USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 822 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -157:sc= -0.239 (180deg=-0.725) USER MOD Single : A 1 MET N :NH3+ 141:sc= 0.0203 (180deg=-0.0199) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN :FLIP amide:sc= -2.43 F(o=-7.3!,f=-2.4) USER MOD Single : A 13 LYS NZ :NH3+ -166:sc= -0.0166 (180deg=-0.224) USER MOD Single : A 16 SER OG : rot -122:sc= -0.181 USER MOD Single : A 17 TYR OH : rot 180:sc= -0.0789 USER MOD Single : A 22 LYS NZ :NH3+ -111:sc= -0.939 (180deg=-3.19!) USER MOD Single : A 23 MET CE :methyl -140:sc= -3.13! (180deg=-3.36!) USER MOD Single : A 26 THR OG1 : rot 91:sc= 0.266 USER MOD Single : A 28 SER OG : rot 180:sc= 0.00664 USER MOD Single : A 34 MET CE :methyl -169:sc= -1.15 (180deg=-1.76) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 47 LYS NZ :NH3+ -173:sc= 0.262 (180deg=0.119) USER MOD Single : A 48 GLN :FLIP amide:sc= -4.13! C(o=-7.1!,f=-4.1!) USER MOD Single : A 49 THR OG1 : rot -48:sc= 0.723 USER MOD Single : B 101 MET CE :methyl -161:sc= -0.26 (180deg=-1.04) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 ASN : amide:sc= -3.32 X(o=-3.3,f=-3.1!) USER MOD Single : B 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 116 SER OG : rot -79:sc= -0.353! USER MOD Single : B 117 TYR OH : rot 180:sc= -0.159 USER MOD Single : B 122 LYS NZ :NH3+ -159:sc= -2.78! (180deg=-4.43!) USER MOD Single : B 123 MET CE :methyl -179:sc= -1.21 (180deg=-1.21) USER MOD Single : B 126 THR OG1 : rot 180:sc= 0 USER MOD Single : B 128 SER OG : rot 180:sc= 0.00556 USER MOD Single : B 134 MET CE :methyl 168:sc=-0.00324 (180deg=-0.0155) USER MOD Single : B 137 TYR OH : rot 180:sc= -0.0543 USER MOD Single : B 141 ASN : amide:sc= 0.994 K(o=0.99,f=0) USER MOD Single : B 147 LYS NZ :NH3+ -117:sc= -0.656 (180deg=-2.78!) USER MOD Single : B 148 GLN :FLIP amide:sc= -0.42 F(o=-2.6,f=-0.42) USER MOD Single : B 149 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.945 13.289 11.620 1.00 0.00 N ATOM 2 CA MET A 1 -2.547 12.007 11.004 1.00 0.00 C ATOM 3 C MET A 1 -2.415 10.931 12.073 1.00 0.00 C ATOM 4 O MET A 1 -1.901 11.206 13.165 1.00 0.00 O ATOM 5 CB MET A 1 -1.232 12.153 10.206 1.00 0.00 C ATOM 6 CG MET A 1 0.002 12.450 11.053 1.00 0.00 C ATOM 7 SD MET A 1 1.442 12.821 10.063 1.00 0.00 S ATOM 8 CE MET A 1 1.444 11.453 8.906 1.00 0.00 C ATOM 0 H1 MET A 1 -2.440 14.070 11.154 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.970 13.425 11.508 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.706 13.277 12.632 1.00 0.00 H new ATOM 0 HA MET A 1 -3.326 11.709 10.302 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.059 11.233 9.647 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.354 12.952 9.475 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.208 13.293 11.712 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.215 11.592 11.691 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.451 11.310 8.513 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.121 10.545 9.415 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.761 11.670 8.084 1.00 0.00 H new ATOM 18 N GLY A 2 -2.888 9.734 11.753 1.00 0.00 N ATOM 19 CA GLY A 2 -2.931 8.660 12.748 1.00 0.00 C ATOM 20 C GLY A 2 -2.186 7.429 12.311 1.00 0.00 C ATOM 21 O GLY A 2 -1.571 7.411 11.237 1.00 0.00 O ATOM 0 H GLY A 2 -3.242 9.480 10.831 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -2.507 9.022 13.685 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -3.970 8.398 12.948 1.00 0.00 H new ATOM 25 N SER A 3 -2.248 6.387 13.123 1.00 0.00 N ATOM 26 CA SER A 3 -1.513 5.153 12.868 1.00 0.00 C ATOM 27 C SER A 3 -2.444 3.951 12.724 1.00 0.00 C ATOM 28 O SER A 3 -3.515 3.885 13.332 1.00 0.00 O ATOM 29 CB SER A 3 -0.528 4.917 14.016 1.00 0.00 C ATOM 30 OG SER A 3 -1.114 5.134 15.275 1.00 0.00 O ATOM 0 H SER A 3 -2.807 6.369 13.976 1.00 0.00 H new ATOM 0 HA SER A 3 -0.979 5.261 11.924 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.151 3.895 13.964 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.330 5.579 13.898 1.00 0.00 H new ATOM 0 HG SER A 3 -0.450 4.970 15.977 1.00 0.00 H new ATOM 36 N ILE A 4 -2.025 2.997 11.876 1.00 0.00 N ATOM 37 CA ILE A 4 -2.752 1.750 11.684 1.00 0.00 C ATOM 38 C ILE A 4 -1.798 0.569 11.810 1.00 0.00 C ATOM 39 O ILE A 4 -0.579 0.753 11.853 1.00 0.00 O ATOM 40 CB ILE A 4 -3.469 1.696 10.297 1.00 0.00 C ATOM 41 CG1 ILE A 4 -2.467 1.629 9.115 1.00 0.00 C ATOM 42 CG2 ILE A 4 -4.380 2.915 10.149 1.00 0.00 C ATOM 43 CD1 ILE A 4 -2.220 0.239 8.569 1.00 0.00 C ATOM 0 H ILE A 4 -1.178 3.076 11.312 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.518 1.696 12.458 1.00 0.00 H new ATOM 0 HB ILE A 4 -4.060 0.781 10.263 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -2.837 2.261 8.307 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.516 2.051 9.439 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.881 2.879 9.182 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.125 2.911 10.944 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.784 3.825 10.215 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -1.507 0.293 7.746 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -1.817 -0.396 9.358 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.158 -0.182 8.209 1.00 0.00 H new ATOM 55 N ASN A 5 -2.355 -0.637 11.892 1.00 0.00 N ATOM 56 CA ASN A 5 -1.571 -1.862 11.995 1.00 0.00 C ATOM 57 C ASN A 5 -1.618 -2.645 10.678 1.00 0.00 C ATOM 58 O ASN A 5 -2.692 -2.851 10.111 1.00 0.00 O ATOM 59 CB ASN A 5 -2.106 -2.744 13.132 1.00 0.00 C ATOM 60 CG ASN A 5 -1.654 -4.196 13.042 1.00 0.00 C ATOM 61 OD1 ASN A 5 -0.441 -4.445 12.580 1.00 0.00 O flip ATOM 62 ND2 ASN A 5 -2.400 -5.110 13.406 1.00 0.00 N flip ATOM 0 H ASN A 5 -3.363 -0.791 11.889 1.00 0.00 H new ATOM 0 HA ASN A 5 -0.538 -1.586 12.208 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -1.780 -2.329 14.086 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -3.195 -2.710 13.125 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -3.333 -4.897 13.760 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -2.084 -6.078 13.353 1.00 0.00 H new ATOM 69 N LEU A 6 -0.451 -3.045 10.205 1.00 0.00 N ATOM 70 CA LEU A 6 -0.327 -3.893 9.042 1.00 0.00 C ATOM 71 C LEU A 6 0.141 -5.269 9.535 1.00 0.00 C ATOM 72 O LEU A 6 0.846 -5.323 10.550 1.00 0.00 O ATOM 73 CB LEU A 6 0.722 -3.297 8.085 1.00 0.00 C ATOM 74 CG LEU A 6 0.563 -3.555 6.569 1.00 0.00 C ATOM 75 CD1 LEU A 6 1.932 -3.598 5.901 1.00 0.00 C ATOM 76 CD2 LEU A 6 -0.218 -4.827 6.280 1.00 0.00 C ATOM 0 H LEU A 6 0.442 -2.786 10.624 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.275 -3.975 8.510 1.00 0.00 H new ATOM 0 HB2 LEU A 6 0.737 -2.218 8.239 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.699 -3.675 8.386 1.00 0.00 H new ATOM 0 HG LEU A 6 -0.014 -2.729 6.152 1.00 0.00 H new ATOM 0 HD11 LEU A 6 1.810 -3.780 4.833 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.440 -2.645 6.051 1.00 0.00 H new ATOM 0 HD13 LEU A 6 2.526 -4.399 6.340 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.303 -4.965 5.202 1.00 0.00 H new ATOM 0 HD22 LEU A 6 0.302 -5.680 6.715 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.214 -4.749 6.716 1.00 0.00 H new ATOM 88 N ARG A 7 -0.237 -6.377 8.884 1.00 0.00 N ATOM 89 CA ARG A 7 0.227 -7.693 9.283 1.00 0.00 C ATOM 90 C ARG A 7 0.620 -8.463 8.029 1.00 0.00 C ATOM 91 O ARG A 7 -0.240 -8.838 7.235 1.00 0.00 O ATOM 92 CB ARG A 7 -0.856 -8.469 10.064 1.00 0.00 C ATOM 93 CG ARG A 7 -1.208 -7.875 11.420 1.00 0.00 C ATOM 94 CD ARG A 7 -1.750 -8.937 12.362 1.00 0.00 C ATOM 95 NE ARG A 7 -2.932 -9.629 11.820 1.00 0.00 N ATOM 96 CZ ARG A 7 -2.958 -10.918 11.465 1.00 0.00 C ATOM 97 NH1 ARG A 7 -1.884 -11.665 11.614 1.00 0.00 N ATOM 98 NH2 ARG A 7 -4.074 -11.451 10.966 1.00 0.00 N ATOM 0 H ARG A 7 -0.864 -6.378 8.079 1.00 0.00 H new ATOM 0 HA ARG A 7 1.083 -7.579 9.948 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.760 -8.515 9.457 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -0.516 -9.495 10.209 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -0.323 -7.414 11.859 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.949 -7.086 11.293 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -0.968 -9.668 12.567 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -2.010 -8.474 13.314 1.00 0.00 H new ATOM 0 HE ARG A 7 -3.789 -9.088 11.708 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -1.031 -11.261 12.001 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -1.905 -12.648 11.343 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -4.909 -10.875 10.855 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -4.093 -12.434 10.695 1.00 0.00 H new ATOM 112 N ILE A 8 1.909 -8.688 7.835 1.00 0.00 N ATOM 113 CA ILE A 8 2.408 -9.357 6.628 1.00 0.00 C ATOM 114 C ILE A 8 3.441 -10.390 6.958 1.00 0.00 C ATOM 115 O ILE A 8 3.923 -10.479 8.099 1.00 0.00 O ATOM 116 CB ILE A 8 3.036 -8.364 5.601 1.00 0.00 C ATOM 117 CG1 ILE A 8 4.423 -7.865 6.055 1.00 0.00 C ATOM 118 CG2 ILE A 8 2.100 -7.198 5.326 1.00 0.00 C ATOM 119 CD1 ILE A 8 4.417 -7.004 7.301 1.00 0.00 C ATOM 0 H ILE A 8 2.637 -8.419 8.496 1.00 0.00 H new ATOM 0 HA ILE A 8 1.532 -9.826 6.180 1.00 0.00 H new ATOM 0 HB ILE A 8 3.179 -8.912 4.670 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.063 -8.729 6.232 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.872 -7.296 5.241 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.563 -6.522 4.607 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.161 -7.573 4.919 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.904 -6.662 6.255 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.437 -6.703 7.540 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.808 -6.117 7.127 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.002 -7.572 8.134 1.00 0.00 H new ATOM 131 N ASP A 9 3.766 -11.197 5.960 1.00 0.00 N ATOM 132 CA ASP A 9 4.876 -12.125 6.046 1.00 0.00 C ATOM 133 C ASP A 9 6.148 -11.351 6.389 1.00 0.00 C ATOM 134 O ASP A 9 6.581 -10.503 5.620 1.00 0.00 O ATOM 135 CB ASP A 9 5.060 -12.817 4.685 1.00 0.00 C ATOM 136 CG ASP A 9 3.813 -13.552 4.225 1.00 0.00 C ATOM 137 OD1 ASP A 9 2.901 -12.899 3.692 1.00 0.00 O ATOM 138 OD2 ASP A 9 3.755 -14.800 4.379 1.00 0.00 O ATOM 0 H ASP A 9 3.267 -11.225 5.071 1.00 0.00 H new ATOM 0 HA ASP A 9 4.677 -12.870 6.816 1.00 0.00 H new ATOM 0 HB2 ASP A 9 5.333 -12.072 3.938 1.00 0.00 H new ATOM 0 HB3 ASP A 9 5.889 -13.522 4.750 1.00 0.00 H new ATOM 143 N ASP A 10 6.740 -11.640 7.554 1.00 0.00 N ATOM 144 CA ASP A 10 7.919 -10.906 8.011 1.00 0.00 C ATOM 145 C ASP A 10 9.052 -11.027 7.001 1.00 0.00 C ATOM 146 O ASP A 10 9.853 -10.105 6.830 1.00 0.00 O ATOM 147 CB ASP A 10 8.374 -11.443 9.385 1.00 0.00 C ATOM 148 CG ASP A 10 8.956 -12.844 9.312 1.00 0.00 C ATOM 149 OD1 ASP A 10 8.171 -13.810 9.212 1.00 0.00 O ATOM 150 OD2 ASP A 10 10.196 -12.993 9.363 1.00 0.00 O ATOM 0 H ASP A 10 6.423 -12.371 8.191 1.00 0.00 H new ATOM 0 HA ASP A 10 7.656 -9.853 8.108 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.120 -10.767 9.804 1.00 0.00 H new ATOM 0 HB3 ASP A 10 7.525 -11.444 10.068 1.00 0.00 H new ATOM 155 N GLU A 11 9.086 -12.171 6.306 1.00 0.00 N ATOM 156 CA GLU A 11 10.108 -12.422 5.294 1.00 0.00 C ATOM 157 C GLU A 11 9.960 -11.453 4.127 1.00 0.00 C ATOM 158 O GLU A 11 10.961 -10.984 3.573 1.00 0.00 O ATOM 159 CB GLU A 11 10.013 -13.862 4.779 1.00 0.00 C ATOM 160 CG GLU A 11 8.622 -14.256 4.280 1.00 0.00 C ATOM 161 CD GLU A 11 8.552 -15.708 3.835 1.00 0.00 C ATOM 162 OE1 GLU A 11 8.320 -16.582 4.686 1.00 0.00 O ATOM 163 OE2 GLU A 11 8.752 -15.976 2.636 1.00 0.00 O ATOM 0 H GLU A 11 8.418 -12.932 6.429 1.00 0.00 H new ATOM 0 HA GLU A 11 11.083 -12.272 5.758 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.729 -13.994 3.968 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.307 -14.542 5.578 1.00 0.00 H new ATOM 0 HG2 GLU A 11 7.894 -14.087 5.073 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.342 -13.610 3.448 1.00 0.00 H new ATOM 