USER MOD reduce.3.24.130724 H: found=0, std=0, add=785, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 785 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 41 THR OG1 : rot 88:sc= 0.976 USER MOD Set 1.2: A 75 CYS SG : rot -64:sc= 0.47 USER MOD Set 2.1: A 37 ASN : amide:sc= -0.54! C(o=0.45!,f=-8.7!) USER MOD Set 2.2: A 74 SER OG : rot -150:sc= 0.991 USER MOD Set 3.1: A 1 MET N :NH3+ -127:sc= 0.0137 (180deg=-0.178) USER MOD Set 3.2: A 3 ASN : amide:sc= -1.05! K(o=-1!,f=-0.088) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 18:sc= 0.87 USER MOD Single : A 7 LYS NZ :NH3+ 171:sc= 1.23 (180deg=0.986) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 ASN : amide:sc= -0.0408 K(o=-0.041,f=-0.75) USER MOD Single : A 12 LYS NZ :NH3+ -120:sc= 0.152 (180deg=-2.36!) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0.22) USER MOD Single : A 21 ASN : amide:sc= 1.06 K(o=1.1,f=-0.53) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.951! USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 40 HIS : no HD1:sc= -0.0795 X(o=-0.079,f=0) USER MOD Single : A 44 SER OG : rot 79:sc= 0.847 USER MOD Single : A 50 GLN : amide:sc= -0.768 K(o=-0.77,f=-0.083) USER MOD Single : A 54 LYS NZ :NH3+ 172:sc= 0.0356 (180deg=0.0137) USER MOD Single : A 55 LYS NZ :NH3+ -141:sc= -0.225 (180deg=-0.329) USER MOD Single : A 58 LYS NZ :NH3+ -136:sc= 0.287 (180deg=-0.0737) USER MOD Single : A 63 HIS : no HD1:sc= -0.0558 X(o=-0.056,f=0) USER MOD Single : A 67 ASN : amide:sc= -1.71 K(o=-1.7,f=0) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0.028 USER MOD Single : A 79 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0102) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 MET CE :methyl 171:sc= -1.77 (180deg=-1.97) USER MOD Single : A 84 LYS NZ :NH3+ 177:sc= 1.22 (180deg=1.16) USER MOD Single : A 87 SER OG : rot 118:sc= 1.21 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -1.09 K(o=-1.1,f=0) USER MOD Single : A 92 TYR OH : rot 59:sc= 0.69 USER MOD Single : A 97 HIS : no HD1:sc= -0.262 X(o=-0.26,f=-0.31) USER MOD Single : A 98 HIS : no HD1:sc= -0.0951 X(o=-0.095,f=-0.37) USER MOD Single : A 99 HIS : no HD1:sc= -0.104 X(o=-0.1,f=-0.0021) USER MOD Single : A 100 HIS : no HD1:sc= -0.0381 X(o=-0.038,f=-0.45) USER MOD Single : A 101 HIS : no HD1:sc= -0.0858 X(o=-0.086,f=-0.0025) USER MOD Single : A 102 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 26.554 1.865 -3.357 1.00 0.00 N ATOM 2 CA MET A 1 26.998 1.379 -4.681 1.00 0.00 C ATOM 3 C MET A 1 25.922 0.501 -5.304 1.00 0.00 C ATOM 4 O MET A 1 25.538 -0.519 -4.730 1.00 0.00 O ATOM 5 CB MET A 1 28.312 0.597 -4.552 1.00 0.00 C ATOM 6 CG MET A 1 29.468 1.441 -4.035 1.00 0.00 C ATOM 7 SD MET A 1 31.022 0.533 -3.934 1.00 0.00 S ATOM 8 CE MET A 1 32.125 1.831 -3.374 1.00 0.00 C ATOM 0 H1 MET A 1 26.640 2.901 -3.321 1.00 0.00 H new ATOM 0 H2 MET A 1 25.562 1.595 -3.203 1.00 0.00 H new ATOM 0 H3 MET A 1 27.147 1.442 -2.615 1.00 0.00 H new ATOM 0 HA MET A 1 27.169 2.239 -5.328 1.00 0.00 H new ATOM 0 HB2 MET A 1 28.159 -0.248 -3.880 1.00 0.00 H new ATOM 0 HB3 MET A 1 28.579 0.186 -5.526 1.00 0.00 H new ATOM 0 HG2 MET A 1 29.600 2.303 -4.689 1.00 0.00 H new ATOM 0 HG3 MET A 1 29.215 1.826 -3.047 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.132 1.429 -3.262 1.00 0.00 H new ATOM 0 HE2 MET A 1 32.136 2.639 -4.105 1.00 0.00 H new ATOM 0 HE3 MET A 1 31.778 2.214 -2.414 1.00 0.00 H new ATOM 20 N SER A 2 25.446 0.910 -6.481 1.00 0.00 N ATOM 21 CA SER A 2 24.367 0.223 -7.200 1.00 0.00 C ATOM 22 C SER A 2 23.168 -0.042 -6.283 1.00 0.00 C ATOM 23 O SER A 2 22.824 -1.191 -5.991 1.00 0.00 O ATOM 24 CB SER A 2 24.867 -1.078 -7.861 1.00 0.00 C ATOM 25 OG SER A 2 25.469 -1.963 -6.926 1.00 0.00 O ATOM 0 H SER A 2 25.800 1.734 -6.968 1.00 0.00 H new ATOM 0 HA SER A 2 24.032 0.886 -7.998 1.00 0.00 H new ATOM 0 HB2 SER A 2 24.030 -1.581 -8.347 1.00 0.00 H new ATOM 0 HB3 SER A 2 25.588 -0.833 -8.641 1.00 0.00 H new ATOM 0 HG SER A 2 25.199 -1.713 -6.018 1.00 0.00 H new ATOM 31 N ASN A 3 22.541 1.035 -5.826 1.00 0.00 N ATOM 32 CA ASN A 3 21.429 0.936 -4.884 1.00 0.00 C ATOM 33 C ASN A 3 20.237 1.764 -5.351 1.00 0.00 C ATOM 34 O ASN A 3 19.950 2.823 -4.796 1.00 0.00 O ATOM 35 CB ASN A 3 21.854 1.393 -3.479 1.00 0.00 C ATOM 36 CG ASN A 3 22.817 0.437 -2.794 1.00 0.00 C ATOM 37 OD1 ASN A 3 23.696 0.859 -2.040 1.00 0.00 O ATOM 38 ND2 ASN A 3 22.651 -0.855 -3.031 1.00 0.00 N ATOM 0 H ASN A 3 22.783 1.989 -6.092 1.00 0.00 H new ATOM 0 HA ASN A 3 21.134 -0.112 -4.841 1.00 0.00 H new ATOM 0 HB2 ASN A 3 22.320 2.376 -3.551 1.00 0.00 H new ATOM 0 HB3 ASN A 3 20.965 1.507 -2.859 1.00 0.00 H new ATOM 0 HD21 ASN A 3 23.262 -1.538 -2.583 1.00 0.00 H new ATOM 0 HD22 ASN A 3 21.912 -1.167 -3.661 1.00 0.00 H new ATOM 45 N LEU A 4 19.564 1.292 -6.389 1.00 0.00 N ATOM 46 CA LEU A 4 18.353 1.944 -6.880 1.00 0.00 C ATOM 47 C LEU A 4 17.293 0.885 -7.172 1.00 0.00 C ATOM 48 O LEU A 4 16.267 1.147 -7.806 1.00 0.00 O ATOM 49 CB LEU A 4 18.665 2.764 -8.139 1.00 0.00 C ATOM 50 CG LEU A 4 17.565 3.733 -8.582 1.00 0.00 C ATOM 51 CD1 LEU A 4 17.252 4.724 -7.470 1.00 0.00 C ATOM 52 CD2 LEU A 4 17.985 4.467 -9.848 1.00 0.00 C ATOM 0 H LEU A 4 19.834 0.458 -6.911 1.00 0.00 H new ATOM 0 HA LEU A 4 17.972 2.626 -6.120 1.00 0.00 H new ATOM 0 HB2 LEU A 4 19.578 3.333 -7.964 1.00 0.00 H new ATOM 0 HB3 LEU A 4 18.871 2.075 -8.959 1.00 0.00 H new ATOM 0 HG LEU A 4 16.663 3.160 -8.797 1.00 0.00 H new ATOM 0 HD11 LEU A 4 16.468 5.406 -7.800 1.00 0.00 H new ATOM 0 HD12 LEU A 4 16.914 4.184 -6.586 1.00 0.00 H new ATOM 0 HD13 LEU A 4 18.149 5.293 -7.227 1.00 0.00 H new ATOM 0 HD21 LEU A 4 17.193 5.152 -10.151 1.00 0.00 H new ATOM 0 HD22 LEU A 4 18.898 5.030 -9.656 1.00 0.00 H new ATOM 0 HD23 LEU A 4 18.164 3.745 -10.645 1.00 0.00 H new ATOM 64 N GLU A 5 17.565 -0.312 -6.676 1.00 0.00 N ATOM 65 CA GLU A 5 16.702 -1.466 -6.877 1.00 0.00 C ATOM 66 C GLU A 5 15.438 -1.379 -6.025 1.00 0.00 C ATOM 67 O GLU A 5 15.379 -0.630 -5.047 1.00 0.00 O ATOM 68 CB GLU A 5 17.470 -2.739 -6.525 1.00 0.00 C ATOM 69 CG GLU A 5 18.133 -2.671 -5.160 1.00 0.00 C ATOM 70 CD GLU A 5 18.829 -3.955 -4.777 1.00 0.00 C ATOM 71 OE1 GLU A 5 19.966 -4.183 -5.239 1.00 0.00 O ATOM 72 OE2 GLU A 5 18.246 -4.732 -3.998 1.00 0.00 O ATOM 0 H GLU A 5 18.396 -0.512 -6.119 1.00 0.00 H new ATOM 0 HA GLU A 5 16.399 -1.485 -7.924 1.00 0.00 H new ATOM 0 HB2 GLU A 5 16.787 -3.588 -6.550 1.00 0.00 H new ATOM 0 HB3 GLU A 5 18.231 -2.920 -7.284 1.00 0.00 H new ATOM 0 HG2 GLU A 5 18.857 -1.856 -5.154 1.00 0.00 H new ATOM 0 HG3 GLU A 5 17.380 -2.434 -4.408 1.00 0.00 H new ATOM 79 N ILE A 6 14.437 -2.160 -6.402 1.00 0.00 N ATOM 80 CA ILE A 6 13.184 -2.222 -5.663 1.00 0.00 C ATOM 81 C ILE A 6 13.125 -3.510 -4.849 1.00 0.00 C ATOM 82 O ILE A 6 13.206 -4.607 -5.403 1.00 0.00 O ATOM 83 CB ILE A 6 11.963 -2.159 -6.608 1.00 0.00 C ATOM 84 CG1 ILE A 6 12.066 -0.939 -7.529 1.00 0.00 C ATOM 85 CG2 ILE A 6 10.670 -2.111 -5.801 1.00 0.00 C ATOM 86 CD1 ILE A 6 10.950 -0.848 -8.548 1.00 0.00 C ATOM 0 H ILE A 6 14.469 -2.765 -7.223 1.00 0.00 H new ATOM 0 HA ILE A 6 13.148 -1.358 -4.999 1.00 0.00 H new ATOM 0 HB ILE A 6 11.952 -3.058 -7.224 1.00 0.00 H new ATOM 0 HG12 ILE A 6 12.065 -0.035 -6.920 1.00 0.00 H new ATOM 0 HG13 ILE A 6 13.022 -0.970 -8.052 1.00 0.00 H new ATOM 0 HG21 ILE A 6 9.819 -2.067 -6.480 1.00 0.00 H new ATOM 0 HG22 ILE A 6 10.594 -3.005 -5.182 1.00 0.00 H new ATOM 0 HG23 ILE A 6 10.672 -1.227 -5.163 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.091 0.041 -9.163 1.00 0.00 H new ATOM 0 HD12 ILE A 6 10.963 -1.734 -9.182 1.00 0.00 H new ATOM 0 HD13 ILE A 6 9.991 -0.785 -8.033 1.00 0.00 H new ATOM 98 N LYS A 7 12.995 -3.377 -3.538 1.00 0.00 N ATOM 99 CA LYS A 7 12.946 -4.535 -2.656 1.00 0.00 C ATOM 100 C LYS A 7 11.557 -5.161 -2.674 1.00 0.00 C ATOM 101 O LYS A 7 10.557 -4.484 -2.420 1.00 0.00 O ATOM 102 CB LYS A 7 13.327 -4.150 -1.222 1.00 0.00 C ATOM 103 CG LYS A 7 14.825 -4.008 -0.968 1.00 0.00 C ATOM 104 CD LYS A 7 15.455 -2.889 -1.784 1.00 0.00 C ATOM 105 CE LYS A 7 16.911 -2.674 -1.402 1.00 0.00 C ATOM 106 NZ LYS A 7 17.718 -3.918 -1.529 1.00 0.00 N ATOM 0 H LYS A 7 12.921 -2.479 -3.060 1.00 0.00 H new ATOM 0 HA LYS A 7 13.669 -5.265 -3.021 1.00 0.00 H new ATOM 0 HB2 LYS A 7 12.841 -3.207 -0.974 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.928 -4.903 -0.542 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.993 -3.818 0.092 1.00 0.00 H new ATOM 0 HG3 LYS A 7 15.321 -4.949 -1.206 1.00 0.00 H new ATOM 0 HD2 LYS A 7 15.388 -3.128 -2.845 1.00 0.00 H new ATOM 0 HD3 LYS A 7 14.897 -1.966 -1.629 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.340 -1.899 -2.037 1.00 0.00 H new ATOM 0 HE3 LYS A 7 16.965 -2.312 -0.