USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1058 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: B 28 SER OG : rot 180:sc= -0.134 USER MOD Set 1.2: B 31 GLN : amide:sc= -0.614 K(o=-0.75,f=-3!) USER MOD Set 2.1: B 17 THR OG1 : rot 17:sc= -1.53! USER MOD Set 2.2: B 19 LYS NZ :NH3+ 163:sc= -0.31 (180deg=-0.956) USER MOD Set 2.3: B 20 SER OG : rot 113:sc= 1.05 USER MOD Set 3.1: A 17 THR OG1 : rot -150:sc= 0.185 USER MOD Set 3.2: A 20 SER OG : rot -97:sc= 0.638 USER MOD Single : A 4 SER OG : rot 116:sc= 0.745 USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ -119:sc= -1.06 (180deg=-3.03!) USER MOD Single : A 25 MET CE :methyl -135:sc= -0.209 (180deg=-2.78!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.186 X(o=-0.19,f=-0.26) USER MOD Single : A 31 GLN : amide:sc= 0.752 K(o=0.75,f=-6.3!) USER MOD Single : A 33 CYS SG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.38 K(o=-0.38,f=-1.7!) USER MOD Single : A 37 GLN : amide:sc= -0.191 X(o=-0.19,f=-0.64) USER MOD Single : A 38 SER OG : rot -95:sc= 0.102 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot -15:sc= -1.43! USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 153:sc= -1.62 (180deg=-2.04) USER MOD Single : A 59 ASN : amide:sc= 0.215 K(o=0.22,f=-7.3!) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 ASN : amide:sc= 0.695 K(o=0.69,f=-0.0084) USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 SER OG : rot -68:sc= 1.12 USER MOD Single : B 25 MET CE :methyl -148:sc= -0.257 (180deg=-1.33!) USER MOD Single : B 30 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : B 33 CYS SG : rot 75:sc= 0.379 USER MOD Single : B 34 ASN : amide:sc= -0.58 K(o=-0.58,f=-2.1!) USER MOD Single : B 37 GLN : amide:sc= -0.207 K(o=-0.21,f=-0.98) USER MOD Single : B 38 SER OG : rot 98:sc= 0.836 USER MOD Single : B 40 THR OG1 : rot 180:sc= -0.175 USER MOD Single : B 46 LYS NZ :NH3+ -164:sc= -0.0106 (180deg=-0.235) USER MOD Single : B 47 TYR OH : rot 180:sc= 0 USER MOD Single : B 53 SER OG : rot 74:sc= 0.144 USER MOD Single : B 54 LYS NZ :NH3+ 150:sc= -2.23 (180deg=-3) USER MOD Single : B 59 ASN :FLIP amide:sc= -0.0958 F(o=-0.68,f=-0.096) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU A 2 9.788 11.825 7.035 1.00 0.00 N ATOM 21 CA GLU A 2 9.149 10.491 6.851 1.00 0.00 C ATOM 22 C GLU A 2 7.786 10.668 6.173 1.00 0.00 C ATOM 23 O GLU A 2 7.129 11.680 6.319 1.00 0.00 O ATOM 24 CB GLU A 2 8.977 9.807 8.218 1.00 0.00 C ATOM 25 CG GLU A 2 8.607 10.851 9.287 1.00 0.00 C ATOM 26 CD GLU A 2 9.874 11.492 9.865 1.00 0.00 C ATOM 27 OE1 GLU A 2 10.874 11.524 9.166 1.00 0.00 O ATOM 28 OE2 GLU A 2 9.819 11.947 10.996 1.00 0.00 O ATOM 0 HA GLU A 2 9.782 9.866 6.221 1.00 0.00 H new ATOM 0 HB2 GLU A 2 8.200 9.045 8.157 1.00 0.00 H new ATOM 0 HB3 GLU A 2 9.900 9.299 8.498 1.00 0.00 H new ATOM 0 HG2 GLU A 2 7.970 11.619 8.850 1.00 0.00 H new ATOM 0 HG3 GLU A 2 8.034 10.378 10.085 1.00 0.00 H new ATOM 35 N LEU A 3 7.372 9.691 5.417 1.00 0.00 N ATOM 36 CA LEU A 3 6.066 9.780 4.700 1.00 0.00 C ATOM 37 C LEU A 3 4.907 9.837 5.703 1.00 0.00 C ATOM 38 O LEU A 3 3.932 10.533 5.499 1.00 0.00 O ATOM 39 CB LEU A 3 5.904 8.548 3.803 1.00 0.00 C ATOM 40 CG LEU A 3 4.701 8.727 2.860 1.00 0.00 C ATOM 41 CD1 LEU A 3 5.076 9.629 1.673 1.00 0.00 C ATOM 42 CD2 LEU A 3 4.263 7.358 2.331 1.00 0.00 C ATOM 0 H LEU A 3 7.887 8.824 5.262 1.00 0.00 H new ATOM 0 HA LEU A 3 6.051 10.688 4.097 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.812 8.393 3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 3 5.764 7.659 4.417 1.00 0.00 H new ATOM 0 HG LEU A 3 3.887 9.193 3.415 1.00 0.00 H new ATOM 0 HD11 LEU A 3 4.213 9.744 1.017 1.00 0.00 H new ATOM 0 HD12 LEU A 3 5.384 10.607 2.042 1.00 0.00 H new ATOM 0 HD13 LEU A 3 5.897 9.176 1.117 1.00 0.00 H new ATOM 0 HD21 LEU A 3 3.411 7.482 1.663 1.00 0.00 H new ATOM 0 HD22 LEU A 3 5.087 6.898 1.786 1.00 0.00 H new ATOM 0 HD23 LEU A 3 3.979 6.719 3.167 1.00 0.00 H new ATOM 54 N SER A 4 4.989 9.093 6.772 1.00 0.00 N ATOM 55 CA SER A 4 3.875 9.088 7.768 1.00 0.00 C ATOM 56 C SER A 4 3.624 10.510 8.275 1.00 0.00 C ATOM 57 O SER A 4 2.498 10.960 8.357 1.00 0.00 O ATOM 58 CB SER A 4 4.260 8.195 8.947 1.00 0.00 C ATOM 59 OG SER A 4 3.191 8.170 9.885 1.00 0.00 O ATOM 0 H SER A 4 5.778 8.488 7.001 1.00 0.00 H new ATOM 0 HA SER A 4 2.969 8.710 7.294 1.00 0.00 H new ATOM 0 HB2 SER A 4 4.477 7.185 8.598 1.00 0.00 H new ATOM 0 HB3 SER A 4 5.167 8.570 9.421 1.00 0.00 H new ATOM 0 HG SER A 4 2.829 7.261 9.944 1.00 0.00 H new ATOM 65 N ASN A 5 4.659 11.223 8.609 1.00 0.00 N ATOM 66 CA ASN A 5 4.472 12.617 9.101 1.00 0.00 C ATOM 67 C ASN A 5 3.894 13.474 7.971 1.00 0.00 C ATOM 68 O ASN A 5 3.031 14.305 8.181 1.00 0.00 O ATOM 69 CB ASN A 5 5.822 13.182 9.540 1.00 0.00 C ATOM 70 CG ASN A 5 5.613 14.503 10.280 1.00 0.00 C ATOM 71 OD1 ASN A 5 5.389 14.514 11.474 1.00 0.00 O ATOM 72 ND2 ASN A 5 5.674 15.624 9.618 1.00 0.00 N ATOM 0 H ASN A 5 5.627 10.903 8.564 1.00 0.00 H new ATOM 0 HA ASN A 5 3.786 12.624 9.948 1.00 0.00 H new ATOM 0 HB2 ASN A 5 6.332 12.469 10.187 1.00 0.00 H new ATOM 0 HB3 ASN A 5 6.461 13.338 8.671 1.00 0.00 H new ATOM 0 HD21 ASN A 5 5.534 16.511 10.102 1.00 0.00 H new ATOM 0 HD22 ASN A 5 5.862 15.615 8.616 1.00 0.00 H new ATOM 79 N GLU A 6 4.364 13.273 6.770 1.00 0.00 N ATOM 80 CA GLU A 6 3.848 14.066 5.616 1.00 0.00 C ATOM 81 C GLU A 6 2.375 13.717 5.384 1.00 0.00 C ATOM 82 O GLU A 6 1.556 14.568 5.099 1.00 0.00 O ATOM 83 CB GLU A 6 4.661 13.717 4.364 1.00 0.00 C ATOM 84 CG GLU A 6 4.443 14.786 3.291 1.00 0.00 C ATOM 85 CD GLU A 6 5.227 16.047 3.659 1.00 0.00 C ATOM 86 OE1 GLU A 6 4.701 16.850 4.411 1.00 0.00 O ATOM 87 OE2 GLU A 6 6.341 16.188 3.183 1.00 0.00 O ATOM 0 H GLU A 6 5.086 12.591 6.537 1.00 0.00 H new ATOM 0 HA GLU A 6 3.941 15.132 5.826 1.00 0.00 H new ATOM 0 HB2 GLU A 6 5.720 13.650 4.614 1.00 0.00 H new ATOM 0 HB3 GLU A 6 4.360 12.741 3.984 1.00 0.00 H new ATOM 0 HG2 GLU A 6 4.769 14.413 2.320 1.00 0.00 H new ATOM 0 HG3 GLU A 6 3.381 15.018 3.204 1.00 0.00 H new ATOM 94 N LEU A 7 2.036 12.464 5.512 1.00 0.00 N ATOM 95 CA LEU A 7 0.620 12.040 5.311 1.00 0.00 C ATOM 96 C LEU A 7 -0.260 12.715 6.368 1.00 0.00 C ATOM 97 O LEU A 7 -1.367 13.138 6.098 1.00 0.00 O ATOM 98 CB LEU A 7 0.528 10.513 5.463 1.00 0.00 C ATOM 99 CG LEU A 7 0.986 9.817 4.163 1.00 0.00 C ATOM 100 CD1 LEU A 7 1.490 8.403 4.482 1.00 0.00 C ATOM 101 CD2 LEU A 7 -0.190 9.712 3.179 1.00 0.00 C ATOM 0 H LEU A 7 2.682 11.711 5.748 1.00 0.00 H new ATOM 0 HA LEU A 7 0.281 12.329 4.316 1.00 0.00 H new ATOM 0 HB2 LEU A 7 1.149 10.186 6.297 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -0.497 10.225 5.696 1.00 0.00 H new ATOM 0 HG LEU A 7 1.787 10.406 3.716 1.00 0.00 H new ATOM 0 HD11 LEU A 7 1.812 7.915 3.562 1.00 0.00 H new ATOM 0 HD12 LEU A 7 2.330 8.464 5.174 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.686 7.824 4.937 1.00 0.00 H new ATOM 0 HD21 LEU A 7 0.143 9.220 2.265 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.993 9.131 3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.555 10.711 2.941 1.00 0.00 H new ATOM 113 N LYS A 8 0.227 12.801 7.572 1.00 0.00 N ATOM 114 CA LYS A 8 -0.567 13.429 8.665 1.00 0.00 C ATOM 115 C LYS A 8 -0.873 14.891 8.319 1.00 0.00 C ATOM 116 O LYS A 8 -1.970 15.371 8.523 1.00 0.00 O ATOM 117 CB LYS A 8 0.247 13.372 9.959 1.00 0.00 C ATOM 118 CG LYS A 8 -0.591 13.897 11.122 1.00 0.00 C ATOM 119 CD LYS A 8 0.211 13.774 12.417 1.00 0.00 C ATOM 120 CE LYS A 8 -0.631 14.279 13.588 1.00 0.00 C ATOM 121 NZ LYS A 8 0.145 14.143 14.852 1.00 0.00 N ATOM 0 H LYS A 8 1.148 12.461 7.849 1.00 0.00 H new ATOM 0 HA LYS A 8 -1.507 12.892 8.788 1.00 0.00 H new ATOM 0 HB2 LYS A 8 0.559 12.347 10.158 1.00 0.00 H new ATOM 0 HB3 LYS A 8 1.154 13.967 9.855 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -0.865 14.938 10.948 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -1.520 13.332 11.201 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.497 12.735 12.583 1.00 0.00 H new ATOM 0 HD3 LYS A 8 1.133 14.351 12.343 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -0.907 15.321 13.429 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.558 13.710 13.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -0.427 14.487 15.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 0.387 13.143 15.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 1.018 14.704 14.785 1.00 0.00 H new ATOM 135 N VAL A 9 0.089 15.604 7.804 1.00 0.00 N ATOM 136 CA VAL A 9 -0.146 17.037 7.452 1.00 0.00 C ATOM 137 C VAL A 9 -1.237 17.143 6.381 1.00 0.00 C ATOM 138 O VAL A 9 -2.121 17.973 6.463 1.00 0.00 O ATOM 139 CB VAL A 9 1.155 17.645 6.918 1.00 0.00 C ATOM 140 CG1 VAL A 9 0.882 19.045 6.351 1.00 0.00 C ATOM 141 CG2 VAL A 9 2.168 17.747 8.060 1.00 0.00 C ATOM 0 H VAL A 9 1.029 15.259 7.611 1.00 0.00 H new ATOM 0 HA VAL A 9 -0.469 17.577 8.342 1.00 0.00 H new ATOM 0 HB VAL A 9 1.553 17.010 6.126 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.811 19.472 5.973 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.158 18.974 5.539 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.483 19.685 7.138 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.096 18.179 7.686 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.764 18.382 8.849 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.366 16.753 8.460 1.00 0.00 H new ATOM 151 N GLU A 10 -1.176 16.323 5.372 1.00 0.00 N ATOM 152 CA GLU A 10 -2.200 16.391 4.293 1.00 0.00 C ATOM 153 C GLU A 10 -3.580 16.077 4.878 1.00 0.00 C ATOM 154 O GLU A 10 -4.592 16.576 4.428 1.00 0.00 O ATOM 155 CB GLU A 10 -1.859 15.360 3.216 1.00 0.00 C ATOM 156 CG GLU A 10 -0.473 15.665 2.645 1.00 0.00 C ATOM 157 CD GLU A 10 -0.113 14.616 1.592 1.00 0.00 C ATOM 158 OE1 GLU A 10 -0.381 13.450 1.829 1.00 0.00 O ATOM 159 OE2 GLU A 10 0.430 14.997 0.568 1.00 0.00 O ATOM 0 H GLU A 10 -0.460 15.607 5.247 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.210 17.390 3.858 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -1.878 14.356 3.639 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.606 15.386 2.422 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.462 16.660 2.201 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.269 15.664 3.443 1.00 0.00 H new ATOM 166 N ARG A 11 -3.630 15.237 5.867 1.00 0.00 N ATOM 167 CA ARG A 11 -4.940 14.880 6.476 1.00 0.00 C ATOM 168 C ARG A 11 -5.460 16.058 7.328 1.00 0.00 C ATOM 169 O ARG A 11 -6.639 16.363 7.331 1.00 0.00 O ATOM 170 CB ARG A 11 -4.756 13.624 7.346 1.00 0.00 C ATOM 171 CG ARG A 11 -6.066 12.833 7.411 1.00 0.00 C ATOM 172 CD ARG A 11 -5.863 11.577 8.259 1.00 0.00 C ATOM 173 NE ARG A 11 -7.056 10.693 8.125 1.00 0.00 N ATOM 174 CZ ARG A 11 -7.310 9.791 9.033 1.00 0.00 C ATOM 175 NH1 ARG A 11 -6.542 9.685 10.083 1.00 0.00 N ATOM 176 NH2 ARG A 11 -8.339 9.001 8.895 1.00 0.00 N ATOM 0 H ARG A 11 -2.819 14.779 6.283 1.00 0.00 H new ATOM 0 HA ARG A 11 -5.672 14.674 5.695 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -3.965 12.999 6.933 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -4.445 13.910 8.351 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -6.855 13.451 7.840 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -6.387 12.558 6.406 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -4.966 11.048 7.937 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -5.714 11.850 9.304 1.00 0.00 H new ATOM 0 HE ARG A 11 -7.676 10.794 7.321 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -5.742 10.308 10.195 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -6.742 8.979 10.792 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -8.944 9.089 8.078 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -8.539 8.295 9.604 1.00 0.00 H new ATOM 190 N ILE A 12 -4.586 16.703 8.066 1.00 0.00 N ATOM 191 CA ILE A 12 -5.015 17.850 8.937 1.00 0.00 C ATOM 192 C ILE A 12 -5.558 19.011 8.092 1.00 0.00 C ATOM 193 O ILE A 12 -6.625 19.534 8.348 1.00 0.00 O ATOM 194 CB ILE A 12 -3.803 18.353 9.728 1.00 0.00 C ATOM 195 CG1 ILE A 12 -3.357 17.279 10.721 1.00 0.00 C ATOM 196 CG2 ILE A 12 -4.167 19.631 10.492 1.00 0.00 C ATOM 197 CD1 ILE A 12 -1.983 17.644 11.290 1.00 0.00 C ATOM 0 H ILE A 12 -3.590 16.485 8.104 1.00 0.00 H new ATOM 0 HA ILE A 12 -5.802 17.500 9.605 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.992 18.570 9.033 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.084 17.191 11.528 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.311 16.309 10.226 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -3.299 19.980 11.051 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -4.478 20.401 9.786 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -4.983 19.422 11.183 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -1.667 16.877 11.997 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.259 17.709 10.478 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.044 18.605 11.800 1.00 0.00 H new ATOM 209 N ARG A 13 -4.827 19.425 7.097 1.00 0.00 N ATOM 210 CA ARG A 13 -5.292 20.557 6.247 1.00 0.00 C ATOM 211 C ARG A 13 -6.588 20.157 5.535 1.00 0.00 C ATOM 212 O ARG A 13 -7.483 20.960 5.359 1.00 0.00 O ATOM 213 CB ARG A 13 -4.205 20.914 5.226 1.00 0.00 C ATOM 214 CG ARG A 13 -3.720 19.635 4.488 1.00 0.00 C ATOM 215 CD ARG A 13 -4.081 19.680 2.994 1.00 0.00 C ATOM 216 NE ARG A 13 -3.018 20.417 2.249 1.00 0.00 N ATOM 217 CZ ARG A 13 -2.042 19.775 1.655 1.00 0.00 C ATOM 218 NH1 ARG A 13 -1.969 18.471 1.712 1.00 0.00 N ATOM 219 NH2 ARG A 13 -1.135 20.443 1.003 1.00 0.00 N ATOM 0 H ARG A 13 -3.925 19.028 6.834 1.00 0.00 H new ATOM 0 HA ARG A 13 -5.486 21.431 6.868 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -4.595 21.633 4.505 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.365 21.392 5.730 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -2.640 19.535 4.600 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -4.171 18.755 4.947 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -4.180 18.668 2.602 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -5.044 20.171 2.856 1.00 0.00 H new ATOM 0 HE ARG A 13 -3.052 21.435 2.202 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -2.676 17.942 2.223 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -1.205 17.982 1.246 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -1.186 21.461 0.956 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -0.373 19.949 0.539 1.00 0.00 H new ATOM 233 N LEU A 14 -6.707 18.916 5.142 1.00 0.00 N ATOM 234 CA LEU A 14 -7.957 18.464 4.469 1.00 0.00 C ATOM 235 C LEU A 14 -8.999 18.133 5.539 1.00 0.00 C ATOM 236 O LEU A 14 -10.139 17.835 5.241 1.00 0.00 O ATOM 237 CB LEU A 14 -7.658 17.208 3.625 1.00 0.00 C ATOM 238 CG LEU A 14 -7.093 17.615 2.249 1.00 0.00 C ATOM 239 CD1 LEU A 14 -6.250 16.475 1.668 1.00 0.00 C ATOM 240 CD2 LEU A 14 -8.247 17.926 1.288 1.00 0.00 C ATOM 0 H LEU A 14 -5.992 18.198 5.258 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.337 19.250 3.816 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -6.943 16.572 4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -8.569 16.623 3.494 1.00 0.00 H new ATOM 0 HG LEU A 14 -6.468 18.499 2.374 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.856 16.773 0.696 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -5.423 16.254 2.343 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.871 15.587 1.551 