.00 H new ATOM 0 HA SER A 76 3.420 -12.137 -1.132 1.00 0.00 H new ATOM 0 HB2 SER A 76 1.683 -13.870 -1.038 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.301 -13.613 -2.729 1.00 0.00 H new ATOM 0 HG SER A 76 2.735 -15.413 -2.416 1.00 0.00 H new ATOM 1200 N SER A 77 2.432 -11.162 -4.090 1.00 0.00 N ATOM 1201 CA SER A 77 2.882 -10.711 -5.395 1.00 0.00 C ATOM 1202 C SER A 77 3.643 -9.390 -5.259 1.00 0.00 C ATOM 1203 O SER A 77 4.629 -9.162 -5.958 1.00 0.00 O ATOM 1204 CB SER A 77 1.705 -10.549 -6.359 1.00 0.00 C ATOM 1205 OG SER A 77 1.782 -11.458 -7.453 1.00 0.00 O ATOM 0 H SER A 77 1.442 -11.003 -3.902 1.00 0.00 H new ATOM 0 HA SER A 77 3.551 -11.468 -5.806 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.771 -10.708 -5.820 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.684 -9.527 -6.738 1.00 0.00 H new ATOM 0 HG SER A 77 1.012 -11.324 -8.044 1.00 0.00 H new ATOM 1211 N VAL A 78 3.154 -8.554 -4.355 1.00 0.00 N ATOM 1212 CA VAL A 78 3.775 -7.262 -4.118 1.00 0.00 C ATOM 1213 C VAL A 78 4.730 -7.370 -2.928 1.00 0.00 C ATOM 1214 O VAL A 78 4.693 -6.540 -2.020 1.00 0.00 O ATOM 1215 CB VAL A 78 2.699 -6.191 -3.926 1.00 0.00 C ATOM 1216 CG1 VAL A 78 1.714 -6.188 -5.096 1.00 0.00 C ATOM 1217 CG2 VAL A 78 1.969 -6.380 -2.595 1.00 0.00 C ATOM 0 H VAL A 78 2.335 -8.746 -3.778 1.00 0.00 H new ATOM 0 HA VAL A 78 4.366 -6.959 -4.982 1.00 0.00 H new ATOM 0 HB VAL A 78 3.193 -5.220 -3.902 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.960 -5.418 -4.935 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.250 -5.982 -6.022 1.00 0.00 H new ATOM 0 HG13 VAL A 78 1.229 -7.162 -5.166 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.210 -5.606 -2.483 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.493 -7.360 -2.577 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.683 -6.308 -1.775 1.00 0.00 H new ATOM 1227 N ALA A 79 5.563 -8.400 -2.969 1.00 0.00 N ATOM 1228 CA ALA A 79 6.526 -8.627 -1.905 1.00 0.00 C ATOM 1229 C ALA A 79 7.901 -8.900 -2.518 1.00 0.00 C ATOM 1230 O ALA A 79 8.552 -9.886 -2.176 1.00 0.00 O ATOM 1231 CB ALA A 79 6.044 -9.777 -1.018 1.00 0.00 C ATOM 0 H ALA A 79 5.591 -9.087 -3.723 1.00 0.00 H new ATOM 0 HA ALA A 79 6.616 -7.743 -1.273 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.766 -9.948 -0.220 1.00 0.00 H new ATOM 0 HB2 ALA A 79 5.077 -9.521 -0.584 1.00 0.00 H new ATOM 0 HB3 ALA A 79 5.945 -10.682 -1.617 1.00 0.00 H new ATOM 1237 N SER A 80 8.302 -8.008 -3.412 1.00 0.00 N ATOM 1238 CA SER A 80 9.589 -8.140 -4.075 1.00 0.00 C ATOM 1239 C SER A 80 10.081 -6.768 -4.539 1.00 0.00 C ATOM 1240 O SER A 80 11.174 -6.340 -4.170 1.00 0.00 O ATOM 1241 CB SER A 80 9.500 -9.102 -5.262 1.00 0.00 C ATOM 1242 OG SER A 80 10.764 -9.287 -5.894 1.00 0.00 O ATOM 0 H SER A 80 7.759 -7.191 -3.693 1.00 0.00 H