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.726 -3.692 -1.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 17.425 -4.598 -0.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.568 -4.335 -2.470 1.00 0.00 H new ATOM 120 N GLN A 8 11.505 -6.446 -2.989 1.00 0.00 N ATOM 121 CA GLN A 8 10.242 -7.167 -3.054 1.00 0.00 C ATOM 122 C GLN A 8 9.876 -7.731 -1.687 1.00 0.00 C ATOM 123 O GLN A 8 10.588 -8.579 -1.145 1.00 0.00 O ATOM 124 CB GLN A 8 10.332 -8.300 -4.078 1.00 0.00 C ATOM 125 CG GLN A 8 9.036 -9.078 -4.250 1.00 0.00 C ATOM 126 CD GLN A 8 9.184 -10.242 -5.211 1.00 0.00 C ATOM 127 OE1 GLN A 8 8.991 -10.096 -6.417 1.00 0.00 O ATOM 128 NE2 GLN A 8 9.524 -11.408 -4.681 1.00 0.00 N ATOM 0 H GLN A 8 12.325 -7.013 -3.204 1.00 0.00 H new ATOM 0 HA GLN A 8 9.464 -6.469 -3.363 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.625 -7.883 -5.042 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.121 -8.989 -3.775 1.00 0.00 H new ATOM 0 HG2 GLN A 8 8.708 -9.451 -3.280 1.00 0.00 H new ATOM 0 HG3 GLN A 8 8.258 -8.407 -4.614 1.00 0.00 H new ATOM 0 HE21 GLN A 8 9.675 -11.486 -3.675 1.00 0.00 H new ATOM 0 HE22 GLN A 8 9.635 -12.227 -5.279 1.00 0.00 H new ATOM 137 N GLY A 9 8.772 -7.252 -1.135 1.00 0.00 N ATOM 138 CA GLY A 9 8.303 -7.740 0.143 1.00 0.00 C ATOM 139 C GLY A 9 6.910 -8.327 0.040 1.00 0.00 C ATOM 140 O GLY A 9 6.401 -8.525 -1.066 1.00 0.00 O ATOM 0 H GLY A 9 8.189 -6.528 -1.554 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.991 -8.498 0.518 1.00 0.00 H new ATOM 0 HA3 GLY A 9 8.302 -6.924 0.866 1.00 0.00 H new ATOM 144 N GLU A 10 6.290 -8.584 1.188 1.00 0.00 N ATOM 145 CA GLU A 10 4.958 -9.188 1.243 1.00 0.00 C ATOM 146 C GLU A 10 3.910 -8.267 0.620 1.00 0.00 C ATOM 147 O GLU A 10 3.391 -7.372 1.290 1.00 0.00 O ATOM 148 CB GLU A 10 4.574 -9.480 2.695 1.00 0.00 C ATOM 149 CG GLU A 10 5.589 -10.329 3.436 1.00 0.00 C ATOM 150 CD GLU A 10 5.238 -10.513 4.895 1.00 0.00 C ATOM 151 OE1 GLU A 10 4.513 -11.477 5.217 1.00 0.00 O ATOM 152 OE2 GLU A 10 5.685 -9.692 5.726 1.00 0.00 O ATOM 0 H GLU A 10 6.692 -8.382 2.103 1.00 0.00 H new ATOM 0 HA GLU A 10 4.988 -10.118 0.675 1.00 0.00 H new ATOM 0 HB2 GLU A 10 4.448 -8.536 3.225 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.609 -9.986 2.711 1.00 0.00 H new ATOM 0 HG2 GLU A 10 5.659 -11.306 2.957 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.572 -9.864 3.358 1.00 0.00 H new ATOM 159 N ASN A 11 3.629 -8.476 -0.670 1.00 0.00 N ATOM 160 CA ASN A 11 2.649 -7.668 -1.411 1.00 0.00 C ATOM 161 C ASN A 11 2.990 -6.181 -1.334 1.00 0.00 C ATOM 162 O ASN A 11 2.116 -5.317 -1.452 1.00 0.00 O ATOM 163 CB ASN A 11 1.227 -7.903 -0.887 1.00 0.00 C ATOM 164 CG ASN A 11 0.616 -9.211 -1.367 1.00 0.00 C ATOM 165 OD1 ASN A 11 1.312 -10.205 -1.582 1.00 0.00 O ATOM 166 ND2 ASN A 11 -0.694 -9.209 -1.555 1.00 0.00 N ATOM 0 H ASN A 11 4.071 -9.206 -1.230 1.00 0.00 H new ATOM 0 HA ASN A 11 2.693 -7.983 -2.454 1.00 0.00 H new ATOM 0 HB2 ASN A 11 1.243 -7.896 0.203 1.00 0.00 H new ATOM 0 HB3 ASN A 11 0.590 -7.076 -1.201 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -1.163 -10.051 -1.889 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -1.235 -8.365 -1.365 1.00 0.00 H new ATOM 173 N LYS A 12 4.269 -5.890 -1.152 1.00 0.00 N ATOM 174 CA LYS A 12 4.730 -4.522 -1.015 1.00 0.00 C ATOM 175 C LYS A 12 6.080 -4.347 -1.698 1.00 0.00 C ATOM 176 O LYS A 12 6.934 -5.232 -1.652 1.00 0.00 O ATOM 177 CB LYS A 12 4.832 -4.134 0.470 1.00 0.00 C ATOM 178 CG LYS A 12 5.859 -4.944 1.252 1.00 0.00 C ATOM 179 CD LYS A 12 5.897 -4.575 2.733 1.00 0.00 C ATOM 180 CE LYS A 12 6.249 -3.111 2.955 1.00 0.00 C ATOM 181 NZ LYS A 12 5.038 -2.249 2.990 1.00 0.00 N ATOM 0 H LYS A 12 5.009 -6.590 -1.096 1.00 0.00 H new ATOM 0 HA LYS A 12 4.006 -3.865 -1.497 1.00 0.00 H new ATOM 0 HB2 LYS A 12 5.087 -3.077 0.542 1.00 0.00 H new ATOM 0 HB3 LYS A 12 3.854 -4.259 0.936 1.00 0.00 H new ATOM 0 HG2 LYS A 12 5.631 -6.005 1.152 1.00 0.00 H new ATOM 0 HG3 LYS A 12 6.846 -4.788 0.817 1.00 0.00 H new ATOM 0 HD2 LYS A 12 4.926 -4.785 3.182 1.00 0.00 H new ATOM 0 HD3 LYS A 12 6.627 -5.203 3.243 1.00 0.00 H new ATOM 0 HE2 LYS A 12 6.796 -3.007 3.892 1.00 0.00 H new ATOM 0 HE3 LYS A 12 6.913 -2.772 2.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 5.094 -1.540 2.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 4.190 -2.836 2.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 4.981 -1.767 3.910 1.00 0.00 H new ATOM 195 N PHE A 13 6.261 -3.214 -2.345 1.00 0.00 N ATOM 196 CA PHE A 13 7.529 -2.891 -2.976 1.00 0.00 C ATOM 197 C PHE A 13 8.083 -1.615 -2.367 1.00 0.00 C ATOM 198 O PHE A 13 7.398 -0.594 -2.337 1.00 0.00 O ATOM 199 CB PHE A 13 7.358 -2.722 -4.490 1.00 0.00 C ATOM 200 CG PHE A 13 6.849 -3.951 -5.192 1.00 0.00 C ATOM 201 CD1 PHE A 13 7.583 -5.126 -5.181 1.00 0.00 C ATOM 202 CD2 PHE A 13 5.634 -3.930 -5.861 1.00 0.00 C ATOM 203 CE1 PHE A 13 7.119 -6.257 -5.825 1.00 0.00 C ATOM 204 CE2 PHE A 13 5.163 -5.058 -6.507 1.00 0.00 C ATOM 205 CZ PHE A 13 5.906 -6.223 -6.489 1.00 0.00 C ATOM 0 H PHE A 13 5.543 -2.497 -2.449 1.00 0.00 H new ATOM 0 HA PHE A 13 8.227 -3.711 -2.805 1.00 0.00 H new ATOM 0 HB2 PHE A 13 6.669 -1.898 -4.677 1.00 0.00 H new ATOM 0 HB3 PHE A 13 8.317 -2.440 -4.924 1.00 0.00 H new ATOM 0 HD1 PHE A 13 8.530 -5.158 -4.662 1.00 0.00 H new ATOM 0 HD2 PHE A 13 5.049 -3.022 -5.877 1.00 0.00 H new ATOM 0 HE1 PHE A 13 7.702 -7.166 -5.810 1.00 0.00 H new ATOM 0 HE2 PHE A 13 4.216 -5.029 -7.025 1.00 0.00 H new ATOM 0 HZ PHE A 13 5.540 -7.106 -6.993 1.00 0.00 H new ATOM 215 N TYR A 14 9.306 -1.669 -1.859 1.00 0.00 N ATOM 216 CA TYR A 14 9.898 -0.496 -1.236 1.00 0.00 C ATOM 217 C TYR A 14 11.318 -0.254 -1.717 1.00 0.00 C ATOM 218 O TYR A 14 12.081 -1.190 -1.957 1.00 0.00 O ATOM 219 CB TYR A 14 9.856 -0.594 0.296 1.00 0.00 C ATOM 220 CG TYR A 14 10.555 -1.793 0.905 1.00 0.00 C ATOM 221 CD1 TYR A 14 9.896 -3.007 1.052 1.00 0.00 C ATOM 222 CD2 TYR A 14 11.862 -1.696 1.367 1.00 0.00 C ATOM 223 CE1 TYR A 14 10.519 -4.090 1.638 1.00 0.00 C ATOM 224 CE2 TYR A 14 12.495 -2.777 1.949 1.00 0.00 C ATOM 225 CZ TYR A 14 11.818 -3.971 2.085 1.00 0.00 C ATOM 226 OH TYR A 14 12.441 -5.049 2.670 1.00 0.00 O ATOM 0 H TYR A 14 9.899 -2.499 -1.865 1.00 0.00 H new ATOM 0 HA TYR A 14 9.295 0.360 -1.540 1.00 0.00 H new ATOM 0 HB2 TYR A 14 10.302 0.310 0.710 1.00 0.00 H new ATOM 0 HB3 TYR A 14 8.813 -0.608 0.611 1.00 0.00 H new ATOM 0 HD1 TYR A 14 8.879 -3.105 0.702 1.00 0.00 H new ATOM 0 HD2 TYR A 14 12.392 -0.760 1.269 1.00 0.00 H new ATOM 0 HE1 TYR A 14 9.992 -5.026 1.746 1.00 0.00 H new ATOM 0 HE2 TYR A 14 13.514 -2.688 2.296 1.00 0.00 H new ATOM 0 HH TYR A 14 13.353 -4.799 2.928 1.00 0.00 H new ATOM 236 N ILE A 15 11.646 1.016 -1.879 1.00 0.00 N ATOM 237 CA ILE A 15 12.983 1.432 -2.255 1.00 0.00 C ATOM 238 C ILE A 15 13.640 2.155 -1.084 1.00 0.00 C ATOM 239 O ILE A 15 13.129 3.169 -0.595 1.00 0.00 O ATOM 240 CB ILE A 15 12.968 2.352 -3.497 1.00 0.00 C ATOM 241 CG1 ILE A 15 12.294 1.638 -4.674 1.00 0.00 C ATOM 242 CG2 ILE A 15 14.386 2.773 -3.869 1.00 0.00 C ATOM 243 CD1 ILE A 15 12.207 2.477 -5.932 1.00 0.00 C ATOM 0 H ILE A 15 10.991 1.788 -1.753 1.00 0.00 H new ATOM 0 HA ILE A 15 13.555 0.540 -2.510 1.00 0.00 H new ATOM 0 HB ILE A 15 12.397 3.249 -3.259 1.00 0.00 H new ATOM 0 HG12 ILE A 15 12.845 0.724 -4.896 1.00 0.00 H new ATOM 0 HG13 ILE A 15 11.288 1.340 -4.378 1.00 0.00 H new ATOM 0 HG21 ILE A 15 14.355 3.420 -4.746 1.00 0.00 H new ATOM 0 HG22 ILE A 15 14.836 3.312 -3.035 1.00 0.00 H new ATOM 0 HG23 ILE A 15 14.982 1.888 -4.092 1.00 0.00 H new ATOM 0 HD11 ILE A 15 11.718 1.903 -6.719 1.00 0.00 H new ATOM 0 HD12 ILE A 15 11.630 3.379 -5.729 1.00 0.00 H new ATOM 0 HD13 ILE A 15 13.211 2.754 -6.255 1.00 0.00 H new ATOM 255 N GLY A 16 14.745 1.599 -0.618 1.00 0.00 N ATOM 256 CA GLY A 16 15.457 2.164 0.505 1.00 0.00 C ATOM 257 C GLY A 16 16.501 1.205 1.029 1.00 0.00 C ATOM 258 O GLY A 16 16.738 0.156 0.425 1.00 0.00 O ATOM 0 H GLY A 16 15.166 0.754 -1.004 1.00 0.00 H new ATOM 0 HA2 GLY A 16 15.934 3.097 0.204 1.00 0.00 H new ATOM 0 HA3 GLY A 16 14.752 2.408 1.300 1.00 0.00 H new ATOM 262 N ASP A 17 17.121 1.555 2.146 1.00 0.00 N ATOM 263 CA ASP A 17 18.157 0.715 2.738 1.00 0.00 C ATOM 264 C ASP A 17 17.538 -0.503 3.408 1.00 0.00 C ATOM 265 O ASP A 17 17.956 -1.639 3.176 1.00 0.00 O ATOM 266 CB ASP A 17 