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -7.844 18.213 0.317 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.874 17.042 1.174 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -8.844 18.745 1.690 1.00 0.00 H new ATOM 252 N SER A 15 -8.611 18.193 6.785 1.00 0.00 N ATOM 253 CA SER A 15 -9.564 17.892 7.897 1.00 0.00 C ATOM 254 C SER A 15 -10.411 16.669 7.541 1.00 0.00 C ATOM 255 O SER A 15 -11.588 16.780 7.255 1.00 0.00 O ATOM 256 CB SER A 15 -10.477 19.097 8.128 1.00 0.00 C ATOM 257 OG SER A 15 -11.339 18.830 9.227 1.00 0.00 O ATOM 0 H SER A 15 -7.667 18.439 7.084 1.00 0.00 H new ATOM 0 HA SER A 15 -8.999 17.683 8.805 1.00 0.00 H new ATOM 0 HB2 SER A 15 -9.880 19.987 8.327 1.00 0.00 H new ATOM 0 HB3 SER A 15 -11.064 19.300 7.232 1.00 0.00 H new ATOM 0 HG SER A 15 -11.924 19.601 9.378 1.00 0.00 H new ATOM 263 N LEU A 16 -9.816 15.503 7.549 1.00 0.00 N ATOM 264 CA LEU A 16 -10.574 14.259 7.203 1.00 0.00 C ATOM 265 C LEU A 16 -10.806 13.432 8.467 1.00 0.00 C ATOM 266 O LEU A 16 -9.893 13.143 9.215 1.00 0.00 O ATOM 267 CB LEU A 16 -9.760 13.444 6.198 1.00 0.00 C ATOM 268 CG LEU A 16 -9.435 14.317 4.981 1.00 0.00 C ATOM 269 CD1 LEU A 16 -8.553 13.527 4.009 1.00 0.00 C ATOM 270 CD2 LEU A 16 -10.734 14.740 4.271 1.00 0.00 C ATOM 0 H LEU A 16 -8.834 15.357 7.781 1.00 0.00 H new ATOM 0 HA LEU A 16 -11.538 14.523 6.768 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.839 13.089 6.661 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.321 12.563 5.888 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.906 15.210 5.313 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.321 14.146 3.143 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.628 13.240 4.508 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.082 12.631 3.683 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.492 15.360 3.408 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.274 13.852 3.940 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.358 15.308 4.962 1.00 0.00 H new ATOM 282 N THR A 17 -12.033 13.057 8.711 1.00 0.00 N ATOM 283 CA THR A 17 -12.350 12.254 9.928 1.00 0.00 C ATOM 284 C THR A 17 -12.178 10.766 9.639 1.00 0.00 C ATOM 285 O THR A 17 -12.220 10.328 8.505 1.00 0.00 O ATOM 286 CB THR A 17 -13.796 12.521 10.346 1.00 0.00 C ATOM 287 OG1 THR A 17 -14.669 12.137 9.293 1.00 0.00 O ATOM 288 CG2 THR A 17 -13.974 14.008 10.646 1.00 0.00 C ATOM 0 H THR A 17 -12.833 13.273 8.117 1.00 0.00 H new ATOM 0 HA THR A 17 -11.670 12.542 10.730 1.00 0.00 H new ATOM 0 HB THR A 17 -14.031 11.943 11.240 1.00 0.00 H new ATOM 0 HG1 THR A 17 -15.473 12.697 9.314 1.00 0.00 H new ATOM 0 HG21 THR A 17 -15.005 14.198 10.944 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.303 14.299 11.454 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.741 14.590 9.754 1.00 0.00 H new ATOM 296 N ALA A 18 -11.991 9.985 10.665 1.00 0.00 N ATOM 297 CA ALA A 18 -11.822 8.521 10.471 1.00 0.00 C ATOM 298 C ALA A 18 -13.146 7.911 10.012 1.00 0.00 C ATOM 299 O ALA A 18 -13.184 7.040 9.165 1.00 0.00 O ATOM 300 CB ALA A 18 -11.402 7.881 11.797 1.00 0.00 C ATOM 0 H ALA A 18 -11.948 10.300 11.634 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.057 8.339 9.716 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.277 6.807 11.659 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -10.459 8.316 12.129 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.170 8.063 12.548 1.00 0.00 H new ATOM 306 N LYS A 19 -14.233 8.358 10.577 1.00 0.00 N ATOM 307 CA LYS A 19 -15.560 7.807 10.196 1.00 0.00 C ATOM 308 C LYS A 19 -15.886 8.162 8.742 1.00 0.00 C ATOM 309 O LYS A 19 -16.382 7.349 7.988 1.00 0.00 O ATOM 310 CB LYS A 19 -16.620 8.410 11.111 1.00 0.00 C ATOM 311 CG LYS A 19 -16.404 7.910 12.538 1.00 0.00 C ATOM 312 CD LYS A 19 -17.496 8.483 13.447 1.00 0.00 C ATOM 313 CE LYS A 19 -17.385 10.016 13.507 1.00 0.00 C ATOM 314 NZ LYS A 19 -18.216 10.611 12.423 1.00 0.00 N ATOM 0 H LYS A 19 -14.257 9.086 11.291 1.00 0.00 H new ATOM 0 HA LYS A 19 -15.543 6.722 10.297 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -16.564 9.498 11.083 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -17.616 8.133 10.764 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -16.430 6.821 12.562 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -15.420 8.213 12.897 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -18.479 8.196 13.073 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -17.402 8.065 14.449 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -17.720 10.379 14.479 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -16.345 10.322 13.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -17.608 11.157 11.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -18.689 9.852 11.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -18.932 11.240 12.840 1.00 0.00 H new ATOM 328 N SER A 20 -15.629 9.380 8.351 1.00 0.00 N ATOM 329 CA SER A 20 -15.940 9.801 6.955 1.00 0.00 C ATOM 330 C SER A 20 -15.134 8.966 5.959 1.00 0.00 C ATOM 331 O SER A 20 -15.649 8.504 4.960 1.00 0.00 O ATOM 332 CB SER A 20 -15.579 11.277 6.786 1.00 0.00 C ATOM 333 OG SER A 20 -14.197 11.456 7.068 1.00 0.00 O ATOM 0 H SER A 20 -15.216 10.104 8.939 1.00 0.00 H new ATOM 0 HA SER A 20 -17.003 9.651 6.764 1.00 0.00 H new ATOM 0 HB2 SER A 20 -15.800 11.604 5.770 1.00 0.00 H new ATOM 0 HB3 SER A 20 -16.181 11.890 7.456 1.00 0.00 H new ATOM 0 HG SER A 20 -14.089 11.759 7.994 1.00 0.00 H new ATOM 339 N VAL A 21 -13.874 8.766 6.221 1.00 0.00 N ATOM 340 CA VAL A 21 -13.041 7.960 5.286 1.00 0.00 C ATOM 341 C VAL A 21 -13.543 6.515 5.276 1.00 0.00 C ATOM 342 O VAL A 21 -13.681 5.901 4.238 1.00 0.00 O ATOM 343 CB VAL A 21 -11.584 7.992 5.747 1.00 0.00 C ATOM 344 CG1 VAL A 21 -10.746 7.055 4.872 1.00 0.00 C ATOM 345 CG2 VAL A 21 -11.047 9.420 5.633 1.00 0.00 C ATOM 0 H VAL A 21 -13.385 9.125 7.041 1.00 0.00 H new ATOM 0 HA VAL A 21 -13.113 8.376 4.281 1.00 0.00 H new ATOM 0 HB VAL A 21 -11.524 7.663 6.784 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.708 7.080 5.203 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -11.130 6.038 4.957 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.803 7.379 3.833 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -10.008 9.445 5.961 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.108 9.750 4.596 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -11.642 10.084 6.260 1.00 0.00 H new ATOM 355 N ALA A 22 -13.813 5.968 6.429 1.00 0.00 N ATOM 356 CA ALA A 22 -14.301 4.561 6.498 1.00 0.00 C ATOM 357 C ALA A 22 -15.644 4.442 5.768 1.00 0.00 C ATOM 358 O ALA A 22 -15.920 3.459 5.110 1.00 0.00 O ATOM 359 CB ALA A 22 -14.476 4.156 7.963 1.00 0.00 C ATOM 0 H ALA A 22 -13.716 6.436 7.330 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.575 3.902 6.021 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.833 3.127 8.016 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.519 4.235 8.479 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -15.201 4.816 8.439 1.00 0.00 H new ATOM 365 N GLU A 23 -16.476 5.441 5.874 1.00 0.00 N ATOM 366 CA GLU A 23 -17.799 5.393 5.181 1.00 0.00 C ATOM 367 C GLU A 23 -17.567 5.275 3.672 1.00 0.00 C ATOM 368 O GLU A 23 -18.084 4.389 3.018 1.00 0.00 O ATOM 369 CB GLU A 23 -18.560 6.698 5.495 1.00 0.00 C ATOM 370 CG GLU A 23 -19.879 6.804 4.699 1.00 0.00 C ATOM 371 CD GLU A 23 -20.957 5.936 5.349 1.00 0.00 C ATOM 372 OE1 GLU A 23 -20.732 4.747 5.489 1.00 0.00 O ATOM 373 OE2 GLU A 23 -21.997 6.479 5.689 1.00 0.00 O ATOM 0 H GLU A 23 -16.299 6.290 6.411 1.00 0.00 H new ATOM 0 HA GLU A 23 -18.381 4.536 5.521 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.776 6.744 6.562 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -17.926 7.553 5.261 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -20.209 7.842 4.664 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.718 6.486 3.669 1.00 0.00 H new ATOM 380 N GLU A 24 -16.804 6.170 3.113 1.00 0.00 N ATOM 381 CA GLU A 24 -16.548 6.125 1.645 1.00 0.00 C ATOM 382 C GLU A 24 -15.680 4.907 1.305 1.00 0.00 C ATOM 383 O GLU A 24 -15.930 4.197 0.352 1.00 0.00 O ATOM 384 CB GLU A 24 -15.822 7.408 1.223 1.00 0.00 C ATOM 385 CG GLU A 24 -15.968 7.621 -0.293 1.00 0.00 C ATOM 386 CD GLU A 24 -17.304 8.308 -0.594 1.00 0.00 C ATOM 387 OE1 GLU A 24 -18.312 7.622 -0.611 1.00 0.00 O ATOM 388 OE2 GLU A 24 -17.294 9.510 -0.801 1.00 0.00 O ATOM 0 H GLU A 24 -16.345 6.934 3.609 1.00 0.00 H new ATOM 0 HA GLU A 24 -17.496 6.045 1.112 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -16.234 8.262 1.760 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.767 7.343 1.489 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -15.144 8.229 -0.665 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.916 6.663 -0.811 1.00 0.00 H new ATOM 395 N MET A 25 -14.660 4.665 2.080 1.00 0.00 N ATOM 396 CA MET A 25 -13.772 3.499 1.807 1.00 0.00 C ATOM 397 C MET A 25 -14.572 2.207 1.983 1.00 0.00 C ATOM 398 O MET A 25 -14.425 1.262 1.234 1.00 0.00 O ATOM 399 CB MET A 25 -12.608 3.515 2.798 1.00 0.00 C ATOM 400 CG MET A 25 -11.611 4.606 2.408 1.00 0.00 C ATOM 401 SD MET A 25 -10.757 4.128 0.883 1.00 0.00 S ATOM 402 CE MET A 25 -9.809 2.735 1.559 1.00 0.00 C ATOM 0 H MET A 25 -14.402 5.225 2.892 1.00 0.00 H new ATOM 0 HA MET A 25 -13.388 3.555 0.789 1.00 0.00 H new ATOM 0 HB2 MET A 25 -12.980 3.693 3.807 1.00 0.00 H new ATOM 0 HB3 MET A 25 -12.113 2.544 2.808 1.00 0.00 H new ATOM 0 HG2 MET A 25 -12.130 5.554 2.265 1.00 0.00 H new ATOM 0 HG3 MET A 25 -10.888 4.757 3.210 1.00 0.00 H new ATOM 0 HE1 MET A 25 -8.780 2.789 1.205 1.00 0.00 H new ATOM 0 HE2 MET A 25 -9.821 2.781 2.648 1.00 0.00 H new ATOM 0 HE3 MET A 25 -10.257 1.797 1.231 1.00 0.00 H new ATOM 412 N GLY A 26 -15.418 2.160 2.976 1.00 0.00 N ATOM 413 CA GLY A 26 -16.229 0.930 3.211 1.00 0.00 C ATOM 414 C GLY A 26 -15.414 -0.071 4.033 1.00 0.00 C ATOM 415 O GLY A 26 -15.551 -1.269 3.878 1.00 0.00 O ATOM 0 H GLY A 26 -15.583 2.920 3.635 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -17.150 1.184 3.737 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -16.518 0.485 2.259 1.00 0.00 H new ATOM 419 N ILE A 27 -14.564 0.416 4.907 1.00 0.00 N ATOM 420 CA ILE A 27 -13.723 -0.494 5.754 1.00 0.00 C ATOM 421 C ILE A 27 -13.958 -0.194 7.236 1.00 0.00 C ATOM 422 O ILE A 27 -14.573 0.791 7.596 1.00 0.00 O ATOM 423 CB ILE A 27 -12.239 -0.297 5.421 1.00 0.00 C ATOM 424 CG1 ILE A 27 -11.822 1.157 5.673 1.00 0.00 C ATOM 425 CG2 ILE A 27 -11.995 -0.643 3.951 1.00 0.00 C ATOM 426 CD1 ILE A 27 -10.308 1.285 5.492 1.00 0.00 C ATOM 0 H ILE A 27 -14.415 1.412 5.072 1.00 0.00 H new ATOM 0 HA ILE A 27 -14.004 -1.526 5.547 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.647 -0.952 6.060 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.340 1.822 4.982 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.107 1.460 6.681 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -10.940 -0.503 3.714 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.272 -1.682 3.771 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -12.598 0.009 3.319 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -10.006 2.317 5.670 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -9.800 0.631 6.201 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.038 0.998 4.476 1.00 0.00 H new ATOM 438 N SER A 28 -13.477 -1.050 8.096 1.00 0.00 N ATOM 439 CA SER A 28 -13.668 -0.844 9.557 1.00 0.00 C ATOM 440 C SER A 28 -12.800 0.320 10.044 1.00 0.00 C ATOM 441 O SER A 28 -11.764 0.626 9.485 1.00 0.00 O ATOM 442 CB SER A 28 -13.270 -2.121 10.299 1.00 0.00 C ATOM 443 OG SER A 28 -14.302 -3.088 10.154 1.00 0.00 O ATOM 0 H SER A 28 -12.956 -1.890 7.845 1.00 0.00 H new ATOM 0 HA SER A 28 -14.714 -0.610 9.753 1.00 0.00 H new ATOM 0 HB2 SER A 28 -12.333 -2.510 9.901 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.103 -1.905 11.354 1.00 0.00 H new ATOM 0 HG SER A 28 -14.050 -3.909 10.627 1.00 0.00 H new ATOM 449 N ARG A 29 -13.229 0.967 11.092 1.00 0.00 N ATOM 450 CA ARG A 29 -12.461 2.115 11.652 1.00 0.00 C ATOM 451 C ARG A 29 -11.114 1.611 12.180 1.00 0.00 C ATOM 452 O ARG A 29 -10.102 2.275 12.072 1.00 0.00 O ATOM 453 CB ARG A 29 -13.261 2.725 12.804 1.00 0.00 C ATOM 454 CG ARG A 29 -14.555 3.334 12.258 1.00 0.00 C ATOM 455 CD ARG A 29 -15.424 3.807 13.426 1.00 0.00 C ATOM 456 NE ARG A 29 -16.756 4.244 12.920 1.00 0.00 N ATOM 457 CZ ARG A 29 -17.620 3.358 12.504 1.00 0.00 C ATOM 458 NH1 ARG A 29 -17.292 2.096 12.459 1.00 0.00 N ATOM 459 NH2 ARG A 29 -18.809 3.735 12.123 1.00 0.00 N ATOM 0 H ARG A 29 -14.091 0.746 11.591 1.00 0.00 H new ATOM 0 HA ARG A 29 -12.291 2.865 10.879 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -13.491 1.961 13.546 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -12.670 3.490 13.307 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -14.326 4.171 11.598 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -15.095 2.597 11.663 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -15.546 3.001 14.150 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -14.934 4.631 13.946 1.00 0.00 H new ATOM 0 HE ARG A 29 -16.993 5.236 12.899 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -16.360 1.801 12.749 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -17.968 1.405 12.134 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -19.064 4.722 12.150 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -19.484 3.043 11.798 1.00 0.00 H new ATOM 473 N GLN A 30 -11.099 0.439 12.758 1.00 0.00 N ATOM 474 CA GLN A 30 -9.824 -0.116 13.303 1.00 0.00 C ATOM 475 C GLN A 30 -8.818 -0.289 12.160 1.00 0.00 C ATOM 476 O GLN A 30 -7.651 0.027 12.293 1.00 0.00 O ATOM 477 CB GLN A 30 -10.099 -1.475 13.953 1.00 0.00 C ATOM 478 CG GLN A 30 -11.028 -1.294 15.155 1.00 0.00 C ATOM 479 CD GLN A 30 -10.314 -0.478 16.236 1.00 0.00 C ATOM 480 OE1 GLN A 30 -9.227 -0.823 16.654 1.00 0.00 O ATOM 481 NE2 GLN A 30 -10.879 0.602 16.702 1.00 0.00 N ATOM 0 H GLN A 30 -11.916 -0.160 12.877 1.00 0.00 H new ATOM 0 HA GLN A 30 -9.415 0.567 14.048 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -10.554 -2.150 13.228 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -9.162 -1.933 14.271 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -11.943 -0.788 14.848 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -11.320 -2.266 15.552 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -11.792 0.892 16.351 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -10.408 1.156 17.417 1.00 0.00 H new ATOM 490 N GLN A 31 -9.264 -0.769 11.029 1.00 0.00 N ATOM 491 CA GLN A 31 -8.333 -0.937 9.875 1.00 0.00 C ATOM 492 C GLN A 31 -7.766 0.424 9.497 1.00 0.00 C ATOM 493 O GLN A 31 -6.588 0.583 9.249 1.00 0.00 O ATOM 494 CB GLN A 31 -9.094 -1.460 8.654 1.00 0.00 C ATOM 495 CG GLN A 31 -9.495 -2.916 8.834 1.00 0.00 C ATOM 496 CD GLN A 31 -10.325 -3.329 7.614 1.00 0.00 C ATOM 497 OE1 GLN A 31 -11.508 -3.066 7.550 1.00 0.00 O ATOM 498 NE2 GLN A 31 -9.738 -3.923 6.612 1.00 0.00 N ATOM 0 H GLN A 31 -10.229 -1.051 10.855 1.00 0.00 H new ATOM 0 HA GLN A 31 -7.547 -1.636 10.161 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -9.984 -0.853 8.491 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -8.472 -1.359 7.765 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -8.611 -3.547 8.926 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.073 -3.042 9.749 