170 N LEU A 12 8.714 -11.112 3.793 1.00 0.00 N ATOM 171 CA LEU A 12 8.435 -10.214 2.673 1.00 0.00 C ATOM 172 C LEU A 12 8.725 -8.781 3.114 1.00 0.00 C ATOM 173 O LEU A 12 9.316 -8.006 2.362 1.00 0.00 O ATOM 174 CB LEU A 12 6.969 -10.351 2.255 1.00 0.00 C ATOM 175 CG LEU A 12 6.551 -9.426 1.085 1.00 0.00 C ATOM 176 CD1 LEU A 12 7.323 -9.763 -0.181 1.00 0.00 C ATOM 177 CD2 LEU A 12 5.038 -9.534 0.846 1.00 0.00 C ATOM 0 H LEU A 12 7.883 -11.444 4.282 1.00 0.00 H new ATOM 0 HA LEU A 12 9.064 -10.470 1.821 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.780 -11.386 1.970 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.336 -10.137 3.116 1.00 0.00 H new ATOM 0 HG LEU A 12 6.791 -8.398 1.354 1.00 0.00 H new ATOM 0 HD11 LEU A 12 7.010 -9.098 -0.986 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.391 -9.636 -0.001 1.00 0.00 H new ATOM 0 HD13 LEU A 12 7.123 -10.796 -0.465 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.752 -8.880 0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.781 -10.564 0.598 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.505 -9.234 1.748 1.00 0.00 H new ATOM 189 N LYS A 13 8.307 -8.495 4.333 1.00 0.00 N ATOM 190 CA LYS A 13 8.580 -7.210 4.958 1.00 0.00 C ATOM 191 C LYS A 13 10.047 -6.825 4.805 1.00 0.00 C ATOM 192 O LYS A 13 10.365 -5.726 4.373 1.00 0.00 O ATOM 193 CB LYS A 13 8.222 -7.278 6.451 1.00 0.00 C ATOM 194 CG LYS A 13 8.789 -6.138 7.294 1.00 0.00 C ATOM 195 CD LYS A 13 8.782 -6.480 8.765 1.00 0.00 C ATOM 196 CE LYS A 13 9.469 -5.426 9.617 1.00 0.00 C ATOM 197 NZ LYS A 13 10.926 -5.376 9.324 1.00 0.00 N ATOM 0 H LYS A 13 7.773 -9.140 4.916 1.00 0.00 H new ATOM 0 HA LYS A 13 7.972 -6.453 4.463 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.137 -7.281 6.551 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.582 -8.224 6.855 1.00 0.00 H new ATOM 0 HG2 LYS A 13 9.808 -5.920 6.975 1.00 0.00 H new ATOM 0 HG3 LYS A 13 8.203 -5.234 7.127 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.752 -6.598 9.101 1.00 0.00 H new ATOM 0 HD3 LYS A 13 9.277 -7.440 8.913 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.022 -4.450 9.427 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.313 -5.648 10.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.411 -4.833 10.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 11.308 -6.343 9.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 11.079 -4.917 8.403 1.00 0.00 H new ATOM 211 N ALA A 14 10.931 -7.742 5.189 1.00 0.00 N ATOM 212 CA ALA A 14 12.352 -7.537 5.061 1.00 0.00 C ATOM 213 C ALA A 14 12.760 -7.098 3.645 1.00 0.00 C ATOM 214 O ALA A 14 13.538 -6.150 3.486 1.00 0.00 O ATOM 215 CB ALA A 14 13.099 -8.812 5.455 1.00 0.00 C ATOM 0 H ALA A 14 10.673 -8.642 5.595 1.00 0.00 H new ATOM 0 HA ALA A 14 12.625 -6.726 5.736 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.172 -8.650 5.356 1.00 0.00 H new ATOM 0 HB2 ALA A 14 12.864 -9.067 6.489 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.794 -9.629 4.802 1.00 0.00 H new ATOM 221 N ARG A 15 12.188 -7.759 2.637 1.00 0.00 N ATOM 222 CA ARG A 15 12.491 -7.428 1.230 1.00 0.00 C ATOM 223 C ARG A 15 12.043 -6.010 0.887 1.00 0.00 C ATOM 224 O ARG A 15 12.840 -5.182 0.445 1.00 0.00 O ATOM 225 CB ARG A 15 11.812 -8.427 0.264 1.00 0.00 C ATOM 226 CG ARG A 15 12.598 -9.720 0.048 1.00 0.00 C ATOM 227 CD ARG A 15 12.806 -10.506 1.333 1.00 0.00 C ATOM 228 NE ARG A 15 13.367 -11.833 1.087 1.00 0.00 N ATOM 229 CZ ARG A 15 13.604 -12.734 2.039 1.00 0.00 C ATOM 230 NH1 ARG A 15 13.307 -12.479 3.296 1.00 0.00 N ATOM 231 NH2 ARG A 15 14.095 -13.925 1.709 1.00 0.00 N ATOM 0 H ARG A 15 11.519 -8.519 2.759 1.00 0.00 H new ATOM 0 HA ARG A 15 13.572 -7.496 1.111 1.00 0.00 H new ATOM 0 HB2 ARG A 15 10.824 -8.676 0.651 1.00 0.00 H new ATOM 0 HB3 ARG A 15 11.663 -7.940 -0.700 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.070 -10.344 -0.673 1.00 0.00 H new ATOM 0 HG3 ARG A 15 13.568 -9.481 -0.387 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.471 -9.949 1.993 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.853 -10.607 1.853 1.00 0.00 H new ATOM 0 HE ARG A 15 13.591 -12.085 0.125 1.00 0.00 H new ATOM 0 HH11 ARG A 15 12.891 -11.583 3.550 1.00 0.00 H new ATOM 0 HH12 ARG A 15 13.493 -13.177 4.016 1.00 0.00 H new ATOM 0 HH21 ARG A 15 14.288 -14.144 0.732 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.279 -14.619 2.433 1.00 0.00 H new ATOM 245 N SER A 16 10.754 -5.747 1.088 1.00 0.00 N ATOM 246 CA SER A 16 10.150 -4.478 0.720 1.00 0.00 C ATOM 247 C SER A 16 10.857 -3.303 1.405 1.00 0.00 C ATOM 248 O SER A 16 11.241 -2.329 0.747 1.00 0.00 O ATOM 249 CB SER A 16 8.660 -4.499 1.098 1.00 0.00 C ATOM 250 OG SER A 16 8.474 -4.955 2.432 1.00 0.00 O ATOM 0 H SER A 16 10.103 -6.409 1.510 1.00 0.00 H new ATOM 0 HA SER A 16 10.255 -4.341 -0.356 1.00 0.00 H new ATOM 0 HB2 SER A 16 8.241 -3.498 0.991 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.117 -5.147 0.410 1.00 0.00 H new ATOM 0 HG SER A 16 7.890 -5.742 2.430 1.00 0.00 H new ATOM 256 N TYR A 17 11.016 -3.396 2.720 1.00 0.00 N ATOM 257 CA TYR A 17 11.697 -2.378 3.503 1.00 0.00 C ATOM 258 C TYR A 17 13.124 -2.177 3.000 1.00 0.00 C ATOM 259 O TYR A 17 13.597 -1.045 2.904 1.00 0.00 O ATOM 260 CB TYR A 17 11.695 -2.761 4.989 1.00 0.00 C ATOM 261 CG TYR A 17 10.353 -2.563 5.678 1.00 0.00 C ATOM 262 CD1 TYR A 17 9.162 -3.005 5.102 1.00 0.00 C ATOM 263 CD2 TYR A 17 10.276 -1.917 6.915 1.00 0.00 C ATOM 264 CE1 TYR A 17 7.947 -2.813 5.731 1.00 0.00 C ATOM 265 CE2 TYR A 17 9.054 -1.721 7.538 1.00 0.00 C ATOM 266 CZ TYR A 17 7.898 -2.168 6.943 1.00 0.00 C ATOM 267 OH TYR A 17 6.702 -1.985 7.566 1.00 0.00 O ATOM 0 H TYR A 17 10.675 -4.182 3.272 1.00 0.00 H new ATOM 0 HA TYR A 17 11.161 -1.436 3.388 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.990 -3.806 5.085 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.449 -2.168 5.507 1.00 0.00 H new ATOM 0 HD1 TYR A 17 9.190 -3.507 4.146 1.00 0.00 H new ATOM 0 HD2 TYR A 17 11.180 -1.566 7.391 1.00 0.00 H new ATOM 0 HE1 TYR A 17 7.037 -3.169 5.271 1.00 0.00 H new ATOM 0 HE2 TYR A 17 9.010 -1.217 8.492 1.00 0.00 H new ATOM 0 HH TYR A 17 6.843 -1.513 8.413 1.00 0.00 H new ATOM 277 N ALA A 18 13.796 -3.274 2.647 1.00 0.00 N ATOM 278 CA ALA A 18 15.163 -3.224 2.137 1.00 0.00 C ATOM 279 C ALA A 18 15.236 -2.388 0.864 1.00 0.00 C ATOM 280 O ALA A 18 16.105 -1.525 0.736 1.00 0.00 O ATOM 281 CB ALA A 18 15.687 -4.628 1.905 1.00 0.00 C ATOM 0 H ALA A 18 13.409 -4.216 2.707 1.00 0.00 H new ATOM 0 HA ALA A 18 15.797 -2.743 2.882 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.707 -4.577 1.525 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.677 -5.180 2.845 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.054 -5.137 1.178 1.00 0.00 H new ATOM 287 N ALA A 19 14.319 -2.631 -0.046 1.00 0.00 N ATOM 288 CA ALA A 19 14.294 -1.932 -1.336 1.00 0.00 C ATOM 289 C ALA A 19 14.058 -0.435 -1.163 1.00 0.00 C ATOM 290 O ALA A 19 14.735 0.399 -1.778 1.00 0.00 O ATOM 291 CB ALA A 19 13.230 -2.542 -2.247 1.00 0.00 C ATOM 0 H ALA A 19 13.569 -3.312 0.074 1.00 0.00 H new ATOM 0 HA ALA A 19 15.272 -2.056 -1.801 1.00 0.00 H new ATOM 0 HB1 ALA A 19 13.222 -2.014 -3.201 1.00 0.00 H new ATOM 0 HB2 ALA A 19 13.456 -3.595 -2.417 1.00 0.00 H new ATOM 0 HB3 ALA A 19 12.252 -2.453 -1.774 1.00 0.00 H new ATOM 297 N LEU A 20 13.110 -0.066 -0.303 1.00 0.00 N ATOM 298 CA LEU A 20 12.723 1.332 -0.156 1.00 0.00 C ATOM 299 C LEU A 20 13.772 2.121 0.610 1.00 0.00 C ATOM 300 O LEU A 20 14.023 3.299 0.306 1.00 0.00 O ATOM 301 CB LEU A 20 11.313 1.440 0.486 1.00 0.00 C ATOM 302 CG LEU A 20 11.120 0.783 1.853 1.00 0.00 C ATOM 303 CD1 LEU A 20 11.641 1.674 2.974 1.00 0.00 C ATOM 304 CD2 LEU A 20 9.629 0.439 2.082 1.00 0.00 C ATOM 0 H LEU A 20 12.600 -0.713 0.298 1.00 0.00 H new ATOM 0 HA LEU A 20 12.665 1.781 -1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.064 2.497 0.580 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.592 1.003 -0.205 1.00 0.00 H new ATOM 0 HG LEU A 20 11.698 -0.141 1.865 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.489 1.179 3.933 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.705 1.860 2.826 1.00 0.00 H new ATOM 0 HD13 LEU A 20 11.102 2.622 2.966 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.509 -0.028 3.060 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.035 1.352 2.041 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.291 -0.249 1.307 1.00 0.00 H new ATOM 316 N GLU A 21 14.443 1.482 1.577 1.00 0.00 N ATOM 317 CA GLU A 21 15.509 2.147 2.335 1.00 0.00 C ATOM 318 C GLU A 21 16.766 2.310 1.466 1.00 0.00 C ATOM 319 O GLU A 21 17.644 3.128 1.770 1.00 0.00 O ATOM 320 CB GLU A 21 15.835 1.395 3.629 1.00 0.00 C ATOM 321 CG GLU A 21 16.321 -0.032 3.415 1.00 0.00 C ATOM 322 CD GLU A 21 16.849 -0.671 4.692 1.00 0.00 C ATOM 323 OE1 GLU A 21 16.036 -0.912 5.603 1.00 0.00 O ATOM 324 OE2 GLU A 21 18.061 -0.933 4.788 1.00 0.00 O ATOM 0 H GLU A 21 14.269 0.515 1.851 1.00 0.00 H new ATOM 0 HA GLU A 21 15.150 3.137 2.615 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.598 1.949 4.176 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.945 1.374 4.258 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.502 -0.635 3.023 1.00 0.00 H new ATOM 0 HG3 GLU A 21 17.108 -0.034 2.660 1.00 0.00 H new ATOM 331 N LYS A 22 16.820 1.531 0.405 1.00 0.00 N ATOM 332 CA LYS A 22 17.908 1.631 -0.567 1.00 0.00 C ATOM 333 C LYS A 22 17.754 2.957 -1.319 1.00 0.00 C ATOM 334 O LYS A 22 18.708 3.714 -1.482 1.00 0.00 O ATOM 335 CB LYS A 22 17.908 0.462 -1.552 1.00 0.00 C ATOM 336 CG LYS A 22 18.428 -0.849 -0.957 1.00 0.00 C ATOM 337 CD LYS A 22 19.915 -0.801 -0.624 1.00 0.00 C ATOM 338 CE LYS A 22 20.815 -0.673 -1.852 1.00 0.00 C ATOM 339 NZ LYS A 22 20.916 0.709 -2.372 1.00 0.00 N ATOM 0 H LYS A 22 16.125 0.817 0.187 1.00 0.00 H new ATOM 0 HA LYS A 22 18.860 1.595 -0.037 1.00 0.00 H new ATOM 0 HB2 LYS A 22 16.893 0.307 -1.917 1.00 0.00 H new ATOM 0 HB3 LYS A 22 18.520 0.726 -2.415 1.00 0.00 H new ATOM 0 HG2 LYS A 22 17.866 -1.080 -0.052 1.00 0.00 H new ATOM 0 HG3 LYS A 22 18.245 -1.660 -1.662 1.00 0.00 H new ATOM 0 HD2 LYS A 22 20.102 0.041 0.042 1.00 0.00 H new ATOM 0 HD3 LYS A 22 20.186 -1.705 -0.079 1.00 0.00 H new ATOM 0 HE2 LYS A 22 21.813 -1.031 -1.599 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.434 -1.322 -2.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 20.435 0.770 -3.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 20.467 1.366 -1.