18.983 1.500 3.767 1.00 0.00 C ATOM 267 CG ASP A 17 19.735 2.666 3.159 1.00 0.00 C ATOM 268 OD1 ASP A 17 20.802 2.437 2.550 1.00 0.00 O ATOM 269 OD2 ASP A 17 19.268 3.816 3.298 1.00 0.00 O ATOM 0 H ASP A 17 16.927 2.413 2.662 1.00 0.00 H new ATOM 0 HA ASP A 17 18.817 0.388 1.934 1.00 0.00 H new ATOM 0 HB2 ASP A 17 18.321 1.871 4.549 1.00 0.00 H new ATOM 0 HB3 ASP A 17 19.694 0.826 4.244 1.00 0.00 H new ATOM 274 N ASP A 18 16.530 -0.258 4.231 1.00 0.00 N ATOM 275 CA ASP A 18 15.887 -1.315 4.991 1.00 0.00 C ATOM 276 C ASP A 18 14.428 -0.960 5.248 1.00 0.00 C ATOM 277 O ASP A 18 13.884 -0.063 4.607 1.00 0.00 O ATOM 278 CB ASP A 18 16.622 -1.532 6.321 1.00 0.00 C ATOM 279 CG ASP A 18 16.310 -0.464 7.351 1.00 0.00 C ATOM 280 OD1 ASP A 18 16.751 0.688 7.182 1.00 0.00 O ATOM 281 OD2 ASP A 18 15.604 -0.772 8.332 1.00 0.00 O ATOM 0 H ASP A 18 16.139 0.671 4.389 1.00 0.00 H new ATOM 0 HA ASP A 18 15.928 -2.239 4.414 1.00 0.00 H new ATOM 0 HB2 ASP A 18 16.352 -2.508 6.724 1.00 0.00 H new ATOM 0 HB3 ASP A 18 17.696 -1.549 6.138 1.00 0.00 H new ATOM 286 N GLU A 19 13.806 -1.663 6.189 1.00 0.00 N ATOM 287 CA GLU A 19 12.406 -1.438 6.531 1.00 0.00 C ATOM 288 C GLU A 19 12.198 -0.050 7.135 1.00 0.00 C ATOM 289 O GLU A 19 11.172 0.589 6.903 1.00 0.00 O ATOM 290 CB GLU A 19 11.937 -2.514 7.508 1.00 0.00 C ATOM 291 CG GLU A 19 12.015 -3.916 6.931 1.00 0.00 C ATOM 292 CD GLU A 19 11.959 -4.991 7.994 1.00 0.00 C ATOM 293 OE1 GLU A 19 13.027 -5.363 8.519 1.00 0.00 O ATOM 294 OE2 GLU A 19 10.856 -5.482 8.300 1.00 0.00 O ATOM 0 H GLU A 19 14.255 -2.400 6.733 1.00 0.00 H new ATOM 0 HA GLU A 19 11.816 -1.495 5.616 1.00 0.00 H new ATOM 0 HB2 GLU A 19 12.544 -2.465 8.412 1.00 0.00 H new ATOM 0 HB3 GLU A 19 10.909 -2.305 7.803 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.193 -4.062 6.230 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.940 -4.020 6.364 1.00 0.00 H new ATOM 301 N ASN A 20 13.175 0.416 7.906 1.00 0.00 N ATOM 302 CA ASN A 20 13.094 1.736 8.526 1.00 0.00 C ATOM 303 C ASN A 20 13.477 2.816 7.525 1.00 0.00 C ATOM 304 O ASN A 20 12.865 3.883 7.478 1.00 0.00 O ATOM 305 CB ASN A 20 14.003 1.821 9.755 1.00 0.00 C ATOM 306 CG ASN A 20 13.566 0.897 10.876 1.00 0.00 C ATOM 307 OD1 ASN A 20 13.977 -0.260 10.940 1.00 0.00 O ATOM 308 ND2 ASN A 20 12.741 1.400 11.779 1.00 0.00 N ATOM 0 H ASN A 20 14.030 -0.098 8.117 1.00 0.00 H new ATOM 0 HA ASN A 20 12.064 1.894 8.846 1.00 0.00 H new ATOM 0 HB2 ASN A 20 15.024 1.573 9.464 1.00 0.00 H new ATOM 0 HB3 ASN A 20 14.016 2.848 10.121 1.00 0.00 H new ATOM 0 HD21 ASN A 20 12.426 0.824 12.559 1.00 0.00 H new ATOM 0 HD22 ASN A 20 12.420 2.364 11.695 1.00 0.00 H new ATOM 315 N ASN A 21 14.483 2.527 6.711 1.00 0.00 N ATOM 316 CA ASN A 21 14.934 3.459 5.681 1.00 0.00 C ATOM 317 C ASN A 21 14.161 3.265 4.385 1.00 0.00 C ATOM 318 O ASN A 21 14.696 3.476 3.294 1.00 0.00 O ATOM 319 CB ASN A 21 16.429 3.294 5.418 1.00 0.00 C ATOM 320 CG ASN A 21 17.287 4.071 6.395 1.00 0.00 C ATOM 321 OD1 ASN A 21 16.893 4.322 7.533 1.00 0.00 O ATOM 322 ND2 ASN A 21 18.472 4.461 5.956 1.00 0.00 N ATOM 0 H ASN A 21 15.005 1.652 6.743 1.00 0.00 H new ATOM 0 HA ASN A 21 14.747 4.468 6.049 1.00 0.00 H new ATOM 0 HB2 ASN A 21 16.689 2.237 5.475 1.00 0.00 H new ATOM 0 HB3 ASN A 21 16.653 3.623 4.403 1.00 0.00 H new ATOM 0 HD21 ASN A 21 19.094 4.989 6.568 1.00 0.00 H new ATOM 0 HD22 ASN A 21 18.764 4.234 5.005 1.00 0.00 H new ATOM 329 N ALA A 22 12.905 2.865 4.505 1.00 0.00 N ATOM 330 CA ALA A 22 12.030 2.762 3.352 1.00 0.00 C ATOM 331 C ALA A 22 11.536 4.149 2.969 1.00 0.00 C ATOM 332 O ALA A 22 10.549 4.642 3.515 1.00 0.00 O ATOM 333 CB ALA A 22 10.861 1.830 3.642 1.00 0.00 C ATOM 0 H ALA A 22 12.470 2.607 5.391 1.00 0.00 H new ATOM 0 HA ALA A 22 12.588 2.339 2.516 1.00 0.00 H new ATOM 0 HB1 ALA A 22 10.218 1.768 2.764 1.00 0.00 H new ATOM 0 HB2 ALA A 22 11.239 0.837 3.886 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.288 2.217 4.484 1.00 0.00 H new ATOM 339 N LEU A 23 12.256 4.790 2.058 1.00 0.00 N ATOM 340 CA LEU A 23 11.960 6.161 1.670 1.00 0.00 C ATOM 341 C LEU A 23 10.725 6.222 0.786 1.00 0.00 C ATOM 342 O LEU A 23 9.974 7.201 0.814 1.00 0.00 O ATOM 343 CB LEU A 23 13.160 6.776 0.945 1.00 0.00 C ATOM 344 CG LEU A 23 14.458 6.818 1.754 1.00 0.00 C ATOM 345 CD1 LEU A 23 15.584 7.406 0.923 1.00 0.00 C ATOM 346 CD2 LEU A 23 14.267 7.611 3.038 1.00 0.00 C ATOM 0 H LEU A 23 13.053 4.379 1.572 1.00 0.00 H new ATOM 0 HA LEU A 23 11.760 6.735 2.575 1.00 0.00 H new ATOM 0 HB2 LEU A 23 13.339 6.212 0.030 1.00 0.00 H new ATOM 0 HB3 LEU A 23 12.903 7.793 0.648 1.00 0.00 H new ATOM 0 HG LEU A 23 14.727 5.797 2.023 1.00 0.00 H new ATOM 0 HD11 LEU A 23 16.499 7.428 1.514 1.00 0.00 H new ATOM 0 HD12 LEU A 23 15.740 6.793 0.036 1.00 0.00 H new ATOM 0 HD13 LEU A 23 15.322 8.420 0.621 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.202 7.628 3.598 1.00 0.00 H new ATOM 0 HD22 LEU A 23 13.971 8.631 2.795 1.00 0.00 H new ATOM 0 HD23 LEU A 23 13.491 7.143 3.643 1.00 0.00 H new ATOM 358 N ALA A 24 10.518 5.175 0.001 1.00 0.00 N ATOM 359 CA ALA A 24 9.360 5.100 -0.870 1.00 0.00 C ATOM 360 C ALA A 24 8.873 3.668 -0.993 1.00 0.00 C ATOM 361 O ALA A 24 9.579 2.812 -1.522 1.00 0.00 O ATOM 362 CB ALA A 24 9.691 5.667 -2.241 1.00 0.00 C ATOM 0 H ALA A 24 11.138 4.367 -0.049 1.00 0.00 H new ATOM 0 HA ALA A 24 8.561 5.697 -0.430 1.00 0.00 H new ATOM 0 HB1 ALA A 24 8.812 5.604 -2.883 1.00 0.00 H new ATOM 0 HB2 ALA A 24 9.992 6.710 -2.140 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.506 5.095 -2.684 1.00 0.00 H new ATOM 368 N GLU A 25 7.677 3.404 -0.490 1.00 0.00 N ATOM 369 CA GLU A 25 7.099 2.076 -0.589 1.00 0.00 C ATOM 370 C GLU A 25 5.624 2.146 -0.961 1.00 0.00 C ATOM 371 O GLU A 25 4.958 3.153 -0.721 1.00 0.00 O ATOM 372 CB GLU A 25 7.302 1.300 0.719 1.00 0.00 C ATOM 373 CG GLU A 25 6.676 1.935 1.950 1.00 0.00 C ATOM 374 CD GLU A 25 5.267 1.451 2.203 1.00 0.00 C ATOM 375 OE1 GLU A 25 5.075 0.224 2.321 1.00 0.00 O ATOM 376 OE2 GLU A 25 4.358 2.297 2.310 1.00 0.00 O ATOM 0 H GLU A 25 7.092 4.089 -0.012 1.00 0.00 H new ATOM 0 HA GLU A 25 7.615 1.540 -1.386 1.00 0.00 H new ATOM 0 HB2 GLU A 25 6.890 0.298 0.597 1.00 0.00 H new ATOM 0 HB3 GLU A 25 8.372 1.185 0.893 1.00 0.00 H new ATOM 0 HG2 GLU A 25 7.293 1.715 2.821 1.00 0.00 H new ATOM 0 HG3 GLU A 25 6.668 3.018 1.831 1.00 0.00 H new ATOM 383 N ILE A 26 5.132 1.076 -1.565 1.00 0.00 N ATOM 384 CA ILE A 26 3.735 0.984 -1.959 1.00 0.00 C ATOM 385 C ILE A 26 3.213 -0.423 -1.676 1.00 0.00 C ATOM 386 O ILE A 26 3.944 -1.408 -1.837 1.00 0.00 O ATOM 387 CB ILE A 26 3.552 1.337 -3.458 1.00 0.00 C ATOM 388 CG1 ILE A 26 2.070 1.309 -3.845 1.00 0.00 C ATOM 389 CG2 ILE A 26 4.356 0.388 -4.340 1.00 0.00 C ATOM 390 CD1 ILE A 26 1.800 1.767 -5.264 1.00 0.00 C ATOM 0 H ILE A 26 5.686 0.251 -1.795 1.00 0.00 H new ATOM 0 HA ILE A 26 3.162 1.705 -1.375 1.00 0.00 H new ATOM 0 HB ILE A 26 3.927 2.348 -3.616 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.691 0.294 -3.722 1.00 0.00 H new ATOM 0 HG13 ILE A 26 1.512 1.943 -3.156 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.212 0.655 -5.387 1.00 0.00 H new ATOM 0 HG22 ILE A 26 5.414 0.465 -4.088 1.00 0.00 H new ATOM 0 HG23 ILE A 26 4.018 -0.635 -4.177 1.00 0.00 H new ATOM 0 HD11 ILE A 26 0.730 1.720 -5.464 1.00 0.00 H new ATOM 0 HD12 ILE A 26 2.147 2.793 -5.387 1.00 0.00 H new ATOM 0 HD13 ILE A 26 2.329 1.119 -5.962 1.00 0.00 H new ATOM 402 N THR A 27 1.969 -0.522 -1.226 1.00 0.00 N ATOM 403 CA THR A 27 1.382 -1.810 -0.892 1.00 0.00 C ATOM 404 C THR A 27 0.097 -2.044 -1.678 1.00 0.00 C ATOM 405 O THR A 27 -0.639 -1.102 -1.973 1.00 0.00 O ATOM 406 CB THR A 27 1.073 -1.909 0.615 1.00 0.00 C ATOM 407 OG1 THR A 27 0.128 -0.903 0.995 1.00 0.00 O ATOM 408 CG2 THR A 27 2.338 -1.743 1.443 1.00 0.00 C ATOM 0 H THR A 27 1.348 0.275 -1.084 1.00 0.00 H new ATOM 0 HA THR A 27 2.113 -2.573 -1.158 1.00 0.00 H new ATOM 0 HB THR A 27 0.653 -2.897 0.804 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.061 -0.977 1.954 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.092 -1.817 2.502 1.00 0.00 H new ATOM 0 HG22 THR A 27 3.050 -2.525 1.180 1.00 0.00 H new ATOM 0 HG23 THR A 27 2.780 -0.767 1.241 1.00 0.00 H new ATOM 416 N TYR A 28 -0.170 -3.297 -2.018 1.00 0.00 N ATOM 417 CA TYR A 28 -1.402 -3.653 -2.700 1.00 0.00 C ATOM 418 C TYR A 28 -1.875 -5.018 -2.227 1.00 0.00 C ATOM 419 O TYR A 28 -1.070 -5.930 -2.039 1.00 0.00 O ATOM 420 CB TYR A 28 -1.210 -3.640 -4.226 1.00 0.00 C ATOM 421 CG TYR A 28 -0.262 -4.699 -4.756 1.00 