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -8.744 -4.146 6.662 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.273 -4.165 5.778 1.00 0.00 H new ATOM 507 N LEU A 32 -8.616 1.402 9.430 1.00 0.00 N ATOM 508 CA LEU A 32 -8.164 2.758 9.045 1.00 0.00 C ATOM 509 C LEU A 32 -7.153 3.267 10.072 1.00 0.00 C ATOM 510 O LEU A 32 -6.135 3.839 9.731 1.00 0.00 O ATOM 511 CB LEU A 32 -9.379 3.685 9.003 1.00 0.00 C ATOM 512 CG LEU A 32 -8.963 5.074 8.512 1.00 0.00 C ATOM 513 CD1 LEU A 32 -8.420 4.985 7.073 1.00 0.00 C ATOM 514 CD2 LEU A 32 -10.182 6.000 8.546 1.00 0.00 C ATOM 0 H LEU A 32 -9.613 1.319 9.627 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.689 2.733 8.064 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.140 3.270 8.342 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.824 3.759 9.995 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.180 5.469 9.159 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.127 5.978 6.733 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.554 4.324 7.051 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -9.195 4.590 6.416 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.895 6.992 8.198 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.961 5.599 7.898 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.558 6.069 9.567 1.00 0.00 H new ATOM 526 N CYS A 33 -7.420 3.056 11.325 1.00 0.00 N ATOM 527 CA CYS A 33 -6.473 3.516 12.375 1.00 0.00 C ATOM 528 C CYS A 33 -5.139 2.778 12.208 1.00 0.00 C ATOM 529 O CYS A 33 -4.083 3.298 12.510 1.00 0.00 O ATOM 530 CB CYS A 33 -7.078 3.215 13.755 1.00 0.00 C ATOM 531 SG CYS A 33 -6.581 4.495 14.934 1.00 0.00 S ATOM 0 H CYS A 33 -8.255 2.584 11.671 1.00 0.00 H new ATOM 0 HA CYS A 33 -6.298 4.588 12.285 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -8.165 3.175 13.685 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -6.744 2.237 14.103 1.00 0.00 H new ATOM 0 HG CYS A 33 -7.097 4.236 16.099 1.00 0.00 H new ATOM 537 N ASN A 34 -5.186 1.565 11.738 1.00 0.00 N ATOM 538 CA ASN A 34 -3.933 0.780 11.557 1.00 0.00 C ATOM 539 C ASN A 34 -3.019 1.494 10.558 1.00 0.00 C ATOM 540 O ASN A 34 -1.835 1.646 10.781 1.00 0.00 O ATOM 541 CB ASN A 34 -4.298 -0.604 11.014 1.00 0.00 C ATOM 542 CG ASN A 34 -3.076 -1.520 11.048 1.00 0.00 C ATOM 543 OD1 ASN A 34 -1.968 -1.070 11.262 1.00 0.00 O ATOM 544 ND2 ASN A 34 -3.237 -2.798 10.835 1.00 0.00 N ATOM 0 H ASN A 34 -6.042 1.080 11.470 1.00 0.00 H new ATOM 0 HA ASN A 34 -3.414 0.684 12.510 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -5.103 -1.036 11.609 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -4.668 -0.516 9.993 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -2.431 -3.423 10.848 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -4.169 -3.172 10.656 1.00 0.00 H new ATOM 551 N ILE A 35 -3.560 1.938 9.458 1.00 0.00 N ATOM 552 CA ILE A 35 -2.724 2.647 8.445 1.00 0.00 C ATOM 553 C ILE A 35 -2.235 3.981 9.020 1.00 0.00 C ATOM 554 O ILE A 35 -1.091 4.361 8.858 1.00 0.00 O ATOM 555 CB ILE A 35 -3.566 2.908 7.193 1.00 0.00 C ATOM 556 CG1 ILE A 35 -3.908 1.572 6.525 1.00 0.00 C ATOM 557 CG2 ILE A 35 -2.772 3.776 6.211 1.00 0.00 C ATOM 558 CD1 ILE A 35 -4.992 1.787 5.462 1.00 0.00 C ATOM 0 H ILE A 35 -4.546 1.841 9.215 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.862 2.031 8.188 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.484 3.425 7.474 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.016 1.145 6.067 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.255 0.859 7.273 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.373 3.961 5.321 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.523 4.726 6.684 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -1.854 3.260 5.929 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.232 0.835 4.989 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.887 2.195 5.932 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.629 2.485 4.708 1.00 0.00 H new ATOM 570 N GLU A 36 -3.104 4.701 9.676 1.00 0.00 N ATOM 571 CA GLU A 36 -2.714 6.022 10.252 1.00 0.00 C ATOM 572 C GLU A 36 -1.704 5.821 11.388 1.00 0.00 C ATOM 573 O GLU A 36 -0.795 6.607 11.572 1.00 0.00 O ATOM 574 CB GLU A 36 -3.967 6.716 10.802 1.00 0.00 C ATOM 575 CG GLU A 36 -3.698 8.213 10.975 1.00 0.00 C ATOM 576 CD GLU A 36 -3.703 8.896 9.605 1.00 0.00 C ATOM 577 OE1 GLU A 36 -4.017 8.228 8.632 1.00 0.00 O ATOM 578 OE2 GLU A 36 -3.396 10.075 9.551 1.00 0.00 O ATOM 0 H GLU A 36 -4.074 4.430 9.839 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.258 6.636 9.475 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.806 6.564 10.122 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -4.248 6.275 11.758 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -4.458 8.658 11.617 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.737 8.366 11.466 1.00 0.00 H new ATOM 585 N GLN A 37 -1.865 4.781 12.158 1.00 0.00 N ATOM 586 CA GLN A 37 -0.924 4.535 13.288 1.00 0.00 C ATOM 587 C GLN A 37 0.377 3.928 12.760 1.00 0.00 C ATOM 588 O GLN A 37 1.197 3.441 13.514 1.00 0.00 O ATOM 589 CB GLN A 37 -1.570 3.567 14.282 1.00 0.00 C ATOM 590 CG GLN A 37 -2.711 4.272 15.017 1.00 0.00 C ATOM 591 CD GLN A 37 -2.132 5.326 15.964 1.00 0.00 C ATOM 592 OE1 GLN A 37 -2.016 6.481 15.608 1.00 0.00 O ATOM 593 NE2 GLN A 37 -1.757 4.971 17.162 1.00 0.00 N ATOM 0 H GLN A 37 -2.608 4.090 12.054 1.00 0.00 H new ATOM 0 HA GLN A 37 -0.702 5.480 13.784 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.949 2.690 13.757 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -0.827 3.214 14.997 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -3.384 4.742 14.300 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.299 3.547 15.579 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -1.855 4.001 17.460 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -1.366 5.664 17.800 1.00 0.00 H new ATOM 602 N SER A 38 0.576 3.955 11.468 1.00 0.00 N ATOM 603 CA SER A 38 1.828 3.384 10.887 1.00 0.00 C ATOM 604 C SER A 38 2.836 4.510 10.648 1.00 0.00 C ATOM 605 O SER A 38 2.580 5.441 9.908 1.00 0.00 O ATOM 606 CB SER A 38 1.506 2.701 9.559 1.00 0.00 C ATOM 607 OG SER A 38 2.691 2.122 9.028 1.00 0.00 O ATOM 0 H SER A 38 -0.075 4.348 10.789 1.00 0.00 H new ATOM 0 HA SER A 38 2.252 2.655 11.578 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.747 1.933 9.707 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.094 3.425 8.855 1.00 0.00 H new ATOM 0 HG SER A 38 3.100 2.742 8.389 1.00 0.00 H new ATOM 613 N GLU A 39 3.981 4.436 11.275 1.00 0.00 N ATOM 614 CA GLU A 39 5.013 5.503 11.095 1.00 0.00 C ATOM 615 C GLU A 39 5.965 5.116 9.959 1.00 0.00 C ATOM 616 O GLU A 39 6.756 5.919 9.501 1.00 0.00 O ATOM 617 CB GLU A 39 5.805 5.661 12.398 1.00 0.00 C ATOM 618 CG GLU A 39 6.755 6.892 12.314 1.00 0.00 C ATOM 619 CD GLU A 39 6.500 7.862 13.479 1.00 0.00 C ATOM 620 OE1 GLU A 39 6.095 7.403 14.535 1.00 0.00 O ATOM 621 OE2 GLU A 39 6.722 9.047 13.294 1.00 0.00 O ATOM 0 H GLU A 39 4.248 3.680 11.906 1.00 0.00 H new ATOM 0 HA GLU A 39 4.524 6.445 10.845 1.00 0.00 H new ATOM 0 HB2 GLU A 39 5.118 5.781 13.236 1.00 0.00 H new ATOM 0 HB3 GLU A 39 6.386 4.759 12.589 1.00 0.00 H new ATOM 0 HG2 GLU A 39 7.792 6.558 12.334 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.605 7.408 11.366 1.00 0.00 H new ATOM 628 N THR A 40 5.888 3.890 9.502 1.00 0.00 N ATOM 629 CA THR A 40 6.779 3.424 8.389 1.00 0.00 C ATOM 630 C THR A 40 5.921 2.879 7.249 1.00 0.00 C ATOM 631 O THR A 40 5.014 2.098 7.457 1.00 0.00 O ATOM 632 CB THR A 40 7.705 2.321 8.901 1.00 0.00 C ATOM 633 OG1 THR A 40 8.519 2.841 9.942 1.00 0.00 O ATOM 634 CG2 THR A 40 8.589 1.822 7.757 1.00 0.00 C ATOM 0 H THR A 40 5.241 3.185 9.854 1.00 0.00 H new ATOM 0 HA THR A 40 7.378 4.260 8.029 1.00 0.00 H new ATOM 0 HB THR A 40 7.111 1.491 9.282 1.00 0.00 H new ATOM 0 HG1 THR A 40 9.114 2.137 10.275 1.00 0.00 H new ATOM 0 HG21 THR A 40 9.249 1.036 8.123 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.962 1.426 6.958 1.00 0.00 H new ATOM 0 HG23 THR A 40 9.188 2.648 7.373 1.00 0.00 H new ATOM 642 N ALA A 41 6.195 3.298 6.043 1.00 0.00 N ATOM 643 CA ALA A 41 5.387 2.819 4.887 1.00 0.00 C ATOM 644 C ALA A 41 5.850 1.407 4.474 1.00 0.00 C ATOM 645 O ALA A 41 7.015 1.081 4.584 1.00 0.00 O ATOM 646 CB ALA A 41 5.582 3.778 3.711 1.00 0.00 C ATOM 0 H ALA A 41 6.943 3.951 5.809 1.00 0.00 H new ATOM 0 HA ALA A 41 4.335 2.783 5.169 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.994 3.435 2.860 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.255 4.777 3.998 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.636 3.806 3.435 1.00 0.00 H new ATOM 652 N PRO A 42 4.948 0.575 3.999 1.00 0.00 N ATOM 653 CA PRO A 42 5.284 -0.817 3.560 1.00 0.00 C ATOM 654 C PRO A 42 6.068 -0.855 2.238 1.00 0.00 C ATOM 655 O PRO A 42 6.037 0.073 1.453 1.00 0.00 O ATOM 656 CB PRO A 42 3.910 -1.487 3.406 1.00 0.00 C ATOM 657 CG PRO A 42 2.975 -0.366 3.088 1.00 0.00 C ATOM 658 CD PRO A 42 3.511 0.860 3.827 1.00 0.00 C ATOM 0 HA PRO A 42 5.936 -1.319 4.275 1.00 0.00 H new ATOM 0 HB2 PRO A 42 3.920 -2.232 2.611 1.00 0.00 H new ATOM 0 HB3 PRO A 42 3.615 -2.001 4.321 1.00 0.00 H new ATOM 0 HG2 PRO A 42 2.935 -0.186 2.014 1.00 0.00 H new ATOM 0 HG3 PRO A 42 1.961 -0.602 3.410 1.00 0.00 H new ATOM 0 HD2 PRO A 42 3.351 1.773 3.253 1.00 0.00 H new ATOM 0 HD3 PRO A 42 3.014 0.996 4.787 1.00 0.00 H new ATOM 666 N VAL A 43 6.769 -1.932 1.994 1.00 0.00 N ATOM 667 CA VAL A 43 7.560 -2.060 0.733 1.00 0.00 C ATOM 668 C VAL A 43 6.615 -2.146 -0.471 1.00 0.00 C ATOM 669 O VAL A 43 6.897 -1.626 -1.533 1.00 0.00 O ATOM 670 CB VAL A 43 8.407 -3.334 0.790 1.00 0.00 C ATOM 671 CG1 VAL A 43 7.491 -4.558 0.801 1.00 0.00 C ATOM 672 CG2 VAL A 43 9.325 -3.395 -0.435 1.00 0.00 C ATOM 0 H VAL A 43 6.828 -2.735 2.620 1.00 0.00 H new ATOM 0 HA VAL A 43 8.204 -1.187 0.629 1.00 0.00 H new ATOM 0 HB VAL A 43 9.012 -3.325 1.697 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.095 -5.464 0.842 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.839 -4.517 1.674 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.884 -4.567 -0.105 1.00 0.00 H new ATOM 0 HG21 VAL A 43 9.928 -4.302 -0.393 1.00 0.00 H new ATOM 0 HG22 VAL A 43 8.721 -3.402 -1.342 1.00 0.00 H new ATOM 0 HG23 VAL A 43 9.981 -2.524 -0.442 1.00 0.00 H new ATOM 682 N VAL A 44 5.503 -2.813 -0.317 1.00 0.00 N ATOM 683 CA VAL A 44 4.546 -2.955 -1.454 1.00 0.00 C ATOM 684 C VAL A 44 4.343 -1.590 -2.125 1.00 0.00 C ATOM 685 O VAL A 44 4.323 -1.475 -3.336 1.00 0.00 O ATOM 686 CB VAL A 44 3.208 -3.491 -0.919 1.00 0.00 C ATOM 687 CG1 VAL A 44 3.478 -4.621 0.080 1.00 0.00 C ATOM 688 CG2 VAL A 44 2.439 -2.369 -0.210 1.00 0.00 C ATOM 0 H VAL A 44 5.215 -3.267 0.550 1.00 0.00 H new ATOM 0 HA VAL A 44 4.943 -3.653 -2.192 1.00 0.00 H new ATOM 0 HB VAL A 44 2.614 -3.864 -1.753 1.00 0.00 H new ATOM 0 HG11 VAL A 44 2.531 -5.003 0.461 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.020 -5.425 -0.418 1.00 0.00 H new ATOM 0 HG13 VAL A 44 4.075 -4.239 0.908 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.493 -2.758 0.166 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.032 -1.991 0.623 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.245 -1.560 -0.914 1.00 0.00 H new ATOM 698 N VAL A 45 4.210 -0.555 -1.344 1.00 0.00 N ATOM 699 CA VAL A 45 4.028 0.804 -1.923 1.00 0.00 C ATOM 700 C VAL A 45 5.302 1.196 -2.674 1.00 0.00 C ATOM 701 O VAL A 45 5.258 1.719 -3.770 1.00 0.00 O ATOM 702 CB VAL A 45 3.758 1.801 -0.791 1.00 0.00 C ATOM 703 CG1 VAL A 45 3.805 3.232 -1.338 1.00 0.00 C ATOM 704 CG2 VAL A 45 2.371 1.528 -0.196 1.00 0.00 C ATOM 0 H VAL A 45 4.220 -0.593 -0.325 1.00 0.00 H new ATOM 0 HA VAL A 45 3.184 0.811 -2.613 1.00 0.00 H new ATOM 0 HB VAL A 45 4.519 1.686 -0.019 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.612 3.937 -0.529 1.00 0.00 H new ATOM 0 HG12 VAL A 45 4.790 3.427 -1.763 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.046 3.351 -2.111 1.00 0.00 H new ATOM 0 HG21 VAL A 45 2.175 2.235 0.610 1.00 0.00 H new ATOM 0 HG22 VAL A 45 1.614 1.642 -0.971 1.00 0.00 H new ATOM 0 HG23 VAL A 45 2.337 0.512 0.197 1.00 0.00 H new ATOM 714 N LYS A 46 6.438 0.939 -2.089 1.00 0.00 N ATOM 715 CA LYS A 46 7.722 1.285 -2.759 1.00 0.00 C ATOM 716 C LYS A 46 7.831 0.502 -4.067 1.00 0.00 C ATOM 717 O LYS A 46 8.320 0.996 -5.064 1.00 0.00 O ATOM 718 CB LYS A 46 8.895 0.907 -1.850 1.00 0.00 C ATOM 719 CG LYS A 46 8.902 1.805 -0.613 1.00 0.00 C ATOM 720 CD LYS A 46 10.075 1.418 0.290 1.00 0.00 C ATOM 721 CE LYS A 46 10.093 2.325 1.519 1.00 0.00 C ATOM 722 NZ LYS A 46 11.239 1.952 2.398 1.00 0.00 N ATOM 0 H LYS A 46 6.533 0.502 -1.172 1.00 0.00 H new ATOM 0 HA LYS A 46 7.749 2.356 -2.962 1.00 0.00 H new ATOM 0 HB2 LYS A 46 8.813 -0.138 -1.551 1.00 0.00 H new ATOM 0 HB3 LYS A 46 9.835 1.011 -2.392 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.987 2.850 -0.910 1.00 0.00 H new ATOM 0 HG3 LYS A 46 7.962 1.703 -0.071 1.00 0.00 H new ATOM 0 HD2 LYS A 46 9.984 0.376 0.595 1.00 0.00 H new ATOM 0 HD3 LYS A 46 11.014 1.509 -0.256 1.00 0.00 H new ATOM 0 HE2 LYS A 46 10.180 3.368 1.213 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.155 2.231 2.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 11.250 2.570 3.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 11.137 0.962 2.