new ATOM 0 HA SER A 80 10.302 -8.552 -3.361 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.121 -10.065 -4.921 1.00 0.00 H new ATOM 0 HB3 SER A 80 8.784 -8.717 -5.988 1.00 0.00 H new ATOM 0 HG SER A 80 10.666 -9.909 -6.645 1.00 0.00 H new ATOM 1248 N GLN A 81 9.252 -6.117 -5.341 1.00 0.00 N ATOM 1249 CA GLN A 81 9.590 -4.802 -5.859 1.00 0.00 C ATOM 1250 C GLN A 81 9.003 -3.711 -4.962 1.00 0.00 C ATOM 1251 O GLN A 81 8.309 -4.008 -3.991 1.00 0.00 O ATOM 1252 CB GLN A 81 9.109 -4.642 -7.303 1.00 0.00 C ATOM 1253 CG GLN A 81 10.292 -4.586 -8.272 1.00 0.00 C ATOM 1254 CD GLN A 81 9.943 -3.770 -9.518 1.00 0.00 C ATOM 1255 OE1 GLN A 81 9.231 -2.780 -9.463 1.00 0.00 O ATOM 1256 NE2 GLN A 81 10.481 -4.239 -10.640 1.00 0.00 N ATOM 0 H GLN A 81 8.347 -6.475 -5.645 1.00 0.00 H new ATOM 0 HA GLN A 81 10.675 -4.700 -5.858 1.00 0.00 H new ATOM 0 HB2 GLN A 81 8.457 -5.475 -7.567 1.00 0.00 H new ATOM 0 HB3 GLN A 81 8.516 -3.732 -7.394 1.00 0.00 H new ATOM 0 HG2 GLN A 81 11.154 -4.144 -7.773 1.00 0.00 H new ATOM 0 HG3 GLN A 81 10.576 -5.597 -8.563 1.00 0.00 H new ATOM 0 HE21 GLN A 81 11.068 -5.073 -10.615 1.00 0.00 H new ATOM 0 HE22 GLN A 81 10.307 -3.765 -11.526 1.00 0.00 H new ATOM 1265 N THR A 82 9.304 -2.471 -5.318 1.00 0.00 N ATOM 1266 CA THR A 82 8.815 -1.334 -4.557 1.00 0.00 C ATOM 1267 C THR A 82 7.549 -0.766 -5.201 1.00 0.00 C ATOM 1268 O THR A 82 7.557 -0.399 -6.375 1.00 0.00 O ATOM 1269 CB THR A 82 9.951 -0.315 -4.447 1.00 0.00 C ATOM 1270 OG1 THR A 82 10.989 -1.023 -3.775 1.00 0.00 O ATOM 1271 CG2 THR A 82 9.613 0.838 -3.500 1.00 0.00 C ATOM 0 H THR A 82 9.881 -2.229 -6.124 1.00 0.00 H new ATOM 0 HA THR A 82 8.524 -1.628 -3.549 1.00 0.00 H new ATOM 0 HB THR A 82 10.179 0.082 -5.436 1.00 0.00 H new ATOM 0 HG1 THR A 82 11.766 -0.436 -3.663 1.00 0.00 H new ATOM 0 HG21 THR A 82 10.452 1.532 -3.458 1.00 0.00 H new ATOM 0 HG22 THR A 82 8.728 1.360 -3.864 1.00 0.00 H new ATOM 0 HG23 THR A 82 9.418 0.444 -2.503 1.00 0.00 H new ATOM 1279 N LEU A 83 6.492 -0.710 -4.405 1.00 0.00 N ATOM 1280 CA LEU A 83 5.221 -0.193 -4.883 1.00 0.00 C ATOM 1281 C LEU A 83 5.224 1.333 -4.776 1.00 0.00 C ATOM 1282 O LEU A 83 6.010 1.905 -4.021 1.00 0.00 O ATOM 1283 CB LEU A 83 4.059 -0.859 -4.143 1.00 0.00 C ATOM 1284 CG LEU A 83 4.069 -2.389 -4.118 1.00 0.00 C ATOM 1285 CD1 LEU A 83 2.938 -2.930 -3.240 1.00 0.00 C ATOM 1286 CD2 LEU A 83 4.018 -2.961 -5.536 1.00 0.00 C ATOM 0 H LEU A 83 6.489 -1.014 -3.431 1.00 0.00 H new ATOM 0 HA LEU A 83 5.081 -0.439 -5.936 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.055 -0.499 -3.114 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.126 -0.529 -4.600 1.00 0.00 H new ATOM 0 HG LEU A 83 5.008 -2.718 -3.672 1.00 0.00 H new ATOM 0 HD11 LEU A 83 2.967 -4.020 -3.239 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.061 -2.563 -2.221 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.979 -2.593 -3.634 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.026 -4.050 -5.490 1.00 0.00 H new ATOM 0 HD22 LEU A 83 3.107 -2.626 -6.031 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.885 -2.615 -6.099 1.00 0.00 H new ATOM 1298 N VAL A 84 4.336 1.950 -5.541 1.00 0.00 N ATOM 1299 CA VAL A 84 4.226 3.399 -5.542 1.00 0.00 C ATOM 1300 C VAL A 84 2.799 3.798 -5.163 1.00 0.00 C ATOM 1301 O VAL A 84 1.838 3.347 -5.785 1.00 0.00 O ATOM 1302 CB VAL A 84 4.664 3.956 -6.898 1.00 0.00 C ATOM 1303 CG1 VAL A 84 4.681 5.486 -6.882 1.00 0.00 C ATOM 1304 CG2 VAL A 84 6.028 3.397 -7.306 1.00 0.00 C ATOM 0 H VAL A 84 3.685 1.473 -6.165 1.00 0.00 H new ATOM 0 HA VAL A 84 4.893 3.834 -4.797 1.00 0.00 H new ATOM 0 HB VAL A 84 3.935 3.636 -7.643 1.00 0.00 H new ATOM 0 HG11 VAL A 84 4.996 5.857 -7.858 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.682 5.859 -6.657 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.378 5.834 -6.120 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.316 3.809 -8.273 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.772 3.672 -6.559 1.00 0.00 H new ATOM 0 HG23 VAL A 84 5.970 2.311 -7.377 1.00 0.00 H new ATOM 1314 N LEU A 85 2.704 4.641 -4.145 1.00 0.00 N ATOM 1315 CA LEU A 85 1.410 5.107 -3.677 1.00 0.00 C ATOM 1316 C LEU A 85 1.215 6.566 -4.095 1.00 0.00 C ATOM 1317 O LEU A 85 2.039 7.422 -3.775 1.00 0.00 O ATOM 1318 CB LEU A 85 1.270 4.874 -2.171 1.00 0.00 C ATOM 1319 CG LEU A 85 -0.159 4.862 -1.624 1.00 0.00 C ATOM 1320 CD1 LEU A 85 -0.199 5.376 -0.184 1.00 0.00 C ATOM 1321 CD2 LEU A 85 -1.103 5.646 -2.539 1.00 0.00 C ATOM 0 H LEU A 85 3.503 5.013 -3.631 1.00 0.00 H new ATOM 0 HA LEU A 85 0.608 4.533 -4.141 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.740 3.922 -1.926 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.831 5.650 -1.650 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.510 3.830 -1.607 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.226 5.357 0.181 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.422 4.740 0.447 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.179 6.398 -0.152 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.112 5.622 -2.127 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.765 6.680 -2.611 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.105 5.195 -3.532 1.00 0.00 H new ATOM 1333 N ASP A 86 0.121 6.804 -4.803 1.00 0.00 N ATOM 1334 CA ASP A 86 -0.192 8.145 -5.267 1.00 0.00 C ATOM 1335 C ASP A 86 -1.256 8.760 -4.357 1.00 0.00 C ATOM 1336 O ASP A 86 -2.346 9.102 -4.813 1.00 0.00 O ATOM 1337 CB ASP A 86 -0.747 8.118 -6.693 1.00 0.00 C ATOM 1338 CG ASP A 86 -0.408 9.345 -7.542 1.00 0.00 C ATOM 1339 OD1 ASP A 86 0.786 9.485 -7.885 1.00 0.00 