0.00 C ATOM 422 CD1 TYR A 28 1.116 -4.541 -4.666 1.00 0.00 C ATOM 423 CD2 TYR A 28 -0.751 -5.854 -5.355 1.00 0.00 C ATOM 424 CE1 TYR A 28 1.979 -5.504 -5.156 1.00 0.00 C ATOM 425 CE2 TYR A 28 0.106 -6.822 -5.844 1.00 0.00 C ATOM 426 CZ TYR A 28 1.468 -6.643 -5.744 1.00 0.00 C ATOM 427 OH TYR A 28 2.323 -7.604 -6.243 1.00 0.00 O ATOM 0 H TYR A 28 0.452 -4.084 -1.832 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.163 -2.912 -2.457 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -2.182 -3.771 -4.702 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.840 -2.659 -4.523 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.519 -3.651 -4.206 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -1.818 -5.997 -5.440 1.00 0.00 H new ATOM 0 HE1 TYR A 28 3.047 -5.365 -5.079 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -0.291 -7.715 -6.303 1.00 0.00 H new ATOM 0 HH TYR A 28 1.801 -8.342 -6.622 1.00 0.00 H new ATOM 437 N ARG A 29 -3.172 -5.155 -2.004 1.00 0.00 N ATOM 438 CA ARG A 29 -3.724 -6.429 -1.581 1.00 0.00 C ATOM 439 C ARG A 29 -4.898 -6.811 -2.472 1.00 0.00 C ATOM 440 O ARG A 29 -5.535 -5.947 -3.079 1.00 0.00 O ATOM 441 CB ARG A 29 -4.164 -6.385 -0.108 1.00 0.00 C ATOM 442 CG ARG A 29 -5.465 -5.632 0.136 1.00 0.00 C ATOM 443 CD ARG A 29 -5.901 -5.711 1.591 1.00 0.00 C ATOM 444 NE ARG A 29 -5.140 -4.805 2.453 1.00 0.00 N ATOM 445 CZ ARG A 29 -4.552 -5.169 3.591 1.00 0.00 C ATOM 446 NH1 ARG A 29 -4.558 -6.438 3.978 1.00 0.00 N ATOM 447 NH2 ARG A 29 -3.951 -4.259 4.343 1.00 0.00 N ATOM 0 H ARG A 29 -3.856 -4.406 -2.108 1.00 0.00 H new ATOM 0 HA ARG A 29 -2.944 -7.184 -1.675 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -4.275 -7.406 0.256 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -3.373 -5.921 0.481 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -5.339 -4.588 -0.149 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -6.248 -6.044 -0.501 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -6.962 -5.471 1.663 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -5.781 -6.734 1.948 1.00 0.00 H new ATOM 0 HE ARG A 29 -5.055 -3.831 2.163 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -5.016 -7.145 3.402 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -4.105 -6.707 4.851 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -3.939 -3.282 4.050 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -3.500 -4.535 5.215 1.00 0.00 H new ATOM 461 N PHE A 30 -5.165 -8.101 -2.559 1.00 0.00 N ATOM 462 CA PHE A 30 -6.288 -8.595 -3.334 1.00 0.00 C ATOM 463 C PHE A 30 -7.553 -8.516 -2.494 1.00 0.00 C ATOM 464 O PHE A 30 -7.785 -9.355 -1.619 1.00 0.00 O ATOM 465 CB PHE A 30 -6.038 -10.038 -3.794 1.00 0.00 C ATOM 466 CG PHE A 30 -4.843 -10.193 -4.700 1.00 0.00 C ATOM 467 CD1 PHE A 30 -3.572 -10.378 -4.175 1.00 0.00 C ATOM 468 CD2 PHE A 30 -4.993 -10.155 -6.079 1.00 0.00 C ATOM 469 CE1 PHE A 30 -2.477 -10.521 -5.007 1.00 0.00 C ATOM 470 CE2 PHE A 30 -3.901 -10.298 -6.914 1.00 0.00 C ATOM 471 CZ PHE A 30 -2.641 -10.481 -6.377 1.00 0.00 C ATOM 0 H PHE A 30 -4.617 -8.829 -2.100 1.00 0.00 H new ATOM 0 HA PHE A 30 -6.406 -7.976 -4.223 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -5.900 -10.670 -2.916 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -6.925 -10.402 -4.313 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -3.436 -10.411 -3.104 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -5.975 -10.012 -6.505 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.493 -10.664 -4.585 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -4.032 -10.267 -7.986 1.00 0.00 H new ATOM 0 HZ PHE A 30 -1.786 -10.592 -7.028 1.00 0.00 H new ATOM 481 N VAL A 31 -8.351 -7.485 -2.738 1.00 0.00 N ATOM 482 CA VAL A 31 -9.551 -7.249 -1.946 1.00 0.00 C ATOM 483 C VAL A 31 -10.663 -8.226 -2.301 1.00 0.00 C ATOM 484 O VAL A 31 -11.371 -8.711 -1.422 1.00 0.00 O ATOM 485 CB VAL A 31 -10.065 -5.797 -2.083 1.00 0.00 C ATOM 486 CG1 VAL A 31 -9.112 -4.833 -1.398 1.00 0.00 C ATOM 487 CG2 VAL A 31 -10.253 -5.411 -3.542 1.00 0.00 C ATOM 0 H VAL A 31 -8.190 -6.800 -3.476 1.00 0.00 H new ATOM 0 HA VAL A 31 -9.264 -7.411 -0.907 1.00 0.00 H new ATOM 0 HB VAL A 31 -11.038 -5.738 -1.595 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -9.487 -3.815 -1.503 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -9.037 -5.085 -0.340 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -8.127 -4.906 -1.859 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -10.615 -4.385 -3.603 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -9.300 -5.491 -4.065 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -10.979 -6.080 -4.005 1.00 0.00 H new ATOM 497 N ASP A 32 -10.802 -8.537 -3.581 1.00 0.00 N ATOM 498 CA ASP A 32 -11.859 -9.438 -4.018 1.00 0.00 C ATOM 499 C ASP A 32 -11.270 -10.594 -4.818 1.00 0.00 C ATOM 500 O ASP A 32 -11.090 -11.687 -4.282 1.00 0.00 O ATOM 501 CB ASP A 32 -12.908 -8.675 -4.829 1.00 0.00 C ATOM 502 CG ASP A 32 -14.231 -9.404 -4.900 1.00 0.00 C ATOM 503 OD1 ASP A 32 -14.979 -9.375 -3.901 1.00 0.00 O ATOM 504 OD2 ASP A 32 -14.541 -9.982 -5.960 1.00 0.00 O ATOM 0 H ASP A 32 -10.204 -8.184 -4.328 1.00 0.00 H new ATOM 0 HA ASP A 32 -12.355 -9.855 -3.141 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -13.062 -7.692 -4.383 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -12.533 -8.512 -5.839 1.00 0.00 H new ATOM 509 N ASN A 33 -10.957 -10.356 -6.089 1.00 0.00 N ATOM 510 CA ASN A 33 -10.258 -11.350 -6.902 1.00 0.00 C ATOM 511 C ASN A 33 -9.141 -10.701 -7.710 1.00 0.00 C ATOM 512 O ASN A 33 -7.997 -10.647 -7.262 1.00 0.00 O ATOM 513 CB ASN A 33 -11.217 -12.099 -7.834 1.00 0.00 C ATOM 514 CG ASN A 33 -11.992 -13.189 -7.122 1.00 0.00 C ATOM 515 OD1 ASN A 33 -13.088 -12.962 -6.615 1.00 0.00 O ATOM 516 ND2 ASN A 33 -11.421 -14.384 -7.077 1.00 0.00 N ATOM 0 H ASN A 33 -11.175 -9.488 -6.578 1.00 0.00 H new ATOM 0 HA ASN A 33 -9.822 -12.076 -6.217 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.917 -11.389 -8.274 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -10.650 -12.539 -8.655 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.893 -15.157 -6.609 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -10.510 -14.530 -7.511 1.00 0.00 H new ATOM 523 N ASN A 34 -9.477 -10.190 -8.889 1.00 0.00 N ATOM 524 CA ASN A 34 -8.490 -9.532 -9.740 1.00 0.00 C ATOM 525 C ASN A 34 -8.402 -8.052 -9.393 1.00 0.00 C ATOM 526 O ASN A 34 -7.624 -7.304 -9.982 1.00 0.00 O ATOM 527 CB ASN A 34 -8.846 -9.700 -11.219 1.00 0.00 C ATOM 528 CG ASN A 34 -8.765 -11.141 -11.693 1.00 0.00 C ATOM 529 OD1 ASN A 34 -7.961 -11.936 -11.196 1.00 0.00 O ATOM 530 ND2 ASN A 34 -9.601 -11.487 -12.657 1.00 0.00 N ATOM 0 H ASN A 34 -10.420 -10.218 -9.277 1.00 0.00 H new ATOM 0 HA ASN A 34 -7.522 -10.000 -9.563 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -9.855 -9.325 -11.388 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -8.173 -9.088 -11.820 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -9.597 -12.441 -13.017 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -10.250 -10.800 -13.041 1.00 0.00 H new ATOM 537 N GLU A 35 -9.219 -7.638 -8.440 1.00 0.00 N ATOM 538 CA GLU A 35 -9.229 -6.262 -7.981 1.00 0.00 C ATOM 539 C GLU A 35 -8.220 -6.074 -6.859 1.00 0.00 C ATOM 540 O GLU A 35 -8.310 -6.725 -5.813 1.00 0.00 O ATOM 541 CB GLU A 35 -10.625 -5.855 -7.489 1.00 0.00 C ATOM 542 CG GLU A 35 -11.727 -5.961 -8.539 1.00 0.00 C ATOM 543 CD GLU A 35 -12.053 -7.392 -8.917 1.00 0.00 C ATOM 544 OE1 GLU A 35 -12.130 -8.249 -8.009 1.00 0.00 O ATOM 545 OE2 GLU A 35 -12.238 -7.667 -10.117 1.00 0.00 O ATOM 0 H GLU A 35 -9.890 -8.243 -7.966 1.00 0.00 H new ATOM 0 HA GLU A 35 -8.958 -5.626 -8.824 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -10.892 -6.481 -6.637 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -10.583 -4.827 -7.129 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -12.628 -5.477 -8.162 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -11.423 -5.416 -9.433 1.00 0.00 H new ATOM 552 N ILE A 36 -7.262 -5.196 -7.082 1.00 0.00 N ATOM 553 CA ILE A 36 -6.271 -4.874 -6.074 1.00 0.00 C ATOM 554 C ILE A 36 -6.378 -3.408 -5.697 1.00 0.00 C ATOM 555 O ILE A 36 -6.727 -2.565 -6.525 1.00 0.00 O ATOM 556 CB ILE A 36 -4.829 -5.173 -6.547 1.00 0.00 C ATOM 557 CG1 ILE A 36 -4.496 -4.375 -7.808 1.00 0.00 C ATOM 558 CG2 ILE A 36 -4.649 -6.663 -6.792 1.00 0.00 C ATOM 559 CD1 ILE A 36 -3.046 -4.474 -8.229 1.00 0.00 C ATOM 0 H ILE A 36 -7.149 -4.689 -7.960 