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 12.130 2.063 1.873 1.00 0.00 H new ATOM 736 N TYR A 47 7.391 -0.724 -4.063 1.00 0.00 N ATOM 737 CA TYR A 47 7.477 -1.555 -5.296 1.00 0.00 C ATOM 738 C TYR A 47 6.674 -0.886 -6.419 1.00 0.00 C ATOM 739 O TYR A 47 7.100 -0.838 -7.555 1.00 0.00 O ATOM 740 CB TYR A 47 6.911 -2.951 -5.011 1.00 0.00 C ATOM 741 CG TYR A 47 7.407 -3.918 -6.058 1.00 0.00 C ATOM 742 CD1 TYR A 47 8.628 -4.570 -5.866 1.00 0.00 C ATOM 743 CD2 TYR A 47 6.661 -4.154 -7.218 1.00 0.00 C ATOM 744 CE1 TYR A 47 9.105 -5.459 -6.831 1.00 0.00 C ATOM 745 CE2 TYR A 47 7.139 -5.044 -8.187 1.00 0.00 C ATOM 746 CZ TYR A 47 8.363 -5.697 -7.993 1.00 0.00 C ATOM 747 OH TYR A 47 8.840 -6.572 -8.947 1.00 0.00 O ATOM 0 H TYR A 47 6.974 -1.189 -3.256 1.00 0.00 H new ATOM 0 HA TYR A 47 8.518 -1.646 -5.605 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.217 -3.284 -4.019 1.00 0.00 H new ATOM 0 HB3 TYR A 47 5.821 -2.921 -5.015 1.00 0.00 H new ATOM 0 HD1 TYR A 47 9.203 -4.386 -4.971 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.717 -3.650 -7.366 1.00 0.00 H new ATOM 0 HE1 TYR A 47 10.048 -5.964 -6.680 1.00 0.00 H new ATOM 0 HE2 TYR A 47 6.565 -5.227 -9.083 1.00 0.00 H new ATOM 0 HH TYR A 47 9.790 -6.749 -8.783 1.00 0.00 H new ATOM 757 N ILE A 48 5.518 -0.364 -6.110 1.00 0.00 N ATOM 758 CA ILE A 48 4.701 0.303 -7.164 1.00 0.00 C ATOM 759 C ILE A 48 5.481 1.500 -7.710 1.00 0.00 C ATOM 760 O ILE A 48 5.538 1.730 -8.901 1.00 0.00 O ATOM 761 CB ILE A 48 3.380 0.793 -6.558 1.00 0.00 C ATOM 762 CG1 ILE A 48 2.517 -0.415 -6.185 1.00 0.00 C ATOM 763 CG2 ILE A 48 2.632 1.662 -7.575 1.00 0.00 C ATOM 764 CD1 ILE A 48 1.319 0.045 -5.355 1.00 0.00 C ATOM 0 H ILE A 48 5.105 -0.370 -5.177 1.00 0.00 H new ATOM 0 HA ILE A 48 4.489 -0.403 -7.967 1.00 0.00 H new ATOM 0 HB ILE A 48 3.588 1.385 -5.667 1.00 0.00 H new ATOM 0 HG12 ILE A 48 2.174 -0.921 -7.087 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.108 -1.136 -5.620 1.00 0.00 H new ATOM 0 HG21 ILE A 48 1.695 2.007 -7.139 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.247 2.522 -7.841 1.00 0.00 H new ATOM 0 HG23 ILE A 48 2.422 1.076 -8.470 1.00 0.00 H new ATOM 0 HD11 ILE A 48 0.707 -0.817 -5.091 1.00 0.00 H new ATOM 0 HD12 ILE A 48 1.672 0.532 -4.446 1.00 0.00 H new ATOM 0 HD13 ILE A 48 0.723 0.749 -5.936 1.00 0.00 H new ATOM 776 N ALA A 49 6.086 2.260 -6.843 1.00 0.00 N ATOM 777 CA ALA A 49 6.869 3.439 -7.303 1.00 0.00 C ATOM 778 C ALA A 49 8.025 2.966 -8.191 1.00 0.00 C ATOM 779 O ALA A 49 8.408 3.627 -9.134 1.00 0.00 O ATOM 780 CB ALA A 49 7.430 4.184 -6.089 1.00 0.00 C ATOM 0 H ALA A 49 6.072 2.116 -5.833 1.00 0.00 H new ATOM 0 HA ALA A 49 6.222 4.107 -7.872 1.00 0.00 H new ATOM 0 HB1 ALA A 49 8.004 5.048 -6.425 1.00 0.00 H new ATOM 0 HB2 ALA A 49 6.608 4.518 -5.456 1.00 0.00 H new ATOM 0 HB3 ALA A 49 8.078 3.517 -5.520 1.00 0.00 H new ATOM 786 N PHE A 50 8.590 1.829 -7.889 1.00 0.00 N ATOM 787 CA PHE A 50 9.727 1.321 -8.710 1.00 0.00 C ATOM 788 C PHE A 50 9.262 1.124 -10.157 1.00 0.00 C ATOM 789 O PHE A 50 9.903 1.561 -11.092 1.00 0.00 O ATOM 790 CB PHE A 50 10.191 -0.022 -8.138 1.00 0.00 C ATOM 791 CG PHE A 50 11.487 -0.436 -8.791 1.00 0.00 C ATOM 792 CD1 PHE A 50 12.689 0.137 -8.367 1.00 0.00 C ATOM 793 CD2 PHE A 50 11.489 -1.394 -9.813 1.00 0.00 C ATOM 794 CE1 PHE A 50 13.896 -0.245 -8.962 1.00 0.00 C ATOM 795 CE2 PHE A 50 12.697 -1.778 -10.409 1.00 0.00 C ATOM 796 CZ PHE A 50 13.900 -1.203 -9.983 1.00 0.00 C ATOM 0 H PHE A 50 8.314 1.230 -7.111 1.00 0.00 H new ATOM 0 HA PHE A 50 10.549 2.037 -8.688 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.326 0.059 -7.059 1.00 0.00 H new ATOM 0 HB3 PHE A 50 9.429 -0.783 -8.307 1.00 0.00 H new ATOM 0 HD1 PHE A 50 12.686 0.876 -7.579 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.560 -1.836 -10.141 1.00 0.00 H new ATOM 0 HE1 PHE A 50 14.824 0.199 -8.634 1.00 0.00 H new ATOM 0 HE2 PHE A 50 12.700 -2.517 -11.197 1.00 0.00 H new ATOM 0 HZ PHE A 50 14.832 -1.499 -10.442 1.00 0.00 H new ATOM 806 N LEU A 51 8.146 0.475 -10.347 1.00 0.00 N ATOM 807 CA LEU A 51 7.628 0.255 -11.730 1.00 0.00 C ATOM 808 C LEU A 51 7.263 1.603 -12.360 1.00 0.00 C ATOM 809 O LEU A 51 7.542 1.865 -13.515 1.00 0.00 O ATOM 810 CB LEU A 51 6.384 -0.633 -11.664 1.00 0.00 C ATOM 811 CG LEU A 51 6.778 -2.052 -11.234 1.00 0.00 C ATOM 812 CD1 LEU A 51 5.507 -2.860 -10.959 1.00 0.00 C ATOM 813 CD2 LEU A 51 7.606 -2.744 -12.340 1.00 0.00 C ATOM 0 H LEU A 51 7.568 0.086 -9.602 1.00 0.00 H new ATOM 0 HA LEU A 51 8.393 -0.230 -12.336 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.666 -0.216 -10.958 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.895 -0.661 -12.638 1.00 0.00 H new ATOM 0 HG LEU A 51 7.387 -1.996 -10.332 1.00 0.00 H new ATOM 0 HD11 LEU A 51 5.777 -3.870 -10.653 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.936 -2.380 -10.164 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.902 -2.905 -11.864 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.876 -3.749 -12.017 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.015 -2.803 -13.254 1.00 0.00 H new ATOM 0 HD23 LEU A 51 8.512 -2.168 -12.530 1.00 0.00 H new ATOM 825 N ARG A 52 6.642 2.461 -11.601 1.00 0.00 N ATOM 826 CA ARG A 52 6.257 3.798 -12.135 1.00 0.00 C ATOM 827 C ARG A 52 7.525 4.585 -12.465 1.00 0.00 C ATOM 828 O ARG A 52 7.570 5.354 -13.405 1.00 0.00 O ATOM 829 CB ARG A 52 5.445 4.551 -11.080 1.00 0.00 C ATOM 830 CG ARG A 52 4.073 3.892 -10.922 1.00 0.00 C ATOM 831 CD ARG A 52 3.295 4.600 -9.811 1.00 0.00 C ATOM 832 NE ARG A 52 1.951 3.974 -9.659 1.00 0.00 N ATOM 833 CZ ARG A 52 1.014 4.226 -10.531 1.00 0.00 C ATOM 834 NH1 ARG A 52 1.267 5.001 -11.548 1.00 0.00 N ATOM 835 NH2 ARG A 52 -0.173 3.706 -10.386 1.00 0.00 N ATOM 0 H ARG A 52 6.383 2.294 -10.629 1.00 0.00 H new ATOM 0 HA ARG A 52 5.654 3.679 -13.035 1.00 0.00 H new ATOM 0 HB2 ARG A 52 5.974 4.546 -10.127 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.327 5.594 -11.373 1.00 0.00 H new ATOM 0 HG2 ARG A 52 3.521 3.947 -11.860 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.190 2.835 -10.683 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.845 4.536 -8.872 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.189 5.659 -10.047 1.00 0.00 H new ATOM 0 HE ARG A 52 1.764 3.350 -8.874 1.00 0.00 H new ATOM 0 HH11 ARG A 52 2.195 5.408 -11.660 1.00 0.00 H new ATOM 0 HH12 ARG A 52 0.537 5.200 -12.232 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -0.371 3.101 -9.589 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -0.904 3.905 -11.069 1.00 0.00 H new ATOM 849 N SER A 53 8.559 4.399 -11.690 1.00 0.00 N ATOM 850 CA SER A 53 9.831 5.130 -11.947 1.00 0.00 C ATOM 851 C SER A 53 10.334 4.791 -13.352 1.00 0.00 C ATOM 852 O SER A 53 11.100 5.525 -13.945 1.00 0.00 O ATOM 853 CB SER A 53 10.876 4.709 -10.911 1.00 0.00 C ATOM 854 OG SER A 53 11.937 5.656 -10.902 1.00 0.00 O ATOM 0 H SER A 53 8.577 3.770 -10.887 1.00 0.00 H new ATOM 0 HA SER A 53 9.660 6.204 -11.872 1.00 0.00 H new ATOM 0 HB2 SER A 53 10.420 4.647 -9.923 1.00 0.00 H new ATOM 0 HB3 SER A 53 11.261 3.717 -11.148 1.00 0.00 H new ATOM 0 HG SER A 53 12.607 5.390 -10.238 1.00 0.00 H new ATOM 860 N LYS A 54 9.899 3.683 -13.893 1.00 0.00 N ATOM 861 CA LYS A 54 10.335 3.292 -15.265 1.00 0.00 C ATOM 862 C LYS A 54 9.313 3.815 -16.277 1.00 0.00 C ATOM 863 O LYS A 54 9.442 3.620 -17.470 1.00 0.00 O ATOM 864 CB LYS A 54 10.419 1.766 -15.354 1.00 0.00 C ATOM 865 CG LYS A 54 11.564 1.268 -14.471 1.00 0.00 C ATOM 866 CD LYS A 54 11.628 -0.259 -14.523 1.00 0.00 C ATOM 867 CE LYS A 54 12.787 -0.750 -13.653 1.00 0.00 C ATOM 868 NZ LYS A 54 12.841 -2.239 -13.687 1.00 0.00 N ATOM 0 H LYS A 54 9.258 3.030 -13.441 1.00 0.00 H new ATOM 0 HA LYS A 54 11.315 3.717 -15.482 1.00 0.00 H new ATOM 0 HB2 LYS A 54 9.478 1.320 -15.034 1.00 0.00 H new ATOM 0 HB3 LYS A 54 10.582 1.459 -16.387 1.00 0.00 H new ATOM 0 HG2 LYS A 54 12.509 1.693 -14.810 1.00 0.00 H new ATOM 0 HG3 LYS A 54 11.415 1.601 -13.444 1.00 0.00 H new ATOM 0 HD2 LYS A 54 10.689 -0.685 -14.171 1.00 0.00 H new ATOM 0 HD3 LYS A 54 11.764 -0.593 -15.552 1.00 0.00 H new ATOM 0 HE2 LYS A 54 13.728 -0.334 -14.014 1.00 0.00 H new ATOM 0 HE3 LYS A 54 12.657 -0.404 -12.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.816 -2.555 -13.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.215 -2.626 -12.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 12.529 -2.576 -14.620 1.00 0.00 H new ATOM 882 N GLY A 55 8.302 4.495 -15.804 1.00 0.00 N ATOM 883 CA GLY A 55 7.270 5.051 -16.727 1.00 0.00 C ATOM 884 C GLY A 55 6.248 3.970 -17.089 1.00 0.00 C ATOM 885 O GLY A 55 5.606 4.031 -18.120 1.00 0.00 O ATOM 0 H GLY A 55 8.146 4.690 -14.815 1.00 0.00 H new ATOM 0 HA2 GLY A 55 6.766 5.895 -16.255 1.00 0.00 H new ATOM 0 HA3 GLY A 55 7.746 5.429 -17.632 1.00 0.00 H new ATOM 889 N VAL A 56 6.087 2.981 -16.254 1.00 0.00 N ATOM 890 CA VAL A 56 5.104 1.903 -16.563 1.00 0.00 C ATOM 891 C VAL A 56 3.689 2.486 -16.588 1.00 0.00 C ATOM 892 O VAL A 56 3.299 3.249 -15.725 1.00 0.00 O ATOM 893 CB VAL A 56 5.203 0.803 -15.503 1.00 0.00 C ATOM 894 CG1 VAL A 56 4.071 -0.211 -15.697 1.00 0.00 C ATOM 895 CG2 VAL A 56 6.550 0.092 -15.657 1.00 0.00 C ATOM 0 H VAL A 56 6.591 2.872 -15.374 1.00 0.00 H new ATOM 0 HA VAL A 56 5.326 1.476 -17.541 1.00 0.00 H new ATOM 0 HB VAL A 56 5.121 1.243 -14.509 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.147 -0.991 -14.939 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.110 0.294 -15.602 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.149 -0.659 -16.688 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.634 -0.695 -14.907 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.618 -0.347 -16.653 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.358 0.810 -15.521 1.00 0.00 H new ATOM 905 N ASP A 57 2.926 2.136 -17.588 1.00 0.00 N ATOM 906 CA ASP A 57 1.538 2.663 -17.703 1.00 0.00 C ATOM 907 C ASP A 57 0.650 2.018 -16.637 1.00 0.00 C ATOM 908 O ASP A 57 -0.391 1.463 -16.933 1.00 0.00 O ATOM 909 CB ASP A 57 0.993 2.332 -19.094 1.00 0.00 C ATOM 910 CG ASP A 57 1.747 3.153 -20.141 1.00 0.00 C ATOM 911 OD1 ASP A 57 2.812 2.721 -20.549 1.00 0.00 O ATOM 912 OD2 ASP A 57 1.244 4.197 -20.522 1.00 0.00 O ATOM 0 H ASP A 57 3.208 1.502 -18.336 1.00 0.00 H new ATOM 0 HA ASP A 57 1.543 3.743 -17.556 1.00 0.00 H new ATOM 0 HB2 ASP A 57 1.108 1.267 -19.298 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -0.073 2.552 -19.141 1.00 0.00 H new ATOM 917 N LEU A 58 1.051 2.090 -15.399 1.00 0.00 N ATOM 918 CA LEU A 58 0.233 1.487 -14.310 1.00 0.00 C ATOM 919 C LEU A 58 -0.926 2.428 -13.987 1.00 0.00 C ATOM 920 O LEU A 58 -1.851 2.081 -13.280 1.00 0.00 O ATOM 921 CB LEU A 58 1.113 1.293 -13.066 1.00 0.00 C ATOM 922 CG LEU A 58 0.468 0.280 -12.101 1.00 0.00 C ATOM 923 CD1 LEU A 58 0.819 -1.149 -12.523 1.00 0.00 C ATOM 924 CD2 LEU A 58 0.994 0.514 -10.682 1.00 0.00 C ATOM 0 H LEU A 58 1.913 2.542 -15.093 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.160 0.520 -14.624 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.101 0.942 -13.364 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.253 2.248 -12.560 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.613 0.414 -12.128 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.357 -1.856 -11.833 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.449 -1.332 -13.532 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.901 -1.278 -12.505 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.536 -0.204 -10.001 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.076 0.387 -10.670 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.744 1.526 -10.364 1.00 0.00 H new ATOM 936 N ASN A 59 -0.882 3.617 -14.515 1.00 0.00 N ATOM 937 CA ASN A 59 -1.979 4.590 -14.264 1.00 0.00 C ATOM 938 C ASN A 59 -3.273 4.058 -14.880 1.00 0.00 C ATOM 939 O ASN A 59 -4.353 4.306 -14.387 1.00 0.00 O ATOM 940 CB ASN A 59 -1.617 5.947 -14.872 1.00 0.00 C ATOM 941 CG ASN A 59 -0.496 6.581 -14.046 1.00 0.00 C ATOM 942 OD1 ASN A 59 -0.421 6.376 -12.852 1.00 0.00 O ATOM 943 ND2 ASN A 59 0.384 7.345 -14.630 1.00 0.00 N ATOM 0 H ASN A 59 -0.130 3.959 -15.113 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.120 4.718 -13.191 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.298 5.823 -15.907 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.490 6.599 -14.884 1.00 0.00 H new ATOM 0 HD21 ASN A 59 1.134 7.769 -14.084 1.00 0.00 H new ATOM 0 HD22 ASN A 59 0.323 7.519 -15.633 1.00 0.00 H new ATOM 950 N ALA A 60 -3.178 3.330 -15.958 1.00 0.00 N ATOM 951 CA ALA A 60 -4.409 2.781 -16.597 1.00 0.00 C ATOM 952 C ALA A 60 -5.106 1.825 -15.624 1.00 0.00 C ATOM 953 O ALA A 60 -6.304 1.884 -15.427 1.00 0.00 O ATOM 954 CB ALA A 60 -4.026 2.019 -17.866 1.00 0.00 C ATOM 0 H ALA A 60 -2.303 3.091 -16.424 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.083 3.600 -16.850 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -4.925 1.617 -18.334 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.527 2.695 -18.560 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.353 1.201 -17.610 1.00 0.00 H new ATOM 960 N LEU A 61 -4.363 0.946 -15.008 1.00 0.00 N ATOM 961 CA LEU A 61 -4.980 -0.007 -14.042 1.00 0.00 C ATOM 962 C LEU A 61 -5.532 0.783 -12.852 1.00 0.00 C ATOM 963 O LEU A 61 -6.589 0.492 -12.329 1.00 0.00 O ATOM 964 CB LEU A 61 -3.923 -1.000 -13.553 1.00 0.00 C ATOM 965 CG LEU A 61 -3.223 -1.650 -14.752 1.00 0.00 C ATOM 966 CD1 LEU A 61 -2.151 -2.615 -14.243 1.00 0.00 C ATOM 967 CD2 LEU A 61 -4.247 -2.420 -15.603 1.00 0.00 C ATOM 0 H LEU A 61 -3.355 0.847 -15.132 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.786 -0.556 -14.528 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.192 -0.488 -12.928 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.390 -1.766 -12.934 1.00 0.00 H new ATOM 0 HG LEU A 61 -2.762 -0.876 -15.366 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.649 -3.081 -15.091 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -1.422 -2.067 -13.646 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.617 -3.386 -13.629 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.742 -2.879 -16.453 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.714 -3.196 -14.996 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.011 -1.732 -15.964 1.00 0.00 H new ATOM 979 N PHE A 62 -4.816 1.780 -12.417 1.00 0.00 N ATOM 980 CA PHE A 62 -5.294 2.597 -11.267 1.00 0.00 C ATOM 981 C PHE A 62 -6.516 3.422 -11.687 1.00 0.00 C ATOM 982 O PHE A 62 -7.534 3.416 -11.031 1.00 0.00 O ATOM 983 CB PHE A 62 -4.152 3.531 -10.815 1.00 0.00 C ATOM 984 CG PHE A 62 -3.435 2.944 -9.624 1.00 0.00 C ATOM 985 CD1 PHE A 62 -2.473 1.947 -9.804 1.00 0.00 C ATOM 986 CD2 PHE A 62 -3.740 3.402 -8.340 1.00 0.00 C ATOM 987 CE1 PHE A 62 -1.814 1.407 -8.695 1.00 0.00 C ATOM 988 CE2 PHE A 62 -3.083 2.865 -7.230 1.00 0.00 C ATOM 989 CZ PHE A 62 -2.118 1.866 -7.407 1.00 0.00 C ATOM 0 H PHE A 62 -3.918 2.066 -12.808 1.00 0.00 H new ATOM 0 HA PHE A 62 -5.583 1.946 -10.442 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.449 3.679 -11.634 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -4.555 4.511 -10.559 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -2.239 1.594 -10.797 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -4.485 4.172 -8.205 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -1.070 0.636 -8.832 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -3.319 3.220 -6.238 1.00 0.00 H new ATOM 0 HZ PHE A 62 -1.608 1.450 -6.551 1.00 0.00 H new ATOM 999 N ASP A 63 -6.426 4.125 -12.782 1.00 0.00 N ATOM 1000 CA ASP A 63 -7.589 4.937 -13.234 1.00 0.00 C ATOM 1001 C ASP A 63 -8.818 4.035 -13.241 1.00 0.00 C ATOM 1002 O ASP A 63 -9.894 4.416 -12.823 1.00 0.00 O ATOM 1003 CB ASP A 63 -7.322 5.484 -14.638 1.00 0.00 C ATOM 1004 CG ASP A 63 -6.265 6.589 -14.560 1.00 0.00 C ATOM 1005 OD1 ASP A 63 -5.613 6.685 -13.532 1.00 0.00 O ATOM 1006 OD2 ASP A 63 -6.133 7.327 -15.522 1.00 0.00 O ATOM 0 H ASP A 63 -5.601 4.172 -13.380 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.751 5.781 -12.564 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.979 4.683 -15.293 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -8.243 5.876 -15.069 1.00 0.00 H new ATOM 1011 N ARG A 64 -8.649 2.823 -13.685 1.00 0.00 N ATOM 1012 CA ARG A 64 -9.782 1.862 -13.692 1.00 0.00 C ATOM 1013 C ARG A 64 -10.271 1.641 -12.256 1.00 0.00 C ATOM 1014 O ARG A 64 -11.448 1.698 -11.977 1.00 0.00 O ATOM 1015 CB ARG A 64 -9.281 0.528 -14.273 1.00 0.00 C ATOM 1016 CG ARG A 64 -10.328 -0.589 -14.089 1.00 0.00 C ATOM 1017 CD ARG A 64 -9.777 -1.917 -14.633 1.00 0.00 C ATOM 1018 NE ARG A 64 -10.062 -2.015 -16.096 1.00 0.00 N ATOM 1019 CZ ARG A 64 -9.207 -2.569 -16.924 1.00 0.00 C ATOM 1020 NH1 ARG A 64 -8.046 -3.001 -16.505 1.00 0.00 N ATOM 1021 NH2 ARG A 64 -9.521 -2.687 -18.183 1.00 0.00 N ATOM 0 H ARG A 64 -7.769 2.455 -14.046 1.00 0.00 H new ATOM 0 HA ARG A 64 -10.603 2.251 -14.294 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -9.059 0.651 -15.333 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -8.350 0.242 -13.783 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -10.579 -0.694 -13.033 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -11.248 -0.326 -14.610 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.703 -1.976 -14.457 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -10.233 -2.755 -14.106 