O ATOM 1340 OD2 ASP A 86 -1.350 10.114 -7.830 1.00 0.00 O ATOM 0 H ASP A 86 -0.560 6.091 -5.067 1.00 0.00 H new ATOM 0 HA ASP A 86 0.727 8.732 -5.248 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -0.368 7.230 -7.198 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.831 8.018 -6.643 1.00 0.00 H new ATOM 1345 N THR A 87 -0.903 8.882 -3.086 1.00 0.00 N ATOM 1346 CA THR A 87 -1.815 9.450 -2.107 1.00 0.00 C ATOM 1347 C THR A 87 -2.539 10.663 -2.694 1.00 0.00 C ATOM 1348 O THR A 87 -2.042 11.299 -3.623 1.00 0.00 O ATOM 1349 CB THR A 87 -1.012 9.774 -0.845 1.00 0.00 C ATOM 1350 OG1 THR A 87 -0.061 10.743 -1.278 1.00 0.00 O ATOM 1351 CG2 THR A 87 -0.156 8.595 -0.378 1.00 0.00 C ATOM 0 H THR A 87 0.002 8.597 -2.711 1.00 0.00 H new ATOM 0 HA THR A 87 -2.599 8.741 -1.838 1.00 0.00 H new ATOM 0 HB THR A 87 -1.693 10.067 -0.046 1.00 0.00 H new ATOM 0 HG1 THR A 87 0.501 11.011 -0.521 1.00 0.00 H new ATOM 0 HG21 THR A 87 0.393 8.877 0.520 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.799 7.743 -0.157 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.549 8.323 -1.164 1.00 0.00 H new ATOM 1359 N PRO A 88 -3.734 10.956 -2.114 1.00 0.00 N ATOM 1360 CA PRO A 88 -4.531 12.082 -2.569 1.00 0.00 C ATOM 1361 C PRO A 88 -3.935 13.406 -2.090 1.00 0.00 C ATOM 1362 O PRO A 88 -3.009 13.417 -1.280 1.00 0.00 O ATOM 1363 CB PRO A 88 -5.925 11.824 -2.019 1.00 0.00 C ATOM 1364 CG PRO A 88 -5.750 10.816 -0.895 1.00 0.00 C ATOM 1365 CD PRO A 88 -4.354 10.226 -1.012 1.00 0.00 C ATOM 0 HA PRO A 88 -4.555 12.169 -3.655 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -6.376 12.745 -1.651 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -6.585 11.434 -2.794 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -5.881 11.298 0.074 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -6.503 10.031 -0.965 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -3.792 10.353 -0.087 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -4.392 9.156 -1.218 1.00 0.00 H new ATOM 1373 N PRO A 89 -4.504 14.520 -2.624 1.00 0.00 N ATOM 1374 CA PRO A 89 -4.038 15.847 -2.259 1.00 0.00 C ATOM 1375 C PRO A 89 -4.519 16.231 -0.858 1.00 0.00 C ATOM 1376 O PRO A 89 -3.813 16.919 -0.123 1.00 0.00 O ATOM 1377 CB PRO A 89 -4.577 16.765 -3.344 1.00 0.00 C ATOM 1378 CG PRO A 89 -5.705 15.999 -4.016 1.00 0.00 C ATOM 1379 CD PRO A 89 -5.602 14.545 -3.586 1.00 0.00 C ATOM 0 HA PRO A 89 -2.951 15.911 -2.205 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -4.940 17.701 -2.919 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -3.797 17.021 -4.061 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -6.672 16.414 -3.730 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -5.630 16.083 -5.100 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -6.532 14.199 -3.135 