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.476 -5.506 -5.210 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.139 -4.867 -5.760 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.127 -4.725 -8.625 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.745 -3.327 -7.640 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.629 -6.856 -7.124 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.839 -7.209 -5.868 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -5.349 -6.993 -7.559 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.888 -3.882 -9.130 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -2.408 -4.096 -7.430 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.796 -5.516 -8.431 1.00 0.00 H new ATOM 571 N ASN A 37 -6.105 -3.104 -4.445 1.00 0.00 N ATOM 572 CA ASN A 37 -6.118 -1.726 -3.993 1.00 0.00 C ATOM 573 C ASN A 37 -4.745 -1.322 -3.503 1.00 0.00 C ATOM 574 O ASN A 37 -4.027 -2.125 -2.903 1.00 0.00 O ATOM 575 CB ASN A 37 -7.146 -1.501 -2.873 1.00 0.00 C ATOM 576 CG ASN A 37 -6.773 -2.190 -1.569 1.00 0.00 C ATOM 577 OD1 ASN A 37 -6.197 -3.274 -1.567 1.00 0.00 O ATOM 578 ND2 ASN A 37 -7.087 -1.557 -0.449 1.00 0.00 N ATOM 0 H ASN A 37 -5.872 -3.788 -3.725 1.00 0.00 H new ATOM 0 HA ASN A 37 -6.403 -1.109 -4.845 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -7.250 -0.431 -2.694 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -8.119 -1.865 -3.203 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -6.850 -1.969 0.453 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -7.566 -0.657 -0.489 1.00 0.00 H new ATOM 585 N ILE A 38 -4.367 -0.092 -3.788 1.00 0.00 N ATOM 586 CA ILE A 38 -3.185 0.474 -3.184 1.00 0.00 C ATOM 587 C ILE A 38 -3.511 0.836 -1.744 1.00 0.00 C ATOM 588 O ILE A 38 -4.137 1.865 -1.463 1.00 0.00 O ATOM 589 CB ILE A 38 -2.668 1.701 -3.958 1.00 0.00 C ATOM 590 CG1 ILE A 38 -2.345 1.302 -5.399 1.00 0.00 C ATOM 591 CG2 ILE A 38 -1.434 2.269 -3.274 1.00 0.00 C ATOM 592 CD1 ILE A 38 -1.961 2.463 -6.291 1.00 0.00 C ATOM 0 H ILE A 38 -4.860 0.529 -4.430 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.383 -0.264 -3.214 1.00 0.00 H new ATOM 0 HB ILE A 38 -3.440 2.470 -3.970 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -1.529 0.579 -5.390 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -3.212 0.799 -5.828 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -1.077 3.136 -3.830 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -1.687 2.569 -2.257 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -0.652 1.510 -3.245 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -1.748 2.096 -7.295 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -2.783 3.177 -6.333 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -1.075 2.954 -5.888 1.00 0.00 H new ATOM 604 N ASP A 39 -3.121 -0.058 -0.850 1.00 0.00 N ATOM 605 CA ASP A 39 -3.483 0.018 0.558 1.00 0.00 C ATOM 606 C ASP A 39 -2.847 1.230 1.222 1.00 0.00 C ATOM 607 O ASP A 39 -3.535 2.067 1.812 1.00 0.00 O ATOM 608 CB ASP A 39 -3.036 -1.270 1.260 1.00 0.00 C ATOM 609 CG ASP A 39 -3.379 -1.301 2.734 1.00 0.00 C ATOM 610 OD1 ASP A 39 -2.609 -0.742 3.542 1.00 0.00 O ATOM 611 OD2 ASP A 39 -4.408 -1.906 3.093 1.00 0.00 O ATOM 0 H ASP A 39 -2.540 -0.863 -1.082 1.00 0.00 H new ATOM 0 HA ASP A 39 -4.565 0.126 0.640 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -3.502 -2.124 0.768 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -1.958 -1.384 1.143 1.00 0.00 H new ATOM 616 N HIS A 40 -1.536 1.323 1.108 1.00 0.00 N ATOM 617 CA HIS A 40 -0.778 2.407 1.710 1.00 0.00 C ATOM 618 C HIS A 40 0.376 2.791 0.796 1.00 0.00 C ATOM 619 O HIS A 40 0.960 1.936 0.132 1.00 0.00 O ATOM 620 CB HIS A 40 -0.266 1.975 3.094 1.00 0.00 C ATOM 621 CG HIS A 40 0.690 2.934 3.744 1.00 0.00 C ATOM 622 ND1 HIS A 40 0.353 4.222 4.102 1.00 0.00 N ATOM 623 CD2 HIS A 40 1.983 2.775 4.108 1.00 0.00 C ATOM 624 CE1 HIS A 40 1.396 4.812 4.655 1.00 0.00 C ATOM 625 NE2 HIS A 40 2.399 3.953 4.672 1.00 0.00 N ATOM 0 H HIS A 40 -0.965 0.650 0.596 1.00 0.00 H new ATOM 0 HA HIS A 40 -1.419 3.279 1.839 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -1.122 1.835 3.754 1.00 0.00 H new ATOM 0 HB3 HIS A 40 0.224 1.006 2.998 1.00 0.00 H new ATOM 0 HD2 HIS A 40 2.578 1.883 3.978 1.00 0.00 H new ATOM 0 HE1 HIS A 40 1.424 5.825 5.030 1.00 0.00 H new ATOM 0 HE2 HIS A 40 3.331 4.136 5.044 1.00 0.00 H new ATOM 634 N THR A 41 0.681 4.074 0.738 1.00 0.00 N ATOM 635 CA THR A 41 1.790 4.545 -0.070 1.00 0.00 C ATOM 636 C THR A 41 2.707 5.439 0.752 1.00 0.00 C ATOM 637 O THR A 41 2.498 6.651 0.840 1.00 0.00 O ATOM 638 CB THR A 41 1.294 5.317 -1.307 1.00 0.00 C ATOM 639 OG1 THR A 41 0.248 4.580 -1.942 1.00 0.00 O ATOM 640 CG2 THR A 41 2.418 5.540 -2.304 1.00 0.00 C ATOM 0 H THR A 41 0.178 4.806 1.239 1.00 0.00 H new ATOM 0 HA THR A 41 2.345 3.669 -0.407 1.00 0.00 H new ATOM 0 HB THR A 41 0.926 6.288 -0.975 1.00 0.00 H new ATOM 0 HG1 THR A 41 -0.613 4.827 -1.546 1.00 0.00 H new ATOM 0 HG21 THR A 41 2.037 6.087 -3.166 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.214 6.116 -1.832 1.00 0.00 H new ATOM 0 HG23 THR A 41 2.811 4.577 -2.631 1.00 0.00 H new ATOM 648 N GLY A 42 3.696 4.830 1.384 1.00 0.00 N ATOM 649 CA GLY A 42 4.655 5.583 2.157 1.00 0.00 C ATOM 650 C GLY A 42 5.797 6.076 1.301 1.00 0.00 C ATOM 651 O GLY A 42 6.915 5.565 1.383 1.00 0.00 O ATOM 0 H GLY A 42 3.851 3.822 1.374 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.158 6.432 2.626 1.00 0.00 H new ATOM 0 HA3 GLY A 42 5.045 4.959 2.961 1.00 0.00 H new ATOM 655 N VAL A 43 5.510 7.056 0.460 1.00 0.00 N ATOM 656 CA VAL A 43 6.510 7.617 -0.427 1.00 0.00 C ATOM 657 C VAL A 43 6.830 9.050 -0.038 1.00 0.00 C ATOM 658 O VAL A 43 5.953 9.917 -0.033 1.00 0.00 O ATOM 659 CB VAL A 43 6.050 7.578 -1.902 1.00 0.00 C ATOM 660 CG1 VAL A 43 7.053 8.285 -2.802 1.00 0.00 C ATOM 661 CG2 VAL A 43 5.854 6.144 -2.364 1.00 0.00 C ATOM 0 H VAL A 43 4.586 7.480 0.375 1.00 0.00 H new ATOM 0 HA VAL A 43 7.406 7.004 -0.327 1.00 0.00 H new ATOM 0 HB VAL A 43 5.096 8.101 -1.970 1.00 0.00 H new ATOM 0 HG11 VAL A 43 6.707 8.244 -3.835 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.149 9.326 -2.492 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.022 7.792 -2.724 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.530 6.138 -3.405 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.795 5.601 -2.274 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.096 5.663 -1.746 1.00 0.00 H new ATOM 671 N SER A 44 8.081 9.287 0.305 1.00 0.00 N ATOM 672 CA SER A 44 8.543 10.630 0.587 1.00 0.00 C ATOM 673 C SER A 44 8.689 11.398 -0.722 1.00 0.00 C ATOM 674 O SER A 44 9.343 10.928 -1.655 1.00 0.00 O ATOM 675 CB SER A 44 9.881 10.583 1.318 1.00 0.00 C ATOM 676 OG SER A 44 9.866 9.598 2.342 1.00 0.00 O ATOM 0 H SER A 44 8.796 8.565 0.395 1.00 0.00 H new ATOM 0 HA SER A 44 7.817 11.135 1.224 1.00 0.00 H new ATOM 0 HB2 SER A 44 10.680 10.364 0.609 1.00 0.00 H new ATOM 0 HB3 SER A 44 10.098 11.560 1.751 1.00 0.00 H new ATOM 0 HG SER A 44 9.995 8.711 1.945 1.00 0.00 H new ATOM 682 N ASP A 45 8.071 12.560 -0.794 1.00 0.00 N ATOM 683 CA ASP A 45 8.112 13.362 -2.000 1.00 0.00 C ATOM 684 C ASP A 45 8.796 14.683 -1.727 1.00 0.00 C ATOM 685 O ASP A 45 8.266 15.548 -1.029 1.00 0.00 O ATOM 686 CB ASP A 45 6.715 13.605 -2.564 1.00 0.00 C ATOM 687 CG ASP A 45 6.754 14.546 -3.750 1.00 0.00 C ATOM 688 OD1 ASP A 45 7.613 14.354 -4.629 1.00 0.00 O ATOM 689 OD2 ASP A 45 5.944 15.498 -3.790 1.00 0.00 O ATOM 0 H ASP A 45 7.534 12.970 -0.030 1.00 0.00 H new ATOM 0 HA ASP A 45 8.681 12.807 -2.745 1.00 0.00 H new ATOM 0 HB2 ASP A 45 6.272 12.656 -2.865 1.00 0.00 H new ATOM 0 HB3 ASP A 45 6.075 14.023 -1.787 1.00 0.00 H new ATOM 694 N GLU A 46 9.983 14.815 -2.273 1.00 0.00 N ATOM 695 CA GLU A 46 10.797 16.002 -2.081 1.00 0.00 C ATOM 696 C GLU A 46 10.254 17.188 -2.879 1.00 0.00 C ATOM 697 O GLU A 46 9.882 18.210 -2.303 1.00 0.00 O ATOM 698 CB GLU A 46 12.240 15.704 -2.488 1.00 0.00 C ATOM 699 CG GLU A 46 12.815 14.472 -1.804 1.00 0.00 C ATOM 700 CD GLU A 46 14.263 14.224 -2.163 1.00 0.00 C ATOM 701 OE1 GLU A 46 14.523 13.607 -3.215 1.00 0.00 O ATOM 702 OE2 GLU A 46 15.151 14.641 -1.389 1.00 0.00 O ATOM 0 H GLU A 46 10.415 14.105 -2.864 1.00 0.00 H new ATOM 0 HA GLU A 46 10.765 16.273 -1.026 1.00 0.00 H new ATOM 0 HB2 GLU A 46 12.285 15.566 -3.568 1.00 0.00 H new ATOM 0 HB3 GLU A 46 12.863 16.567 -2.251 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.728 14.588 -0.724 1.00 0.00 H new ATOM 0 HG3 GLU A 46 12.223 13.599 -2.079 1.00 