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 21.918 0.964 -2.488 1.00 0.00 H new ATOM 353 N MET A 23 16.529 3.208 -1.776 1.00 0.00 N ATOM 354 CA MET A 23 16.197 4.467 -2.451 1.00 0.00 C ATOM 355 C MET A 23 16.227 5.621 -1.459 1.00 0.00 C ATOM 356 O MET A 23 16.396 6.778 -1.841 1.00 0.00 O ATOM 357 CB MET A 23 14.813 4.368 -3.097 1.00 0.00 C ATOM 358 CG MET A 23 14.692 3.258 -4.144 1.00 0.00 C ATOM 359 SD MET A 23 13.074 3.243 -4.939 1.00 0.00 S ATOM 360 CE MET A 23 12.020 2.851 -3.559 1.00 0.00 C ATOM 0 H MET A 23 15.748 2.558 -1.693 1.00 0.00 H new ATOM 0 HA MET A 23 16.938 4.653 -3.228 1.00 0.00 H new ATOM 0 HB2 MET A 23 14.071 4.200 -2.317 1.00 0.00 H new ATOM 0 HB3 MET A 23 14.573 5.323 -3.565 1.00 0.00 H new ATOM 0 HG2 MET A 23 15.465 3.389 -4.901 1.00 0.00 H new ATOM 0 HG3 MET A 23 14.871 2.293 -3.670 1.00 0.00 H new ATOM 0 HE1 MET A 23 11.245 2.154 -3.879 1.00 0.00 H new ATOM 0 HE2 MET A 23 12.613 2.395 -2.766 1.00 0.00 H new ATOM 0 HE3 MET A 23 11.555 3.763 -3.185 1.00 0.00 H new ATOM 370 N GLY A 24 16.073 5.296 -0.184 1.00 0.00 N ATOM 371 CA GLY A 24 16.100 6.319 0.869 1.00 0.00 C ATOM 372 C GLY A 24 14.725 6.791 1.256 1.00 0.00 C ATOM 373 O GLY A 24 14.585 7.783 1.978 1.00 0.00 O ATOM 0 H GLY A 24 15.929 4.344 0.152 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.602 5.916 1.749 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.689 7.170 0.528 1.00 0.00 H new ATOM 377 N VAL A 25 13.689 6.102 0.787 1.00 0.00 N ATOM 378 CA VAL A 25 12.311 6.459 1.118 1.00 0.00 C ATOM 379 C VAL A 25 11.892 5.745 2.395 1.00 0.00 C ATOM 380 O VAL A 25 12.218 4.570 2.593 1.00 0.00 O ATOM 381 CB VAL A 25 11.333 6.048 -0.017 1.00 0.00 C ATOM 382 CG1 VAL A 25 9.933 6.635 0.220 1.00 0.00 C ATOM 383 CG2 VAL A 25 11.894 6.423 -1.388 1.00 0.00 C ATOM 0 H VAL A 25 13.777 5.291 0.175 1.00 0.00 H new ATOM 0 HA VAL A 25 12.269 7.540 1.248 1.00 0.00 H new ATOM 0 HB VAL A 25 11.229 4.963 -0.002 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.269 6.331 -0.590 1.00 0.00 H new ATOM 0 HG12 VAL A 25 9.540 6.268 1.168 1.00 0.00 H new ATOM 0 HG13 VAL A 25 9.995 7.723 0.250 1.00 0.00 H new ATOM 0 HG21 VAL A 25 11.189 6.124 -2.164 1.00 0.00 H new ATOM 0 HG22 VAL A 25 12.050 7.501 -1.435 1.00 0.00 H new ATOM 0 HG23 VAL A 25 12.844 5.912 -1.544 1.00 0.00 H new ATOM 393 N THR A 26 11.196 6.458 3.273 1.00 0.00 N ATOM 394 CA THR A 26 10.726 5.883 4.514 1.00 0.00 C ATOM 395 C THR A 26 9.581 4.892 4.255 1.00 0.00 C ATOM 396 O THR A 26 8.716 5.157 3.411 1.00 0.00 O ATOM 397 CB THR A 26 10.231 7.019 5.444 1.00 0.00 C ATOM 398 OG1 THR A 26 11.287 7.946 5.680 1.00 0.00 O ATOM 399 CG2 THR A 26 9.694 6.488 6.750 1.00 0.00 C ATOM 0 H THR A 26 10.947 7.438 3.142 1.00 0.00 H new ATOM 0 HA THR A 26 11.547 5.344 4.987 1.00 0.00 H new ATOM 0 HB THR A 26 9.408 7.527 4.941 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.255 8.657 5.006 1.00 0.00 H new ATOM 0 HG21 THR A 26 9.358 7.319 7.370 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.855 5.820 6.554 1.00 0.00 H new ATOM 0 HG23 THR A 26 10.480 5.941 7.271 1.00 0.00 H new ATOM 407 N PRO A 27 9.542 3.742 4.957 1.00 0.00 N ATOM 408 CA PRO A 27 8.458 2.756 4.823 1.00 0.00 C ATOM 409 C PRO A 27 7.093 3.426 4.966 1.00 0.00 C ATOM 410 O PRO A 27 6.184 3.169 4.186 1.00 0.00 O ATOM 411 CB PRO A 27 8.718 1.745 5.959 1.00 0.00 C ATOM 412 CG PRO A 27 9.763 2.375 6.826 1.00 0.00 C ATOM 413 CD PRO A 27 10.563 3.275 5.924 1.00 0.00 C ATOM 0 HA PRO A 27 8.446 2.275 3.845 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.807 1.547 6.524 1.00 0.00 H new ATOM 0 HB3 PRO A 27 9.061 0.789 5.563 1.00 0.00 H new ATOM 0 HG2 PRO A 27 9.307 2.942 7.638 1.00 0.00 H new ATOM 0 HG3 PRO A 27 10.398 1.617 7.284 1.00 0.00 H new ATOM 0 HD2 PRO A 27 11.013 4.103 6.471 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.375 2.740 5.431 1.00 0.00 H new ATOM 421 N SER A 28 6.973 4.295 5.965 1.00 0.00 N ATOM 422 CA SER A 28 5.735 5.041 6.199 1.00 0.00 C ATOM 423 C SER A 28 5.342 5.864 4.980 1.00 0.00 C ATOM 424 O SER A 28 4.153 6.045 4.698 1.00 0.00 O ATOM 425 CB SER A 28 5.930 5.946 7.422 1.00 0.00 C ATOM 426 OG SER A 28 6.515 5.233 8.494 1.00 0.00 O ATOM 0 H SER A 28 7.719 4.502 6.629 1.00 0.00 H new ATOM 0 HA SER A 28 4.924 4.336 6.384 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.563 6.792 7.155 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.968 6.354 7.734 1.00 0.00 H new ATOM 0 HG SER A 28 6.631 5.832 9.261 1.00 0.00 H new ATOM 432 N GLU A 29 6.343 6.318 4.233 1.00 0.00 N ATOM 433 CA GLU A 29 6.109 7.146 3.061 1.00 0.00 C ATOM 434 C GLU A 29 5.643 6.282 1.897 1.00 0.00 C ATOM 435 O GLU A 29 4.667 6.605 1.219 1.00 0.00 O ATOM 436 CB GLU A 29 7.387 7.881 2.658 1.00 0.00 C ATOM 437 CG GLU A 29 7.804 9.012 3.588 1.00 0.00 C ATOM 438 CD GLU A 29 9.022 9.748 3.049 1.00 0.00 C ATOM 439 OE1 GLU A 29 10.163 9.310 3.315 1.00 0.00 O ATOM 440 OE2 GLU A 29 8.843 10.736 2.312 1.00 0.00 O ATOM 0 H GLU A 29 7.327 6.124 4.421 1.00 0.00 H new ATOM 0 HA GLU A 29 5.339 7.877 3.308 1.00 0.00 H new ATOM 0 HB2 GLU A 29 8.201 7.158 2.603 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.253 8.287 1.655 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.977 9.712 3.708 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.027 8.610 4.576 1.00 0.00 H new ATOM 447 N ALA A 30 6.347 5.180 1.652 1.00 0.00 N ATOM 448 CA ALA A 30 5.974 4.248 0.580 1.00 0.00 C ATOM 449 C ALA A 30 4.575 3.708 0.781 1.00 0.00 C ATOM 450 O ALA A 30 3.805 3.564 -0.183 1.00 0.00 O ATOM 451 CB ALA A 30 6.994 3.105 0.512 1.00 0.00 C ATOM 0 H ALA A 30 7.178 4.907 2.177 1.00 0.00 H new ATOM 0 HA ALA A 30 5.980 4.789 -0.366 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.715 2.415 -0.284 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.984 3.513 0.308 1.00 0.00 H new ATOM 0 HB3 ALA A 30 7.009 2.574 1.464 1.00 0.00 H new ATOM 457 N LEU A 31 4.229 3.427 2.021 1.00 0.00 N ATOM 458 CA LEU A 31 2.888 2.940 2.349 1.00 0.00 C ATOM 459 C LEU A 31 1.867 4.058 2.171 1.00 0.00 C ATOM 460 O LEU A 31 0.701 3.802 1.837 1.00 0.00 O ATOM 461 CB LEU A 31 2.867 2.390 3.772 1.00 0.00 C ATOM 462 CG LEU A 31 3.751 1.137 3.995 1.00 0.00 C ATOM 463 CD1 LEU A 31 3.775 0.730 5.461 1.00 0.00 C ATOM 464 CD2 LEU A 31 3.270 -0.014 3.117 1.00 0.00 C ATOM 0 H LEU A 31 4.851 3.525 2.823 1.00 0.00 H new ATOM 0 HA LEU A 31 2.621 2.130 1.670 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.193 3.174 4.455 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.839 2.144 4.037 1.00 0.00 H new ATOM 0 HG LEU A 31 4.772 1.388 3.709 1.00 0.00 H new ATOM 0 HD11 LEU A 31 4.404 -0.152 5.584 1.00 0.00 H new ATOM 0 HD12 LEU A 31 4.177 1.548 6.059 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.762 0.502 5.792 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.900 -0.887 3.284 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.238 -0.258 3.370 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.327 0.279 2.069 1.00 0.00 H new ATOM 476 N ARG A 32 2.301 5.298 2.379 1.00 0.00 N ATOM 477 CA ARG A 32 1.427 6.451 2.248 1.00 0.00 C ATOM 478 C ARG A 32 1.028 6.652 0.789 1.00 0.00 C ATOM 479 O ARG A 32 -0.146 6.856 0.487 1.00 0.00 O ATOM 480 CB ARG A 32 2.078 7.728 2.771 1.00 0.00 C ATOM 481 CG ARG A 32 1.068 8.876 2.888 1.00 0.00 C ATOM 482 CD ARG A 32 1.728 10.246 2.855 1.00 0.00 C ATOM 483 NE ARG A 32 0.730 11.315 2.952 1.00 0.00 N ATOM 484 CZ ARG A 32 0.031 11.794 1.913 1.00 0.00 C ATOM 485 NH1 ARG A 32 0.309 11.399 0.677 1.00 0.00 N ATOM 486 NH2 ARG A 32 -0.910 12.703 2.115 1.00 0.00 N ATOM 0 H ARG A 32 3.260 5.527 2.641 1.00 0.00 H new ATOM 0 HA ARG A 32 0.542 6.249 2.852 1.00 0.00 H new ATOM 0 HB2 ARG A 32 2.524 7.535 3.747 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.888 8.023 2.103 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.348 8.805 2.073 1.00 0.00 H new ATOM 0 HG3 ARG A 32 0.509 8.769 3.818 1.00 0.00 H new ATOM 0 HD2 ARG A 32 2.438 10.331 3.678 1.00 0.00 H new ATOM 0 HD3 ARG A 32 2.296 10.357 1.931 1.00 0.00 H new ATOM 0 HE ARG A 32 0.556 11.722 3.871 1.00 0.00 H new ATOM 0 HH11 ARG A 32 1.058 10.727 0.513 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -0.227 11.767 -0.109 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.102 13.037 3.059 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -1.443 13.069 1.326 1.00 0.00 H new ATOM 500 N LEU A 33 1.996 6.586 -0.120 1.00 0.00 N ATOM 501 CA LEU A 33 1.742 6.806 -1.547 1.00 0.00 C ATOM 502 C LEU A 33 0.907 5.663 -2.108 1.00 0.00 C ATOM 503 O LEU A 33 0.239 5.817 -3.135 1.00 0.00 O ATOM 504 CB LEU A 33 3.028 6.990 -2.336 1.00 0.00 C ATOM 505 CG LEU A 33 4.130 5.949 -2.120 1.00 0.00 C ATOM 506 CD1 LEU A 33 4.145 4.913 -3.237 1.00 0.00 C ATOM 507 CD2 LEU A 33 5.466 6.653 -1.984 1.00 0.00 C ATOM 0 H LEU A 33 2.970 6.381 0.104 1.00 0.00 H new ATOM 0 HA LEU A 33 1.181 7.735 -1.649 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.776 7.002 -3.396 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.437 7.971 -2.094 1.00 0.00 H new ATOM 0 HG LEU A 33 3.929 5.404 -1.198 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.939 4.190 -3.052 1.00 0.00 H new ATOM 0 HD12 LEU A 33 3.185 4.398 -3.268 1.00 0.00 H new ATOM 0 HD13 LEU A 33 4.322 5.409 -4.191 1.00 0.00 H new ATOM 0 HD21 LEU A 33 6.253 5.914 -1.830 1.00 0.00 H new ATOM 0 HD22 LEU A 33 5.673 7.219 -2.892 1.00 0.00 H new ATOM 0 HD23 LEU A 33 5.434 7.332 -1.132 1.00 0.00 H new ATOM 519 N MET A 34 0.960 4.520 -1.443 1.00 0.00 N ATOM 520 CA MET A 34 0.110 3.387 -1.814 1.00 0.00 C ATOM 521 C MET A 34 -1.363 3.761 -1.594 1.00 0.00 C ATOM 522 O MET A 34 -2.205 3.535 -2.468 1.00 0.00 O ATOM 523 CB MET A 34 0.445 2.132 -1.003 1.00 0.00 C ATOM 524 CG MET A 34 -0.580 1.022 -1.226 1.00 0.00 C ATOM 525 SD MET A 34 -0.741 -0.094 0.167 1.00 0.00 S ATOM 526 CE MET A 34 -2.445 -0.602 -0.049 1.00 0.00 C ATOM 0 H MET A 34 1.576 4.347 -0.649 1.00 0.00 H new ATOM 0 HA MET A 34 0.292 3.163 -2.865 1.00 0.00 H new ATOM 0 HB2 MET A 34 1.436 1.773 -1.282 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.483 2.384 0.057 1.00 0.00 H new ATOM 0 HG2 MET A 34 -1.551 1.472 -1.435 1.00 0.00 H new ATOM 0 HG3 MET A 34 -0.297 0.449 -2.109 1.00 0.00 H new ATOM 0 HE1 MET A 34 -2.778 -1.144 0.836 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.072 0.278 -0.192 1.00 0.00 H new ATOM 0 HE3 MET A 34 -2.524 -1.250 -0.922 1.00 0.00 H new ATOM 536 N LEU A 35 -1.646 4.314 -0.414 1.00 0.00 N ATOM 537 CA LEU A 35 -3.023 4.707 -0.064 1.00 0.00 C ATOM 538 C LEU A 35 -3.536 5.713 -1.072 1.00 0.00 C ATOM 539 O LEU A 35 -4.745 5.765 -1.368 1.00 0.00 O ATOM 540 CB LEU A 35 -3.074 5.267 1.367 1.00 0.00 C ATOM 541 CG LEU A 35 -2.692 4.269 2.473 1.00 0.00 C ATOM 542 CD1 LEU A 35 -2.881 4.896 3.856 1.00 0.00 C ATOM 543 CD2 LEU A 35 -3.500 2.983 2.360 1.00 0.00 C ATOM 0 H LEU A 35 -0.954 4.501 0.312 1.00 0.00 H new ATOM 0 HA LEU A 35 -3.670 3.830 -0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.406 6.126 1.428 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.082 5.633 1.562 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.639 4.019 2.344 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.605 4.173 4.624 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.248 5.779 3.945 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -3.925 5.183 3.986 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.207 2.298 3.156 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.562 3.211 2.451 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.310 2.518 1.393 1.00 0.00 H new ATOM 555 N GLU A 36 -2.609 6.510 -1.620 1.00 0.00 N ATOM 556 CA GLU A 36 -2.935 7.463 -2.667 1.00 0.00 C ATOM 557 C GLU A 36 -3.462 6.745 -3.917 1.00 0.00 C ATOM 558 O GLU A 36 -4.534 7.090 -4.426 1.00 0.00 O ATOM 559 CB GLU A 36 -1.684 8.292 -3.004 1.00 0.00 C ATOM 560 CG GLU A 36 -1.111 9.105 -1.834 1.00 0.00 C ATOM 561 CD GLU A 36 -1.690 10.509 -1.745 1.00 0.00 C ATOM 562 OE1 GLU A 36 -2.925 10.643 -1.588 1.00 0.00 O ATOM 563 OE2 GLU A 36 -0.918 11.487 -1.821 1.00 0.00 O ATOM 0 H GLU A 36 -1.626 6.507 -1.348 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.723 8.127 -2.312 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -0.910 7.620 -3.374 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -1.928 8.976 -3.817 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.308 8.577 -0.901 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -0.028 9.171 -1.940 1.00 0.00 H new ATOM 570 N TYR A 37 -2.740 5.730 -4.400 1.00 0.00 N ATOM 571 CA TYR A 37 -3.098 5.072 -5.661 1.00 0.00 C ATOM 572 C TYR A 37 -4.352 4.209 -5.520 1.00 0.00 C ATOM 573 O TYR A 37 -5.126 4.082 -6.470 1.00 0.00 O ATOM 574 CB TYR A 37 -1.906 4.259 -6.225 1.00 0.00 C ATOM 575 CG TYR A 37 -1.749 2.803 -5.751 1.00 0.00 C ATOM 576 CD1 TYR A 37 -2.656 1.809 -6.136 1.00 0.00 C ATOM 577 CD2 TYR A 37 -0.688 2.425 -4.934 1.00 0.00 C ATOM 578 CE1 TYR A 37 -2.505 0.509 -5.709 1.00 0.00 C ATOM 579 CE2 TYR A 37 -0.532 1.124 -4.513 1.00 0.00 C ATOM 580 CZ TYR A 37 -1.444 0.171 -4.898 1.00 0.00 C ATOM 581 OH TYR A 37 -1.294 -1.141 -4.481 1.00 0.00 O ATOM 0 H TYR A 37 -1.912 5.348 -3.943 1.00 0.00 H new ATOM 0 HA TYR A 37 -3.334 5.856 -6.380 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -1.989 4.251 -7.312 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -0.988 4.793 -5.979 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -3.486 2.066 -6.777 1.00 0.00 H new ATOM 0 HD2 TYR A 37 0.030 3.170 -4.623 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.217 -0.245 -6.009 1.00 0.00 H new ATOM 0 HE2 TYR A 37 0.303 0.854 -3.883 