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -5.398 13.894 -4.436 1.00 0.00 H new ATOM 1387 N ASP A 90 -5.717 15.770 -0.531 1.00 0.00 N ATOM 1388 CA ASP A 90 -6.301 16.056 0.768 1.00 0.00 C ATOM 1389 C ASP A 90 -6.093 14.855 1.692 1.00 0.00 C ATOM 1390 O ASP A 90 -6.941 13.967 1.762 1.00 0.00 O ATOM 1391 CB ASP A 90 -7.805 16.309 0.653 1.00 0.00 C ATOM 1392 CG ASP A 90 -8.386 17.251 1.709 1.00 0.00 C ATOM 1393 OD1 ASP A 90 -7.659 18.195 2.088 1.00 0.00 O ATOM 1394 OD2 ASP A 90 -9.542 17.006 2.114 1.00 0.00 O ATOM 0 H ASP A 90 -6.300 15.200 -1.144 1.00 0.00 H new ATOM 0 HA ASP A 90 -5.815 16.947 1.166 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -8.014 16.721 -0.334 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -8.325 15.353 0.716 1.00 0.00 H new ATOM 1399 N ALA A 91 -4.959 14.865 2.378 1.00 0.00 N ATOM 1400 CA ALA A 91 -4.629 13.787 3.294 1.00 0.00 C ATOM 1401 C ALA A 91 -3.356 14.149 4.063 1.00 0.00 C ATOM 1402 O ALA A 91 -2.650 15.086 3.694 1.00 0.00 O ATOM 1403 CB ALA A 91 -4.487 12.479 2.514 1.00 0.00 C ATOM 0 H ALA A 91 -4.257 15.603 2.317 1.00 0.00 H new ATOM 0 HA ALA A 91 -5.426 13.646 4.024 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -4.239 11.670 3.202 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -5.427 12.252 2.010 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.694 12.581 1.773 1.00 0.00 H new ATOM 1409 N LYS A 92 -3.103 13.387 5.117 1.00 0.00 N ATOM 1410 CA LYS A 92 -1.928 13.615 5.940 1.00 0.00 C ATOM 1411 C LYS A 92 -2.211 14.756 6.919 1.00 0.00 C ATOM 1412 O LYS A 92 -2.218 14.551 8.132 1.00 0.00 O ATOM 1413 CB LYS A 92 -0.696 13.849 5.063 1.00 0.00 C ATOM 1414 CG LYS A 92 0.513 13.080 5.600 1.00 0.00 C ATOM 1415 CD LYS A 92 1.737 13.991 5.710 1.00 0.00 C ATOM 1416 CE LYS A 92 3.029 13.173 5.737 1.00 0.00 C ATOM 1417 NZ LYS A 92 4.189 14.023 5.387 1.00 0.00 N ATOM 0 H LYS A 92 -3.692 12.611 5.420 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.703 12.731 6.536 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.907 13.534 4.041 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -0.467 14.914 5.027 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.277 12.662 6.579 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.737 12.241 4.941 1.00 0.00 H new ATOM 0 HD2 LYS A 92 1.757 14.682 4.867 1.00 0.00 H new ATOM 0 HD3 LYS A 92 1.665 14.594 6.615 1.00 0.00 H new ATOM 0 HE2 LYS A 92 3.173 12.742 6.728 1.00 0.00 H new ATOM 0 HE3 LYS A 92 2.955 12.342 5.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 5.015 13.421 5.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 3.965 14.585 4.