0.00 H new ATOM 709 N LEU A 47 10.194 17.043 -4.200 1.00 0.00 N ATOM 710 CA LEU A 47 9.807 18.156 -5.067 1.00 0.00 C ATOM 711 C LEU A 47 8.917 17.705 -6.226 1.00 0.00 C ATOM 712 O LEU A 47 8.790 18.416 -7.222 1.00 0.00 O ATOM 713 CB LEU A 47 11.054 18.848 -5.635 1.00 0.00 C ATOM 714 CG LEU A 47 11.902 19.628 -4.627 1.00 0.00 C ATOM 715 CD1 LEU A 47 13.164 20.154 -5.293 1.00 0.00 C ATOM 716 CD2 LEU A 47 11.103 20.779 -4.031 1.00 0.00 C ATOM 0 H LEU A 47 10.406 16.175 -4.692 1.00 0.00 H new ATOM 0 HA LEU A 47 9.238 18.852 -4.451 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.684 18.092 -6.103 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.739 19.532 -6.423 1.00 0.00 H new ATOM 0 HG LEU A 47 12.186 18.951 -3.821 1.00 0.00 H new ATOM 0 HD11 LEU A 47 13.757 20.706 -4.564 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.748 19.318 -5.677 1.00 0.00 H new ATOM 0 HD13 LEU A 47 12.893 20.815 -6.116 1.00 0.00 H new ATOM 0 HD21 LEU A 47 11.723 21.321 -3.317 1.00 0.00 H new ATOM 0 HD22 LEU A 47 10.790 21.455 -4.827 1.00 0.00 H new ATOM 0 HD23 LEU A 47 10.223 20.386 -3.522 1.00 0.00 H new ATOM 728 N GLY A 48 8.301 16.539 -6.106 1.00 0.00 N ATOM 729 CA GLY A 48 7.459 16.041 -7.179 1.00 0.00 C ATOM 730 C GLY A 48 8.266 15.374 -8.276 1.00 0.00 C ATOM 731 O GLY A 48 8.052 14.199 -8.586 1.00 0.00 O ATOM 0 H GLY A 48 8.367 15.930 -5.291 1.00 0.00 H new ATOM 0 HA2 GLY A 48 6.740 15.328 -6.774 1.00 0.00 H new ATOM 0 HA3 GLY A 48 6.886 16.866 -7.602 1.00 0.00 H new ATOM 735 N GLY A 49 9.204 16.121 -8.853 1.00 0.00 N ATOM 736 CA GLY A 49 10.073 15.578 -9.884 1.00 0.00 C ATOM 737 C GLY A 49 10.988 14.504 -9.336 1.00 0.00 C ATOM 738 O GLY A 49 11.436 13.618 -10.060 1.00 0.00 O ATOM 0 H GLY A 49 9.378 17.099 -8.623 1.00 0.00 H new ATOM 0 HA2 GLY A 49 9.467 15.164 -10.690 1.00 0.00 H new ATOM 0 HA3 GLY A 49 10.671 16.380 -10.316 1.00 0.00 H new ATOM 742 N GLN A 50 11.263 14.593 -8.044 1.00 0.00 N ATOM 743 CA GLN A 50 12.068 13.594 -7.352 1.00 0.00 C ATOM 744 C GLN A 50 11.161 12.628 -6.596 1.00 0.00 C ATOM 745 O GLN A 50 11.583 11.959 -5.653 1.00 0.00 O ATOM 746 CB GLN A 50 13.048 14.275 -6.391 1.00 0.00 C ATOM 747 CG GLN A 50 14.141 15.062 -7.094 1.00 0.00 C ATOM 748 CD GLN A 50 15.045 15.797 -6.126 1.00 0.00 C ATOM 749 OE1 GLN A 50 16.046 15.257 -5.654 1.00 0.00 O ATOM 750 NE2 GLN A 50 14.709 17.044 -5.843 1.00 0.00 N ATOM 0 H GLN A 50 10.938 15.354 -7.447 1.00 0.00 H new ATOM 0 HA GLN A 50 12.643 13.031 -8.087 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.493 14.946 -5.735 1.00 0.00 H new ATOM 0 HB3 GLN A 50 13.508 13.517 -5.757 1.00 0.00 H new ATOM 0 HG2 GLN A 50 14.740 14.382 -7.700 1.00 0.00 H new ATOM 0 HG3 GLN A 50 13.685 15.780 -7.776 1.00 0.00 H new ATOM 0 HE21 GLN A 50 13.871 17.453 -6.256 1.00 0.00 H new ATOM 0 HE22 GLN A 50 15.288 17.597 -5.211 1.00 0.00 H new ATOM 759 N GLY A 51 9.908 12.563 -7.025 1.00 0.00 N ATOM 760 CA GLY A 51 8.953 11.668 -6.414 1.00 0.00 C ATOM 761 C GLY A 51 9.121 10.247 -6.903 1.00 0.00 C ATOM 762 O GLY A 51 8.685 9.904 -8.005 1.00 0.00 O ATOM 0 H GLY A 51 9.536 13.121 -7.793 1.00 0.00 H new ATOM 0 HA2 GLY A 51 9.071 11.696 -5.331 1.00 0.00 H new ATOM 0 HA3 GLY A 51 7.942 12.011 -6.634 1.00 0.00 H new ATOM 766 N VAL A 52 9.748 9.421 -6.074 1.00 0.00 N ATOM 767 CA VAL A 52 10.025 8.028 -6.418 1.00 0.00 C ATOM 768 C VAL A 52 8.726 7.243 -6.629 1.00 0.00 C ATOM 769 O VAL A 52 8.723 6.173 -7.244 1.00 0.00 O ATOM 770 CB VAL A 52 10.867 7.347 -5.314 1.00 0.00 C ATOM 771 CG1 VAL A 52 11.346 5.976 -5.760 1.00 0.00 C ATOM 772 CG2 VAL A 52 12.047 8.224 -4.921 1.00 0.00 C ATOM 0 H VAL A 52 10.078 9.694 -5.148 1.00 0.00 H new ATOM 0 HA VAL A 52 10.591 8.027 -7.350 1.00 0.00 H new ATOM 0 HB VAL A 52 10.230 7.214 -4.440 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.935 5.520 -4.965 1.00 0.00 H new ATOM 0 HG12 VAL A 52 10.486 5.344 -5.982 1.00 0.00 H new ATOM 0 HG13 VAL A 52 11.961 6.079 -6.654 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.627 7.727 -4.143 1.00 0.00 H new ATOM 0 HG22 VAL A 52 12.680 8.394 -5.792 1.00 0.00 H new ATOM 0 HG23 VAL A 52 11.681 9.180 -4.546 1.00 0.00 H new ATOM 782 N GLY A 53 7.621 7.801 -6.138 1.00 0.00 N ATOM 783 CA GLY A 53 6.325 7.159 -6.267 1.00 0.00 C ATOM 784 C GLY A 53 5.958 6.840 -7.705 1.00 0.00 C ATOM 785 O GLY A 53 5.294 5.844 -7.966 1.00 0.00 O ATOM 0 H GLY A 53 7.603 8.696 -5.648 1.00 0.00 H new ATOM 0 HA2 GLY A 53 6.323 6.237 -5.685 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.561 7.808 -5.839 1.00 0.00 H new ATOM 789 N LYS A 54 6.405 7.673 -8.644 1.00 0.00 N ATOM 790 CA LYS A 54 6.095 7.457 -10.056 1.00 0.00 C ATOM 791 C LYS A 54 6.698 6.148 -10.562 1.00 0.00 C ATOM 792 O LYS A 54 6.081 5.435 -11.355 1.00 0.00 O ATOM 793 CB LYS A 54 6.597 8.617 -10.916 1.00 0.00 C ATOM 794 CG LYS A 54 5.895 9.935 -10.641 1.00 0.00 C ATOM 795 CD LYS A 54 6.237 10.966 -11.703 1.00 0.00 C ATOM 796 CE LYS A 54 5.511 12.285 -11.473 1.00 0.00 C ATOM 797 NZ LYS A 54 5.993 12.990 -10.255 1.00 0.00 N ATOM 0 H LYS A 54 6.977 8.496 -8.455 1.00 0.00 H new ATOM 0 HA LYS A 54 5.010 7.399 -10.140 1.00 0.00 H new ATOM 0 HB2 LYS A 54 7.667 8.744 -10.749 1.00 0.00 H new ATOM 0 HB3 LYS A 54 6.467 8.360 -11.967 1.00 0.00 H new ATOM 0 HG2 LYS A 54 4.817 9.778 -10.615 1.00 0.00 H new ATOM 0 HG3 LYS A 54 6.186 10.308 -9.659 1.00 0.00 H new ATOM 0 HD2 LYS A 54 7.313 11.140 -11.706 1.00 0.00 H new ATOM 0 HD3 LYS A 54 5.975 10.575 -12.686 1.00 0.00 H new ATOM 0 HE2 LYS A 54 5.649 12.929 -12.341 1.00 0.00 H new ATOM 0 HE3 LYS A 54 4.441 12.097 -11.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 5.570 13.939 -10.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 5.717 12.451 -9.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 7.029 13.074 -10.289 1.00 0.00 H new ATOM 811 N LYS A 55 7.900 5.835 -10.089 1.00 0.00 N ATOM 812 CA LYS A 55 8.587 4.614 -10.488 1.00 0.00 C ATOM 813 C LYS A 55 7.836 3.397 -9.958 1.00 0.00 C ATOM 814 O LYS A 55 7.695 2.386 -10.649 1.00 0.00 O ATOM 815 CB LYS A 55 10.031 4.623 -9.970 1.00 0.00 C ATOM 816 CG LYS A 55 10.871 3.454 -10.463 1.00 0.00 C ATOM 817 CD LYS A 55 12.318 3.579 -10.013 1.00 0.00 C ATOM 818 CE LYS A 55 13.187 2.482 -10.609 1.00 0.00 C ATOM 819 NZ LYS A 55 14.625 2.662 -10.268 1.00 0.00 N ATOM 0 H LYS A 55 8.419 6.412 -9.427 1.00 0.00 H new ATOM 0 HA LYS A 55 8.613 4.562 -11.576 1.00 0.00 H new ATOM 0 HB2 LYS A 55 10.509 5.554 -10.273 1.00 0.00 H new ATOM 0 HB3 LYS A 55 10.016 4.612 -8.880 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.452 2.520 -10.089 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.830 3.408 -11.551 1.00 0.00 H new ATOM 0 HD2 LYS A 55 12.708 4.553 -10.307 1.00 0.00 H new ATOM 0 HD3 LYS A 55 12.367 3.532 -8.925 1.00 0.00 H new ATOM 0 HE2 LYS A 55 12.847 1.512 -10.245 1.00 0.00 H new ATOM 0 HE3 LYS A 55 13.070 2.475 -11.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 15.211 2.413 -11.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 14.798 3.654 -10.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 14.872 2.045 -9.468 1.00 0.00 H new ATOM 833 N LEU A 56 7.339 3.514 -8.731 1.00 0.00 N ATOM 834 CA LEU A 56 6.550 2.454 -8.118 1.00 0.00 C ATOM 835 C LEU A 56 5.220 2.284 -8.845 1.00 0.00 C ATOM 836 O LEU A 56 4.817 1.167 -9.166 1.00 0.00 O ATOM 837 CB LEU A 56 6.305 2.762 -6.639 1.00 0.00 C ATOM 838 CG LEU A 56 7.565 2.856 -5.774 1.00 0.00 C ATOM 839 CD1 LEU A 56 7.205 3.256 -4.354 1.00 0.00 C ATOM 840 CD2 LEU A 56 8.313 1.532 -5.778 1.00 0.00 C ATOM 0 H LEU A 56 7.470 4.335 -8.141 1.00 0.00 H new ATOM 0 HA LEU A 56 7.109 1.522 -8.197 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.763 3.705 -6.566 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.657 1.989 -6.226 1.00 0.00 H new ATOM 0 HG LEU A 56 8.216 3.622 -6.195 1.00 0.00 H new ATOM 0 HD11 LEU A 56 8.112 3.318 -3.753 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.709 4.227 -4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.535 2.511 -3.925 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.206 1.617 -5.158 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.668 0.749 -5.380 1.00 0.00 H new ATOM 0 HD23 LEU A 56 8.602 1.281 -6.798 1.00 0.00 H new ATOM 852 N LEU A 57 4.553 3.405 -9.113 1.00 0.00 N ATOM 853 CA LEU A 57 3.277 3.398 -9.827 1.00 0.00 C ATOM 854 C LEU A 57 3.410 2.727 -11.187 1.00 0.00 C ATOM 855 O LEU A 57 2.579 1.896 -11.558 1.00 0.00 O ATOM 856 CB LEU A 57 2.746 4.824 -9.999 1.00 0.00 C ATOM 857 CG LEU A 57 1.701 5.272 -8.971 1.00 0.00 C ATOM 858 CD1 LEU A 