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.497 -1.216 -3.916 1.00 0.00 H new ATOM 591 N ILE A 38 -4.570 3.605 -4.349 1.00 0.00 N ATOM 592 CA ILE A 38 -5.759 2.751 -4.149 1.00 0.00 C ATOM 593 C ILE A 38 -7.028 3.598 -4.137 1.00 0.00 C ATOM 594 O ILE A 38 -8.048 3.215 -4.721 1.00 0.00 O ATOM 595 CB ILE A 38 -5.653 1.870 -2.868 1.00 0.00 C ATOM 596 CG1 ILE A 38 -7.007 1.219 -2.503 1.00 0.00 C ATOM 597 CG2 ILE A 38 -5.136 2.689 -1.692 1.00 0.00 C ATOM 598 CD1 ILE A 38 -7.593 0.323 -3.580 1.00 0.00 C ATOM 0 H ILE A 38 -3.958 3.684 -3.537 1.00 0.00 H new ATOM 0 HA ILE A 38 -5.809 2.062 -4.992 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.945 1.071 -3.086 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -6.879 0.633 -1.593 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -7.724 2.008 -2.276 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.070 2.055 -0.808 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.148 3.084 -1.930 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.820 3.515 -1.495 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.541 -0.088 -3.235 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.758 0.905 -4.487 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -6.900 -0.491 -3.793 1.00 0.00 H new ATOM 610 N ALA A 39 -6.969 4.767 -3.495 1.00 0.00 N ATOM 611 CA ALA A 39 -8.118 5.659 -3.415 1.00 0.00 C ATOM 612 C ALA A 39 -8.479 6.200 -4.819 1.00 0.00 C ATOM 613 O ALA A 39 -9.642 6.487 -5.102 1.00 0.00 O ATOM 614 CB ALA A 39 -7.828 6.816 -2.469 1.00 0.00 C ATOM 0 H ALA A 39 -6.134 5.115 -3.023 1.00 0.00 H new ATOM 0 HA ALA A 39 -8.966 5.094 -3.028 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -8.696 7.473 -2.421 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -7.611 6.427 -1.474 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.968 7.378 -2.834 1.00 0.00 H new ATOM 620 N ASP A 40 -7.448 6.339 -5.650 1.00 0.00 N ATOM 621 CA ASP A 40 -7.625 6.855 -7.007 1.00 0.00 C ATOM 622 C ASP A 40 -8.159 5.772 -7.960 1.00 0.00 C ATOM 623 O ASP A 40 -9.242 5.906 -8.527 1.00 0.00 O ATOM 624 CB ASP A 40 -6.275 7.370 -7.533 1.00 0.00 C ATOM 625 CG ASP A 40 -6.337 7.852 -8.976 1.00 0.00 C ATOM 626 OD1 ASP A 40 -6.798 8.990 -9.206 1.00 0.00 O ATOM 627 OD2 ASP A 40 -5.913 7.105 -9.883 1.00 0.00 O ATOM 0 H ASP A 40 -6.485 6.103 -5.410 1.00 0.00 H new ATOM 0 HA ASP A 40 -8.355 7.664 -6.969 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -5.933 8.188 -6.898 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -5.534 6.574 -7.454 1.00 0.00 H new ATOM 632 N ASN A 41 -7.378 4.707 -8.124 1.00 0.00 N ATOM 633 CA ASN A 41 -7.717 3.636 -9.072 1.00 0.00 C ATOM 634 C ASN A 41 -8.871 2.788 -8.556 1.00 0.00 C ATOM 635 O ASN A 41 -9.687 2.300 -9.347 1.00 0.00 O ATOM 636 CB ASN A 41 -6.493 2.756 -9.307 1.00 0.00 C ATOM 637 CG ASN A 41 -5.361 3.484 -10.013 1.00 0.00 C ATOM 638 OD1 ASN A 41 -5.263 3.487 -11.242 1.00 0.00 O ATOM 639 ND2 ASN A 41 -4.491 4.099 -9.233 1.00 0.00 N ATOM 0 H ASN A 41 -6.506 4.558 -7.616 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.028 4.094 -10.011 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.134 2.381 -8.349 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -6.785 1.889 -9.900 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -3.703 4.600 -9.644 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -4.607 4.073 -8.220 1.00 0.00 H new ATOM 646 N GLU A 42 -8.926 2.609 -7.240 1.00 0.00 N ATOM 647 CA GLU A 42 -9.977 1.812 -6.594 1.00 0.00 C ATOM 648 C GLU A 42 -10.045 0.391 -7.186 1.00 0.00 C ATOM 649 O GLU A 42 -11.123 -0.150 -7.366 1.00 0.00 O ATOM 650 CB GLU A 42 -11.347 2.503 -6.732 1.00 0.00 C ATOM 651 CG GLU A 42 -11.372 3.920 -6.157 1.00 0.00 C ATOM 652 CD GLU A 42 -12.766 4.533 -6.186 1.00 0.00 C ATOM 653 OE1 GLU A 42 -13.530 4.312 -5.236 1.00 0.00 O ATOM 654 OE2 GLU A 42 -13.091 5.223 -7.171 1.00 0.00 O ATOM 0 H GLU A 42 -8.249 3.008 -6.589 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.725 1.732 -5.537 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.622 2.541 -7.786 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.102 1.900 -6.227 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.008 3.899 -5.130 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.688 4.552 -6.724 1.00 0.00 H new ATOM 661 N ARG A 43 -8.875 -0.207 -7.477 1.00 0.00 N ATOM 662 CA ARG A 43 -8.834 -1.560 -8.039 1.00 0.00 C ATOM 663 C ARG A 43 -7.601 -2.345 -7.593 1.00 0.00 C ATOM 664 O ARG A 43 -7.680 -3.568 -7.404 1.00 0.00 O ATOM 665 CB ARG A 43 -8.899 -1.546 -9.573 1.00 0.00 C ATOM 666 CG ARG A 43 -7.753 -0.786 -10.235 1.00 0.00 C ATOM 667 CD ARG A 43 -7.762 -1.005 -11.737 1.00 0.00 C ATOM 668 NE ARG A 43 -7.667 -2.415 -12.068 1.00 0.00 N ATOM 669 CZ ARG A 43 -6.542 -3.030 -12.370 1.00 0.00 C ATOM 670 NH1 ARG A 43 -5.393 -2.349 -12.445 1.00 0.00 N ATOM 671 NH2 ARG A 43 -6.539 -4.326 -12.589 1.00 0.00 N ATOM 0 H ARG A 43 -7.961 0.222 -7.333 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.719 -2.063 -7.650 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.898 -2.574 -9.936 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.844 -1.100 -9.883 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -7.842 0.278 -10.017 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -6.802 -1.118 -9.820 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -8.677 -0.591 -12.161 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -6.929 -0.467 -12.190 1.00 0.00 H new ATOM 0 HE ARG A 43 -8.526 -2.965 -12.067 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -5.383 -1.345 -12.268 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -4.527 -2.834 -12.680 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -7.408 -4.856 -12.525 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -5.668 -4.802 -12.823 1.00 0.00 H new ATOM 685 N LEU A 44 -6.460 -1.658 -7.437 1.00 0.00 N ATOM 686 CA LEU A 44 -5.178 -2.302 -7.071 1.00 0.00 C ATOM 687 C LEU A 44 -4.601 -3.075 -8.265 1.00 0.00 C ATOM 688 O LEU A 44 -5.333 -3.593 -9.105 1.00 0.00 O ATOM 689 CB LEU A 44 -5.333 -3.249 -5.861 1.00 0.00 C ATOM 690 CG LEU A 44 -5.762 -2.584 -4.535 1.00 0.00 C ATOM 691 CD1 LEU A 44 -6.117 -3.642 -3.488 1.00 0.00 C ATOM 692 CD2 LEU A 44 -4.666 -1.643 -4.028 1.00 0.00 C ATOM 0 H LEU A 44 -6.393 -0.647 -7.559 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.489 -1.506 -6.789 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -6.066 -4.015 -6.115 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.383 -3.759 -5.699 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.656 -1.988 -4.719 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.416 -3.151 -2.562 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.939 -4.256 -3.855 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.249 -4.273 -3.300 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.985 -1.183 -3.093 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.750 -2.209 -3.860 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.482 -0.866 -4.770 1.00 0.00 H new ATOM 704 N PRO A 45 -3.256 -3.160 -8.352 1.00 0.00 N ATOM 705 CA PRO A 45 -2.584 -3.921 -9.422 1.00 0.00 C ATOM 706 C PRO A 45 -2.790 -5.426 -9.264 1.00 0.00 C ATOM 707 O PRO A 45 -3.148 -6.120 -10.212 1.00 0.00 O ATOM 708 CB PRO A 45 -1.102 -3.540 -9.240 1.00 0.00 C ATOM 709 CG PRO A 45 -0.985 -3.144 -7.806 1.00 0.00 C ATOM 710 CD PRO A 45 -2.295 -2.494 -7.464 1.00 0.00 C ATOM 0 HA PRO A 45 -2.973 -3.688 -10.413 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -0.446 -4.379 -9.474 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -0.820 -2.721 -9.901 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -0.800 -4.012 -7.173 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -0.153 -2.456 -7.655 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.552 -2.639 -6.415 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.266 -1.419 -7.639 1.00 0.00 H new ATOM 718 N PHE A 46 -2.563 -5.919 -8.039 1.00 0.00 N ATOM 719 CA PHE A 46 -2.647 -7.360 -7.759 1.00 0.00 C ATOM 720 C PHE A 46 -4.004 -7.724 -7.158 1.00 0.00 C ATOM 721 O PHE A 46 -4.617 -8.719 -7.543 1.00 0.00 O ATOM 722 CB PHE A 46 -1.519 -7.782 -6.805 1.00 0.00 C ATOM 723 CG PHE A 46 -0.136 -7.507 -7.346 1.00 0.00 C ATOM 724 CD1 PHE A 46 0.529 -8.451 -8.126 1.00 0.00 C ATOM 725 CD2 PHE A 46 0.498 -6.300 -7.085 1.00 0.00 C ATOM 726 CE1 PHE A 46 1.792 -8.195 -8.623 1.00 0.00 C ATOM 727 CE2 PHE A 46 1.757 -6.039 -7.577 1.00 0.00 C ATOM 728 CZ PHE A 46 2.406 -6.993 -8.342 1.00 0.00 C ATOM 0 H PHE A 46 -2.321 -5.346 -7.230 1.00 0.00 H new ATOM 0 HA PHE A 46 -2.536 -7.895 -8.702 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.640 -7.257 -5.857 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.612 -8.847 -6.594 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.051 -9.394 -8.345 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.004 -5.554 -6.487 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.296 -8.933 -9.229 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.236 -5.094 -7.367 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.398 -6.795 -8.720 1.00 0.00 H new ATOM 738 N LYS A 47 -4.447 -6.896 -6.203 1.00 0.00 N ATOM 739 CA LYS A 47 -5.707 -7.088 -5.464 1.00 0.00 C ATOM 740 C LYS A 47 -5.965 -8.554 -5.129 1.00 0.00 C ATOM 741 O LYS A 47 -7.093 -9.049 -5.228 1.00 0.00 O ATOM 742 CB LYS A 47 -6.903 -6.481 -6.214 1.00 0.00 C ATOM 743 CG LYS A 47 -7.218 -7.130 -7.572 1.00 0.00 C ATOM 744 CD LYS A 47 -8.552 -6.653 -8.121 1.00 0.00 C ATOM 745 CE LYS A 47 -9.716 -6.975 -7.191 1.00 0.00 C ATOM 746 NZ LYS A 47 -9.731 -8.404 -6.784 1.00 0.00 N ATOM 0 H LYS A 47 -3.935 -6.062 -5.916 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.594 -6.554 -4.520 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.786 -6.556 -5.579 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.713 -5.419 -6.371 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.426 -6.893 -8.282 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -7.235 -8.214 -7.463 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -8.509 -5.576 -8.285 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -8.728 -7.116 -9.092 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -9.653 -6.347 -6.303 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -10.655 -6.731 -7.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -10.601 -8.604 -6.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -9.697 -9.007 -7.