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.940 -1.644 -16.459 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -7.793 -2.910 -15.521 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.394 -3.429 -17.162 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -10.424 -2.350 -18.517 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.864 -3.116 -18.835 1.00 0.00 H new ATOM 1035 N ILE A 65 -9.376 1.358 -11.351 1.00 0.00 N ATOM 1036 CA ILE A 65 -9.791 1.101 -9.939 1.00 0.00 C ATOM 1037 C ILE A 65 -10.324 2.384 -9.284 1.00 0.00 C ATOM 1038 O ILE A 65 -11.317 2.369 -8.583 1.00 0.00 O ATOM 1039 CB ILE A 65 -8.583 0.596 -9.143 1.00 0.00 C ATOM 1040 CG1 ILE A 65 -8.157 -0.773 -9.679 1.00 0.00 C ATOM 1041 CG2 ILE A 65 -8.966 0.458 -7.665 1.00 0.00 C ATOM 1042 CD1 ILE A 65 -6.798 -1.153 -9.088 1.00 0.00 C ATOM 0 H ILE A 65 -8.373 1.293 -11.526 1.00 0.00 H new ATOM 0 HA ILE A 65 -10.584 0.353 -9.940 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.761 1.304 -9.245 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -8.902 -1.525 -9.418 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -8.098 -0.747 -10.767 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -8.107 0.099 -7.099 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -9.276 1.428 -7.277 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -9.788 -0.251 -7.567 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.495 -2.128 -9.470 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.056 -0.406 -9.371 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.873 -1.196 -8.001 1.00 0.00 H new ATOM 1282 N GLU B 2 -7.188 -10.243 -12.336 1.00 0.00 N ATOM 1283 CA GLU B 2 -6.918 -9.668 -10.986 1.00 0.00 C ATOM 1284 C GLU B 2 -5.845 -8.580 -11.062 1.00 0.00 C ATOM 1285 O GLU B 2 -5.126 -8.461 -12.034 1.00 0.00 O ATOM 1286 CB GLU B 2 -6.450 -10.774 -10.038 1.00 0.00 C ATOM 1287 CG GLU B 2 -7.626 -11.695 -9.709 1.00 0.00 C ATOM 1288 CD GLU B 2 -7.175 -12.760 -8.708 1.00 0.00 C ATOM 1289 OE1 GLU B 2 -6.214 -13.453 -9.001 1.00 0.00 O ATOM 1290 OE2 GLU B 2 -7.806 -12.873 -7.671 1.00 0.00 O ATOM 0 HA GLU B 2 -7.841 -9.224 -10.612 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -5.644 -11.346 -10.499 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -6.049 -10.338 -9.123 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -8.450 -11.116 -9.293 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -7.996 -12.169 -10.618 1.00 0.00 H new ATOM 1297 N LEU B 3 -5.738 -7.787 -10.027 1.00 0.00 N ATOM 1298 CA LEU B 3 -4.719 -6.697 -10.008 1.00 0.00 C ATOM 1299 C LEU B 3 -3.320 -7.311 -10.089 1.00 0.00 C ATOM 1300 O LEU B 3 -2.466 -6.846 -10.817 1.00 0.00 O ATOM 1301 CB LEU B 3 -4.857 -5.914 -8.693 1.00 0.00 C ATOM 1302 CG LEU B 3 -3.764 -4.840 -8.581 1.00 0.00 C ATOM 1303 CD1 LEU B 3 -3.830 -3.887 -9.783 1.00 0.00 C ATOM 1304 CD2 LEU B 3 -3.977 -4.049 -7.285 1.00 0.00 C ATOM 0 H LEU B 3 -6.317 -7.849 -9.189 1.00 0.00 H new ATOM 0 HA LEU B 3 -4.871 -6.029 -10.856 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -5.840 -5.445 -8.645 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -4.788 -6.599 -7.848 1.00 0.00 H new ATOM 0 HG LEU B 3 -2.785 -5.319 -8.570 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -3.050 -3.131 -9.691 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -3.681 -4.452 -10.704 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -4.805 -3.401 -9.809 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -3.206 -3.283 -7.195 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -4.958 -3.575 -7.305 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -3.918 -4.725 -6.432 1.00 0.00 H new ATOM 1316 N SER B 4 -3.083 -8.351 -9.343 1.00 0.00 N ATOM 1317 CA SER B 4 -1.742 -9.001 -9.369 1.00 0.00 C ATOM 1318 C SER B 4 -1.498 -9.627 -10.745 1.00 0.00 C ATOM 1319 O SER B 4 -0.373 -9.787 -11.176 1.00 0.00 O ATOM 1320 CB SER B 4 -1.684 -10.085 -8.289 1.00 0.00 C ATOM 1321 OG SER B 4 -0.326 -10.395 -8.009 1.00 0.00 O ATOM 0 H SER B 4 -3.761 -8.781 -8.714 1.00 0.00 H new ATOM 0 HA SER B 4 -0.972 -8.255 -9.176 1.00 0.00 H new ATOM 0 HB2 SER B 4 -2.185 -9.740 -7.384 1.00 0.00 H new ATOM 0 HB3 SER B 4 -2.211 -10.978 -8.625 1.00 0.00 H new ATOM 0 HG SER B 4 -0.285 -11.088 -7.317 1.00 0.00 H new ATOM 1327 N ASN B 5 -2.544 -9.992 -11.434 1.00 0.00 N ATOM 1328 CA ASN B 5 -2.373 -10.616 -12.778 1.00 0.00 C ATOM 1329 C ASN B 5 -1.704 -9.621 -13.732 1.00 0.00 C ATOM 1330 O ASN B 5 -0.774 -9.952 -14.442 1.00 0.00 O ATOM 1331 CB ASN B 5 -3.748 -10.995 -13.329 1.00 0.00 C ATOM 1332 CG ASN B 5 -3.578 -11.864 -14.575 1.00 0.00 C ATOM 1333 OD1 ASN B 5 -3.053 -12.957 -14.500 1.00 0.00 O ATOM 1334 ND2 ASN B 5 -3.997 -11.418 -15.726 1.00 0.00 N ATOM 0 H ASN B 5 -3.510 -9.885 -11.125 1.00 0.00 H new ATOM 0 HA ASN B 5 -1.748 -11.504 -12.689 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -4.319 -11.534 -12.572 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -4.313 -10.096 -13.574 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -3.884 -11.987 -16.565 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -4.438 -10.500 -15.788 1.00 0.00 H new ATOM 1341 N GLU B 6 -2.164 -8.401 -13.748 1.00 0.00 N ATOM 1342 CA GLU B 6 -1.550 -7.384 -14.649 1.00 0.00 C ATOM 1343 C GLU B 6 -0.151 -7.035 -14.137 1.00 0.00 C ATOM 1344 O GLU B 6 0.765 -6.802 -14.901 1.00 0.00 O ATOM 1345 CB GLU B 6 -2.427 -6.125 -14.669 1.00 0.00 C ATOM 1346 CG GLU B 6 -3.618 -6.342 -15.607 1.00 0.00 C ATOM 1347 CD GLU B 6 -4.478 -7.495 -15.087 1.00 0.00 C ATOM 1348 OE1 GLU B 6 -5.178 -7.294 -14.108 1.00 0.00 O ATOM 1349 OE2 GLU B 6 -4.423 -8.560 -15.679 1.00 0.00 O ATOM 0 H GLU B 6 -2.938 -8.063 -13.176 1.00 0.00 H new ATOM 0 HA GLU B 6 -1.475 -7.784 -15.660 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -2.780 -5.900 -13.663 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -1.842 -5.267 -15.001 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -4.214 -5.431 -15.672 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -3.265 -6.564 -16.614 1.00 0.00 H new ATOM 1356 N LEU B 7 0.020 -6.996 -12.846 1.00 0.00 N ATOM 1357 CA LEU B 7 1.356 -6.661 -12.278 1.00 0.00 C ATOM 1358 C LEU B 7 2.362 -7.734 -12.707 1.00 0.00 C ATOM 1359 O LEU B 7 3.485 -7.444 -13.074 1.00 0.00 O ATOM 1360 CB LEU B 7 1.260 -6.626 -10.749 1.00 0.00 C ATOM 1361 CG LEU B 7 2.585 -6.139 -10.142 1.00 0.00 C ATOM 1362 CD1 LEU B 7 2.823 -4.656 -10.491 1.00 0.00 C ATOM 1363 CD2 LEU B 7 2.526 -6.307 -8.620 1.00 0.00 C ATOM 0 H LEU B 7 -0.709 -7.182 -12.157 1.00 0.00 H new ATOM 0 HA LEU B 7 1.683 -5.687 -12.641 1.00 0.00 H new ATOM 0 HB2 LEU B 7 0.448 -5.966 -10.444 1.00 0.00 H new ATOM 0 HB3 LEU B 7 1.022 -7.620 -10.370 1.00 0.00 H new ATOM 0 HG LEU B 7 3.406 -6.728 -10.551 1.00 0.00 H new ATOM 0 HD11 LEU B 7 3.765 -4.326 -10.054 1.00 0.00 H new ATOM 0 HD12 LEU B 7 2.865 -4.539 -11.574 1.00 0.00 H new ATOM 0 HD13 LEU B 7 2.007 -4.053 -10.092 1.00 0.00 H new ATOM 0 HD21 LEU B 7 3.462 -5.964 -8.180 1.00 0.00 H new ATOM 0 HD22 LEU B 7 1.700 -5.718 -8.221 1.00 0.00 H new ATOM 0 HD23 LEU B 7 2.374 -7.358 -8.376 1.00 0.00 H new ATOM 1375 N LYS B 8 1.962 -8.975 -12.665 1.00 0.00 N ATOM 1376 CA LYS B 8 2.881 -10.077 -13.067 1.00 0.00 C ATOM 1377 C LYS B 8 3.257 -9.909 -14.542 1.00 0.00 C ATOM 1378 O LYS B 8 4.391 -10.106 -14.933 1.00 0.00 O ATOM 1379 CB LYS B 8 2.174 -11.421 -12.872 1.00 0.00 C ATOM 1380 CG LYS B 8 3.149 -12.563 -13.160 1.00 0.00 C ATOM 1381 CD LYS B 8 2.449 -13.900 -12.920 1.00 0.00 C ATOM 1382 CE LYS B 8 3.428 -15.045 -13.187 1.00 0.00 C ATOM 1383 NZ LYS B 8 2.748 -16.347 -12.938 1.00 0.00 N ATOM 0 H LYS B 8 1.033 -9.275 -12.368 1.00 0.00 H new ATOM 0 HA LYS B 8 3.782 -10.046 -12.455 1.00 0.00 H new ATOM 0 HB2 LYS B 8 1.797 -11.500 -11.852 1.00 0.00 H new ATOM 0 HB3 LYS B 8 1.312 -11.489 -13.536 1.00 0.00 H new ATOM 0 HG2 LYS B 8 3.501 -12.504 -14.190 1.00 0.00 H new ATOM 0 HG3 LYS B 8 4.026 -12.478 -12.518 1.00 0.00 H new ATOM 0 HD2 LYS B 8 2.083 -13.952 -11.894 1.00 0.00 H new ATOM 0 HD3 LYS B 8 1.581 -13.990 -13.573 1.00 0.00 H new ATOM 0 HE2 LYS B 8 3.785 -15.000 -14.216 1.00 0.00 H new ATOM 0 HE3 LYS B 8 4.301 -14.949 -12.542 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 3.413 -17.126 -13.119 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 2.428 -16.388 -11.949 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 1.928 -16.437 -13.571 1.00 0.00 H new ATOM 1397 N VAL B 9 2.311 -9.547 -15.362 1.00 0.00 N ATOM 1398 CA VAL B 9 2.601 -9.364 -16.814 1.00 0.00 C ATOM 1399 C VAL B 9 3.644 -8.258 -16.992 1.00 0.00 C ATOM 1400 O VAL B 9 4.577 -8.388 -17.759 1.00 0.00 O ATOM 1401 CB VAL B 9 1.315 -8.968 -17.542 1.00 0.00 C ATOM 1402 CG1 VAL B 9 1.633 -8.618 -18.999 1.00 0.00 C ATOM 1403 CG2 VAL B 9 0.326 -10.135 -17.498 1.00 0.00 C ATOM 0 H VAL B 9 1.344 -9.369 -15.089 1.00 0.00 H new ATOM 0 HA VAL B 9 2.985 -10.296 -17.228 1.00 0.00 H new ATOM 0 HB VAL B 9 0.875 -8.099 -17.053 1.00 0.00 H new ATOM 0 HG11 VAL B 9 0.715 -8.336 -19.514 1.00 0.00 H new ATOM 0 HG12 VAL B 9 2.335 -7.785 -19.028 1.00 0.00 H new ATOM 0 HG13 VAL B 9 2.076 -9.483 -19.493 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -0.591 -9.855 -18.016 1.00 0.00 H new ATOM 0 HG22 VAL B 9 0.767 -11.004 -17.986 1.00 0.00 H new ATOM 0 HG23 VAL B 9 0.096 -10.378 -16.461 1.00 0.00 H new ATOM 1413 N GLU B 10 3.492 -7.167 -16.292 1.00 0.00 N ATOM 1414 CA GLU B 10 4.471 -6.055 -16.428 1.00 0.00 C ATOM 1415 C GLU B 10 5.883 -6.572 -16.155 1.00 0.00 C ATOM 1416 O GLU B 10 6.816 -6.268 -16.871 1.00 0.00 O ATOM 1417 CB GLU B 10 4.137 -4.960 -15.418 1.00 0.00 C ATOM 1418 CG GLU B 10 2.823 -4.290 -15.811 1.00 0.00 C ATOM 1419 CD GLU B 10 2.455 -3.246 -14.758 1.00 0.00 C ATOM 1420 OE1 GLU B 10 2.506 -3.573 -13.583 1.00 0.00 O ATOM 1421 OE2 GLU B 10 2.142 -2.133 -15.144 1.00 0.00 O ATOM 0 H GLU B 10 2.732 -6.999 -15.633 1.00 0.00 H new ATOM 0 HA GLU B 10 4.420 -5.655 -17.440 1.00 0.00 H new ATOM 0 HB2 GLU B 10 4.056 -5.385 -14.418 1.00 0.00 H new ATOM 0 HB3 GLU B 10 4.939 -4.222 -15.387 1.00 0.00 H new ATOM 0 HG2 GLU B 10 2.920 -3.819 -16.789 1.00 0.00 H new ATOM 0 HG3 GLU B 10 2.032 -5.035 -15.893 1.00 0.00 H new ATOM 1428 N ARG B 11 6.050 -7.354 -15.127 1.00 0.00 N ATOM 1429 CA ARG B 11 7.406 -7.890 -14.815 1.00 0.00 C ATOM 1430 C ARG B 11 7.923 -8.689 -16.015 1.00 0.00 C ATOM 1431 O ARG B 11 9.061 -8.552 -16.423 1.00 0.00 O ATOM 1432 CB ARG B 11 7.313 -8.801 -13.586 1.00 0.00 C ATOM 1433 CG ARG B 11 8.704 -9.329 -13.216 1.00 0.00 C ATOM 1434 CD ARG B 11 8.601 -10.256 -11.997 1.00 0.00 C ATOM 1435 NE ARG B 11 8.612 -9.433 -10.743 1.00 0.00 N ATOM 1436 CZ ARG B 11 7.570 -9.361 -9.946 1.00 0.00 C ATOM 1437 NH1 ARG B 11 6.442 -9.951 -10.246 1.00 0.00 N ATOM 1438 NH2 ARG B 11 7.658 -8.674 -8.842 1.00 0.00 N ATOM 0 H ARG B 11 5.309 -7.646 -14.490 1.00 0.00 H new ATOM 0 HA ARG B 11 8.092 -7.069 -14.608 1.00 0.00 H new ATOM 0 HB2 ARG B 11 6.889 -8.250 -12.746 1.00 0.00 H new ATOM 0 HB3 ARG B 11 6.642 -9.635 -13.791 1.00 0.00 H new ATOM 0 HG2 ARG B 11 9.134 -9.869 -14.060 1.00 0.00 H new ATOM 0 HG3 ARG B 11 9.372 -8.497 -12.996 1.00 0.00 H new ATOM 0 HD2 ARG B 11 7.685 -10.845 -12.051 1.00 0.00 H new ATOM 0 HD3 ARG B 11 9.433 -10.960 -11.990 1.00 0.00 H new ATOM 0 HE ARG B 11 9.455 -8.913 -10.501 1.00 0.00 H new ATOM 0 HH11 ARG B 11 6.358 -10.480 -11.114 1.00 0.00 H new ATOM 0 HH12 ARG B 11 5.646 -9.882 -9.612 1.00 0.00 H new ATOM 0 HH21 ARG B 11 8.529 -8.199 -8.605 1.00 0.00 H new ATOM 0 HH22 ARG B 11 6.856 -8.611 -8.215 1.00 0.00 H new ATOM 1452 N ILE B 12 7.091 -9.519 -16.585 1.00 0.00 N ATOM 1453 CA ILE B 12 7.521 -10.320 -17.767 1.00 0.00 C ATOM 1454 C ILE B 12 7.777 -9.382 -18.954 1.00 0.00 C ATOM 1455 O ILE B 12 8.738 -9.530 -19.683 1.00 0.00 O ATOM 1456 CB ILE B 12 6.428 -11.327 -18.130 1.00 0.00 C ATOM 1457 CG1 ILE B 12 6.317 -12.369 -17.014 1.00 0.00 C ATOM 1458 CG2 ILE B 12 6.792 -12.028 -19.443 1.00 0.00 C ATOM 1459 CD1 ILE B 12 5.044 -13.194 -17.206 1.00 0.00 C ATOM 0 H ILE B 12 6.130 -9.677 -16.282 1.00 0.00 H new ATOM 0 HA ILE B 12 8.438 -10.858 -17.528 1.00 0.00 H new ATOM 0 HB ILE B 12 5.477 -10.808 -18.248 1.00 0.00 H new ATOM 0 HG12 ILE B 12 7.190 -13.022 -17.024 1.00 0.00 H new ATOM 0 HG13 ILE B 12 6.299 -11.875 -16.042 1.00 0.00 H new ATOM 0 HG21 ILE B 12 6.013 -12.745 -19.701 1.00 0.00 H new ATOM 0 HG22 ILE B 12 6.881 -11.288 -20.238 1.00 0.00 H new ATOM 0 HG23 ILE B 12 7.741 -12.550 -19.325 1.00 0.00 H new ATOM 0 HD11 ILE B 12 4.967 -13.935 -16.410 1.00 0.00 H new ATOM 0 HD12 ILE B 12 4.176 -12.536 -17.174 1.00 0.00 H new ATOM 0 HD13 ILE B 12 5.080 -13.700 -18.171 1.00 0.00 H new ATOM 1471 N ARG B 13 6.915 -8.421 -19.152 1.00 0.00 N ATOM 1472 CA ARG B 13 7.092 -7.472 -20.290 1.00 0.00 C ATOM 1473 C ARG B 13 8.453 -6.788 -20.172 1.00 0.00 C ATOM 1474 O ARG B 13 9.184 -6.666 -21.135 1.00 0.00 O ATOM 1475 CB ARG B 13 5.976 -6.416 -20.234 1.00 0.00 C ATOM 1476 CG ARG B 13 4.661 -6.996 -20.815 1.00 0.00 C ATOM 1477 CD ARG B 13 4.481 -6.557 -22.281 1.00 0.00 C ATOM 1478 NE ARG B 13 5.822 -6.419 -22.923 1.00 0.00 N ATOM 1479 CZ ARG B 13 6.059 -5.473 -23.803 1.00 0.00 C ATOM 1480 NH1 ARG B 13 5.107 -4.659 -24.177 1.00 0.00 N ATOM 1481 NH2 ARG B 13 7.252 -5.346 -24.316 1.00 0.00 N ATOM 0 H ARG B 13 6.093 -8.252 -18.573 1.00 0.00 H new ATOM 0 HA ARG B 13 7.042 -8.011 -21.236 1.00 0.00 H new ATOM 0 HB2 ARG B 13 5.818 -6.098 -19.204 1.00 0.00 H new ATOM 0 HB3 ARG B 13 6.273 -5.532 -20.799 1.00 0.00 H new ATOM 0 HG2 ARG B 13 4.678 -8.084 -20.754 1.00 0.00 H new ATOM 0 HG3 ARG B 13 3.813 -6.657 -20.221 1.00 0.00 H new ATOM 0 HD2 ARG B 13 3.880 -7.289 -22.821 1.00 0.00 H new ATOM 0 HD3 ARG B 13 3.944 -5.609 -22.326 1.00 0.00 H new ATOM 0 HE ARG B 13 6.567 -7.070 -22.674 1.00 0.00 H new ATOM 0 HH11 ARG B 13 4.170 -4.755 -23.785 1.00 0.00 H new ATOM 0 HH12 ARG B 13 5.301 -3.928 -24.861 1.00 0.00 H new ATOM 0 HH21 ARG B 13 7.999 -5.981 -24.034 1.00 0.00 H new ATOM 0 HH22 ARG B 13 7.438 -4.612 -24.999 1.00 0.00 H new ATOM 1495 N LEU B 14 8.809 -6.356 -18.996 1.00 0.00 N ATOM 1496 CA LEU B 14 10.133 -5.697 -18.808 1.00 0.00 C ATOM 1497 C LEU B 14 11.142 -6.759 -18.364 1.00 0.00 C ATOM 1498 O LEU B 14 12.315 -6.490 -18.203 1.00 0.00 O ATOM 1499 CB LEU B 14 10.016 -4.609 -17.737 1.00 0.00 C ATOM 1500 CG LEU B 14 8.986 -3.556 -18.175 1.00 0.00 C ATOM 1501 CD1 LEU B 14 8.827 -2.508 -17.065 1.00 0.00 C ATOM 1502 CD2 LEU B 14 9.449 -2.869 -19.474 1.00 0.00 C ATOM 0 H LEU B 14 8.239 -6.430 -18.153 1.00 0.00 H new ATOM 0 HA LEU B 14 10.463 -5.238 -19.740 1.00 0.00 H new ATOM 0 HB2 LEU B 14 9.716 -5.052 -16.787 1.00 0.00 H new ATOM 0 HB3 LEU B 14 10.986 -4.138 -17.577 1.00 0.00 H new ATOM 0 HG LEU B 14 8.029 -4.045 -18.357 1.00 0.00 H new ATOM 0 HD11 LEU B 14 8.097 -1.760 -17.373 1.00 0.00 H new ATOM 0 HD12 LEU B 14 8.485 -2.994 -16.152 1.00 0.00 H new ATOM 0 HD13 LEU B 14 9.786 -2.025 -16.881 1.00 0.00 H new ATOM 0 HD21 LEU B 14 8.711 -2.125 -19.775 1.00 0.00 H new ATOM 0 HD22 LEU B 14 10.409 -2.381 -19.305 1.00 0.00 H new ATOM 0 HD23 LEU B 14 9.555 -3.614 -20.262 1.00 0.00 H new ATOM 1514 N SER B 15 10.679 -7.971 -18.174 1.00 0.00 N ATOM 1515 CA SER B 15 11.584 -9.080 -17.745 1.00 0.00 C ATOM 1516 C SER B 15 12.566 -8.577 -16.686 1.00 0.00 C ATOM 1517 O SER B 15 13.712 -8.289 -16.972 1.00 0.00 O ATOM 1518 CB SER B 15 12.359 -9.605 -18.955 1.00 0.00 C ATOM 1519 OG SER B 15 13.548 -10.245 -18.509 1.00 0.00 O ATOM 0 H SER