57 2.247 5.191 -7.552 1.00 0.00 C ATOM 859 CD2 LEU A 57 1.235 6.687 -9.278 1.00 0.00 C ATOM 0 H LEU A 57 4.877 4.334 -8.845 1.00 0.00 H new ATOM 0 HA LEU A 57 2.568 2.826 -9.229 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.589 5.514 -9.957 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.311 4.913 -10.994 1.00 0.00 H new ATOM 0 HG LEU A 57 0.850 4.594 -9.040 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.481 5.516 -6.848 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.532 4.163 -7.330 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.120 5.837 -7.461 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.493 6.994 -8.541 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.086 7.367 -9.240 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.791 6.716 -10.273 1.00 0.00 H new ATOM 871 N LYS A 58 4.464 3.080 -11.921 1.00 0.00 N ATOM 872 CA LYS A 58 4.718 2.489 -13.231 1.00 0.00 C ATOM 873 C LYS A 58 4.792 0.971 -13.118 1.00 0.00 C ATOM 874 O LYS A 58 4.147 0.250 -13.875 1.00 0.00 O ATOM 875 CB LYS A 58 6.027 3.012 -13.830 1.00 0.00 C ATOM 876 CG LYS A 58 6.238 2.600 -15.282 1.00 0.00 C ATOM 877 CD LYS A 58 7.667 2.850 -15.734 1.00 0.00 C ATOM 878 CE LYS A 58 8.608 1.769 -15.222 1.00 0.00 C ATOM 879 NZ LYS A 58 8.408 0.472 -15.931 1.00 0.00 N ATOM 0 H LYS A 58 5.155 3.772 -11.630 1.00 0.00 H new ATOM 0 HA LYS A 58 3.894 2.771 -13.887 1.00 0.00 H new ATOM 0 HB2 LYS A 58 6.039 4.100 -13.764 1.00 0.00 H new ATOM 0 HB3 LYS A 58 6.862 2.647 -13.232 1.00 0.00 H new ATOM 0 HG2 LYS A 58 5.999 1.543 -15.399 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.551 3.155 -15.921 1.00 0.00 H new ATOM 0 HD2 LYS A 58 7.706 2.882 -16.823 1.00 0.00 H new ATOM 0 HD3 LYS A 58 7.999 3.824 -15.374 1.00 0.00 H new ATOM 0 HE2 LYS A 58 9.640 2.096 -15.350 1.00 0.00 H new ATOM 0 HE3 LYS A 58 8.449 1.626 -14.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 8.407 -0.305 -15.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 7.498 0.488 -16.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 9.179 0.327 -16.614 1.00 0.00 H new ATOM 893 N ALA A 59 5.574 0.499 -12.152 1.00 0.00 N ATOM 894 CA ALA A 59 5.779 -0.929 -11.955 1.00 0.00 C ATOM 895 C ALA A 59 4.473 -1.638 -11.607 1.00 0.00 C ATOM 896 O ALA A 59 4.171 -2.698 -12.154 1.00 0.00 O ATOM 897 CB ALA A 59 6.818 -1.165 -10.869 1.00 0.00 C ATOM 0 H ALA A 59 6.078 1.090 -11.491 1.00 0.00 H new ATOM 0 HA ALA A 59 6.144 -1.349 -12.893 1.00 0.00 H new ATOM 0 HB1 ALA A 59 6.963 -2.236 -10.731 1.00 0.00 H new ATOM 0 HB2 ALA A 59 7.762 -0.706 -11.163 1.00 0.00 H new ATOM 0 HB3 ALA A 59 6.475 -0.722 -9.934 1.00 0.00 H new ATOM 903 N VAL A 60 3.699 -1.043 -10.704 1.00 0.00 N ATOM 904 CA VAL A 60 2.437 -1.635 -10.270 1.00 0.00 C ATOM 905 C VAL A 60 1.434 -1.714 -11.420 1.00 0.00 C ATOM 906 O VAL A 60 0.862 -2.773 -11.673 1.00 0.00 O ATOM 907 CB VAL A 60 1.814 -0.857 -9.088 1.00 0.00 C ATOM 908 CG1 VAL A 60 0.459 -1.434 -8.705 1.00 0.00 C ATOM 909 CG2 VAL A 60 2.752 -0.871 -7.890 1.00 0.00 C ATOM 0 H VAL A 60 3.923 -0.153 -10.259 1.00 0.00 H new ATOM 0 HA VAL A 60 2.667 -2.646 -9.933 1.00 0.00 H new ATOM 0 HB VAL A 60 1.665 0.175 -9.406 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.045 -0.867 -7.871 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.217 -1.372 -9.558 1.00 0.00 H new ATOM 0 HG13 VAL A 60 0.578 -2.477 -8.411 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.299 -0.319 -7.067 1.00 0.00 H new ATOM 0 HG22 VAL A 60 2.932 -1.901 -7.581 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.698 -0.403 -8.163 1.00 0.00 H new ATOM 919 N VAL A 61 1.238 -0.602 -12.123 1.00 0.00 N ATOM 920 CA VAL A 61 0.293 -0.559 -13.237 1.00 0.00 C ATOM 921 C VAL A 61 0.731 -1.499 -14.358 1.00 0.00 C ATOM 922 O VAL A 61 -0.091 -2.211 -14.940 1.00 0.00 O ATOM 923 CB VAL A 61 0.140 0.872 -13.797 1.00 0.00 C ATOM 924 CG1 VAL A 61 -0.785 0.887 -15.008 1.00 0.00 C ATOM 925 CG2 VAL A 61 -0.378 1.815 -12.721 1.00 0.00 C ATOM 0 H VAL A 61 1.719 0.279 -11.943 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.672 -0.885 -12.850 1.00 0.00 H new ATOM 0 HB VAL A 61 1.124 1.216 -14.116 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.876 1.906 -15.384 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.373 0.248 -15.789 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.769 0.517 -14.719 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.479 2.818 -13.135 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.350 1.468 -12.370 1.00 0.00 H new ATOM 0 HG23 VAL A 61 0.323 1.835 -11.887 1.00 0.00 H new ATOM 935 N GLU A 62 2.028 -1.502 -14.642 1.00 0.00 N ATOM 936 CA GLU A 62 2.599 -2.365 -15.670 1.00 0.00 C ATOM 937 C GLU A 62 2.330 -3.830 -15.335 1.00 0.00 C ATOM 938 O GLU A 62 1.854 -4.599 -16.173 1.00 0.00 O ATOM 939 CB GLU A 62 4.103 -2.103 -15.766 1.00 0.00 C ATOM 940 CG GLU A 62 4.781 -2.725 -16.972 1.00 0.00 C ATOM 941 CD GLU A 62 6.245 -2.343 -17.049 1.00 0.00 C ATOM 942 OE1 GLU A 62 6.539 -1.136 -17.192 1.00 0.00 O ATOM 943 OE2 GLU A 62 7.108 -3.238 -16.945 1.00 0.00 O ATOM 0 H GLU A 62 2.711 -0.910 -14.169 1.00 0.00 H new ATOM 0 HA GLU A 62 2.135 -2.145 -16.632 1.00 0.00 H new ATOM 0 HB2 GLU A 62 4.269 -1.026 -15.789 1.00 0.00 H new ATOM 0 HB3 GLU A 62 4.582 -2.481 -14.863 1.00 0.00 H new ATOM 0 HG2 GLU A 62 4.690 -3.810 -16.922 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.273 -2.404 -17.881 1.00 0.00 H new ATOM 950 N HIS A 63 2.612 -4.194 -14.090 1.00 0.00 N ATOM 951 CA HIS A 63 2.399 -5.552 -13.613 1.00 0.00 C ATOM 952 C HIS A 63 0.908 -5.892 -13.639 1.00 0.00 C ATOM 953 O HIS A 63 0.515 -6.982 -14.058 1.00 0.00 O ATOM 954 CB HIS A 63 2.954 -5.686 -12.187 1.00 0.00 C ATOM 955 CG HIS A 63 3.052 -7.095 -11.678 1.00 0.00 C ATOM 956 ND1 HIS A 63 4.255 -7.717 -11.427 1.00 0.00 N ATOM 957 CD2 HIS A 63 2.092 -7.991 -11.344 1.00 0.00 C ATOM 958 CE1 HIS A 63 4.033 -8.934 -10.964 1.00 0.00 C ATOM 959 NE2 HIS A 63 2.728 -9.125 -10.903 1.00 0.00 N ATOM 0 H HIS A 63 2.992 -3.560 -13.388 1.00 0.00 H new ATOM 0 HA HIS A 63 2.922 -6.250 -14.266 1.00 0.00 H new ATOM 0 HB2 HIS A 63 3.945 -5.233 -12.154 1.00 0.00 H new ATOM 0 HB3 HIS A 63 2.320 -5.114 -11.510 1.00 0.00 H new ATOM 0 HD2 HIS A 63 1.025 -7.841 -11.412 1.00 0.00 H new ATOM 0 HE1 HIS A 63 4.790 -9.651 -10.683 1.00 0.00 H new ATOM 0 HE2 HIS A 63 2.267 -9.976 -10.581 1.00 0.00 H new ATOM 968 N ALA A 64 0.085 -4.943 -13.204 1.00 0.00 N ATOM 969 CA ALA A 64 -1.356 -5.150 -13.108 1.00 0.00 C ATOM 970 C ALA A 64 -2.000 -5.338 -14.477 1.00 0.00 C ATOM 971 O ALA A 64 -2.860 -6.203 -14.642 1.00 0.00 O ATOM 972 CB ALA A 64 -2.009 -3.990 -12.377 1.00 0.00 C ATOM 0 H ALA A 64 0.394 -4.016 -12.910 1.00 0.00 H new ATOM 0 HA ALA A 64 -1.515 -6.068 -12.542 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.084 -4.159 -12.313 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.594 -3.913 -11.372 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.819 -3.064 -12.920 1.00 0.00 H new ATOM 978 N ARG A 65 -1.586 -4.531 -15.450 1.00 0.00 N ATOM 979 CA ARG A 65 -2.130 -4.622 -16.803 1.00 0.00 C ATOM 980 C ARG A 65 -1.908 -6.018 -17.375 1.00 0.00 C ATOM 981 O ARG A 65 -2.831 -6.640 -17.904 1.00 0.00 O ATOM 982 CB ARG A 65 -1.489 -3.575 -17.722 1.00 0.00 C ATOM 983 CG ARG A 65 -1.962 -3.675 -19.165 1.00 0.00 C ATOM 984 CD ARG A 65 -1.170 -2.764 -20.091 1.00 0.00 C ATOM 985 NE ARG A 65 -1.492 -1.350 -19.899 1.00 0.00 N ATOM 986 CZ ARG A 65 -0.583 -0.375 -19.893 1.00 0.00 C ATOM 987 NH1 ARG A 65 0.712 -0.663 -19.972 1.00 0.00 N ATOM 988 NH2 ARG A 65 -0.965 0.894 -19.798 1.00 0.00 N ATOM 0 H ARG A 65 -0.877 -3.808 -15.328 1.00 0.00 H new ATOM 0 HA ARG A 65 -3.201 -4.427 -16.748 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -1.715 -2.579 -17.341 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -0.405 -3.690 -17.693 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -1.870 -4.706 -19.506 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -3.019 -3.415 -19.218 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -0.104 -2.917 -19.921 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -1.370 -3.041 -21.126 1.00 0.00 H new ATOM 0 HE ARG A 65 -2.470 -1.095 -19.762 1.00 0.00 H new ATOM 0 HH11 ARG A 65 1.015 -1.635 -20.038 1.00 0.00 H new ATOM 0 HH12 ARG A 65 1.403 0.088 -19.967 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -1.956 1.124 -19.729 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -0.267 1.638 -19.794 1.00 0.00 H new ATOM 1002 N GLU A 66 -0.689 -6.520 -17.233 