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -8.905 -8.603 -6.185 1.00 0.00 H new ATOM 760 N GLN A 48 -4.891 -9.257 -4.746 1.00 0.00 N ATOM 761 CA GLN A 48 -4.999 -10.618 -4.230 1.00 0.00 C ATOM 762 C GLN A 48 -5.884 -10.684 -2.985 1.00 0.00 C ATOM 763 O GLN A 48 -6.526 -9.704 -2.617 1.00 0.00 O ATOM 764 CB GLN A 48 -3.589 -11.152 -3.898 1.00 0.00 C ATOM 765 CG GLN A 48 -2.673 -10.128 -3.189 1.00 0.00 C ATOM 766 CD GLN A 48 -3.269 -9.565 -1.909 1.00 0.00 C ATOM 767 OE1 GLN A 48 -4.061 -8.515 -2.055 1.00 0.00 O flip ATOM 768 NE2 GLN A 48 -3.060 -10.077 -0.823 1.00 0.00 N flip ATOM 0 H GLN A 48 -3.937 -8.900 -4.786 1.00 0.00 H new ATOM 0 HA GLN A 48 -5.463 -11.236 -4.998 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -3.687 -12.034 -3.265 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -3.108 -11.474 -4.822 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -1.720 -10.604 -2.958 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -2.461 -9.307 -3.874 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -2.443 -10.886 -0.751 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -3.502 -9.697 0.014 1.00 0.00 H new ATOM 777 N THR A 49 -5.908 -11.827 -2.323 1.00 0.00 N ATOM 778 CA THR A 49 -6.658 -12.002 -1.092 1.00 0.00 C ATOM 779 C THR A 49 -6.139 -13.212 -0.326 1.00 0.00 C ATOM 780 O THR A 49 -6.866 -13.838 0.450 1.00 0.00 O ATOM 781 CB THR A 49 -8.173 -12.142 -1.400 1.00 0.00 C ATOM 782 OG1 THR A 49 -8.932 -12.206 -0.183 1.00 0.00 O ATOM 783 CG2 THR A 49 -8.447 -13.393 -2.231 1.00 0.00 C ATOM 0 H THR A 49 -5.406 -12.662 -2.625 1.00 0.00 H new ATOM 0 HA THR A 49 -6.521 -11.121 -0.465 1.00 0.00 H new ATOM 0 HB THR A 49 -8.477 -11.264 -1.969 1.00 0.00 H new ATOM 0 HG1 THR A 49 -8.521 -12.856 0.425 1.00 0.00 H new ATOM 0 HG21 THR A 49 -9.515 -13.469 -2.433 1.00 0.00 H new ATOM 0 HG22 THR A 49 -7.903 -13.330 -3.173 1.00 0.00 H new ATOM 0 HG23 THR A 49 -8.119 -14.275 -1.680 1.00 0.00 H new ATOM 791 N LEU A 50 -4.852 -13.521 -0.526 1.00 0.00 N ATOM 792 CA LEU A 50 -4.198 -14.671 0.097 1.00 0.00 C ATOM 793 C LEU A 50 -4.963 -15.959 -0.227 1.00 0.00 C ATOM 794 O LEU A 50 -5.586 -16.555 0.683 1.00 0.00 O ATOM 795 CB LEU A 50 -4.059 -14.477 1.615 1.00 0.00 C ATOM 796 CG LEU A 50 -3.036 -13.409 2.060 1.00 0.00 C ATOM 797 CD1 LEU A 50 -1.664 -13.694 1.444 1.00 0.00 C ATOM 798 CD2 LEU A 50 -3.509 -11.993 1.739 1.00 0.00 C ATOM 799 OXT LEU A 50 -4.976 -16.346 -1.417 1.00 0.00 O ATOM 0 H LEU A 50 -4.235 -12.976 -1.128 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.192 -14.756 -0.315 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.035 -14.210 2.020 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.779 -15.431 2.061 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.945 -13.469 3.145 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.955 -12.932 1.767 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.316 -14.675 1.768 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.743 -13.678 0.357 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.758 -11.275 2.069 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.657 -11.894 0.664 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.449 -11.798 2.254 1.00 0.00 H new TER 811 LEU A 50 ATOM 812 N MET B 101 4.256 -14.457 10.525 1.00 0.00 N ATOM 813 CA MET B 101 3.937 -13.103 10.011 1.00 0.00 C ATOM 814 C MET B 101 3.732 -12.139 11.186 1.00 0.00 C ATOM 815 O MET B 101 3.151 -12.514 12.210 1.00 0.00 O ATOM 816 CB MET B 101 2.677 -13.155 9.128 1.00 0.00 C ATOM 817 CG MET B 101 1.381 -13.445 9.876 1.00 0.00 C ATOM 818 SD MET B 101 -0.027 -13.618 8.763 1.00 0.00 S ATOM 819 CE MET B 101 0.121 -12.126 7.788 1.00 0.00 C ATOM 0 HA MET B 101 4.768 -12.744 9.403 1.00 0.00 H new ATOM 0 HB2 MET B 101 2.575 -12.202 8.610 1.00 0.00 H new ATOM 0 HB3 MET B 101 2.818 -13.920 8.364 1.00 0.00 H new ATOM 0 HG2 MET B 101 1.496 -14.360 10.457 1.00 0.00 H new ATOM 0 HG3 MET B 101 1.185 -12.640 10.584 1.00 0.00 H new ATOM 0 HE1 MET B 101 -0.831 -11.913 7.302 1.00 0.00 H new ATOM 0 HE2 MET B 101 0.391 -11.293 8.437 1.00 0.00 H new ATOM 0 HE3 MET B 101 0.893 -12.261 7.031 1.00 0.00 H new ATOM 829 N GLY B 102 4.206 -10.899 11.012 1.00 0.00 N ATOM 830 CA GLY B 102 4.200 -9.943 12.100 1.00 0.00 C ATOM 831 C GLY B 102 3.489 -8.665 11.729 1.00 0.00 C ATOM 832 O GLY B 102 2.937 -8.549 10.633 1.00 0.00 O ATOM 0 H GLY B 102 4.592 -10.548 10.136 1.00 0.00 H new ATOM 0 HA2 GLY B 102 3.716 -10.387 12.970 1.00 0.00 H new ATOM 0 HA3 GLY B 102 5.226 -9.716 12.388 1.00 0.00 H new ATOM 836 N SER B 103 3.483 -7.705 12.657 1.00 0.00 N ATOM 837 CA SER B 103 2.764 -6.451 12.468 1.00 0.00 C ATOM 838 C SER B 103 3.709 -5.246 12.489 1.00 0.00 C ATOM 839 O SER B 103 4.729 -5.238 13.159 1.00 0.00 O ATOM 840 CB SER B 103 1.710 -6.323 13.572 1.00 0.00 C ATOM 841 OG SER B 103 2.247 -6.610 14.845 1.00 0.00 O ATOM 0 H SER B 103 3.972 -7.777 13.549 1.00 0.00 H new ATOM 0 HA SER B 103 2.286 -6.463 11.489 1.00 0.00 H new ATOM 0 HB2 SER B 103 1.302 -5.312 13.569 1.00 0.00 H new ATOM 0 HB3 SER B 103 0.883 -7.002 13.365 1.00 0.00 H new ATOM 0 HG SER B 103 1.547 -6.517 15.524 1.00 0.00 H new ATOM 847 N ILE B 104 3.341 -4.222 11.712 1.00 0.00 N ATOM 848 CA ILE B 104 4.069 -2.958 11.684 1.00 0.00 C ATOM 849 C ILE B 104 3.102 -1.805 11.878 1.00 0.00 C ATOM 850 O ILE B 104 1.882 -1.983 11.818 1.00 0.00 O ATOM 851 CB ILE B 104 4.871 -2.758 10.367 1.00 0.00 C ATOM 852 CG1 ILE B 104 3.931 -2.575 9.150 1.00 0.00 C ATOM 853 CG2 ILE B 104 5.797 -3.946 10.141 1.00 0.00 C ATOM 854 CD1 ILE B 104 3.669 -1.126 8.759 1.00 0.00 C ATOM 0 H ILE B 104 2.534 -4.250 11.089 1.00 0.00 H new ATOM 0 HA ILE B 104 4.792 -2.984 12.499 1.00 0.00 H new ATOM 0 HB ILE B 104 5.463 -1.849 10.467 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.361 -3.096 8.294 1.00 0.00 H new ATOM 0 HG13 ILE B 104 2.978 -3.056 9.369 1.00 0.00 H new ATOM 0 HG21 ILE B 104 6.356 -3.801 9.217 1.00 0.00 H new ATOM 0 HG22 ILE B 104 6.492 -4.030 10.977 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.206 -4.859 10.068 1.00 0.00 H new ATOM 0 HD11 ILE B 104 3.001 -1.097 7.898 1.00 0.00 H new ATOM 0 HD12 ILE B 104 3.207 -0.601 9.595 1.00 0.00 H new ATOM 0 HD13 ILE B 104 4.612 -0.642 8.504 1.00 0.00 H new ATOM 866 N ASN B 105 3.651 -0.608 12.093 1.00 0.00 N ATOM 867 CA ASN B 105 2.847 0.594 12.264 1.00 0.00 C ATOM 868 C ASN B 105 2.974 1.502 11.042 1.00 0.00 C ATOM 869 O ASN B 105 4.081 1.779 10.570 1.00 0.00 O ATOM 870 CB ASN B 105 3.303 1.370 13.504 1.00 0.00 C ATOM 871 CG ASN B 105 2.379 2.546 13.811 1.00 0.00 C ATOM 872 OD1 ASN B 105 1.575 2.491 14.737 1.00 0.00 O ATOM 873 ND2 ASN B 105 2.458 3.591 13.012 1.00 0.00 N ATOM 0 H ASN B 105 4.657 -0.449 12.152 1.00 0.00 H new ATOM 0 HA ASN B 105 1.808 0.287 12.384 1.00 0.00 H new ATOM 0 HB2 ASN B 105 3.333 0.698 14.362 1.00 0.00 H new ATOM 0 HB3 ASN B 105 4.318 1.736 13.350 1.00 0.00 H new ATOM 0 HD21 ASN B 105 1.839 4.389 13.153 1.00 0.00 H new ATOM 0 HD22 ASN B 105 3.139 3.602 12.252 1.00 0.00 H new ATOM 880 N LEU B 106 1.842 1.957 10.546 1.00 0.00 N ATOM 881 CA LEU B 106 1.789 2.921 9.456 1.00 0.00 C ATOM 882 C LEU B 106 1.300 4.241 10.058 1.00 0.00 C ATOM 883 O LEU B 106 0.538 4.218 11.026 1.00 0.00 O ATOM 884 CB LEU B 106 0.812 2.421 8.374 1.00 0.00 C ATOM 885 CG LEU B 106 1.205 2.682 6.921 1.00 0.00 C ATOM 886 CD1 LEU B 106 0.012 2.527 5.990 1.00 0.00 C ATOM 887 CD2 LEU B 106 1.879 4.053 6.738 1.00 0.00 C ATOM 0 H LEU B 106 0.925 1.669 10.887 1.00 0.00 H new ATOM 0 HA LEU B 106 2.765 3.053 8.988 1.00 0.00 H new ATOM 0 HB2 LEU B 106 0.682 1.347 8.503 1.00 0.00 H new ATOM 0 HB3 LEU B 106 -0.159 2.884 8.552 1.00 0.00 H new ATOM 0 HG LEU B 106 1.943 1.926 6.652 1.00 0.00 H new ATOM 0 HD11 LEU B 106 0.324 2.719 4.963 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -0.380 1.513 6.066 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -0.765 3.238 6.272 1.00 0.00 H new ATOM 0 HD21 LEU B 106 2.140 4.193 5.689 1.00 0.00 H new ATOM 0 HD22 LEU B 106 1.192 4.840 7.049 1.00 0.00 H new ATOM 0 HD23 LEU B 106 2.783 4.098 7.346 1.00 0.00 H new ATOM 899 N ARG B 107 1.702 5.389 9.531 1.00 0.00 N ATOM 900 CA ARG B 107 1.218 6.675 10.035 1.00 0.00 C ATOM 901 C ARG B 107 0.901 7.574 8.838 1.00 0.00 C ATOM 902 O ARG B 107 1.808 8.002 8.131 1.00 0.00 O ATOM 903 CB ARG B 107 2.239 7.370 10.954 1.00 0.00 C ATOM 904 CG ARG B 107 2.443 6.646 12.289 1.00 0.00 C ATOM 905 CD ARG B 107 2.830 7.591 13.422 1.00 0.00 C ATOM 906 NE ARG B 107 3.041 6.895 14.684 1.00 0.00 N ATOM 907 CZ ARG B 107 2.681 7.389 15.876 1.00 0.00 C ATOM 908 NH1 ARG B 107 2.133 8.604 15.967 1.00 0.00 N ATOM 909 NH2 ARG B 107 2.878 6.673 16.970 1.00 0.00 N ATOM 0 H ARG B 107 2.361 5.461 8.756 1.00 0.00 H new ATOM 0 HA ARG B 107 0.326 6.493 10.635 1.00 0.00 H new ATOM 0 HB2 ARG B 107 3.196 7.439 10.436 1.00 0.00 H new ATOM 0 HB3 ARG B 107 1.907 8.390 11.149 1.00 0.00 H new ATOM 0 HG2 ARG B 107 1.525 6.122 12.557 1.00 0.00 H new ATOM 0 HG3 ARG B 107 3.219 5.890 12.172 1.00 0.00 H new ATOM 0 HD2 ARG B 107 3.740 8.126 13.150 1.00 0.00 H new ATOM 0 HD3 ARG B 107 2.047 8.339 13.550 1.00 0.00 H new ATOM 0 HE ARG B 107 3.489 5.979 14.659 1.00 0.00 H new ATOM 0 HH11 ARG B 107 1.986 9.162 15.126 1.00 0.00 H new ATOM 0 HH12 ARG B 107 1.861 8.974 16.878 1.00 0.00 H new ATOM 0 HH21 ARG B 107 3.303 5.748 16.904 1.00 0.00 H new ATOM 0 HH22 ARG B 107 2.605 7.046 17.879 1.00 0.00 H new ATOM 923 N ILE B 108 -0.376 7.823 8.599 1.00 0.00 N ATOM 924 CA ILE B 108 -0.776 8.595 7.412 1.00 0.00 C ATOM 925 C ILE B 108 -1.841 9.609 7.779 1.00 0.00 C ATOM 926 O ILE B 108 -2.401 9.588 8.878 1.00 0.00 O ATOM 927 CB ILE B 108 -1.346 7.712 6.265 1.00 0.00 C ATOM 928 CG1 ILE B 108 -2.768 7.198 6.588 1.00 0.00 C ATOM 929 CG2 ILE B 108 -0.422 6.547 5.950 1.00 0.00 C ATOM 930 CD1 ILE B 108 -2.847 6.248 7.776 1.00 0.00 C ATOM 0 H ILE B 108 -1.147 7.514 9.191 1.00 0.00 H new ATOM 0 HA ILE B 108 0.134 9.078 7.056 1.00 0.00 H new ATOM 0 HB ILE B 108 -1.411 8.347 5.382 1.00 0.00 H new ATOM 0 HG12 ILE B 108 -3.414 8.054 6.782 1.00 0.00 H new ATOM 0 HG13 ILE B 108 -3.165 6.692 5.708 1.00 0.00 H new ATOM 0 HG21 ILE B 108 -0.850 5.951 5.144 1.00 0.00 H new ATOM 0 HG22 ILE B 108 0.552 6.928 5.642 1.00 0.00 H new ATOM 0 HG23 ILE B 108 -0.304 5.926 6.838 1.00 0.00 H new ATOM 0 HD11 ILE B 108 -3.882 5.940 7.927 1.00 0.00 H new ATOM 0 HD12 ILE B 108 -2.232 5.370 7.581 1.00 0.00 H new ATOM 0 HD13 ILE B 108 -2.484 6.754 8.671 1.00 0.00 H new ATOM 942 N ASP B 109 -2.111 10.503 6.841 1.00 0.00 N ATOM 943 CA ASP B 109 -3.226 11.420 6.943 1.00 0.00 C ATOM 944 C ASP B 109 -4.520 10.633 7.133 1.00 0.00 C ATOM 945 O ASP B 109 -4.909 9.865 6.254 1.00 0.00 O ATOM 946 CB ASP B 109 -3.323 12.260 5.671 1.00 0.00 C ATOM 947 CG ASP B 109 -2.094 13.110 5.406 1.00 0.00 C ATOM 948 OD1 ASP B 109 -1.070 12.548 4.947 1.00 0.00 O ATOM 949 OD2 ASP B 109 -2.123 14.334 5.656 1.00 0.00 O ATOM 0 H ASP B 109 -1.561 10.610 5.989 1.00 0.00 H new ATOM 0 HA ASP B 109 -3.071 12.078 7.798 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -3.486 11.598 4.821 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -4.195 12.910 5.741 1.00 0.00 H new ATOM 954 N ASP B 110 -5.176 10.812 8.283 1.00 0.00 N ATOM 955 CA ASP B 110 -6.379 10.044 8.606 1.00 0.00 C ATOM 956 C ASP B 110 -7.468 10.268 7.549 1.00 0.00 C ATOM 957 O ASP B 110 -8.259 9.360 7.242 1.00 0.00 O ATOM 958 CB ASP B 110 -6.919 10.421 9.997 1.00 0.00 C ATOM 959 CG ASP B 110 -8.126 9.571 10.390 1.00 0.00 C ATOM 960 OD1 ASP B 110 -7.929 8.428 10.848 1.00 0.00 O ATOM 961 OD2 ASP B 110 -9.269 10.052 10.250 1.00 0.00 O ATOM 0 H ASP B 110 -4.895 11.479 9.002 1.00 0.00 H new ATOM 0 HA ASP B 110 -6.104 8.989 8.613 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -6.130 10.296 10.739 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -7.199 11.474 10.004 1.00 0.00 H new ATOM 966 N GLU B 111 -7.462 11.461 6.968 1.00 0.00 N ATOM 967 CA GLU B 111 -8.408 11.824 5.910 1.00 0.00 C ATOM 968 C GLU B 111 -8.185 10.959 4.690 1.00 0.00 C ATOM 969 O GLU B 111 -9.144 10.553 4.030 1.00 0.00 O ATOM 970 CB GLU B 111 -8.279 13.305 5.545 1.00 0.00 C ATOM 971 CG GLU B 111 -6.919 13.667 4.931 1.00 0.00 C ATOM 972 CD GLU B 111 -6.840 15.130 4.523 1.00 0.00 C ATOM 973 OE1 GLU B 111 -7.449 15.487 3.485 1.00 0.00 O ATOM 974 OE2 GLU B 111 -6.193 15.923 5.234 1.00 0.00 O ATOM 0 H GLU B 111 -6.807 12.204 7.212 1.00 0.00 H new ATOM 0 HA GLU B 111 -9.418 11.654 6.282 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -9.068 13.568 4.841 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -8.437 13.907 6.440 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -6.129 13.450 5.650 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -6.738 13.039 4.059 1.00 0.00 H new ATOM 981 N LEU B 112 -6.926 10.643 4.396 1.00 0.00 N ATOM 982 CA LEU B 112 -6.575 9.859 3.214 1.00 0.00 C ATOM 983 C LEU B 112 -6.880 8.395 3.492 1.00 0.00 C ATOM 984 O LEU B 112 -7.434 7.697 2.629 1.00 0.00 O ATOM 985 CB LEU B 112 -5.071 10.029 2.906 1.00 0.00 C ATOM 986 CG LEU B 112 -4.567 9.261 1.677 1.00 0.00 C ATOM 987 CD1 LEU B 112 -5.310 9.708 0.409 1.00 0.00 C ATOM 988 CD2 LEU B 112 -3.055 9.437 1.526 1.00 0.00 C ATOM 0 H LEU B 112 -6.126 10.920 4.965 1.00 0.00 H new ATOM 0 HA LEU B 112 -7.153 10.201 2.355 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -4.863 11.089 2.763 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.499 9.707 3.776 1.00 0.00 H new ATOM 0 HG LEU B 112 -4.773 8.200 1.821 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.935 9.149 -0.448 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -6.377 9.519 0.527 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -5.146 10.773 0.248 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -2.710 8.887 0.650 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -2.822 10.495 1.405 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.554 9.055 2.415 1.00 0.00 H new ATOM 1000 N LYS B 113 -6.547 7.977 4.698 1.00 0.00 N ATOM 1001 CA LYS B 113 -6.853 6.646 5.190 1.00 0.00 C ATOM 1002 C LYS B 113 -8.300 6.291 4.902 1.00 0.00 C ATOM 1003 O LYS B 113 -8.597 5.239 4.346 1.00 0.00 O ATOM 1004 CB LYS B 113 -6.577 6.581 6.697 1.00 0.00 C ATOM 1005 CG LYS B 113 -7.151 5.347 7.380 1.00 0.00 C ATOM 1006 CD LYS B 113 -7.335 5.598 8.872 1.00 0.00 C ATOM 1007 CE LYS B 113 -8.097 4.438 9.535 1.00 0.00 C ATOM 1008 NZ LYS B 113 -8.205 4.648 11.003 1.00 0.00 N ATOM 0 H LYS B 113 -6.050 8.559 5.373 1.00 0.00 H new ATOM 0 HA LYS B 113 -6.218 5.923 4.678 1.00 0.00 H new ATOM 0 HB2 LYS B 113 -5.500 6.605 6.860 1.00 0.00 H new ATOM 0 HB3 LYS B 113 -6.991 7.471 7.170 1.00 0.00 H new ATOM 0 HG2 LYS B 113 -8.108 5.087 6.929 1.00 0.00 H new ATOM 0 HG3 LYS B 113 -6.485 4.497 7.228 1.00 0.00 H new ATOM 0 HD2 LYS B 113 -6.361 5.717 9.347 1.00 0.00 H new ATOM 0 HD3 LYS B 113 -7.880 6.530 9.023 1.00 0.00 H new ATOM 0 HE2 LYS B 113 -9.093 4.356 9.101 1.00 0.00 H new ATOM 0 HE3 LYS B 113 -7.583 3.498 9.334 1.00 0.00 H new ATOM 0 HZ1 LYS B 113 -8.723 3.854 11.430 1.00 0.00 H new ATOM 0 HZ2 LYS B 113 -7.252 4.703 11.