B 15 9.703 -8.240 -18.299 1.00 0.00 H new ATOM 0 HA SER B 15 10.984 -9.884 -17.319 1.00 0.00 H new ATOM 0 HB2 SER B 15 11.744 -10.306 -19.519 1.00 0.00 H new ATOM 0 HB3 SER B 15 12.605 -8.784 -19.628 1.00 0.00 H new ATOM 0 HG SER B 15 14.157 -9.577 -18.130 1.00 0.00 H new ATOM 1525 N LEU B 16 12.118 -8.462 -15.462 1.00 0.00 N ATOM 1526 CA LEU B 16 13.011 -7.969 -14.364 1.00 0.00 C ATOM 1527 C LEU B 16 13.391 -9.132 -13.450 1.00 0.00 C ATOM 1528 O LEU B 16 12.559 -9.922 -13.046 1.00 0.00 O ATOM 1529 CB LEU B 16 12.269 -6.905 -13.555 1.00 0.00 C ATOM 1530 CG LEU B 16 11.805 -5.781 -14.489 1.00 0.00 C ATOM 1531 CD1 LEU B 16 11.008 -4.751 -13.683 1.00 0.00 C ATOM 1532 CD2 LEU B 16 13.019 -5.099 -15.143 1.00 0.00 C ATOM 0 H LEU B 16 11.167 -8.689 -15.172 1.00 0.00 H new ATOM 0 HA LEU B 16 13.916 -7.540 -14.794 1.00 0.00 H new ATOM 0 HB2 LEU B 16 11.411 -7.350 -13.050 1.00 0.00 H new ATOM 0 HB3 LEU B 16 12.921 -6.502 -12.780 1.00 0.00 H new ATOM 0 HG LEU B 16 11.175 -6.203 -15.272 1.00 0.00 H new ATOM 0 HD11 LEU B 16 10.676 -3.950 -14.343 1.00 0.00 H new ATOM 0 HD12 LEU B 16 10.140 -5.233 -13.233 1.00 0.00 H new ATOM 0 HD13 LEU B 16 11.640 -4.336 -12.898 1.00 0.00 H new ATOM 0 HD21 LEU B 16 12.677 -4.303 -15.804 1.00 0.00 H new ATOM 0 HD22 LEU B 16 13.660 -4.678 -14.369 1.00 0.00 H new ATOM 0 HD23 LEU B 16 13.581 -5.833 -15.720 1.00 0.00 H new ATOM 1544 N THR B 17 14.652 -9.245 -13.130 1.00 0.00 N ATOM 1545 CA THR B 17 15.108 -10.358 -12.248 1.00 0.00 C ATOM 1546 C THR B 17 14.929 -9.974 -10.781 1.00 0.00 C ATOM 1547 O THR B 17 14.835 -8.813 -10.433 1.00 0.00 O ATOM 1548 CB THR B 17 16.587 -10.641 -12.517 1.00 0.00 C ATOM 1549 OG1 THR B 17 17.350 -9.479 -12.226 1.00 0.00 O ATOM 1550 CG2 THR B 17 16.774 -11.027 -13.985 1.00 0.00 C ATOM 0 H THR B 17 15.388 -8.612 -13.443 1.00 0.00 H new ATOM 0 HA THR B 17 14.513 -11.247 -12.460 1.00 0.00 H new ATOM 0 HB THR B 17 16.923 -11.462 -11.884 1.00 0.00 H new ATOM 0 HG1 THR B 17 16.815 -8.864 -11.682 1.00 0.00 H new ATOM 0 HG21 THR B 17 17.828 -11.229 -14.177 1.00 0.00 H new ATOM 0 HG22 THR B 17 16.188 -11.920 -14.204 1.00 0.00 H new ATOM 0 HG23 THR B 17 16.440 -10.208 -14.622 1.00 0.00 H new ATOM 1558 N ALA B 18 14.887 -10.951 -9.918 1.00 0.00 N ATOM 1559 CA ALA B 18 14.720 -10.665 -8.467 1.00 0.00 C ATOM 1560 C ALA B 18 15.987 -9.998 -7.929 1.00 0.00 C ATOM 1561 O ALA B 18 15.933 -9.114 -7.096 1.00 0.00 O ATOM 1562 CB ALA B 18 14.481 -11.976 -7.714 1.00 0.00 C ATOM 0 H ALA B 18 14.962 -11.940 -10.157 1.00 0.00 H new ATOM 0 HA ALA B 18 13.868 -10.000 -8.324 1.00 0.00 H new ATOM 0 HB1 ALA B 18 14.359 -11.768 -6.651 1.00 0.00 H new ATOM 0 HB2 ALA B 18 13.580 -12.456 -8.096 1.00 0.00 H new ATOM 0 HB3 ALA B 18 15.334 -12.639 -7.858 1.00 0.00 H new ATOM 1568 N LYS B 19 17.129 -10.423 -8.392 1.00 0.00 N ATOM 1569 CA LYS B 19 18.401 -9.831 -7.908 1.00 0.00 C ATOM 1570 C LYS B 19 18.513 -8.377 -8.378 1.00 0.00 C ATOM 1571 O LYS B 19 18.908 -7.502 -7.633 1.00 0.00 O ATOM 1572 CB LYS B 19 19.569 -10.660 -8.455 1.00 0.00 C ATOM 1573 CG LYS B 19 19.593 -10.588 -9.983 1.00 0.00 C ATOM 1574 CD LYS B 19 20.651 -11.547 -10.528 1.00 0.00 C ATOM 1575 CE LYS B 19 20.631 -11.504 -12.058 1.00 0.00 C ATOM 1576 NZ LYS B 19 20.650 -10.084 -12.516 1.00 0.00 N ATOM 0 H LYS B 19 17.234 -11.160 -9.089 1.00 0.00 H new ATOM 0 HA LYS B 19 18.425 -9.841 -6.818 1.00 0.00 H new ATOM 0 HB2 LYS B 19 20.510 -10.288 -8.051 1.00 0.00 H new ATOM 0 HB3 LYS B 19 19.472 -11.697 -8.133 1.00 0.00 H new ATOM 0 HG2 LYS B 19 18.613 -10.846 -10.384 1.00 0.00 H new ATOM 0 HG3 LYS B 19 19.811 -9.570 -10.305 1.00 0.00 H new ATOM 0 HD2 LYS B 19 21.637 -11.268 -10.158 1.00 0.00 H new ATOM 0 HD3 LYS B 19 20.455 -12.561 -10.178 1.00 0.00 H new ATOM 0 HE2 LYS B 19 21.493 -12.038 -12.459 1.00 0.00 H new ATOM 0 HE3 LYS B 19 19.741 -12.007 -12.435 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 20.924 -10.046 -13.519 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 19.704 -9.669 -12.400 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 21.336 -9.546 -11.949 1.00 0.00 H new ATOM 1590 N SER B 20 18.179 -8.116 -9.610 1.00 0.00 N ATOM 1591 CA SER B 20 18.275 -6.724 -10.129 1.00 0.00 C ATOM 1592 C SER B 20 17.289 -5.824 -9.386 1.00 0.00 C ATOM 1593 O SER B 20 17.623 -4.741 -8.949 1.00 0.00 O ATOM 1594 CB SER B 20 17.944 -6.726 -11.621 1.00 0.00 C ATOM 1595 OG SER B 20 18.911 -7.506 -12.311 1.00 0.00 O ATOM 0 H SER B 20 17.843 -8.807 -10.281 1.00 0.00 H new ATOM 0 HA SER B 20 19.285 -6.345 -9.975 1.00 0.00 H new ATOM 0 HB2 SER B 20 16.946 -7.133 -11.784 1.00 0.00 H new ATOM 0 HB3 SER B 20 17.939 -5.706 -12.006 1.00 0.00 H new ATOM 0 HG SER B 20 18.483 -8.308 -12.678 1.00 0.00 H new ATOM 1601 N VAL B 21 16.071 -6.265 -9.244 1.00 0.00 N ATOM 1602 CA VAL B 21 15.055 -5.442 -8.533 1.00 0.00 C ATOM 1603 C VAL B 21 15.386 -5.375 -7.041 1.00 0.00 C ATOM 1604 O VAL B 21 15.307 -4.335 -6.421 1.00 0.00 O ATOM 1605 CB VAL B 21 13.673 -6.070 -8.721 1.00 0.00 C ATOM 1606 CG1 VAL B 21 12.630 -5.266 -7.938 1.00 0.00 C ATOM 1607 CG2 VAL B 21 13.315 -6.069 -10.210 1.00 0.00 C ATOM 0 H VAL B 21 15.734 -7.163 -9.591 1.00 0.00 H new ATOM 0 HA VAL B 21 15.060 -4.433 -8.944 1.00 0.00 H new ATOM 0 HB VAL B 21 13.685 -7.095 -8.350 1.00 0.00 H new ATOM 0 HG11 VAL B 21 11.647 -5.716 -8.074 1.00 0.00 H new ATOM 0 HG12 VAL B 21 12.888 -5.270 -6.879 1.00 0.00 H new ATOM 0 HG13 VAL B 21 12.613 -4.239 -8.303 1.00 0.00 H new ATOM 0 HG21 VAL B 21 12.330 -6.516 -10.348 1.00 0.00 H new ATOM 0 HG22 VAL B 21 13.303 -5.044 -10.581 1.00 0.00 H new ATOM 0 HG23 VAL B 21 14.056 -6.646 -10.763 1.00 0.00 H new ATOM 1617 N ALA B 22 15.740 -6.487 -6.460 1.00 0.00 N ATOM 1618 CA ALA B 22 16.060 -6.508 -5.002 1.00 0.00 C ATOM 1619 C ALA B 22 17.277 -5.626 -4.709 1.00 0.00 C ATOM 1620 O ALA B 22 17.318 -4.919 -3.721 1.00 0.00 O ATOM 1621 CB ALA B 22 16.366 -7.946 -4.578 1.00 0.00 C ATOM 0 H ALA B 22 15.822 -7.387 -6.933 1.00 0.00 H new ATOM 0 HA ALA B 22 15.205 -6.125 -4.445 1.00 0.00 H new ATOM 0 HB1 ALA B 22 16.601 -7.969 -3.514 1.00 0.00 H new ATOM 0 HB2 ALA B 22 15.497 -8.575 -4.772 1.00 0.00 H new ATOM 0 HB3 ALA B 22 17.218 -8.319 -5.146 1.00 0.00 H new ATOM 1627 N GLU B 23 18.271 -5.667 -5.549 1.00 0.00 N ATOM 1628 CA GLU B 23 19.485 -4.836 -5.302 1.00 0.00 C ATOM 1629 C GLU B 23 19.128 -3.351 -5.417 1.00 0.00 C ATOM 1630 O GLU B 23 19.496 -2.547 -4.582 1.00 0.00 O ATOM 1631 CB GLU B 23 20.558 -5.191 -6.341 1.00 0.00 C ATOM 1632 CG GLU B 23 21.820 -4.301 -6.155 1.00 0.00 C ATOM 1633 CD GLU B 23 21.997 -3.364 -7.356 1.00 0.00 C ATOM 1634 OE1 GLU B 23 21.023 -2.741 -7.742 1.00 0.00 O ATOM 1635 OE2 GLU B 23 23.102 -3.289 -7.868 1.00 0.00 O ATOM 0 H GLU B 23 18.298 -6.237 -6.394 1.00 0.00 H new ATOM 0 HA GLU B 23 19.865 -5.034 -4.300 1.00 0.00 H new ATOM 0 HB2 GLU B 23 20.831 -6.242 -6.245 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.157 -5.057 -7.346 1.00 0.00 H new ATOM 0 HG2 GLU B 23 21.728 -3.716 -5.240 1.00 0.00 H new ATOM 0 HG3 GLU B 23 22.703 -4.930 -6.044 1.00 0.00 H new ATOM 1642 N GLU B 24 18.408 -2.981 -6.439 1.00 0.00 N ATOM 1643 CA GLU B 24 18.021 -1.549 -6.599 1.00 0.00 C ATOM 1644 C GLU B 24 17.002 -1.176 -5.517 1.00 0.00 C ATOM 1645 O GLU B 24 17.043 -0.102 -4.952 1.00 0.00 O ATOM 1646 CB GLU B 24 17.406 -1.344 -7.985 1.00 0.00 C ATOM 1647 CG GLU B 24 18.477 -1.549 -9.061 1.00 0.00 C ATOM 1648 CD GLU B 24 19.523 -0.435 -8.968 1.00 0.00 C ATOM 1649 OE1 GLU B 24 19.128 0.716 -8.900 1.00 0.00 O ATOM 1650 OE2 GLU B 24 20.700 -0.753 -8.962 1.00 0.00 O ATOM 0 H GLU B 24 18.070 -3.607 -7.170 1.00 0.00 H new ATOM 0 HA GLU B 24 18.901 -0.914 -6.498 1.00 0.00 H new ATOM 0 HB2 GLU B 24 16.586 -2.045 -8.137 1.00 0.00 H new ATOM 0 HB3 GLU B 24 16.986 -0.341 -8.062 1.00 0.00 H new ATOM 0 HG2 GLU B 24 18.954 -2.521 -8.932 1.00 0.00 H new ATOM 0 HG3 GLU B 24 18.018 -1.548 -10.050 1.00 0.00 H new ATOM 1657 N MET B 25 16.092 -2.064 -5.222 1.00 0.00 N ATOM 1658 CA MET B 25 15.071 -1.779 -4.169 1.00 0.00 C ATOM 1659 C MET B 25 15.769 -1.624 -2.814 1.00 0.00 C ATOM 1660 O MET B 25 15.397 -0.800 -2.001 1.00 0.00 O ATOM 1661 CB MET B 25 14.072 -2.943 -4.103 1.00 0.00 C ATOM 1662 CG MET B 25 13.027 -2.803 -5.212 1.00 0.00 C ATOM 1663 SD MET B 25 11.934 -1.406 -4.839 1.00 0.00 S ATOM 1664 CE MET B 25 11.106 -2.118 -3.389 1.00 0.00 C ATOM 0 H MET B 25 16.010 -2.979 -5.666 1.00 0.00 H new ATOM 0 HA MET B 25 14.541 -0.858 -4.411 1.00 0.00 H new ATOM 0 HB2 MET B 25 14.599 -3.891 -4.207 1.00 0.00 H new ATOM 0 HB3 MET B 25 13.581 -2.956 -3.130 1.00 0.00 H new ATOM 0 HG2 MET B 25 13.519 -2.648 -6.172 1.00 0.00 H new ATOM 0 HG3 MET B 25 12.446 -3.721 -5.297 1.00 0.00 H new ATOM 0 HE1 MET B 25 10.082 -1.749 -3.337 1.00 0.00 H new ATOM 0 HE2 MET B 25 11.096 -3.205 -3.473 1.00 0.00 H new ATOM 0 HE3 MET B 25 11.642 -1.829 -2.485 1.00 0.00 H new ATOM 1674 N GLY B 26 16.774 -2.420 -2.561 1.00 0.00 N ATOM 1675 CA GLY B 26 17.495 -2.335 -1.254 1.00 0.00 C ATOM 1676 C GLY B 26 16.931 -3.385 -0.293 1.00 0.00 C ATOM 1677 O GLY B 26 17.023 -3.249 0.912 1.00 0.00 O ATOM 0 H GLY B 26 17.129 -3.128 -3.204 1.00 0.00 H new ATOM 0 HA2 GLY B 26 18.562 -2.499 -1.403 1.00 0.00 H new ATOM 0 HA3 GLY B 26 17.382 -1.338 -0.828 1.00 0.00 H new ATOM 1681 N ILE B 27 16.346 -4.434 -0.822 1.00 0.00 N ATOM 1682 CA ILE B 27 15.764 -5.514 0.042 1.00 0.00 C ATOM 1683 C ILE B 27 16.372 -6.866 -0.335 1.00 0.00 C ATOM 1684 O ILE B 27 16.996 -7.018 -1.368 1.00 0.00 O ATOM 1685 CB ILE B 27 14.244 -5.559 -0.146 1.00 0.00 C ATOM 1686 CG1 ILE B 27 13.901 -5.811 -1.618 1.00 0.00 C ATOM 1687 CG2 ILE B 27 13.637 -4.227 0.296 1.00 0.00 C ATOM 1688 CD1 ILE B 27 12.386 -5.956 -1.768 1.00 0.00 C ATOM 0 H ILE B 27 16.246 -4.590 -1.825 1.00 0.00 H new ATOM 0 HA ILE B 27 15.992 -5.300 1.086 1.00 0.00 H new ATOM 0 HB ILE B 27 13.835 -6.369 0.458 1.00 0.00 H new ATOM 0 HG12 ILE B 27 14.261 -4.987 -2.233 1.00 0.00 H new ATOM 0 HG13 ILE B 27 14.401 -6.714 -1.970 1.00 0.00 H new ATOM 0 HG21 ILE B 27 12.556 -4.258 0.163 1.00 0.00 H new ATOM 0 HG22 ILE B 27 13.868 -4.053 1.347 1.00 0.00 H new ATOM 0 HG23 ILE B 27 14.054 -3.420 -0.306 1.00 0.00 H new ATOM 0 HD11 ILE B 27 12.140 -6.135 -2.815 1.00 0.00 H new ATOM 0 HD12 ILE B 27 12.039 -6.795 -1.165 1.00 0.00 H new ATOM 0 HD13 ILE B 27 11.898 -5.041 -1.432 1.00 0.00 H new ATOM 1700 N SER B 28 16.203 -7.846 0.509 1.00 0.00 N ATOM 1701 CA SER B 28 16.774 -9.194 0.230 1.00 0.00 C ATOM 1702 C SER B 28 15.946 -9.918 -0.833 1.00 0.00 C ATOM 1703 O SER B 28 14.808 -9.584 -1.096 1.00 0.00 O ATOM 1704 CB SER B 28 16.763 -10.014 1.520 1.00 0.00 C ATOM 1705 OG SER B 28 15.469 -9.950 2.106 1.00 0.00 O ATOM 0 H SER B 28 15.690 -7.770 1.387 1.00 0.00 H new ATOM 0 HA SER B 28 17.794 -9.079 -0.138 1.00 0.00 H new ATOM 0 HB2 SER B 28 17.028 -11.050 1.308 1.00 0.00 H new ATOM 0 HB3 SER B 28 17.509 -9.630 2.215 1.00 0.00 H new ATOM 0 HG SER B 28 15.458 -10.476 2.933 1.00 0.00 H new ATOM 1711 N ARG B 29 16.523 -10.918 -1.439 1.00 0.00 N ATOM 1712 CA ARG B 29 15.801 -11.693 -2.486 1.00 0.00 C ATOM 1713 C ARG B 29 14.615 -12.419 -1.846 1.00 0.00 C ATOM 1714 O ARG B 29 13.548 -12.521 -2.419 1.00 0.00 O ATOM 1715 CB ARG B 29 16.762 -12.717 -3.096 1.00 0.00 C ATOM 1716 CG ARG B 29 17.838 -11.992 -3.908 1.00 0.00 C ATOM 1717 CD ARG B 29 18.894 -12.996 -4.373 1.00 0.00 C ATOM 1718 NE ARG B 29 18.284 -13.969 -5.320 1.00 0.00 N ATOM 1719 CZ ARG B 29 18.944 -15.039 -5.670 1.00 0.00 C ATOM 1720 NH1 ARG B 29 20.122 -15.276 -5.160 1.00 0.00 N ATOM 1721 NH2 ARG B 29 18.423 -15.876 -6.524 1.00 0.00 N ATOM 0 H ARG B 29 17.474 -11.235 -1.251 1.00 0.00 H new ATOM 0 HA ARG B 29 15.437 -11.022 -3.264 1.00 0.00 H new ATOM 0 HB2 ARG B 29 17.225 -13.310 -2.308 1.00 0.00 H new ATOM 0 HB3 ARG B 29 16.214 -13.409 -3.736 1.00 0.00 H new ATOM 0 HG2 ARG B 29 17.387 -11.498 -4.769 1.00 0.00 H new ATOM 0 HG3 ARG B 29 18.303 -11.214 -3.302 1.00 0.00 H new ATOM 0 HD2 ARG B 29 19.719 -12.472 -4.857 1.00 0.00 H new ATOM 0 HD3 ARG B 29 19.311 -13.523 -3.515 1.00 0.00 H new ATOM 0 HE ARG B 29 17.351 -13.800 -5.695 1.00 0.00 H new ATOM 0 HH11 ARG B 29 20.527 -14.625 -4.488 1.00 0.00 H new ATOM 0 HH12 ARG B 29 20.637 -16.112 -5.434 1.00 0.00 H new ATOM 0 HH21 ARG B 29 17.500 -15.694 -6.918 1.00 0.00 H new ATOM 0 HH22 ARG B 29 18.939 -16.712 -6.798 1.00 0.00 H new ATOM 1735 N GLN B 30 14.797 -12.924 -0.655 1.00 0.00 N ATOM 1736 CA GLN B 30 13.687 -13.643 0.035 1.00 0.00 C ATOM 1737 C GLN B 30 12.550 -12.662 0.325 1.00 0.00 C ATOM 1738 O GLN B 30 11.385 -12.992 0.219 1.00 0.00 O ATOM 1739 CB GLN B 30 14.202 -14.229 1.352 1.00 0.00 C ATOM 1740 CG GLN B 30 13.109 -15.084 1.999 1.00 0.00 C ATOM 1741 CD GLN B 30 13.617 -15.633 3.333 1.00 0.00 C ATOM 1742 OE1 GLN B 30 14.224 -14.920 4.107 1.00 0.00 O ATOM 1743 NE2 GLN B 30 13.394 -16.882 3.638 1.00 0.00 N ATOM 0 H GLN B 30 15.669 -12.869 -0.129 1.00 0.00 H new ATOM 0 HA GLN B 30 13.321 -14.447 -0.603 1.00 0.00 H new ATOM 0 HB2 GLN B 30 15.090 -14.834 1.169 1.00 0.00 H new ATOM 0 HB3 GLN B 30 14.497 -13.426 2.028 1.00 0.00 H new ATOM 0 HG2 GLN B 30 12.211 -14.487 2.157 1.00 0.00 H new ATOM 0 HG3 GLN B 30 12.834 -15.905 1.336 1.00 0.00 H new ATOM 0 HE21 GLN B 30 12.885 -17.482 2.989 1.00 0.00 H new ATOM 0 HE22 GLN B 30 13.729 -17.258 4.525 1.00 0.00 H new ATOM 1752 N GLN B 31 12.881 -11.455 0.692 1.00 0.00 N ATOM 1753 CA GLN B 31 11.822 -10.451 0.989 1.00 0.00 C ATOM 1754 C GLN B 31 10.992 -10.211 -0.272 1.00 0.00 C ATOM 1755 O GLN B 31 9.782 -10.108 -0.224 1.00 0.00 O ATOM 1756 CB GLN B 31 12.479 -9.139 1.426 1.00 0.00 C ATOM 1757 CG GLN B 31 11.400 -8.113 1.769 1.00 0.00 C ATOM 1758 CD GLN B 31 12.058 -6.862 2.353 1.00 0.00 C ATOM 1759 OE1 GLN B 31 13.207 -6.894 2.747 1.00 0.00 O ATOM 1760 NE2 GLN B 31 11.375 -5.752 2.429 1.00 0.00 N ATOM 0 H GLN B 31 13.839 -11.121 0.799 1.00 0.00 H new ATOM 0 HA GLN B 31 11.177 -10.818 1.787 1.00 0.00 H new ATOM 0 HB2 GLN B 31 13.119 -9.312 2.292 1.00 0.00 H new ATOM 0 HB3 GLN B 31 13.117 -8.757 0.629 1.00 0.00 H new ATOM 0 HG2 GLN B 31 10.831 -7.855 0.876 1.00 0.00 H new ATOM 0 HG3 GLN B 31 10.695 -8.535 2.485 1.00 0.00 H new ATOM 0 HE21 GLN B 31 10.410 -5.723 2.099 1.00 0.00 H new ATOM 0 HE22 GLN B 31 11.806 -4.914 2.819 1.00 0.00 H new ATOM 1769 N LEU B 32 11.634 -10.128 -1.403 1.00 0.00 N ATOM 1770 CA LEU B 32 10.886 -9.904 -2.671 1.00 0.00 C ATOM 1771 C LEU B 32 9.958 -11.091 -2.936 1.00 0.00 C ATOM 1772 O LEU B 32 8.819 -10.927 -3.326 1.00 0.00 O ATOM 1773 CB LEU B 32 11.885 -9.764 -3.825 1.00 0.00 C ATOM 1774 CG LEU B 32 11.146 -9.660 -5.168 1.00 0.00 C ATOM 1775 CD1 LEU B 32 10.144 -8.500 -5.132 1.00 0.00 C ATOM 1776 CD2 LEU B 32 12.171 -9.415 -6.281 1.00 0.00 C ATOM 0 H LEU B 32 12.646 -10.206 -1.504 1.00 0.00 H new ATOM 0 HA LEU B 32 10.290 -8.995 -2.590 1.00 0.00 H new ATOM 0 HB2 LEU B 32 12.502 -8.879 -3.674 1.00 0.00 H new ATOM 0 HB3 LEU B 32 12.557 -10.622 -3.838 1.00 0.00 H new ATOM 0 HG LEU B 32 10.604 -10.587 -5.355 1.00 0.00 H new ATOM 0 HD11 LEU B 32 9.627 -8.436 -6.089 1.00 0.00 H new ATOM 0 HD12 LEU B 32 9.418 -8.671 -4.338 1.00 0.00 H new ATOM 0 HD13 LEU B 32 10.675 -7.567 -4.944 1.00 0.00 H new ATOM 0 HD21 LEU B 32 11.657 -9.340 -7.239 1.00 0.00 H new ATOM 0 HD22 LEU B 32 12.708 -8.487 -6.083 1.00 0.00 H new ATOM 0 HD23 LEU B 32 12.878 -10.244 -6.313 1.00 0.00 H new ATOM 1788 N CYS B 33 10.438 -12.284 -2.732 1.00 0.00 N ATOM 1789 CA CYS B 33 9.593 -13.486 -2.979 1.00 0.00 C ATOM 1790 C CYS B 33 8.364 -13.441 -2.072 1.00 0.00 C ATOM 1791 O CYS B 33 7.287 -13.864 -2.444 1.00 0.00 O ATOM 1792 CB CYS B 33 10.407 -14.747 -2.682 1.00 0.00 C ATOM 1793 SG CYS B 33 11.769 -14.872 -3.866 1.00 0.00 S ATOM 0 H CYS B 33 11.383 -12.480 -2.403 1.00 0.00 H new ATOM 0 HA CYS B 33 9.271 -13.499 -4.020 1.00 0.00 H new ATOM 0 HB2 CYS B 33 10.797 -14.711 -1.665 1.00 0.00 H new ATOM 0 HB3 CYS B 33 9.770 -15.629 -2.748 1.00 0.00 H new ATOM 0 HG CYS B 33 12.695 -14.015 -3.554 1.00 0.00 H new ATOM 1799 N ASN B 34 8.515 -12.930 -0.885 1.00 0.00 N ATOM 1800 CA ASN B 34 7.357 -12.854 0.046 1.00 0.00 C ATOM 1801 C ASN B 34 6.283 -11.946 -0.563 1.00 0.00 C ATOM 1802 O ASN B 34 5.101 -12.220 -0.480 1.00 0.00 O ATOM 1803 CB ASN B 34 7.824 -12.278 1.384 1.00 0.00 C ATOM 1804 CG ASN B 34 6.735 -12.472 2.439 1.00 0.00 C ATOM 1805 OD1 ASN B 34 5.566 -12.280 2.168 1.00 0.00 O ATOM 1806 ND2 ASN B 34 7.073 -12.850 3.642 1.00 0.00 N ATOM 0 H ASN B 34 9.392 -12.561 -0.518 1.00 0.00 H new ATOM 0 HA ASN B 34 6.942 -13.849 0.207 1.00 0.00 H new ATOM 0 HB2 ASN B 34 8.743 -12.771 1.702 1.00 0.00 H new ATOM 0 HB3 ASN B 34 8.052 -11.218 1.274 1.00 0.00 H new ATOM 0 HD21 ASN B 34 6.356 -12.984 4.355 1.00 0.00 H new ATOM 0 HD22 ASN B 34 8.054 -13.011 3.869 1.00 0.00 H new ATOM 1813 N ILE B 35 6.687 -10.869 -1.177 1.00 0.00 N ATOM 1814 CA ILE B 35 5.696 -9.940 -1.796 1.00 0.00 C ATOM 1815 C ILE B 35 4.952 -10.664 -2.924 1.00 0.00 C ATOM 1816 O ILE B 35 3.750 -10.558 -3.060 1.00 0.00 O ATOM 1817 CB ILE B 35 6.434 -8.727 -2.377 1.00 0.00 C ATOM 1818 CG1 ILE B 35 7.037 -7.905 -1.236 1.00 0.00 C ATOM 1819 CG2 ILE B 35 5.455 -7.855 -3.171 1.00 0.00 C ATOM 1820 CD1 ILE B 35 7.982 -6.845 -1.808 1.00 0.00 C ATOM 0 H ILE B 35 7.663 -10.590 -1.278 1.00 0.00 H new ATOM 0 HA ILE B 35 4.983 -9.612 -1.040 1.00 0.00 H new ATOM 0 HB ILE B 35 7.227 -9.072 -3.040 1.00 0.00 H new ATOM 0 HG12 ILE B 35 6.244 -7.427 -0.661 1.00 0.00 H new ATOM 0 HG13 ILE B 35 7.579 -8.558 -0.551 1.00 0.00 H new ATOM 0 HG21 ILE B 35 5.984 -6.995 -3.581 1.00 0.00 H new ATOM 0 HG22 ILE B 35 5.025 -8.439 -3.985 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.658 -7.510 -2.512 1.00 0.00 H new ATOM 0 HD11 ILE B 35 8.410 -6.261 -0.993 1.00 0.00 H new ATOM 0 HD12 ILE B 35 8.782 -7.333 -2.364 1.00 0.00 H new ATOM 0 HD13 ILE B 35 7.427 -6.185 -2.475 1.00 0.00 H new ATOM 1832 N GLU B 36 5.665 -11.394 -3.738 1.00 0.00 N ATOM 1833 CA GLU B 36 5.008 -12.119 -4.864 1.00 0.00 C ATOM 1834 C GLU B 36 4.156 -13.269 -4.319 1.00 0.00 C ATOM 1835 O GLU B 36 3.287 -13.787 -4.993 1.00 0.00 O ATOM 1836 CB GLU B 36 6.084 -12.673 -5.810 1.00 0.00 C ATOM 1837 CG GLU B 36 7.244 -11.656 -5.950 1.00 0.00 C ATOM 1838 CD GLU B 36 7.760 -11.635 -7.392 1.00 0.00 C ATOM 1839 OE1 GLU B 36 6.987 -11.282 -8.268 1.00 0.00 O ATOM 1840 OE2 GLU B 36 8.916 -11.968 -7.595 1.00 0.00 O ATOM 0 H GLU B 36 6.675 -11.520 -3.672 1.00 0.00 H new ATOM 0 HA GLU B 36 4.364 -11.430 -5.409 1.00 0.00 H new ATOM 0 HB2 GLU B 36 6.464 -13.620 -5.426 1.00 0.00 H new ATOM 0 HB3 GLU B 36 5.649 -12.877 -6.788 1.00 0.00 H new ATOM 0 HG2 GLU B 36 6.901 -10.661 -5.664 1.00 0.00 H new ATOM 0 HG3 GLU B 36 8.054 -11.922 -5.270 1.00 0.00 H new ATOM 1847 N GLN B 37 4.405 -13.675 -3.106 1.00 0.00 N ATOM 1848 CA GLN B 37 3.618 -14.795 -2.515 1.00 0.00 C ATOM 1849 C GLN B 37 2.330 -14.232 -1.905 1.00 0.00 C ATOM 1850 O GLN B 37 1.498 -14.956 -1.393 1.00 0.00 O ATOM 1851 CB GLN B 37 4.461 -15.470 -1.423 1.00 0.00 C ATOM 1852 CG GLN B 37 3.922 -16.873 -1.137 1.00 0.00 C ATOM 1853 CD GLN B 37 4.212 -17.781 -2.334 1.00 0.00 C ATOM 1854 OE1 GLN B 37 5.285 -17.731 -2.901 1.00 0.00 O ATOM 1855 NE2 GLN B 37 3.295 -18.611 -2.748 1.00 0.00 N ATOM 0 H GLN B 37 5.121 -13.280 -2.496 1.00 0.00 H new ATOM 0 HA GLN B 37 3.364 -15.526 -3.282 1.00 0.00 H new ATOM 0 HB2 GLN B 37 5.502 -15.529 -1.741 1.00 0.00 H new ATOM 0 HB3 GLN B 37 4.439 -14.871 -0.513 1.00 0.00 H new ATOM 0 HG2 GLN B 37 4.387 -17.277 -0.238 1.00 0.00 H new ATOM 0 HG3 GLN B 37 2.849 -16.831 -0.949 1.00 0.00 H new ATOM 0 HE21 GLN B 37 2.394 -18.654 -2.273 1.00 0.00 H new ATOM 0 HE22 GLN B 37 3.479 -19.217 -3.547 1.00 0.00 H new ATOM 1864 N SER B 38 2.166 -12.938 -1.953 1.00 0.00 N ATOM 1865 CA SER B 38 0.945 -12.312 -1.375 1.00 0.00 C ATOM 1866 C SER B 38 -0.273 -12.612 -2.253 1.00 0.00 C ATOM 1867 O SER B 38 -0.189 -12.661 -3.465 1.00 0.00 O ATOM 1868 CB SER B 38 1.145 -10.797 -1.295 1.00 0.00 C ATOM 1869 OG SER B 38 2.399 -10.520 -0.688 1.00 0.00 O ATOM 0 H SER B 38 2.829 -12.285 -2.370 1.00 0.00 H new ATOM 0 HA SER B 38 0.775 -12.721 -0.379 1.00 0.00 H new ATOM 0 HB2 SER B 38 1.107 -10.360 -2.293 1.00 0.00 H new ATOM 0 HB3 SER B 38 0.340 -10.342 -0.717 1.00 0.00 H new ATOM 0 HG SER B 38 3.066 -10.340 -1.383 1.00 0.00 H new ATOM 1875 N GLU B 39 -1.409 -12.792 -1.640 1.00 0.00 N ATOM 1876 CA GLU B 39 -2.656 -13.068 -2.412 1.00 0.00 C ATOM 1877 C GLU B 39 -3.205 -11.740 -2.942 1.00 0.00 C ATOM 1878 O GLU B 39 -3.018 -11.390 -4.092 1.00 0.00 O ATOM 1879 CB GLU B 39 -3.687 -13.725 -1.473 1.00 0.00 C ATOM 1880 CG GLU B 39 -5.039 -13.941 -2.182 1.00 0.00 C ATOM 1881 CD GLU B 39 -4.931 -15.090 -3.185 1.00 0.00 C ATOM 1882 OE1 GLU B 39 -3.898 -15.736 -3.211 1.00 0.00 O ATOM 1883 OE2 GLU B 39 -5.892 -15.311 -3.905 1.00 0.00 O ATOM 0 H GLU B 39 -1.530 -12.760 -0.628 1.00 0.00 H new ATOM 0 HA GLU B 39 -2.451 -13.738 -3.247 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -3.302 -14.682 -1.121 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -3.832 -13.097 -0.594 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -5.812 -14.162 -1.447 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -5.339 -13.027 -2.695 1.00 0.00 H new ATOM 1890 N THR B 40 -3.891 -11.001 -2.107 1.00 0.00 N ATOM 1891 CA THR B 40 -4.473 -9.696 -2.543 1.00 0.00 C ATOM 1892 C THR B 40 -3.579 -8.547 -2.077 1.00 0.00 C ATOM 1893 O THR B 40 -2.626 -8.740 -1.347 1.00 0.00 O ATOM 1894 CB THR B 40 -5.868 -9.536 -1.934 1.00 0.00 C ATOM 1895 OG1 THR B 40 -6.472 -8.358 -2.452 1.00 0.00 O ATOM 1896 CG2 THR B 40 -5.760 -9.432 -0.411 1.00 0.00 C ATOM 0 H THR B 40 -4.074 -11.248 -1.134 1.00 0.00 H new ATOM 0 HA THR B 40 -4.542 -9.677 -3.631 1.00 0.00 H new ATOM 0 HB THR B 40 -6.478 -10.403 -2.189 1.00 0.00 H new ATOM 0 HG1 THR B 40 -7.367 -8.252 -2.066 1.00 0.00 H new ATOM 0 HG21 THR B 40 -6.756 -9.318 0.017 1.00 0.00 H new ATOM 0 HG22 THR B 40 -5.296 -10.336 -0.017 1.00 0.00 H new ATOM 0 HG23 THR B 40 -5.151 -8.567 -0.148 1.00 0.00 H new ATOM 1904 N ALA B 41 -3.878 -7.347 -2.507 1.00 0.00 N ATOM 1905 CA ALA B 41 -3.048 -6.173 -2.110 1.00 0.00 C ATOM 1906 C ALA B 41 -3.606 -5.554 -0.813 1.00 0.00 C ATOM 1907 O ALA B 41 -4.795 -5.598 -0.566 1.00 0.00 O ATOM 1908 CB ALA B 41 -3.101 -5.128 -3.227 1.00 0.00 C ATOM 0 H ALA B 41 -4.665 -7.131 -3.119 1.00 0.00 H new ATOM 0 HA ALA B 41 -2.020 -6.494 -1.943 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -2.497 -4.265 -2.947 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -2.711 -5.560 -4.148 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -4.133 -4.814 -3.382 1.00 0.00 H new ATOM 1914 N PRO B 42 -2.758 -4.974 0.008 1.00 0.00 N ATOM 1915 CA PRO B 42 -3.188 -4.334 1.291 1.00 0.00 C ATOM 1916 C PRO B 42 -4.019 -3.056 1.076 1.00 0.00 C ATOM 1917 O PRO B 42 -3.904 -2.383 0.070 1.00 0.00 O ATOM 1918 CB PRO B 42 -1.862 -4.017 2.008 1.00 0.00 C ATOM 1919 CG PRO B 42 -0.835 -3.931 0.923 1.00 0.00 C ATOM 1920 CD PRO B 42 -1.301 -4.870 -0.190 1.00 0.00 C ATOM 0 HA PRO B 42 -3.844 -4.990 1.864 1.00 0.00 H new ATOM 0 HB2 PRO B 42 -1.929 -3.080 2.561 1.00 0.00 H new ATOM 0 HB3 PRO B 42 -1.609 -4.795 2.728 1.00 0.00 H new ATOM 0 HG2 PRO B 42 -0.743 -2.909 0.555 1.00 0.00 H new ATOM 0 HG3 PRO B 42 0.147 -4.226 1.294 1.00 0.00 H new ATOM 0 HD2 PRO B 42 -1.061 -4.470 -1.175 1.00 0.00 H new ATOM 0 HD3 PRO B 42 -0.819 -5.845 -0.116 1.00 0.00 H new ATOM 1928 N VAL B 43 -4.853 -2.726 2.030 1.00 0.00 N ATOM 1929 CA VAL B 43 -5.701 -1.501 1.918 1.00 0.00 C ATOM 1930 C VAL B 43 -4.825 -0.246 1.928 1.00 0.00 C ATOM 1931 O VAL B 43 -5.174 0.768 1.356 1.00 0.00 O ATOM 1932 CB VAL B 43 -6.668 -1.442 3.107 1.00 0.00 C ATOM 1933 CG1 VAL B 43 -7.805 -2.443 2.899 1.00 0.00 C ATOM 1934 CG2 VAL B 43 -5.915 -1.790 4.400 1.00 0.00 C ATOM 0 H VAL B 43 -4.983 -3.259 2.890 1.00 0.00 H new ATOM 0 HA VAL B 43 -6.258 -1.543 0.982 1.00 0.00 H new ATOM 0 HB VAL B 43 -7.080 -0.436 3.183 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -8.489 -2.397 3.746 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -8.344 -2.197 1.984 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -7.394 -3.449 2.819 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -6.603 -1.748 5.244 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -5.500 -2.795 4.320 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -5.107 -1.075 4.554 1.00 0.00 H new ATOM 1944 N VAL B 44 -3.699 -0.300 2.588 1.00 0.00 N ATOM 1945 CA VAL B 44 -2.803 0.896 2.653 1.00 0.00 C ATOM 1946 C VAL B 44 -2.681 1.516 1.256 1.00 0.00 C ATOM 1947 O VAL B 44 -2.618 2.719 1.098 1.00 0.00 O ATOM 1948 CB VAL B 44 -1.420 0.443 3.134 1.00 0.00 C ATOM 1949 CG1 VAL B 44 -0.753 -0.426 2.050 1.00 0.00 C ATOM 1950 CG2 VAL B 44 -0.549 1.670 3.432 1.00 0.00 C ATOM 0 H VAL B 44 -3.358 -1.122 3.087 1.00 0.00 H new ATOM 0 HA VAL B 44 -3.213 1.636 3.340 1.00 0.00 H new ATOM 0 HB VAL B 44 -1.529 -0.145 4.045 1.00 0.00 H new ATOM 0 HG11 VAL B 44 0.230 -0.747 2.395 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -1.372 -1.301 1.854 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -0.645 0.155 1.134 1.00 0.00 H new ATOM 0 HG21 VAL B 44 0.434 1.344 3.774 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -0.439 2.267 2.526 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -1.022 2.272 4.208 1.00 0.00 H new ATOM 1960 N VAL B 45 -2.666 0.695 0.244 1.00 0.00 N ATOM 1961 CA VAL B 45 -2.571 1.218 -1.146 1.00 0.00 C ATOM 1962 C VAL B 45 -3.848 1.995 -1.477 1.00 0.00 C ATOM 1963 O VAL B 45 -3.810 3.057 -2.065 1.00 0.00 O ATOM 1964 CB VAL B 45 -2.410 0.049 -2.120 1.00 0.00 C ATOM 1965 CG1 VAL B 45 -2.481 0.563 -3.560 1.00 0.00 C ATOM 1966 CG2 VAL B 45 -1.055 -0.619 -1.883 1.00 0.00 C ATOM 0 H VAL B 45 -2.716 -0.321 0.321 1.00 0.00 H new ATOM 0 HA VAL B 45 -1.709 1.879 -1.234 1.00 0.00 H new ATOM 0 HB VAL B 45 -3.210 -0.673 -1.957 1.00 0.00 H new ATOM 0 HG11 VAL B 45 -2.366 -0.272 -4.251 1.00 0.00 H new ATOM 0 HG12 VAL B 45 -3.445 1.043 -3.728 1.00 0.00 H new ATOM 0 HG13 VAL B 45 -1.682 1.285 -3.728 1.00 0.00 H new ATOM 0 HG21 VAL B 45 -0.935 -1.453 -2.574 1.00 0.00 H new ATOM 0 HG22 VAL B 45 -0.258 0.106 -2.047 1.00 0.00 H new ATOM 0 HG23 VAL B 45 -1.005 -0.987 -0.858 1.00 0.00 H new ATOM 1976 N LYS B 46 -4.982 1.465 -1.106 1.00 0.00 N ATOM 1977 CA LYS B 46 -6.268 2.160 -1.400 1.00 0.00 C ATOM 1978 C LYS B 46 -6.292 3.519 -0.694 1.00 0.00 C ATOM 1979 O LYS B 46 -6.745 4.507 -1.237 1.00 0.00 O ATOM 1980 CB LYS B 46 -7.437 1.312 -0.891 1.00 0.00 C ATOM 1981 CG LYS B 46 -7.530 0.022 -1.707 1.00 0.00 C ATOM 1982 CD LYS B 46 -8.694 -0.824 -1.186 1.00 0.00 C ATOM 1983 CE LYS B 46 -8.741 -2.150 -1.945 1.00 0.00 C ATOM 1984 NZ LYS B 46 -9.128 -1.898 -3.363 1.00 0.00 N ATOM 0 H LYS B 46 -5.073 0.578 -0.611 1.00 0.00 H new ATOM 0 HA LYS B 46 -6.359 2.304 -2.477 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -7.297 1.077 0.164 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.368 1.873 -0.972 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -7.678 0.255 -2.761 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -6.597 -0.537 -1.632 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -8.574 -1.008 -0.118 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -9.634 -0.286 -1.313 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -7.768 -2.639 -1.904 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -9.457 -2.825 -1.476 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -9.423 -2.791 -3.806 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -9.916 -1.220 -3.393 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -8.315 -1.507 -3.880 1.00 0.00 H new ATOM 1998 N TYR B 47 -5.817 3.574 0.520 1.00 0.00 N ATOM 1999 CA TYR B 47 -5.819 4.863 1.270 1.00 0.00 C ATOM 2000 C TYR B 47 -4.973 5.898 0.523 1.00 0.00 C ATOM 2001 O TYR B 47 -5.359 7.041 0.369 1.00 0.00 O ATOM 2002 CB TYR B 47 -5.230 4.641 2.662 1.00 0.00 C ATOM 2003 CG TYR B 47 -5.299 5.927 3.448 1.00 0.00 C ATOM 2004 CD1 TYR B 47 -6.430 6.210 4.221 1.00 0.00 C ATOM 2005 CD2 TYR B 47 -4.238 6.838 3.401 1.00 0.00 C ATOM 2006 CE1 TYR B 47 -6.501 7.403 4.948 1.00 0.00 C ATOM 2007 CE2 TYR B 47 -4.309 8.032 4.129 1.00 0.00 C ATOM 2008 CZ TYR B 47 -5.441 8.314 4.903 1.00 0.00 C ATOM 2009 OH TYR B 47 -5.513 9.490 5.620 1.00 0.00 O ATOM 0 H TYR B 47 -5.426 2.780 1.027 1.00 0.00 H new ATOM 0 HA TYR B 47 -6.843 5.227 1.357 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -5.780 3.856 3.180 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -4.196 4.306 2.582 1.00 0.00 H new ATOM 0 HD1 TYR B 47 -7.249 5.507 4.257 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -3.365 6.620 2.804 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -7.375 7.621 5.544 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -3.490 8.736 4.093 1.00 0.00 H new ATOM 0 HH TYR B 47 -4.694 10.009 5.480 1.00 0.00 H new ATOM 2019 N ILE B 48 -3.821 5.507 0.055 1.00 0.00 N ATOM 2020 CA ILE B 48 -2.955 6.468 -0.680 1.00 0.00 C ATOM 2021 C ILE B 48 -3.692 6.930 -1.938 1.00 0.00 C ATOM 2022 O ILE B 48 -3.696 8.097 -2.279 1.00 0.00 O ATOM 2023 CB ILE B 48 -1.646 5.777 -1.078 1.00 0.00 C ATOM 2024 CG1 ILE B 48 -0.829 5.465 0.178 1.00 0.00 C ATOM 2025 CG2 ILE B 48 -0.839 6.701 -1.990 1.00 0.00 C ATOM 2026 CD1 ILE B 48 0.351 4.558 -0.187 1.00 0.00 C ATOM 0 H ILE B 48 -3.443 4.565 0.150 1.00 0.00 H new ATOM 0 HA ILE B 48 -2.729 7.325 -0.046 1.00 0.00 H new ATOM 0 HB ILE B 48 -1.872 4.850 -1.605 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -0.465 6.390 0.626 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -1.459 4.977 0.922 1.00 0.00 H new ATOM 0 HG21 ILE B 48 0.092 6.210 -2.273 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -1.418 6.925 -2.886 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -0.614 7.628 -1.462 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.931 4.337 0.709 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.024 3.628 -0.615 1.00 0.00 H new ATOM 0 HD13 ILE B 48 0.986 5.063 -0.915 1.00 0.00 H new ATOM 2038 N ALA B 49 -4.319 6.021 -2.627 1.00 0.00 N ATOM 2039 CA ALA B 49 -5.062 6.395 -3.863 1.00 0.00 C ATOM 2040 C ALA B 49 -6.170 7.393 -3.507 1.00 0.00 C ATOM 2041 O ALA B 49 -6.483 8.287 -4.267 1.00 0.00 O ATOM 2042 CB ALA B 49 -5.686 5.139 -4.477 1.00 0.00 C ATOM 0 H ALA B 49 -4.350 5.030 -2.387 1.00 0.00 H new ATOM 0 HA ALA B 49 -4.378 6.850 -4.579 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -6.231 5.408 -5.382 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -4.900 4.426 -4.726 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -6.373 4.687 -3.761 1.00 0.00 H new ATOM 2048 N PHE B 50 -6.772 7.241 -2.361 1.00 0.00 N ATOM 2049 CA PHE B 50 -7.864 8.175 -1.966 1.00 0.00 C ATOM 2050 C PHE B 50 -7.308 9.606 -1.895 1.00 0.00 C ATOM 2051 O PHE B 50 -7.894 10.535 -2.413 1.00 0.00 O ATOM 2052 CB PHE B 50 -8.420 7.754 -0.597 1.00 0.00 C ATOM 2053 CG PHE B 50 -9.821 8.295 -0.423 1.00 0.00 C ATOM 