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 4.403 14.661 6.180 1.00 0.00 H new ATOM 1431 N MET A 93 -2.436 15.934 6.357 1.00 0.00 N ATOM 1432 CA MET A 93 -2.719 17.108 7.165 1.00 0.00 C ATOM 1433 C MET A 93 -3.618 16.753 8.351 1.00 0.00 C ATOM 1434 O MET A 93 -4.796 16.448 8.173 1.00 0.00 O ATOM 1435 CB MET A 93 -3.407 18.169 6.303 1.00 0.00 C ATOM 1436 CG MET A 93 -2.770 19.544 6.513 1.00 0.00 C ATOM 1437 SD MET A 93 -4.039 20.772 6.767 1.00 0.00 S ATOM 1438 CE MET A 93 -3.655 21.276 8.435 1.00 0.00 C ATOM 0 H MET A 93 -2.428 16.101 5.351 1.00 0.00 H new ATOM 0 HA MET A 93 -1.776 17.496 7.550 1.00 0.00 H new ATOM 0 HB2 MET A 93 -3.338 17.889 5.252 1.00 0.00 H new ATOM 0 HB3 MET A 93 -4.467 18.214 6.552 1.00 0.00 H new ATOM 0 HG2 MET A 93 -2.101 19.517 7.373 1.00 0.00 H new ATOM 0 HG3 MET A 93 -2.164 19.809 5.647 1.00 0.00 H new ATOM 0 HE1 MET A 93 -4.358 22.046 8.754 1.00 0.00 H new ATOM 0 HE2 MET A 93 -3.731 20.417 9.101 1.00 0.00 H new ATOM 0 HE3 MET A 93 -2.641 21.674 8.470 1.00 0.00 H new ATOM 1448 N SER A 94 -3.027 16.806 9.536 1.00 0.00 N ATOM 1449 CA SER A 94 -3.760 16.494 10.752 1.00 0.00 C ATOM 1450 C SER A 94 -3.102 17.181 11.950 1.00 0.00 C ATOM 1451 O SER A 94 -2.023 17.758 11.824 1.00 0.00 O ATOM 1452 CB SER A 94 -3.830 14.982 10.980 1.00 0.00 C ATOM 1453 OG SER A 94 -5.154 14.479 10.820 1.00 0.00 O ATOM 0 H SER A 94 -2.050 17.060 9.680 1.00 0.00 H new ATOM 0 HA SER A 94 -4.779 16.866 10.642 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.164 14.478 10.280 1.00 0.00 H new ATOM 0 HB3 SER A 94 -3.473 14.750 11.983 1.00 0.00 H new ATOM 0 HG SER A 94 -5.157 13.511 10.972 1.00 0.00 H new ATOM 1459 N GLU A 95 -3.780 17.097 13.085 1.00 0.00 N ATOM 1460 CA GLU A 95 -3.275 17.705 14.305 1.00 0.00 C ATOM 1461 C GLU A 95 -1.905 17.123 14.660 1.00 0.00 C ATOM 1462 O GLU A 95 -1.795 15.944 14.992 1.00 0.00 O ATOM 1463 CB GLU A 95 -4.264 17.521 15.458 1.00 0.00 C ATOM 1464 CG GLU A 95 -5.538 18.335 15.223 1.00 0.00 C ATOM 1465 CD GLU A 95 -5.894 19.166 16.457 1.00 0.00 C ATOM 1466 OE1 GLU A 95 -6.499 18.579 17.381 1.00 0.00 O ATOM 1467 OE2 GLU A 95 -5.554 20.368 16.449 1.00 0.00 O ATOM 0 H GLU A 95 -4.675 16.617 13.186 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.160 18.775 14.135 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -4.516 16.466 15.560 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -3.798 17.830 16.394 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.400 18.993 14.365 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.363 17.664 14.982 1.00 0.00 H new ATOM 1474 N ALA A 96 -0.896 17.977 14.576 1.00 0.00 N ATOM 1475 CA ALA A 96 0.462 17.563 14.884 1.00 0.00 C ATOM 1476 C ALA A 96 1.017 18.442 16.008 1.00 0.00 C ATOM 1477 O ALA A 96 0.300 19.275 16.559 1.00 0.00 O ATOM 1478 CB ALA A 96 1.316 17.630 13.617 1.00 0.00 C ATOM 0 H ALA A 96 -0.992 18.954 14.299 1.00 0.00 H new ATOM 0 HA ALA A 96 0.478 16.531 15.234 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.335 