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 113 -8.716 5.535 11.190 1.00 0.00 H new ATOM 1022 N ALA B 114 -9.201 7.180 5.307 1.00 0.00 N ATOM 1023 CA ALA B 114 -10.633 6.999 5.091 1.00 0.00 C ATOM 1024 C ALA B 114 -10.937 6.688 3.619 1.00 0.00 C ATOM 1025 O ALA B 114 -11.697 5.769 3.315 1.00 0.00 O ATOM 1026 CB ALA B 114 -11.391 8.210 5.554 1.00 0.00 C ATOM 0 H ALA B 114 -8.961 8.044 5.793 1.00 0.00 H new ATOM 0 HA ALA B 114 -10.960 6.144 5.682 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -12.457 8.058 5.386 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -11.210 8.368 6.617 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -11.056 9.084 4.996 1.00 0.00 H new ATOM 1032 N ARG B 115 -10.314 7.432 2.708 1.00 0.00 N ATOM 1033 CA ARG B 115 -10.524 7.250 1.274 1.00 0.00 C ATOM 1034 C ARG B 115 -10.055 5.854 0.817 1.00 0.00 C ATOM 1035 O ARG B 115 -10.818 5.078 0.261 1.00 0.00 O ATOM 1036 CB ARG B 115 -9.791 8.332 0.453 1.00 0.00 C ATOM 1037 CG ARG B 115 -10.578 9.629 0.285 1.00 0.00 C ATOM 1038 CD ARG B 115 -10.927 10.293 1.603 1.00 0.00 C ATOM 1039 NE ARG B 115 -11.700 11.514 1.415 1.00 0.00 N ATOM 1040 CZ ARG B 115 -11.719 12.543 2.275 1.00 0.00 C ATOM 1041 NH1 ARG B 115 -10.976 12.499 3.379 1.00 0.00 N ATOM 1042 NH2 ARG B 115 -12.464 13.604 2.017 1.00 0.00 N ATOM 0 H ARG B 115 -9.653 8.173 2.941 1.00 0.00 H new ATOM 0 HA ARG B 115 -11.595 7.343 1.096 1.00 0.00 H new ATOM 0 HB2 ARG B 115 -8.840 8.557 0.936 1.00 0.00 H new ATOM 0 HB3 ARG B 115 -9.560 7.930 -0.533 1.00 0.00 H new ATOM 0 HG2 ARG B 115 -9.996 10.323 -0.321 1.00 0.00 H new ATOM 0 HG3 ARG B 115 -11.497 9.420 -0.263 1.00 0.00 H new ATOM 0 HD2 ARG B 115 -11.495 9.597 2.220 1.00 0.00 H new ATOM 0 HD3 ARG B 115 -10.010 10.525 2.145 1.00 0.00 H new ATOM 0 HE ARG B 115 -12.266 11.591 0.570 1.00 0.00 H new ATOM 0 HH11 ARG B 115 -10.394 11.684 3.570 1.00 0.00 H new ATOM 0 HH12 ARG B 115 -10.989 13.281 4.034 1.00 0.00 H new ATOM 0 HH21 ARG B 115 -13.023 13.639 1.165 1.00 0.00 H new ATOM 0 HH22 ARG B 115 -12.479 14.387 2.670 1.00 0.00 H new ATOM 1056 N SER B 116 -8.778 5.581 1.058 1.00 0.00 N ATOM 1057 CA SER B 116 -8.155 4.353 0.629 1.00 0.00 C ATOM 1058 C SER B 116 -8.899 3.129 1.138 1.00 0.00 C ATOM 1059 O SER B 116 -9.266 2.230 0.366 1.00 0.00 O ATOM 1060 CB SER B 116 -6.702 4.340 1.107 1.00 0.00 C ATOM 1061 OG SER B 116 -6.107 5.610 0.897 1.00 0.00 O ATOM 0 H SER B 116 -8.152 6.212 1.558 1.00 0.00 H new ATOM 0 HA SER B 116 -8.188 4.310 -0.460 1.00 0.00 H new ATOM 0 HB2 SER B 116 -6.662 4.082 2.165 1.00 0.00 H new ATOM 0 HB3 SER B 116 -6.142 3.574 0.570 1.00 0.00 H new ATOM 0 HG SER B 116 -5.856 5.702 -0.046 1.00 0.00 H new ATOM 1067 N TYR B 117 -9.144 3.096 2.449 1.00 0.00 N ATOM 1068 CA TYR B 117 -9.866 2.010 3.088 1.00 0.00 C ATOM 1069 C TYR B 117 -11.261 1.859 2.483 1.00 0.00 C ATOM 1070 O TYR B 117 -11.728 0.751 2.261 1.00 0.00 O ATOM 1071 CB TYR B 117 -9.953 2.225 4.605 1.00 0.00 C ATOM 1072 CG TYR B 117 -8.642 1.969 5.343 1.00 0.00 C ATOM 1073 CD1 TYR B 117 -7.455 2.534 4.905 1.00 0.00 C ATOM 1074 CD2 TYR B 117 -8.605 1.151 6.482 1.00 0.00 C ATOM 1075 CE1 TYR B 117 -6.265 2.299 5.567 1.00 0.00 C ATOM 1076 CE2 TYR B 117 -7.413 0.930 7.145 1.00 0.00 C ATOM 1077 CZ TYR B 117 -6.243 1.508 6.678 1.00 0.00 C ATOM 1078 OH TYR B 117 -5.071 1.296 7.336 1.00 0.00 O ATOM 0 H TYR B 117 -8.844 3.827 3.094 1.00 0.00 H new ATOM 0 HA TYR B 117 -9.314 1.087 2.910 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -10.274 3.249 4.799 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -10.722 1.568 5.012 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -7.460 3.169 4.031 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -9.513 0.691 6.843 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -5.350 2.743 5.204 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -7.393 0.307 8.027 1.00 0.00 H new ATOM 0 HH TYR B 117 -5.229 0.711 8.106 1.00 0.00 H new ATOM 1088 N ALA B 118 -11.889 2.986 2.203 1.00 0.00 N ATOM 1089 CA ALA B 118 -13.233 2.986 1.610 1.00 0.00 C ATOM 1090 C ALA B 118 -13.245 2.278 0.250 1.00 0.00 C ATOM 1091 O ALA B 118 -14.114 1.445 -0.016 1.00 0.00 O ATOM 1092 CB ALA B 118 -13.745 4.419 1.467 1.00 0.00 C ATOM 0 H ALA B 118 -11.501 3.914 2.372 1.00 0.00 H new ATOM 0 HA ALA B 118 -13.895 2.435 2.278 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -14.742 4.407 1.026 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -13.788 4.890 2.449 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -13.071 4.984 0.823 1.00 0.00 H new ATOM 1098 N ALA B 119 -12.261 2.611 -0.582 1.00 0.00 N ATOM 1099 CA ALA B 119 -12.158 2.023 -1.924 1.00 0.00 C ATOM 1100 C ALA B 119 -11.930 0.515 -1.877 1.00 0.00 C ATOM 1101 O ALA B 119 -12.554 -0.256 -2.614 1.00 0.00 O ATOM 1102 CB ALA B 119 -11.051 2.708 -2.694 1.00 0.00 C ATOM 0 H ALA B 119 -11.525 3.281 -0.357 1.00 0.00 H new ATOM 0 HA ALA B 119 -13.108 2.181 -2.434 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -10.976 2.271 -3.690 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -11.272 3.772 -2.781 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -10.106 2.576 -2.167 1.00 0.00 H new ATOM 1108 N LEU B 120 -11.028 0.074 -0.996 1.00 0.00 N ATOM 1109 CA LEU B 120 -10.653 -1.330 -0.956 1.00 0.00 C ATOM 1110 C LEU B 120 -11.756 -2.189 -0.348 1.00 0.00 C ATOM 1111 O LEU B 120 -11.969 -3.321 -0.780 1.00 0.00 O ATOM 1112 CB LEU B 120 -9.302 -1.488 -0.238 1.00 0.00 C ATOM 1113 CG LEU B 120 -9.167 -0.895 1.161 1.00 0.00 C ATOM 1114 CD1 LEU B 120 -9.774 -1.788 2.234 1.00 0.00 C ATOM 1115 CD2 LEU B 120 -7.685 -0.593 1.492 1.00 0.00 C ATOM 0 H LEU B 120 -10.553 0.664 -0.313 1.00 0.00 H new ATOM 0 HA LEU B 120 -10.528 -1.694 -1.976 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -9.080 -2.553 -0.173 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -8.534 -1.040 -0.868 1.00 0.00 H new ATOM 0 HG LEU B 120 -9.729 0.039 1.159 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -9.651 -1.319 3.210 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -10.835 -1.930 2.031 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -9.271 -2.755 2.230 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -7.615 -0.171 2.495 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -7.106 -1.516 1.445 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -7.289 0.121 0.769 1.00 0.00 H new ATOM 1127 N GLU B 121 -12.477 -1.639 0.631 1.00 0.00 N ATOM 1128 CA GLU B 121 -13.586 -2.380 1.260 1.00 0.00 C ATOM 1129 C GLU B 121 -14.781 -2.448 0.306 1.00 0.00 C ATOM 1130 O GLU B 121 -15.670 -3.290 0.461 1.00 0.00 O ATOM 1131 CB GLU B 121 -13.984 -1.745 2.598 1.00 0.00 C ATOM 1132 CG GLU B 121 -14.530 -0.319 2.526 1.00 0.00 C ATOM 1133 CD GLU B 121 -16.008 -0.230 2.210 1.00 0.00 C ATOM 1134 OE1 GLU B 121 -16.837 -0.565 3.102 1.00 0.00 O ATOM 1135 OE2 GLU B 121 -16.395 0.215 1.105 1.00 0.00 O ATOM 0 H GLU B 121 -12.322 -0.702 1.004 1.00 0.00 H new ATOM 0 HA GLU B 121 -13.250 -3.396 1.467 1.00 0.00 H new ATOM 0 HB2 GLU B 121 -14.737 -2.378 3.068 1.00 0.00 H new ATOM 0 HB3 GLU B 121 -13.112 -1.747 3.252 1.00 0.00 H new ATOM 0 HG2 GLU B 121 -14.344 0.177 3.479 1.00 0.00 H new ATOM 0 HG3 GLU B 121 -13.975 0.232 1.767 1.00 0.00 H new ATOM 1142 N LYS B 122 -14.777 -1.564 -0.689 1.00 0.00 N ATOM 1143 CA LYS B 122 -15.796 -1.579 -1.708 1.00 0.00 C ATOM 1144 C LYS B 122 -15.613 -2.816 -2.584 1.00 0.00 C ATOM 1145 O LYS B 122 -16.563 -3.544 -2.875 1.00 0.00 O ATOM 1146 CB LYS B 122 -15.727 -0.305 -2.556 1.00 0.00 C ATOM 1147 CG LYS B 122 -17.056 0.104 -3.161 1.00 0.00 C ATOM 1148 CD LYS B 122 -18.021 0.608 -2.078 1.00 0.00 C ATOM 1149 CE LYS B 122 -17.724 2.036 -1.631 1.00 0.00 C ATOM 1150 NZ LYS B 122 -16.389 2.172 -0.959 1.00 0.00 N ATOM 0 H LYS B 122 -14.075 -0.833 -0.802 1.00 0.00 H new ATOM 0 HA LYS B 122 -16.777 -1.615 -1.235 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -15.354 0.511 -1.938 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -15.004 -0.453 -3.358 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -16.896 0.886 -3.904 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -17.499 -0.745 -3.682 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -19.042 0.557 -2.457 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -17.968 -0.055 -1.215 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -17.758 2.697 -2.497 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -18.505 2.367 -0.947 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -16.381 3.032 -0.375 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -16.218 1.342 -0.356 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -15.642 2.236 -1.680 1.00 0.00 H new ATOM 1164 N MET B 123 -14.360 -3.029 -2.987 1.00 0.00 N ATOM 1165 CA MET B 123 -13.994 -4.219 -3.748 1.00 0.00 C ATOM 1166 C MET B 123 -14.089 -5.468 -2.894 1.00 0.00 C ATOM 1167 O MET B 123 -14.229 -6.581 -3.393 1.00 0.00 O ATOM 1168 CB MET B 123 -12.570 -4.081 -4.317 1.00 0.00 C ATOM 1169 CG MET B 123 -12.408 -2.924 -5.259 1.00 0.00 C ATOM 1170 SD MET B 123 -10.770 -2.879 -6.008 1.00 0.00 S ATOM 1171 CE MET B 123 -9.750 -2.598 -4.554 1.00 0.00 C ATOM 0 H MET B 123 -13.585 -2.393 -2.799 1.00 0.00 H new ATOM 0 HA MET B 123 -14.700 -4.313 -4.573 1.00 0.00 H new ATOM 0 HB2 MET B 123 -11.867 -3.967 -3.491 1.00 0.00 H new ATOM 0 HB3 MET B 123 -12.305 -5.002 -4.837 1.00 0.00 H new ATOM 0 HG2 MET B 123 -13.162 -2.988 -6.043 1.00 0.00 H new ATOM 0 HG3 MET B 123 -12.585 -1.993 -4.721 1.00 0.00 H new ATOM 0 HE1 MET B 123 -8.704 -2.527 -4.852 1.00 0.00 H new ATOM 0 HE2 MET B 123 -10.053 -1.669 -4.071 1.00 0.00 H new ATOM 0 HE3 MET B 123 -9.874 -3.427 -3.857 1.00 0.00 H new ATOM 1181 N GLY B 124 -13.999 -5.279 -1.583 1.00 0.00 N ATOM 1182 CA GLY B 124 -14.096 -6.386 -0.648 1.00 0.00 C ATOM 1183 C GLY B 124 -12.741 -6.908 -0.212 1.00 0.00 C ATOM 1184 O GLY B 124 -12.639 -7.956 0.428 1.00 0.00 O ATOM 0 H GLY B 124 -13.859 -4.368 -1.146 1.00 0.00 H new ATOM 0 HA2 GLY B 124 -14.656 -6.066 0.230 1.00 0.00 H new ATOM 0 HA3 GLY B 124 -14.661 -7.196 -1.109 1.00 0.00 H new ATOM 1188 N VAL B 125 -11.669 -6.170 -0.551 1.00 0.00 N ATOM 1189 CA VAL B 125 -10.324 -6.566 -0.169 1.00 0.00 C ATOM 1190 C VAL B 125 -9.975 -5.975 1.190 1.00 0.00 C ATOM 1191 O VAL B 125 -10.299 -4.819 1.471 1.00 0.00 O ATOM 1192 CB VAL B 125 -9.270 -6.143 -1.229 1.00 0.00 C ATOM 1193 CG1 VAL B 125 -9.190 -4.638 -1.407 1.00 0.00 C ATOM 1194 CG2 VAL B 125 -7.890 -6.722 -0.903 1.00 0.00 C ATOM 0 H VAL B 125 -11.719 -5.303 -1.086 1.00 0.00 H new ATOM 0 HA VAL B 125 -10.303 -7.654 -0.108 1.00 0.00 H new ATOM 0 HB VAL B 125 -9.606 -6.560 -2.179 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -8.438 -4.400 -2.159 1.00 0.00 H new ATOM 0 HG12 VAL B 125 -10.159 -4.258 -1.730 1.00 0.00 H new ATOM 0 HG13 VAL B 125 -8.915 -4.174 -0.460 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -7.175 -6.408 -1.663 1.00 0.00 H new ATOM 0 HG22 VAL B 125 -7.565 -6.360 0.073 1.00 0.00 H new ATOM 0 HG23 VAL B 125 -7.947 -7.810 -0.886 1.00 0.00 H new ATOM 1204 N THR B 126 -9.327 -6.769 2.029 1.00 0.00 N ATOM 1205 CA THR B 126 -8.937 -6.332 3.351 1.00 0.00 C ATOM 1206 C THR B 126 -7.779 -5.322 3.262 1.00 0.00 C ATOM 1207 O THR B 126 -6.869 -5.506 2.451 1.00 0.00 O ATOM 1208 CB THR B 126 -8.506 -7.557 4.199 1.00 0.00 C ATOM 1209 OG1 THR B 126 -9.578 -8.496 4.269 1.00 0.00 O ATOM 1210 CG2 THR B 126 -8.089 -7.150 5.598 1.00 0.00 C ATOM 0 H THR B 126 -9.060 -7.729 1.810 1.00 0.00 H new ATOM 0 HA THR B 126 -9.788 -5.844 3.827 1.00 0.00 H new ATOM 0 HB THR B 126 -7.644 -8.014 3.713 1.00 0.00 H new ATOM 0 HG1 THR B 126 -9.301 -9.269 4.804 1.00 0.00 H new ATOM 0 HG21 THR B 126 -7.794 -8.035 6.162 1.00 0.00 H new ATOM 0 HG22 THR B 126 -7.248 -6.459 5.540 1.00 0.00 H new ATOM 0 HG23 THR B 126 -8.925 -6.662 6.100 1.00 0.00 H new ATOM 1218 N PRO B 127 -7.802 -4.250 4.072 1.00 0.00 N ATOM 1219 CA PRO B 127 -6.713 -3.269 4.105 1.00 0.00 C ATOM 1220 C PRO B 127 -5.354 -3.951 4.256 1.00 0.00 C ATOM 1221 O PRO B 127 -4.398 -3.626 3.558 1.00 0.00 O ATOM 1222 CB PRO B 127 -7.037 -2.369 5.317 1.00 0.00 C ATOM 1223 CG PRO B 127 -8.168 -3.061 6.032 1.00 0.00 C ATOM 1224 CD PRO B 127 -8.885 -3.877 4.997 1.00 0.00 C ATOM 0 HA PRO B 127 -6.645 -2.697 3.180 1.00 0.00 H new ATOM 0 HB2 PRO B 127 -6.170 -2.257 5.968 1.00 0.00 H new ATOM 0 HB3 PRO B 127 -7.327 -1.368 4.998 1.00 0.00 H new ATOM 0 HG2 PRO B 127 -7.791 -3.695 6.834 1.00 0.00 H new ATOM 0 HG3 PRO B 127 -8.841 -2.335 6.489 1.00 0.00 H new ATOM 0 HD2 PRO B 127 -9.365 -4.753 5.433 1.00 0.00 H new ATOM 0 HD3 PRO B 127 -9.665 -3.302 4.497 1.00 0.00 H new ATOM 1232 N SER B 128 -5.277 -4.899 5.183 1.00 0.00 N ATOM 1233 CA SER B 128 -4.063 -5.659 5.427 1.00 0.00 C ATOM 1234 C SER B 128 -3.589 -6.370 4.147 1.00 0.00 C ATOM 1235 O SER B 128 -2.387 -6.531 3.920 1.00 0.00 O ATOM 1236 CB SER B 128 -4.329 -6.685 6.539 1.00 0.00 C ATOM 1237 OG SER B 128 -4.980 -6.076 7.643 1.00 0.00 O ATOM 0 H SER B 128 -6.057 -5.160 5.786 1.00 0.00 H new ATOM 0 HA SER B 128 -3.273 -4.975 5.738 1.00 0.00 H new ATOM 0 HB2 SER B 128 -4.944 -7.497 6.151 1.00 0.00 H new ATOM 0 HB3 SER B 128 -3.387 -7.127 6.865 1.00 0.00 H new ATOM 0 HG SER B 128 -5.141 -6.747 8.339 1.00 0.00 H new ATOM 1243 N GLU B 129 -4.535 -6.746 3.295 1.00 0.00 N ATOM 1244 CA GLU B 129 -4.244 -7.463 2.057 1.00 0.00 C ATOM 1245 C GLU B 129 -3.704 -6.499 1.004 1.00 0.00 C ATOM 1246 O GLU B 129 -2.695 -6.766 0.371 1.00 0.00 O ATOM 1247 CB GLU B 129 -5.490 -8.186 1.536 1.00 0.00 C ATOM 1248 CG GLU B 129 -6.007 -9.257 2.501 1.00 0.00 C ATOM 1249 CD GLU B 129 -7.246 -9.985 1.982 1.00 0.00 C ATOM 1250 OE1 GLU B 129 -8.126 -9.340 1.377 1.00 0.00 O ATOM 1251 OE2 GLU B 129 -7.359 -11.218 2.233 1.00 0.00 O ATOM 0 H GLU B 129 -5.528 -6.563 3.442 1.00 0.00 H new ATOM 0 HA GLU B 129 -3.483 -8.215 2.267 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -6.279 -7.455 1.356 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -5.260 -8.650 0.577 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -5.216 -9.984 2.684 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -6.241 -8.792 3.459 1.00 0.00 H new ATOM 1258 N ALA B 130 -4.406 -5.370 0.835 1.00 0.00 N ATOM 1259 CA ALA B 130 -3.974 -4.346 -0.115 1.00 0.00 C ATOM 1260 C ALA B 130 -2.581 -3.842 0.223 1.00 0.00 C ATOM 1261 O ALA B 130 -1.755 -3.601 -0.673 1.00 0.00 O ATOM 1262 CB ALA B 130 -4.969 -3.181 -0.135 1.00 0.00 C ATOM 0 H ALA B 130 -5.265 -5.148 1.339 1.00 0.00 H new ATOM 0 HA ALA B 130 -3.942 -4.798 -1.106 1.00 0.00 H new ATOM 0 HB1 ALA B 130 -4.633 -2.427 -0.847 1.00 0.00 H new ATOM 0 HB2 ALA B 130 -5.952 -3.547 -0.431 1.00 0.00 H new ATOM 0 HB3 ALA B 130 -5.031 -2.738 0.859 1.00 0.00 H new ATOM 1268 N LEU B 131 -2.297 -3.676 1.517 1.00 0.00 N ATOM 1269 CA LEU B 131 -0.990 -3.220 1.972 1.00 0.00 C ATOM 1270 C LEU B 131 0.057 -4.319 1.747 1.00 0.00 C ATOM 1271 O LEU B 131 1.237 -4.042 1.510 1.00 0.00 O ATOM 1272 CB LEU B 131 -1.051 -2.844 3.462 1.00 0.00 C ATOM 1273 CG LEU B 131 -2.005 -1.699 3.824 1.00 0.00 C ATOM 1274 CD1 LEU B 131 -2.179 -1.611 5.341 1.00 0.00 C ATOM 1275 CD2 LEU B 131 -1.497 -0.361 3.277 1.00 0.00 C ATOM 0 H LEU B 131 -2.963 -3.853 2.269 1.00 0.00 H new ATOM 0 HA LEU B 131 -0.704 -2.338 1.399 1.00 0.00 H new ATOM 0 HB2 LEU B 131 -1.344 -3.728 4.028 1.00 0.00 H new ATOM 0 HB3 LEU B 131 -0.048 -2.573 3.790 1.00 0.00 H new ATOM 0 HG LEU B 131 -2.971 -1.911 3.365 1.00 0.00 H new ATOM 0 HD11 LEU B 131 -2.859 -0.794 5.582 1.00 0.00 H new ATOM 0 HD12 LEU B 131 -2.591 -2.548 5.715 1.00 0.00 H new ATOM 0 HD13 LEU B 131 -1.211 -1.428 5.808 1.00 0.00 H new ATOM 0 HD21 LEU B 131 -2.194 0.432 3.549 1.00 0.00 H new ATOM 0 HD22 LEU B 131 -0.516 -0.143 3.701 1.00 0.00 H new ATOM 0 HD23 LEU B 131 -1.419 -0.418 2.191 1.00 0.00 H new ATOM 1287 N ARG B 132 -0.393 -5.570 1.797 1.00 0.00 N ATOM 1288 CA ARG B 132 0.483 -6.727 1.612 1.00 0.00 C ATOM 1289 C ARG B 132 0.971 -6.785 0.166 1.00 0.00 C ATOM 1290 O ARG B 132 2.176 -6.946 -0.087 1.00 0.00 O ATOM 1291 CB ARG B 132 -0.261 -8.018 1.996 1.00 0.00 C ATOM 1292 CG ARG B 132 0.629 -9.230 2.307 1.00 0.00 C ATOM 1293 CD ARG B 132 1.085 -9.977 1.051 1.00 0.00 C ATOM 1294 NE ARG B 132 1.753 -11.236 1.408 1.00 0.00 N ATOM 1295 CZ ARG B 132 2.051 -12.207 0.533 1.00 0.00 C ATOM 1296 NH1 ARG B 132 1.871 -12.014 -0.766 1.00 0.00 N ATOM 1297 NH2 ARG B 132 2.611 -13.334 0.964 1.00 0.00 N ATOM 0 H ARG B 132 -1.370 -5.811 1.966 1.00 0.00 H new ATOM 0 HA ARG B 132 1.352 -6.629 2.262 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -0.882 -7.812 2.868 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -0.934 -8.284 1.181 1.00 0.00 H new ATOM 0 HG2 ARG B 132 1.505 -8.897 2.863 1.00 0.00 H new ATOM 0 HG3 ARG B 132 0.084 -9.917 2.954 1.00 0.00 H new ATOM 0 HD2 ARG B 132 0.226 -10.184 0.413 1.00 0.00 H new ATOM 0 HD3 ARG B 132 1.765 -9.349 0.476 1.00 0.00 H new ATOM 0 HE ARG B 132 2.007 -11.381 2.385 1.00 0.00 H new ATOM 0 HH11 ARG B 132 1.504 -11.124 -1.103 1.00 0.00 H new ATOM 0 HH12 ARG B 132 2.099 -12.756 -1.428 1.00 0.00 H new ATOM 0 HH21 ARG B 132 2.812 -13.457 1.956 1.00 0.00 H new ATOM 0 HH22 ARG B 132 2.839 -14.076 0.302 1.00 0.00 H new ATOM 1311 N LEU B 133 0.042 -6.627 -0.786 1.00 0.00 N ATOM 1312 CA LEU B 133 0.390 -6.705 -2.204 1.00 0.00 C ATOM 1313 C LEU B 133 1.265 -5.518 -2.606 1.00 0.00 C ATOM 1314 O LEU B 133 2.000 -5.573 -3.608 1.00 0.00 O ATOM 1315 CB LEU B 133 -0.855 -6.763 -3.072 1.00 0.00 C ATOM 1316 CG LEU B 133 -1.734 -5.505 -3.077 1.00 0.00 C ATOM 1317 CD1 LEU B 133 -1.348 -4.519 -4.180 1.00 0.00 C ATOM 1318 CD2 LEU B 133 -3.190 -5.911 -3.210 1.00 0.00 C ATOM 0 H LEU B 133 -0.944 -6.447 -0.600 1.00 0.00 H new ATOM 0 HA LEU B 133 0.954 -7.625 -2.361 1.00 0.00 H new ATOM 0 HB2 LEU B 133 -0.549 -6.972 -4.097 1.00 0.00 H new ATOM 0 HB3 LEU B 133 -1.464 -7.605 -2.743 1.00 0.00 H new ATOM 0 HG LEU B 133 -1.576 -4.986 -2.132 1.00 0.00 H new ATOM 0 HD11 LEU B 133 -2.003 -3.649 -4.136 1.00 0.00 H new ATOM 0 HD12 LEU B 133 -0.314 -4.203 -4.040 1.00 0.00 H new ATOM 0 HD13 LEU B 133 -1.451 -5.002 -5.152 1.00 0.00 H new ATOM 0 HD21 LEU B 133 -3.817 -5.020 -3.214 1.00 0.00 H new ATOM 0 HD22 LEU B 133 -3.331 -6.458 -4.142 1.00 0.00 H new ATOM 0 HD23 LEU B 133 -3.469 -6.547 -2.370 1.00 0.00 H new ATOM 1330 N MET B 134 1.188 -4.439 -1.834 1.00 0.00 N ATOM 1331 CA MET B 134 2.058 -3.292 -2.042 1.00 0.00 C ATOM 1332 C MET B 134 3.499 -3.679 -1.764 1.00 0.00 C ATOM 1333 O MET B 134 4.395 -3.363 -2.555 1.00 0.00 O ATOM 1334 CB MET B 134 1.629 -2.105 -1.152 1.00 0.00 C ATOM 1335 CG MET B 134 2.673 -0.981 -1.057 1.00 0.00 C ATOM 1336 SD MET B 134 4.071 -1.396 -0.004 1.00 0.00 S ATOM 1337 CE MET B 134 5.080 0.075 -0.183 1.00 0.00 C ATOM 0 H MET B 134 0.532 -4.337 -1.060 1.00 0.00 H new ATOM 0 HA MET B 134 1.973 -2.975 -3.082 1.00 0.00 H new ATOM 0 HB2 MET B 134 0.699 -1.690 -1.542 1.00 0.00 H new ATOM 0 HB3 MET B 134 1.417 -2.475 -0.149 1.00 0.00 H new ATOM 0 HG2 MET B 134 3.037 -0.747 -2.057 1.00 0.00 H new ATOM 0 HG3 MET B 134 2.193 -0.080 -0.674 1.00 0.00 H new ATOM 0 HE1 MET B 134 5.872 0.067 0.566 1.00 0.00 H new ATOM 0 HE2 MET B 134 5.523 0.093 -1.179 1.00 0.00 H new ATOM 0 HE3 MET B 134 4.460 0.961 -0.046 1.00 0.00 H new ATOM 1347 N LEU B 135 3.709 -4.372 -0.641 1.00 0.00 N ATOM 1348 CA LEU B 135 5.054 -4.786 -0.239 1.00 0.00 C ATOM 1349 C LEU B 135 5.638 -5.683 -1.309 1.00 0.00 C ATOM 1350 O LEU B 135 6.863 -5.721 -1.536 1.00 0.00 O ATOM 1351 CB LEU B 135 5.037 -5.478 1.119 1.00 0.00 C ATOM 1352 CG LEU B 135 4.610 -4.594 2.311 1.00 0.00 C ATOM 1353 CD1 LEU B 135 4.749 -5.368 3.613 1.00 0.00 C ATOM 1354 CD2 LEU B 135 5.436 -3.305 2.359 1.00 0.00 C ATOM 0 H LEU B 135 2.969 -4.656 0.001 1.00 0.00 H new ATOM 0 HA LEU B 135 5.684 -3.902 -0.134 1.00 0.00 H new ATOM 0 HB2 LEU B 135 4.363 -6.333 1.063 1.00 0.00 H new ATOM 0 HB3 LEU B 135 6.034 -5.871 1.319 1.00 0.00 H new ATOM 0 HG LEU B 135 3.564 -4.318 2.178 1.00 0.00 H new ATOM 0 HD11 LEU B 135 4.445 -4.735 4.447 1.00 0.00 H new ATOM 0 HD12 LEU B 135 4.114 -6.253 3.579 1.00 0.00 H new ATOM 0 HD13 LEU B 135 5.787 -5.671 3.747 1.00 0.00 H new ATOM 0 HD21 LEU B 135 5.116 -2.699 3.207 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.492 -3.553 2.468 1.00 0.00 H new ATOM 0 HD23 LEU B 135 5.288 -2.744 1.436 1.00 0.00 H new ATOM 1366 N GLU B 136 4.751 -6.407 -1.987 1.00 0.00 N ATOM 1367 CA GLU B 136 5.134 -7.259 -3.091 1.00 0.00 C ATOM 1368 C GLU B 136 5.732 -6.428 -4.229 1.00 0.00 C ATOM 1369 O GLU B 136 6.827 -6.735 -4.712 1.00 0.00 O ATOM 1370 CB GLU B 136 3.933 -8.070 -3.585 1.00 0.00 C ATOM 1371 CG GLU B 136 3.250 -8.875 -2.478 1.00 0.00 C ATOM 1372 CD GLU B 136 2.284 -9.919 -2.998 1.00 0.00 C ATOM 1373 OE1 GLU B 136 2.664 -10.660 -3.936 1.00 0.00 O ATOM 1374 OE2 GLU B 136 1.157 -10.021 -2.462 1.00 0.00 O ATOM 0 H GLU B 136 3.752 -6.414 -1.781 1.00 0.00 H new ATOM 0 HA GLU B 136 5.896 -7.956 -2.741 1.00 0.00 H new ATOM 0 HB2 GLU B 136 3.206 -7.393 -4.034 1.00 0.00 H new ATOM 0 HB3 GLU B 136 4.261 -8.751 -4.370 1.00 0.00 H new ATOM 0 HG2 GLU B 136 4.013 -9.366 -1.874 1.00 0.00 H new ATOM 0 HG3 GLU B 136 2.714 -8.191 -1.820 1.00 0.00 H new ATOM 1381 N TYR B 137 5.036 -5.363 -4.670 1.00 0.00 N ATOM 1382 CA TYR B 137 5.470 -4.604 -5.836 1.00 0.00 C ATOM 1383 C TYR B 137 6.718 -3.765 -5.542 1.00 0.00 C ATOM 1384 O TYR B 137 7.554 -3.572 -6.409 1.00 0.00 O ATOM 1385 CB TYR B 137 4.325 -3.731 -6.396 1.00 0.00 C ATOM 1386 CG TYR B 137 4.176 -2.348 -5.789 1.00 0.00 C ATOM 1387 CD1 TYR B 137 5.108 -1.339 -6.040 1.00 0.00 C ATOM 1388 CD2 TYR B 137 3.084 -2.029 -4.980 1.00 0.00 C ATOM 1389 CE1 TYR B 137 4.968 -0.071 -5.501 1.00 0.00 C ATOM 1390 CE2 TYR B 137 2.948 -0.764 -4.431 1.00 0.00 C ATOM 1391 CZ TYR B 137 3.886 0.209 -4.689 1.00 0.00 C ATOM 1392 OH TYR B 137 3.750 1.455 -4.154 1.00 0.00 O ATOM 0 H TYR B 137 4.180 -5.019 -4.235 1.00 0.00 H new ATOM 0 HA TYR B 137 5.744 -5.327 -6.605 1.00 0.00 H new ATOM 0 HB2 TYR B 137 4.474 -3.619 -7.470 1.00 0.00 H new ATOM 0 HB3 TYR B 137 3.387 -4.268 -6.258 1.00 0.00 H new ATOM 0 HD1 TYR B 137 5.959 -1.553 -6.670 1.00 0.00 H new ATOM 0 HD2 TYR B 137 2.334 -2.779 -4.779 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.700 0.694 -5.714 1.00 0.00 H new ATOM 0 HE2 TYR B 137 2.102 -0.541 -3.798 1.00 0.00 H new ATOM 0 HH TYR B 137 2.937 1.490 -3.608 1.00 0.00 H new ATOM 1402 N ILE B 138 6.859 -3.260 -4.308 1.00 0.00 N ATOM 1403 CA ILE B 138 8.028 -2.451 -3.966 1.00 0.00 C ATOM 1404 C ILE B 138 9.313 -3.294 -3.940 1.00 0.00 C ATOM 1405 O ILE B 138 10.360 -2.864 -4.411 1.00 0.00 O ATOM 1406 CB ILE B 138 7.856 -1.675 -2.622 1.00 0.00 C ATOM 1407 CG1 ILE B 138 9.180 -1.063 -2.115 1.00 0.00 C ATOM 1408 CG2 ILE B 138 