2054 CD1 PHE B 50 -10.894 7.654 -1.052 1.00 0.00 C ATOM 2055 CD2 PHE B 50 -10.045 9.433 0.361 1.00 0.00 C ATOM 2056 CE1 PHE B 50 -12.192 8.150 -0.898 1.00 0.00 C ATOM 2057 CE2 PHE B 50 -11.346 9.929 0.516 1.00 0.00 C ATOM 2058 CZ PHE B 50 -12.420 9.287 -0.114 1.00 0.00 C ATOM 0 H PHE B 50 -6.556 6.512 -1.681 1.00 0.00 H new ATOM 0 HA PHE B 50 -8.667 8.142 -2.703 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -8.428 6.667 -0.516 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -7.775 8.128 0.198 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -10.719 6.776 -1.656 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -9.216 9.928 0.846 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -13.020 7.655 -1.384 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -11.521 10.806 1.121 1.00 0.00 H new ATOM 0 HZ PHE B 50 -13.423 9.669 0.005 1.00 0.00 H new ATOM 2068 N LEU B 51 -6.177 9.791 -1.268 1.00 0.00 N ATOM 2069 CA LEU B 51 -5.584 11.163 -1.182 1.00 0.00 C ATOM 2070 C LEU B 51 -5.254 11.657 -2.594 1.00 0.00 C ATOM 2071 O LEU B 51 -5.480 12.802 -2.949 1.00 0.00 O ATOM 2072 CB LEU B 51 -4.293 11.110 -0.357 1.00 0.00 C ATOM 2073 CG LEU B 51 -4.611 10.835 1.120 1.00 0.00 C ATOM 2074 CD1 LEU B 51 -3.298 10.598 1.885 1.00 0.00 C ATOM 2075 CD2 LEU B 51 -5.371 12.030 1.738 1.00 0.00 C ATOM 0 H LEU B 51 -5.637 9.055 -0.812 1.00 0.00 H new ATOM 0 HA LEU B 51 -6.295 11.839 -0.708 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -3.638 10.330 -0.745 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -3.756 12.054 -0.450 1.00 0.00 H new ATOM 0 HG LEU B 51 -5.242 9.949 1.191 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -3.519 10.402 2.934 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.778 9.741 1.458 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -2.666 11.483 1.806 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -5.589 11.820 2.785 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.756 12.927 1.668 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -6.304 12.187 1.197 1.00 0.00 H new ATOM 2087 N ARG B 52 -4.718 10.791 -3.402 1.00 0.00 N ATOM 2088 CA ARG B 52 -4.366 11.163 -4.799 1.00 0.00 C ATOM 2089 C ARG B 52 -5.632 11.547 -5.569 1.00 0.00 C ATOM 2090 O ARG B 52 -5.639 12.479 -6.348 1.00 0.00 O ATOM 2091 CB ARG B 52 -3.683 9.965 -5.464 1.00 0.00 C ATOM 2092 CG ARG B 52 -3.445 10.225 -6.975 1.00 0.00 C ATOM 2093 CD ARG B 52 -4.574 9.621 -7.837 1.00 0.00 C ATOM 2094 NE ARG B 52 -4.960 8.274 -7.320 1.00 0.00 N ATOM 2095 CZ ARG B 52 -4.114 7.283 -7.365 1.00 0.00 C ATOM 2096 NH1 ARG B 52 -2.942 7.447 -7.913 1.00 0.00 N ATOM 2097 NH2 ARG B 52 -4.444 6.127 -6.865 1.00 0.00 N ATOM 0 H ARG B 52 -4.505 9.826 -3.151 1.00 0.00 H new ATOM 0 HA ARG B 52 -3.690 12.018 -4.801 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -2.731 9.766 -4.972 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -4.299 9.075 -5.338 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -3.382 11.298 -7.155 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -2.489 9.795 -7.273 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -5.440 10.283 -7.829 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -4.245 9.539 -8.873 1.00 0.00 H new ATOM 0 HE ARG B 52 -5.891 8.129 -6.929 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -2.686 8.352 -8.308 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -2.282 6.670 -7.947 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -5.362 5.999 -6.440 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -3.784 5.350 -6.899 1.00 0.00 H new ATOM 2111 N SER B 53 -6.704 10.832 -5.365 1.00 0.00 N ATOM 2112 CA SER B 53 -7.967 11.153 -6.090 1.00 0.00 C ATOM 2113 C SER B 53 -8.383 12.592 -5.779 1.00 0.00 C ATOM 2114 O SER B 53 -9.107 13.216 -6.530 1.00 0.00 O ATOM 2115 CB SER B 53 -9.069 10.193 -5.646 1.00 0.00 C ATOM 2116 OG SER B 53 -8.831 8.912 -6.215 1.00 0.00 O ATOM 0 H SER B 53 -6.760 10.038 -4.727 1.00 0.00 H new ATOM 0 HA SER B 53 -7.807 11.047 -7.163 1.00 0.00 H new ATOM 0 HB2 SER B 53 -9.090 10.123 -4.558 1.00 0.00 H new ATOM 0 HB3 SER B 53 -10.043 10.568 -5.960 1.00 0.00 H new ATOM 0 HG SER B 53 -8.086 8.480 -5.747 1.00 0.00 H new ATOM 2122 N LYS B 54 -7.927 13.128 -4.682 1.00 0.00 N ATOM 2123 CA LYS B 54 -8.289 14.531 -4.327 1.00 0.00 C ATOM 2124 C LYS B 54 -7.306 15.486 -5.009 1.00 0.00 C ATOM 2125 O LYS B 54 -7.358 16.688 -4.828 1.00 0.00 O ATOM 2126 CB LYS B 54 -8.207 14.708 -2.808 1.00 0.00 C ATOM 2127 CG LYS B 54 -9.306 13.887 -2.137 1.00 0.00 C ATOM 2128 CD LYS B 54 -9.205 14.047 -0.619 1.00 0.00 C ATOM 2129 CE LYS B 54 -10.295 13.214 0.054 1.00 0.00 C ATOM 2130 NZ LYS B 54 -10.185 13.354 1.533 1.00 0.00 N ATOM 0 H LYS B 54 -7.318 12.655 -4.014 1.00 0.00 H new ATOM 0 HA LYS B 54 -9.304 14.748 -4.660 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -7.229 14.389 -2.447 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -8.315 15.761 -2.548 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -10.285 14.217 -2.484 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -9.208 12.836 -2.410 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -8.222 13.727 -0.273 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -9.313 15.096 -0.345 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -11.278 13.544 -0.281 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -10.196 12.167 -0.231 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -11.127 13.253 1.962 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -9.553 12.616 1.906 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -9.798 14.291 1.765 1.00 0.00 H new ATOM 2144 N GLY B 55 -6.411 14.956 -5.798 1.00 0.00 N ATOM 2145 CA GLY B 55 -5.422 15.824 -6.500 1.00 0.00 C ATOM 2146 C GLY B 55 -4.283 16.184 -5.543 1.00 0.00 C ATOM 2147 O GLY B 55 -3.560 17.139 -5.751 1.00 0.00 O ATOM 0 H GLY B 55 -6.322 13.958 -5.987 1.00 0.00 H new ATOM 0 HA2 GLY B 55 -5.026 15.308 -7.374 1.00 0.00 H new ATOM 0 HA3 GLY B 55 -5.909 16.731 -6.859 1.00 0.00 H new ATOM 2151 N VAL B 56 -4.119 15.427 -4.492 1.00 0.00 N ATOM 2152 CA VAL B 56 -3.032 15.721 -3.516 1.00 0.00 C ATOM 2153 C VAL B 56 -1.666 15.641 -4.206 1.00 0.00 C ATOM 2154 O VAL B 56 -1.459 14.859 -5.114 1.00 0.00 O ATOM 2155 CB VAL B 56 -3.111 14.709 -2.365 1.00 0.00 C ATOM 2156 CG1 VAL B 56 -1.846 14.791 -1.501 1.00 0.00 C ATOM 2157 CG2 VAL B 56 -4.342 15.027 -1.503 1.00 0.00 C ATOM 0 H VAL B 56 -4.693 14.615 -4.267 1.00 0.00 H new ATOM 0 HA VAL B 56 -3.155 16.730 -3.122 1.00 0.00 H new ATOM 0 HB VAL B 56 -3.193 13.702 -2.775 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -1.913 14.069 -0.688 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -0.972 14.568 -2.113 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -1.752 15.795 -1.087 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -4.406 14.312 -0.682 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -4.253 16.036 -1.100 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -5.242 14.959 -2.114 1.00 0.00 H new ATOM 2167 N ASP B 57 -0.738 16.457 -3.777 1.00 0.00 N ATOM 2168 CA ASP B 57 0.625 16.454 -4.387 1.00 0.00 C ATOM 2169 C ASP B 57 1.343 15.142 -4.048 1.00 0.00 C ATOM 2170 O ASP B 57 2.534 15.116 -3.807 1.00 0.00 O ATOM 2171 CB ASP B 57 1.427 17.638 -3.835 1.00 0.00 C ATOM 2172 CG ASP B 57 0.977 18.931 -4.519 1.00 0.00 C ATOM 2173 OD1 ASP B 57 1.154 19.034 -5.722 1.00 0.00 O ATOM 2174 OD2 ASP B 57 0.463 19.796 -3.829 1.00 0.00 O ATOM 0 H ASP B 57 -0.868 17.132 -3.023 1.00 0.00 H new ATOM 0 HA ASP B 57 0.539 16.543 -5.470 1.00 0.00 H new ATOM 0 HB2 ASP B 57 1.283 17.716 -2.757 1.00 0.00 H new ATOM 0 HB3 ASP B 57 2.492 17.478 -4.003 1.00 0.00 H new ATOM 2179 N LEU B 58 0.625 14.056 -4.036 1.00 0.00 N ATOM 2180 CA LEU B 58 1.242 12.740 -3.726 1.00 0.00 C ATOM 2181 C LEU B 58 2.280 12.404 -4.798 1.00 0.00 C ATOM 2182 O LEU B 58 3.329 11.858 -4.516 1.00 0.00 O ATOM 2183 CB LEU B 58 0.143 11.671 -3.726 1.00 0.00 C ATOM 2184 CG LEU B 58 0.717 10.295 -3.322 1.00 0.00 C ATOM 2185 CD1 LEU B 58 0.790 10.181 -1.794 1.00 0.00 C ATOM 2186 CD2 LEU B 58 -0.177 9.176 -3.869 1.00 0.00 C ATOM 0 H LEU B 58 -0.376 14.025 -4.230 1.00 0.00 H new ATOM 0 HA LEU B 58 1.728 12.774 -2.751 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -0.649 11.957 -3.034 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -0.307 11.606 -4.716 1.00 0.00 H new ATOM 0 HG LEU B 58 1.719 10.199 -3.739 1.00 0.00 H new ATOM 0 HD11 LEU B 58 1.196 9.207 -1.521 1.00 0.00 H new ATOM 0 HD12 LEU B 58 1.435 10.966 -1.401 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -0.210 10.288 -1.373 1.00 0.00 H new ATOM 0 HD21 LEU B 58 0.234 8.208 -3.580 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -1.182 9.280 -3.460 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -0.219 9.243 -4.956 1.00 0.00 H new ATOM 2198 N ASN B 59 1.983 12.699 -6.028 1.00 0.00 N ATOM 2199 CA ASN B 59 2.934 12.372 -7.126 1.00 0.00 C ATOM 2200 C ASN B 59 4.255 13.103 -6.880 1.00 0.00 C ATOM 2201 O ASN B 59 5.326 12.560 -7.061 1.00 0.00 O ATOM 2202 CB ASN B 59 2.343 12.861 -8.448 1.00 0.00 C ATOM 2203 CG ASN B 59 0.895 12.388 -8.559 1.00 0.00 C ATOM 2204 OD1 ASN B 59 -0.063 13.202 -8.206 1.00 0.00 O flip ATOM 2205 ND2 ASN B 59 0.633 11.271 -8.959 1.00 0.00 N flip ATOM 0 H ASN B 59 1.120 13.154 -6.324 1.00 0.00 H new ATOM 0 HA ASN B 59 3.105 11.296 -7.161 1.00 0.00 H new ATOM 0 HB2 ASN B 59 2.387 13.949 -8.499 1.00 0.00 H new ATOM 0 HB3 ASN B 59 2.928 12.479 -9.285 1.00 0.00 H new ATOM 0 HD21 ASN B 59 1.384 10.638 -9.234 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -0.338 10.966 -9.020 1.00 0.00 H new ATOM 2212 N ALA B 60 4.180 14.338 -6.471 1.00 0.00 N ATOM 2213 CA ALA B 60 5.421 15.118 -6.215 1.00 0.00 C ATOM 2214 C ALA B 60 6.165 14.552 -5.006 1.00 0.00 C ATOM 2215 O ALA B 60 7.376 14.499 -4.991 1.00 0.00 O ATOM 2216 CB ALA B 60 5.058 16.578 -5.944 1.00 0.00 C ATOM 0 H ALA B 60 3.309 14.842 -6.303 1.00 0.00 H new ATOM 0 HA ALA B 60 6.065 15.051 -7.092 1.00 0.00 H new ATOM 0 HB1 ALA B 60 5.967 17.150 -5.756 1.00 0.00 H new ATOM 0 HB2 ALA B 60 4.541 16.991 -6.810 1.00 0.00 H new ATOM 0 HB3 ALA B 60 4.407 16.635 -5.072 1.00 0.00 H new ATOM 2222 N LEU B 61 5.455 14.135 -3.986 1.00 0.00 N ATOM 2223 CA LEU B 61 6.136 13.591 -2.771 1.00 0.00 C ATOM 2224 C LEU B 61 6.975 12.367 -3.148 1.00 0.00 C ATOM 2225 O LEU B 61 8.095 12.208 -2.704 1.00 0.00 O ATOM 2226 CB LEU B 61 5.091 13.181 -1.724 1.00 0.00 C ATOM 2227 CG LEU B 61 4.403 14.422 -1.133 1.00 0.00 C ATOM 2228 CD1 LEU B 61 3.281 13.972 -0.188 1.00 0.00 C ATOM 2229 CD2 LEU B 61 5.421 15.284 -0.354 1.00 0.00 C ATOM 0 H LEU B 61 4.436 14.148 -3.943 1.00 0.00 H new ATOM 0 HA LEU B 61 6.783 14.364 -2.357 1.00 0.00 H new ATOM 0 HB2 LEU B 61 4.347 12.529 -2.181 1.00 0.00 H new ATOM 0 HB3 LEU B 61 5.570 12.610 -0.928 1.00 0.00 H new ATOM 0 HG LEU B 61 3.989 15.021 -1.944 1.00 0.00 H new ATOM 0 HD11 LEU B 61 2.789 14.848 0.235 1.00 0.00 H new ATOM 0 HD12 LEU B 61 2.554 13.379 -0.743 1.00 0.00 H new ATOM 0 HD13 LEU B 61 3.703 13.369 0.616 1.00 0.00 H new ATOM 0 HD21 LEU B 61 4.917 16.159 0.058 1.00 0.00 H new ATOM 0 HD22 LEU B 61 5.850 14.696 0.458 1.00 0.00 H new ATOM 0 HD23 LEU B 61 6.215 15.606 -1.027 1.00 0.00 H new ATOM 2241 N PHE B 62 6.451 11.501 -3.966 1.00 0.00 N ATOM 2242 CA PHE B 62 7.234 10.299 -4.370 1.00 0.00 C ATOM 2243 C PHE B 62 8.465 10.731 -5.169 1.00 0.00 C ATOM 2244 O PHE B 62 9.553 10.233 -4.971 1.00 0.00 O ATOM 2245 CB PHE B 62 6.351 9.371 -5.226 1.00 0.00 C ATOM 2246 CG PHE B 62 5.614 8.402 -4.331 1.00 0.00 C ATOM 2247 CD1 PHE B 62 6.322 7.373 -3.700 1.00 0.00 C ATOM 2248 CD2 PHE B 62 4.237 8.532 -4.127 1.00 0.00 C ATOM 2249 CE1 PHE B 62 5.654 6.472 -2.867 1.00 0.00 C ATOM 2250 CE2 PHE B 62 3.567 7.631 -3.292 1.00 0.00 C ATOM 2251 CZ PHE B 62 4.276 6.600 -2.662 1.00 0.00 C ATOM 0 H PHE B 62 5.518 11.571 -4.372 1.00 0.00 H new ATOM 0 HA PHE B 62 7.559 9.762 -3.479 1.00 0.00 H new ATOM 0 HB2 PHE B 62 5.639 9.961 -5.804 1.00 0.00 H new ATOM 0 HB3 PHE B 62 6.967 8.825 -5.941 1.00 0.00 H new ATOM 0 HD1 PHE B 62 7.386 7.275 -3.857 1.00 0.00 H new ATOM 0 HD2 PHE B 62 3.691 9.327 -4.613 1.00 0.00 H new ATOM 0 HE1 PHE B 62 6.201 5.677 -2.382 1.00 0.00 H new ATOM 0 HE2 PHE B 62 2.503 7.730 -3.133 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.759 5.904 -2.018 1.00 0.00 H new ATOM 2261 N ASP B 63 8.306 11.652 -6.072 1.00 0.00 N ATOM 2262 CA ASP B 63 9.471 12.102 -6.883 1.00 0.00 C ATOM 2263 C ASP B 63 10.639 12.431 -5.949 1.00 0.00 C ATOM 2264 O ASP B 63 11.783 12.145 -6.241 1.00 0.00 O ATOM 2265 CB ASP B 63 9.081 13.347 -7.684 1.00 0.00 C ATOM 2266 CG ASP B 63 10.247 13.771 -8.577 1.00 0.00 C ATOM 2267 OD1 ASP B 63 10.737 12.933 -9.316 1.00 0.00 O ATOM 2268 OD2 ASP B 63 10.629 14.928 -8.509 1.00 0.00 O ATOM 0 H ASP B 63 7.422 12.114 -6.285 1.00 0.00 H new ATOM 0 HA ASP B 63 9.770 11.311 -7.571 1.00 0.00 H new ATOM 0 HB2 ASP B 63 8.201 13.139 -8.293 1.00 0.00 H new ATOM 0 HB3 ASP B 63 8.815 14.159 -7.007 1.00 0.00 H new ATOM 2273 N ARG B 64 10.360 13.036 -4.829 1.00 0.00 N ATOM 2274 CA ARG B 64 11.462 13.385 -3.879 1.00 0.00 C ATOM 2275 C ARG B 64 12.083 12.087 -3.333 1.00 0.00 C ATOM 2276 O ARG B 64 13.287 11.918 -3.304 1.00 0.00 O ATOM 2277 CB ARG B 64 10.891 14.209 -2.704 1.00 0.00 C ATOM 2278 CG ARG B 64 9.677 15.003 -3.182 1.00 0.00 C ATOM 2279 CD ARG B 64 9.255 16.041 -2.135 1.00 0.00 C ATOM 2280 NE ARG B 64 10.024 17.294 -2.345 1.00 0.00 N ATOM 2281 CZ ARG B 64 9.866 18.295 -1.528 1.00 0.00 C ATOM 2282 NH1 ARG B 64 9.063 18.180 -0.506 1.00 0.00 N ATOM 2283 NH2 ARG B 64 10.509 19.410 -1.731 1.00 0.00 N ATOM 0 H ARG B 64 9.423 13.304 -4.528 1.00 0.00 H new ATOM 0 HA ARG B 64 12.220 13.971 -4.398 1.00 0.00 H new ATOM 0 HB2 ARG B 64 10.607 13.547 -1.886 1.00 0.00 H new ATOM 0 HB3 ARG B 64 11.652 14.886 -2.317 1.00 0.00 H new ATOM 0 HG2 ARG B 64 9.912 15.503 -4.122 1.00 0.00 H new ATOM 0 HG3 ARG B 64 8.848 14.323 -3.381 1.00 0.00 H new ATOM 0 HD2 ARG B 64 8.186 16.240 -2.214 1.00 0.00 H new ATOM 0 HD3 ARG B 64 9.434 15.655 -1.131 1.00 0.00 H new ATOM 0 HE ARG B 64 10.674 17.370 -3.127 1.00 0.00 H new ATOM 0 HH11 ARG B 64 8.560 17.307 -0.348 1.00 0.00 H new ATOM 0 HH12 ARG B 64 8.938 18.963 0.135 1.00 0.00 H new ATOM 0 HH21 ARG B 64 11.136 19.499 -2.530 1.00 0.00 H new ATOM 0 HH22 ARG B 64 10.385 20.194 -1.091 1.00 0.00 H new ATOM 2297 N ILE B 65 11.253 11.180 -2.890 1.00 0.00 N ATOM 2298 CA ILE B 65 11.752 9.888 -2.323 1.00 0.00 C ATOM 2299 C ILE B 65 12.412 9.035 -3.416 1.00 0.00 C ATOM 2300 O ILE B 65 13.438 8.420 -3.202 1.00 0.00 O ATOM 2301 CB ILE B 65 10.573 9.115 -1.722 1.00 0.00 C ATOM 2302 CG1 ILE B 65 10.034 9.876 -0.508 1.00 0.00 C ATOM 2303 CG2 ILE B 65 11.042 7.725 -1.277 1.00 0.00 C ATOM 2304 CD1 ILE B 65 8.701 9.264 -0.072 1.00 0.00 C ATOM 0 H ILE B 65 10.238 11.279 -2.896 1.00 0.00 H new ATOM 0 HA ILE B 65 12.493 10.105 -1.554 1.00 0.00 H new ATOM 0 HB ILE B 65 9.789 9.012 -2.472 1.00 0.00 H new ATOM 0 HG12 ILE B 65 10.752 9.831 0.311 1.00 0.00 H new ATOM 0 HG13 ILE B 65 9.899 10.929 -0.756 1.00 0.00 H new ATOM 0 HG21 ILE B 65 10.202 7.177 -0.850 1.00 0.00 H new ATOM 0 HG22 ILE B 65 11.431 7.180 -2.137 1.00 0.00 H new ATOM 0 HG23 ILE B 65 11.827 7.828 -0.527 1.00 0.00 H new ATOM 0 HD11 ILE B 65 8.317 9.806 0.792 1.00 0.00 H new ATOM 0 HD12 ILE B 65 7.984 9.332 -0.890 1.00 0.00 H new ATOM 0 HD13 ILE B 65 8.851 8.217 0.193 1.00 0.00 H new