17.319 13.848 1.00 0.00 H new ATOM 0 HB2 ALA A 96 0.897 16.966 12.860 1.00 0.00 H new ATOM 0 HB3 ALA A 96 1.325 18.652 13.238 1.00 0.00 H new ATOM 1484 N ARG A 97 2.288 18.225 16.313 1.00 0.00 N ATOM 1485 CA ARG A 97 2.946 18.986 17.361 1.00 0.00 C ATOM 1486 C ARG A 97 4.466 18.869 17.227 1.00 0.00 C ATOM 1487 O ARG A 97 4.964 18.001 16.512 1.00 0.00 O ATOM 1488 CB ARG A 97 2.524 18.496 18.747 1.00 0.00 C ATOM 1489 CG ARG A 97 1.993 19.650 19.599 1.00 0.00 C ATOM 1490 CD ARG A 97 0.819 19.195 20.469 1.00 0.00 C ATOM 1491 NE ARG A 97 1.260 19.043 21.874 1.00 0.00 N ATOM 1492 CZ ARG A 97 1.915 17.973 22.344 1.00 0.00 C ATOM 1493 NH1 ARG A 97 2.209 16.954 21.525 1.00 0.00 N ATOM 1494 NH2 ARG A 97 2.276 17.921 23.633 1.00 0.00 N ATOM 0 H ARG A 97 2.879 17.533 15.853 1.00 0.00 H new ATOM 0 HA ARG A 97 2.647 20.028 17.251 1.00 0.00 H new ATOM 0 HB2 ARG A 97 1.755 17.730 18.647 1.00 0.00 H new ATOM 0 HB3 ARG A 97 3.374 18.032 19.247 1.00 0.00 H new ATOM 0 HG2 ARG A 97 2.791 20.036 20.233 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.675 20.468 18.952 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.009 19.922 20.410 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.426 18.248 20.098 1.00 0.00 H new ATOM 0 HE ARG A 97 1.052 19.800 22.525 1.00 0.00 H new ATOM 0 HH11 ARG A 97 1.934 16.993 20.544 1.00 0.00 H new ATOM 0 HH12 ARG A 97 2.708 16.139 21.883 1.00 0.00 H new ATOM 0 HH21 ARG A 97 2.052 18.696 24.257 1.00 0.00 H new ATOM 0 HH22 ARG A 97 2.775 17.106 23.990 1.00 0.00 H new ATOM 1508 N SER A 98 5.159 19.755 17.926 1.00 0.00 N ATOM 1509 CA SER A 98 6.612 19.762 17.895 1.00 0.00 C ATOM 1510 C SER A 98 7.142 18.327 17.907 1.00 0.00 C ATOM 1511 O SER A 98 6.902 17.580 18.854 1.00 0.00 O ATOM 1512 CB SER A 98 7.185 20.549 19.074 1.00 0.00 C ATOM 1513 OG SER A 98 7.104 19.818 20.295 1.00 0.00 O ATOM 0 H SER A 98 4.742 20.473 18.518 1.00 0.00 H new ATOM 0 HA SER A 98 6.932 20.254 16.976 1.00 0.00 H new ATOM 0 HB2 SER A 98 8.226 20.800 18.870 1.00 0.00 H new ATOM 0 HB3 SER A 98 6.645 21.490 19.178 1.00 0.00 H new ATOM 0 HG SER A 98 6.933 18.873 20.100 1.00 0.00 H new ATOM 1519 N SER A 99 7.854 17.984 16.843 1.00 0.00 N ATOM 1520 CA SER A 99 8.420 16.651 16.719 1.00 0.00 C ATOM 1521 C SER A 99 9.687 16.699 15.862 1.00 0.00 C ATOM 1522 O SER A 99 9.896 17.649 15.110 1.00 0.00 O ATOM 1523 CB SER A 99 7.408 15.676 16.117 1.00 0.00 C ATOM 1524 OG SER A 99 6.837 14.821 17.103 1.00 0.00 O ATOM 0 H SER A 99 8.052 18.606 16.059 1.00 0.00 H new ATOM 0 HA SER A 99 8.677 16.294 17.716 1.00 0.00 H new ATOM 0 HB2 SER A 99 6.616 16.237 15.621 1.00 0.00 H new ATOM 0 HB3 SER A 99 7.897 15.072 15.353 1.00 0.00 H new ATOM 0 HG SER A 99 6.195 14.215 16.678 1.00 0.00 H new ATOM 1530 N GLY A 100 10.499 15.661 16.005 1.00 0.00 N ATOM 1531 CA