7.239 -2.570 -1.557 1.00 0.00 C ATOM 1409 CD1 ILE B 138 9.794 -0.037 -3.050 1.00 0.00 C ATOM 0 H ILE B 138 6.192 -3.395 -3.548 1.00 0.00 H new ATOM 0 HA ILE B 138 8.119 -1.707 -4.758 1.00 0.00 H new ATOM 0 HB ILE B 138 7.179 -0.845 -2.824 1.00 0.00 H new ATOM 0 HG12 ILE B 138 9.003 -0.594 -1.147 1.00 0.00 H new ATOM 0 HG13 ILE B 138 9.899 -1.866 -1.953 1.00 0.00 H new ATOM 0 HG21 ILE B 138 7.129 -2.009 -0.629 1.00 0.00 H new ATOM 0 HG22 ILE B 138 6.260 -2.913 -1.892 1.00 0.00 H new ATOM 0 HG23 ILE B 138 7.886 -3.430 -1.385 1.00 0.00 H new ATOM 0 HD11 ILE B 138 10.720 0.341 -2.617 1.00 0.00 H new ATOM 0 HD12 ILE B 138 10.007 -0.503 -4.012 1.00 0.00 H new ATOM 0 HD13 ILE B 138 9.097 0.788 -3.193 1.00 0.00 H new ATOM 1421 N ALA B 139 9.203 -4.520 -3.422 1.00 0.00 N ATOM 1422 CA ALA B 139 10.345 -5.429 -3.364 1.00 0.00 C ATOM 1423 C ALA B 139 10.789 -5.837 -4.783 1.00 0.00 C ATOM 1424 O ALA B 139 11.970 -6.107 -5.015 1.00 0.00 O ATOM 1425 CB ALA B 139 10.011 -6.667 -2.551 1.00 0.00 C ATOM 0 H ALA B 139 8.338 -4.902 -3.039 1.00 0.00 H new ATOM 0 HA ALA B 139 11.165 -4.903 -2.876 1.00 0.00 H new ATOM 0 HB1 ALA B 139 10.877 -7.328 -2.523 1.00 0.00 H new ATOM 0 HB2 ALA B 139 9.744 -6.374 -1.535 1.00 0.00 H new ATOM 0 HB3 ALA B 139 9.171 -7.188 -3.011 1.00 0.00 H new ATOM 1431 N ASP B 140 9.821 -5.872 -5.693 1.00 0.00 N ATOM 1432 CA ASP B 140 10.067 -6.267 -7.083 1.00 0.00 C ATOM 1433 C ASP B 140 10.660 -5.111 -7.888 1.00 0.00 C ATOM 1434 O ASP B 140 11.783 -5.199 -8.399 1.00 0.00 O ATOM 1435 CB ASP B 140 8.749 -6.722 -7.735 1.00 0.00 C ATOM 1436 CG ASP B 140 8.922 -7.285 -9.130 1.00 0.00 C ATOM 1437 OD1 ASP B 140 9.137 -6.511 -10.081 1.00 0.00 O ATOM 1438 OD2 ASP B 140 8.781 -8.515 -9.290 1.00 0.00 O ATOM 0 H ASP B 140 8.850 -5.630 -5.494 1.00 0.00 H new ATOM 0 HA ASP B 140 10.783 -7.089 -7.081 1.00 0.00 H new ATOM 0 HB2 ASP B 140 8.283 -7.478 -7.103 1.00 0.00 H new ATOM 0 HB3 ASP B 140 8.064 -5.876 -7.777 1.00 0.00 H new ATOM 1443 N ASN B 141 9.900 -4.028 -7.999 1.00 0.00 N ATOM 1444 CA ASN B 141 10.284 -2.870 -8.803 1.00 0.00 C ATOM 1445 C ASN B 141 11.400 -2.068 -8.143 1.00 0.00 C ATOM 1446 O ASN B 141 12.276 -1.531 -8.818 1.00 0.00 O ATOM 1447 CB ASN B 141 9.067 -1.972 -9.052 1.00 0.00 C ATOM 1448 CG ASN B 141 7.995 -2.651 -9.875 1.00 0.00 C ATOM 1449 OD1 ASN B 141 8.004 -2.581 -11.118 1.00 0.00 O ATOM 1450 ND2 ASN B 141 7.056 -3.322 -9.202 1.00 0.00 N ATOM 0 H ASN B 141 8.998 -3.926 -7.534 1.00 0.00 H new ATOM 0 HA ASN B 141 10.661 -3.241 -9.756 1.00 0.00 H new ATOM 0 HB2 ASN B 141 8.645 -1.667 -8.095 1.00 0.00 H new ATOM 0 HB3 ASN B 141 9.389 -1.064 -9.562 1.00 0.00 H new ATOM 0 HD21 ASN B 141 6.311 -3.801 -9.707 1.00 0.00 H new ATOM 0 HD22 ASN B 141 7.084 -3.355 -8.183 1.00 0.00 H new ATOM 1457 N GLU B 142 11.359 -1.987 -6.802 1.00 0.00 N ATOM 1458 CA GLU B 142 12.351 -1.253 -6.027 1.00 0.00 C ATOM 1459 C GLU B 142 12.468 0.205 -6.497 1.00 0.00 C ATOM 1460 O GLU B 142 13.557 0.778 -6.515 1.00 0.00 O ATOM 1461 CB GLU B 142 13.710 -1.967 -6.141 1.00 0.00 C ATOM 1462 CG GLU B 142 13.637 -3.440 -5.783 1.00 0.00 C ATOM 1463 CD GLU B 142 14.959 -4.158 -6.036 1.00 0.00 C ATOM 1464 OE1 GLU B 142 15.211 -4.565 -7.183 1.00 0.00 O ATOM 1465 OE2 GLU B 142 15.748 -4.301 -5.084 1.00 0.00 O ATOM 0 H GLU B 142 10.636 -2.430 -6.235 1.00 0.00 H new ATOM 0 HA GLU B 142 12.033 -1.232 -4.985 1.00 0.00 H new ATOM 0 HB2 GLU B 142 14.084 -1.864 -7.160 1.00 0.00 H new ATOM 0 HB3 GLU B 142 14.429 -1.475 -5.486 1.00 0.00 H new ATOM 0 HG2 GLU B 142 13.363 -3.544 -4.733 1.00 0.00 H new ATOM 0 HG3 GLU B 142 12.849 -3.916 -6.367 1.00 0.00 H new ATOM 1472 N ARG B 143 11.322 0.804 -6.877 1.00 0.00 N ATOM 1473 CA ARG B 143 11.320 2.161 -7.412 1.00 0.00 C ATOM 1474 C ARG B 143 10.061 2.962 -7.017 1.00 0.00 C ATOM 1475 O ARG B 143 10.107 4.186 -6.996 1.00 0.00 O ATOM 1476 CB ARG B 143 11.438 2.121 -8.947 1.00 0.00 C ATOM 1477 CG ARG B 143 10.188 1.590 -9.644 1.00 0.00 C ATOM 1478 CD ARG B 143 10.337 1.553 -11.154 1.00 0.00 C ATOM 1479 NE ARG B 143 10.876 2.816 -11.675 1.00 0.00 N ATOM 1480 CZ ARG B 143 10.132 3.898 -11.932 1.00 0.00 C ATOM 1481 NH1 ARG B 143 8.831 3.908 -11.689 1.00 0.00 N ATOM 1482 NH2 ARG B 143 10.718 5.003 -12.422 1.00 0.00 N ATOM 0 H ARG B 143 10.402 0.368 -6.821 1.00 0.00 H new ATOM 0 HA ARG B 143 12.179 2.671 -6.976 1.00 0.00 H new ATOM 0 HB2 ARG B 143 11.648 3.126 -9.313 1.00 0.00 H new ATOM 0 HB3 ARG B 143 12.289 1.497 -9.221 1.00 0.00 H new ATOM 0 HG2 ARG B 143 9.971 0.586 -9.279 1.00 0.00 H new ATOM 0 HG3 ARG B 143 9.335 2.216 -9.381 1.00 0.00 H new ATOM 0 HD2 ARG B 143 10.996 0.732 -11.435 1.00 0.00 H new ATOM 0 HD3 ARG B 143 9.368 1.354 -11.611 1.00 0.00 H new ATOM 0 HE ARG B 143 11.879 2.872 -11.852 1.00 0.00 H new ATOM 0 HH11 ARG B 143 8.379 3.081 -11.299 1.00 0.00 H new ATOM 0 HH12 ARG B 143 8.281 4.743 -11.892 1.00 0.00 H new ATOM 0 HH21 ARG B 143 11.723 5.013 -12.596 1.00 0.00 H new ATOM 0 HH22 ARG B 143 10.158 5.832 -12.621 1.00 0.00 H new ATOM 1496 N LEU B 144 8.960 2.249 -6.743 1.00 0.00 N ATOM 1497 CA LEU B 144 7.667 2.874 -6.412 1.00 0.00 C ATOM 1498 C LEU B 144 7.029 3.458 -7.675 1.00 0.00 C ATOM 1499 O LEU B 144 7.725 3.808 -8.632 1.00 0.00 O ATOM 1500 CB LEU B 144 7.827 3.941 -5.307 1.00 0.00 C ATOM 1501 CG LEU B 144 8.212 3.415 -3.923 1.00 0.00 C ATOM 1502 CD1 LEU B 144 8.431 4.564 -2.950 1.00 0.00 C ATOM 1503 CD2 LEU B 144 7.158 2.438 -3.398 1.00 0.00 C ATOM 0 H LEU B 144 8.937 1.229 -6.744 1.00 0.00 H new ATOM 0 HA LEU B 144 7.000 2.108 -6.017 1.00 0.00 H new ATOM 0 HB2 LEU B 144 8.585 4.657 -5.626 1.00 0.00 H new ATOM 0 HB3 LEU B 144 6.889 4.488 -5.219 1.00 0.00 H new ATOM 0 HG LEU B 144 9.152 2.871 -4.015 1.00 0.00 H new ATOM 0 HD11 LEU B 144 8.704 4.166 -1.973 1.00 0.00 H new ATOM 0 HD12 LEU B 144 9.233 5.204 -3.318 1.00 0.00 H new ATOM 0 HD13 LEU B 144 7.514 5.146 -2.862 1.00 0.00 H new ATOM 0 HD21 LEU B 144 7.454 2.078 -2.413 1.00 0.00 H new ATOM 0 HD22 LEU B 144 6.196 2.945 -3.325 1.00 0.00 H new ATOM 0 HD23 LEU B 144 7.072 1.594 -4.082 1.00 0.00 H new ATOM 1515 N PRO B 145 5.676 3.563 -7.717 1.00 0.00 N ATOM 1516 CA PRO B 145 4.945 4.010 -8.906 1.00 0.00 C ATOM 1517 C PRO B 145 4.888 5.531 -9.035 1.00 0.00 C ATOM 1518 O PRO B 145 4.734 6.057 -10.144 1.00 0.00 O ATOM 1519 CB PRO B 145 3.561 3.423 -8.678 1.00 0.00 C ATOM 1520 CG PRO B 145 3.377 3.499 -7.187 1.00 0.00 C ATOM 1521 CD PRO B 145 4.747 3.258 -6.593 1.00 0.00 C ATOM 0 HA PRO B 145 5.419 3.688 -9.833 1.00 0.00 H new ATOM 0 HB2 PRO B 145 2.794 3.991 -9.205 1.00 0.00 H new ATOM 0 HB3 PRO B 145 3.499 2.395 -9.036 1.00 0.00 H new ATOM 0 HG2 PRO B 145 2.987 4.472 -6.890 1.00 0.00 H new ATOM 0 HG3 PRO B 145 2.663 2.751 -6.842 1.00 0.00 H new ATOM 0 HD2 PRO B 145 4.931 3.904 -5.735 1.00 0.00 H new ATOM 0 HD3 PRO B 145 4.859 2.230 -6.248 1.00 0.00 H new ATOM 1529 N PHE B 146 5.012 6.230 -7.910 1.00 0.00 N ATOM 1530 CA PHE B 146 4.899 7.690 -7.885 1.00 0.00 C ATOM 1531 C PHE B 146 5.968 8.306 -7.009 1.00 0.00 C ATOM 1532 O PHE B 146 6.851 9.018 -7.493 1.00 0.00 O ATOM 1533 CB PHE B 146 3.517 8.120 -7.390 1.00 0.00 C ATOM 1534 CG PHE B 146 2.378 7.713 -8.287 1.00 0.00 C ATOM 1535 CD1 PHE B 146 2.088 8.454 -9.424 1.00 0.00 C ATOM 1536 CD2 PHE B 146 1.599 6.606 -7.997 1.00 0.00 C ATOM 1537 CE1 PHE B 146 1.041 8.096 -10.253 1.00 0.00 C ATOM 1538 CE2 PHE B 146 0.543 6.243 -8.817 1.00 0.00 C ATOM 1539 CZ PHE B 146 0.267 6.993 -9.942 1.00 0.00 C ATOM 0 H PHE B 146 5.192 5.809 -6.999 1.00 0.00 H new ATOM 0 HA PHE B 146 5.037 8.046 -8.906 1.00 0.00 H new ATOM 0 HB2 PHE B 146 3.352 7.696 -6.399 1.00 0.00 H new ATOM 0 HB3 PHE B 146 3.506 9.204 -7.279 1.00 0.00 H new ATOM 0 HD1 PHE B 146 2.687 9.320 -9.664 1.00 0.00 H new ATOM 0 HD2 PHE B 146 1.818 6.017 -7.119 1.00 0.00 H new ATOM 0 HE1 PHE B 146 0.829 8.675 -11.139 1.00 0.00 H new ATOM 0 HE2 PHE B 146 -0.060 5.379 -8.578 1.00 0.00 H new ATOM 0 HZ PHE B 146 -0.558 6.717 -10.583 1.00 0.00 H new ATOM 1549 N LYS B 147 5.889 8.004 -5.708 1.00 0.00 N ATOM 1550 CA LYS B 147 6.698 8.688 -4.707 1.00 0.00 C ATOM 1551 C LYS B 147 6.417 10.198 -4.765 1.00 0.00 C ATOM 1552 O LYS B 147 7.241 11.010 -5.196 1.00 0.00 O ATOM 1553 CB LYS B 147 8.203 8.355 -4.871 1.00 0.00 C ATOM 1554 CG LYS B 147 9.133 9.219 -4.025 1.00 0.00 C ATOM 1555 CD LYS B 147 8.806 9.174 -2.527 1.00 0.00 C ATOM 1556 CE LYS B 147 9.770 10.046 -1.746 1.00 0.00 C ATOM 1557 NZ LYS B 147 9.405 10.157 -0.313 1.00 0.00 N ATOM 0 H LYS B 147 5.270 7.288 -5.328 1.00 0.00 H new ATOM 0 HA LYS B 147 6.420 8.332 -3.715 1.00 0.00 H new ATOM 0 HB2 LYS B 147 8.362 7.308 -4.611 1.00 0.00 H new ATOM 0 HB3 LYS B 147 8.476 8.468 -5.920 1.00 0.00 H new ATOM 0 HG2 LYS B 147 10.161 8.889 -4.176 1.00 0.00 H new ATOM 0 HG3 LYS B 147 9.075 10.251 -4.372 1.00 0.00 H new ATOM 0 HD2 LYS B 147 7.784 9.514 -2.362 1.00 0.00 H new ATOM 0 HD3 LYS B 147 8.863 8.147 -2.167 1.00 0.00 H new ATOM 0 HE2 LYS B 147 10.776 9.635 -1.830 1.00 0.00 H new ATOM 0 HE3 LYS B 147 9.794 11.042 -2.189 1.00 0.00 H new ATOM 0 HZ1 LYS B 147 9.182 11.147 -0.087 1.00 0.00 H new ATOM 0 HZ2 LYS B 147 8.574 9.562 -0.119 1.00 0.00 H new ATOM 0 HZ3 LYS B 147 10.202 9.839 0.274 1.00 0.00 H new ATOM 1571 N GLN B 148 5.185 10.555 -4.383 1.00 0.00 N ATOM 1572 CA GLN B 148 4.779 11.960 -4.277 1.00 0.00 C ATOM 1573 C GLN B 148 5.717 12.768 -3.390 1.00 0.00 C ATOM 1574 O GLN B 148 6.299 12.264 -2.432 1.00 0.00 O ATOM 1575 CB GLN B 148 3.320 12.060 -3.771 1.00 0.00 C ATOM 1576 CG GLN B 148 2.881 10.959 -2.782 1.00 0.00 C ATOM 1577 CD GLN B 148 3.765 10.844 -1.553 1.00 0.00 C ATOM 1578 OE1 GLN B 148 4.794 10.002 -1.637 1.00 0.00 O flip ATOM 1579 NE2 GLN B 148 3.512 11.494 -0.534 1.00 0.00 N flip ATOM 0 H GLN B 148 4.451 9.888 -4.142 1.00 0.00 H new ATOM 0 HA GLN B 148 4.839 12.393 -5.276 1.00 0.00 H new ATOM 0 HB2 GLN B 148 3.186 13.029 -3.291 1.00 0.00 H new ATOM 0 HB3 GLN B 148 2.653 12.037 -4.633 1.00 0.00 H new ATOM 0 HG2 GLN B 148 1.858 11.158 -2.463 1.00 0.00 H new ATOM 0 HG3 GLN B 148 2.872 10.001 -3.302 1.00 0.00 H new ATOM 0 HE21 GLN B 148 2.712 12.127 -0.518 1.00 0.00 H new ATOM 0 HE22 GLN B 148 4.103 11.398 0.292 1.00 0.00 H new ATOM 1588 N THR B 149 5.862 14.039 -3.737 1.00 0.00 N ATOM 1589 CA THR B 149 6.676 14.975 -2.964 1.00 0.00 C ATOM 1590 C THR B 149 5.760 15.952 -2.231 1.00 0.00 C ATOM 1591 O THR B 149 6.155 16.564 -1.242 1.00 0.00 O ATOM 1592 CB THR B 149 7.631 15.754 -3.894 1.00 0.00 C ATOM 1593 OG1 THR B 149 6.903 16.290 -5.012 1.00 0.00 O ATOM 1594 CG2 THR B 149 8.766 14.877 -4.393 1.00 0.00 C ATOM 0 H THR B 149 5.422 14.452 -4.559 1.00 0.00 H new ATOM 0 HA THR B 149 7.272 14.417 -2.243 1.00 0.00 H new ATOM 0 HB THR B 149 8.065 16.569 -3.315 1.00 0.00 H new ATOM 0 HG1 THR B 149 7.516 16.784 -5.595 1.00 0.00 H new ATOM 0 HG21 THR B 149 9.417 15.460 -5.044 1.00 0.00 H new ATOM 0 HG22 THR B 149 9.340 14.507 -3.544 1.00 0.00 H new ATOM 0 HG23 THR B 149 8.357 14.034 -4.950 1.00 0.00 H new ATOM 1602 N LEU B 150 4.528 16.069 -2.732 1.00 0.00 N ATOM 1603 CA LEU B 150 3.501 16.945 -2.169 1.00 0.00 C ATOM 1604 C LEU B 150 3.979 18.403 -2.132 1.00 0.00 C ATOM 1605 O LEU B 150 4.206 18.954 -1.027 1.00 0.00 O ATOM 1606 CB LEU B 150 3.093 16.462 -0.768 1.00 0.00 C ATOM 1607 CG LEU B 150 2.585 15.003 -0.701 1.00 0.00 C ATOM 1608 CD1 LEU B 150 2.217 14.624 0.732 1.00 0.00 C ATOM 1609 CD2 LEU B 150 1.391 14.788 -1.631 1.00 0.00 C ATOM 1610 OXT LEU B 150 4.147 18.989 -3.224 1.00 0.00 O ATOM 0 H LEU B 150 4.213 15.550 -3.552 1.00 0.00 H new ATOM 0 HA LEU B 150 2.624 16.902 -2.815 1.00 0.00 H new ATOM 0 HB2 LEU B 150 3.950 16.563 -0.102 1.00 0.00 H new ATOM 0 HB3 LEU B 150 2.313 17.120 -0.386 1.00 0.00 H new ATOM 0 HG LEU B 150 3.395 14.355 -1.036 1.00 0.00 H new ATOM 0 HD11 LEU B 150 1.862 13.594 0.756 1.00 0.00 H new ATOM 0 HD12 LEU B 150 3.095 14.720 1.371 1.00 0.00 H new ATOM 0 HD13 LEU B 150 1.431 15.287 1.093 1.00 0.00 H new ATOM 0 HD21 LEU B 150 1.057 13.753 -1.561 1.00 0.00 H new ATOM 0 HD22 LEU B 150 0.578 15.452 -1.338 1.00 0.00 H new ATOM 0 HD23 LEU B 150 1.686 15.006 -2.658 1.00 0.00 H new TER 1622 LEU B 150