GLY A 100 11.739 15.572 15.253 1.00 0.00 C ATOM 1532 C GLY A 100 11.462 15.415 13.756 1.00 0.00 C ATOM 1533 O GLY A 100 10.931 14.394 13.324 1.00 0.00 O ATOM 0 H GLY A 100 10.322 14.875 16.630 1.00 0.00 H new ATOM 0 HA2 GLY A 100 12.337 16.467 15.424 1.00 0.00 H new ATOM 0 HA3 GLY A 100 12.325 14.724 15.609 1.00 0.00 H new ATOM 1537 N PRO A 101 11.846 16.469 12.987 1.00 0.00 N ATOM 1538 CA PRO A 101 11.645 16.457 11.548 1.00 0.00 C ATOM 1539 C PRO A 101 12.660 15.542 10.860 1.00 0.00 C ATOM 1540 O PRO A 101 13.549 14.994 11.511 1.00 0.00 O ATOM 1541 CB PRO A 101 11.772 17.911 11.122 1.00 0.00 C ATOM 1542 CG PRO A 101 12.496 18.616 12.257 1.00 0.00 C ATOM 1543 CD PRO A 101 12.479 17.694 13.465 1.00 0.00 C ATOM 0 HA PRO A 101 10.673 16.055 11.262 1.00 0.00 H new ATOM 0 HB2 PRO A 101 12.330 17.997 10.190 1.00 0.00 H new ATOM 0 HB3 PRO A 101 10.791 18.354 10.949 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.521 18.849 11.969 1.00 0.00 H new ATOM 0 HG3 PRO A 101 12.008 19.562 12.492 1.00 0.00 H new ATOM 0 HD2 PRO A 101 13.488 17.502 13.831 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.919 18.133 14.291 1.00 0.00 H new ATOM 1551 N SER A 102 12.493 15.403 9.553 1.00 0.00 N ATOM 1552 CA SER A 102 13.383 14.563 8.770 1.00 0.00 C ATOM 1553 C SER A 102 14.464 15.420 8.109 1.00 0.00 C ATOM 1554 O SER A 102 15.652 15.240 8.375 1.00 0.00 O ATOM 1555 CB SER A 102 12.608 13.777 7.711 1.00 0.00 C ATOM 1556 OG SER A 102 13.476 13.114 6.796 1.00 0.00 O ATOM 0 H SER A 102 11.754 15.858 9.017 1.00 0.00 H new ATOM 0 HA SER A 102 13.856 13.847 9.442 1.00 0.00 H new ATOM 0 HB2 SER A 102 11.968 13.043 8.201 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.954 14.455 7.163 1.00 0.00 H new ATOM 0 HG SER A 102 12.943 12.622 6.137 1.00 0.00 H new ATOM 1562 N SER A 103 14.015 16.333 7.261 1.00 0.00 N ATOM 1563 CA SER A 103 14.930 17.218 6.560 1.00 0.00 C ATOM 1564 C SER A 103 15.798 16.413 5.592 1.00 0.00 C ATOM 1565 O SER A 103 16.232 15.308 5.913 1.00 0.00 O ATOM 1566 CB SER A 103 15.810 17.992 7.544 1.00 0.00 C ATOM 1567 OG SER A 103 16.365 19.165 6.955 1.00 0.00 O ATOM 0 H SER A 103 13.029 16.479 7.043 1.00 0.00 H new ATOM 0 HA SER A 103 14.341 17.941 5.995 1.00 0.00 H new ATOM 0 HB2 SER A 103 15.220 18.269 8.417 1.00 0.00 H new ATOM 0 HB3 SER A 103 16.615 17.347 7.895 1.00 0.00 H new ATOM 0 HG SER A 103 16.919 19.632 7.615 1.00 0.00 H new ATOM 1573 N GLY A 104 16.025 16.998 4.425 1.00 0.00 N ATOM 1574 CA GLY A 104 16.834 16.349 3.407 1.00 0.00 C ATOM 1575 C GLY A 104 18.140 15.817 4.001 1.00 0.00 C ATOM 1576 O GLY A 104 19.049 15.433 3.267 1.00 0.00 O ATOM 0 H GLY A 104 15.663 17.914 4.162 1.00 0.00 H new ATOM 0 HA2 GLY A 104 16.273 15.528 2.960 1.00 0.00 H new ATOM 0 HA3 GLY A 104 17.055 17.056 2.608 1.00 0.00 H new TER 1580 GLY A 104