1.00 0.00 N ATOM 1003 CA GLU A 66 -0.332 -7.826 -17.770 1.00 0.00 C ATOM 1004 C GLU A 66 -0.999 -8.953 -16.977 1.00 0.00 C ATOM 1005 O GLU A 66 -1.101 -10.083 -17.459 1.00 0.00 O ATOM 1006 CB GLU A 66 1.188 -8.008 -17.755 1.00 0.00 C ATOM 1007 CG GLU A 66 1.943 -6.948 -18.546 1.00 0.00 C ATOM 1008 CD GLU A 66 1.480 -6.847 -19.987 1.00 0.00 C ATOM 1009 OE1 GLU A 66 1.653 -7.826 -20.745 1.00 0.00 O ATOM 1010 OE2 GLU A 66 0.934 -5.788 -20.370 1.00 0.00 O ATOM 0 H GLU A 66 0.071 -6.041 -16.749 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.690 -7.874 -18.798 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.536 -7.993 -16.722 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.431 -8.991 -18.159 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.817 -5.980 -18.060 1.00 0.00 H new ATOM 0 HG3 GLU A 66 3.008 -7.178 -18.527 1.00 0.00 H new ATOM 1017 N ASN A 67 -1.444 -8.647 -15.760 1.00 0.00 N ATOM 1018 CA ASN A 67 -2.080 -9.650 -14.903 1.00 0.00 C ATOM 1019 C ASN A 67 -3.600 -9.519 -14.910 1.00 0.00 C ATOM 1020 O ASN A 67 -4.287 -10.263 -14.213 1.00 0.00 O ATOM 1021 CB ASN A 67 -1.570 -9.552 -13.459 1.00 0.00 C ATOM 1022 CG ASN A 67 -0.221 -10.217 -13.251 1.00 0.00 C ATOM 1023 OD1 ASN A 67 0.060 -10.755 -12.181 1.00 0.00 O ATOM 1024 ND2 ASN A 67 0.630 -10.170 -14.261 1.00 0.00 N ATOM 0 H ASN A 67 -1.377 -7.718 -15.345 1.00 0.00 H new ATOM 0 HA ASN A 67 -1.812 -10.624 -15.313 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -1.496 -8.501 -13.178 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -2.300 -10.010 -12.792 1.00 0.00 H new ATOM 0 HD21 ASN A 67 1.555 -10.589 -14.168 1.00 0.00 H new ATOM 0 HD22 ASN A 67 0.361 -9.715 -15.133 1.00 0.00 H new ATOM 1031 N ASN A 68 -4.118 -8.571 -15.696 1.00 0.00 N ATOM 1032 CA ASN A 68 -5.566 -8.335 -15.791 1.00 0.00 C ATOM 1033 C ASN A 68 -6.135 -7.848 -14.462 1.00 0.00 C ATOM 1034 O ASN A 68 -7.322 -8.021 -14.178 1.00 0.00 O ATOM 1035 CB ASN A 68 -6.302 -9.603 -16.240 1.00 0.00 C ATOM 1036 CG ASN A 68 -6.006 -9.978 -17.677 1.00 0.00 C ATOM 1037 OD1 ASN A 68 -6.693 -9.539 -18.596 1.00 0.00 O ATOM 1038 ND2 ASN A 68 -4.990 -10.803 -17.882 1.00 0.00 N ATOM 0 H ASN A 68 -3.556 -7.951 -16.279 1.00 0.00 H new ATOM 0 HA ASN A 68 -5.720 -7.557 -16.539 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -6.021 -10.430 -15.588 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -7.375 -9.455 -16.122 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.754 -11.096 -18.830 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.444 -11.145 -17.092 1.00 0.00 H new ATOM 1045 N LEU A 69 -5.292 -7.208 -13.665 1.00 0.00 N ATOM 1046 CA LEU A 69 -5.697 -6.722 -12.356 1.00 0.00 C ATOM 1047 C LEU A 69 -6.318 -5.333 -12.465 1.00 0.00 C ATOM 1048 O LEU A 69 -5.903 -4.520 -13.294 1.00 0.00 O ATOM 1049 CB LEU A 69 -4.496 -6.678 -11.408 1.00 0.00 C ATOM 1050 CG LEU A 69 -3.796 -8.022 -11.169 1.00 0.00 C ATOM 1051 CD1 LEU A 69 -2.591 -7.841 -10.262 1.00 0.00 C ATOM 1052 CD2 LEU A 69 -4.759 -9.031 -10.565 1.00 0.00 C ATOM 0 H LEU A 69 -4.320 -7.013 -13.904 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.442 -7.409 -11.956 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -3.766 -5.973 -11.806 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.827 -6.284 -10.447 1.00 0.00 H new ATOM 0 HG LEU A 69 -3.455 -8.403 -12.132 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.107 -8.805 -10.103 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.885 -7.153 -10.727 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -2.915 -7.436 -9.303 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.241 -9.977 -10.404 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.131 -8.654 -9.612 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.596 -9.187 -11.245 1.00 0.00 H new ATOM 1064 N LYS A 70 -7.314 -5.077 -11.636 1.00 0.00 N ATOM 1065 CA LYS A 70 -7.951 -3.769 -11.580 1.00 0.00 C ATOM 1066 C LYS A 70 -7.411 -3.006 -10.383 1.00 0.00 C ATOM 1067 O LYS A 70 -7.402 -3.531 -9.272 1.00 0.00 O ATOM 1068 CB LYS A 70 -9.471 -3.920 -11.459 1.00 0.00 C ATOM 1069 CG LYS A 70 -10.084 -4.828 -12.513 1.00 0.00 C ATOM 1070 CD LYS A 70 -11.591 -4.933 -12.352 1.00 0.00 C ATOM 1071 CE LYS A 70 -12.170 -5.961 -13.306 1.00 0.00 C ATOM 1072 NZ LYS A 70 -13.650 -6.041 -13.218 1.00 0.00 N ATOM 0 H LYS A 70 -7.703 -5.761 -10.987 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.731 -3.222 -12.497 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -9.710 -4.313 -10.471 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.931 -2.934 -11.530 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.849 -4.444 -13.506 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -9.640 -5.821 -12.442 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -11.832 -5.208 -11.325 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -12.049 -3.961 -12.537 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -11.882 -5.709 -14.327 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -11.742 -6.939 -13.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -13.999 -6.756 -13.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -13.926 -6.307 -12.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -14.062 -5.116 -13.453 1.00 0.00 H new ATOM 1086 N ILE A 71 -6.957 -1.782 -10.602 1.00 0.00 N ATOM 1087 CA ILE A 71 -6.315 -1.022 -9.540 1.00 0.00 C ATOM 1088 C ILE A 71 -7.230 0.055 -8.971 1.00 0.00 C ATOM 1089 O ILE A 71 -7.668 0.967 -9.677 1.00 0.00 O ATOM 1090 CB ILE A 71 -4.999 -0.365 -10.015 1.00 0.00 C ATOM 1091 CG1 ILE A 71 -3.984 -1.435 -10.423 1.00 0.00 C ATOM 1092 CG2 ILE A 71 -4.421 0.526 -8.921 1.00 0.00 C ATOM 1093 CD1 ILE A 71 -2.647 -0.861 -10.839 1.00 0.00 C ATOM 0 H ILE A 71 -7.020 -1.297 -11.497 1.00 0.00 H new ATOM 0 HA ILE A 71 -6.090 -1.744 -8.755 1.00 0.00 H new ATOM 0 HB ILE A 71 -5.218 0.254 -10.885 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -3.834 -2.121 -9.589 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -4.393 -2.019 -11.247 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -3.495 0.980 -9.273 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -5.138 1.309 -8.673 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -4.217 -0.073 -8.034 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.973 -1.672 -11.116 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.786 -0.197 -11.692 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -2.218 -0.300 -10.009 1.00 0.00 H new ATOM 1105 N ILE A 72 -7.524 -0.077 -7.691 1.00 0.00 N ATOM 1106 CA ILE A 72 -8.164 0.981 -6.930 1.00 0.00 C ATOM 1107 C ILE A 72 -7.206 1.430 -5.834 1.00 0.00 C ATOM 1108 O ILE A 72 -6.134 0.847 -5.678 1.00 0.00 O ATOM 1109 CB ILE A 72 -9.508 0.530 -6.314 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -9.329 -0.753 -5.494 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -10.552 0.334 -7.406 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -10.592 -1.223 -4.804 1.00 0.00 C ATOM 0 H ILE A 72 -7.327 -0.919 -7.150 1.00 0.00 H new ATOM 0 HA ILE A 72 -8.392 1.806 -7.605 1.00 0.00 H new ATOM 0 HB ILE A 72 -9.857 1.312 -5.640 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -8.970 -1.545 -6.151 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -8.557 -0.587 -4.743 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -11.493 0.016 -6.957 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -10.703 1.273 -7.938 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -10.208 -0.428 -8.105 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -10.383 -2.135 -4.245 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -10.942 -0.450 -4.120 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -11.361 -1.423 -5.550 1.00 0.00 H new ATOM 1124 N ALA A 73 -7.566 2.449 -5.079 1.00 0.00 N ATOM 1125 CA ALA A 73 -6.677 2.956 -4.047 1.00 0.00 C ATOM 1126 C ALA A 73 -7.450 3.343 -2.799 1.00 0.00 C ATOM 1127 O ALA A 73 -8.467 4.030 -2.877 1.00 0.00 O ATOM 1128 CB ALA A 73 -5.882 4.143 -4.573 1.00 0.00 C ATOM 0 H ALA A 73 -8.457 2.939 -5.157 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.983 2.161 -3.776 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -5.220 4.513 -3.790 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -5.289 3.831 -5.433 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -6.567 4.936 -4.873 1.00 0.00 H new ATOM 1134 N SER A 74 -6.970 2.889 -1.653 1.00 0.00 N ATOM 1135 CA SER A 74 -7.562 3.263 -0.381 1.00 0.00 C ATOM 1136 C SER A 74 -6.892 4.527 0.147 1.00 0.00 C ATOM 1137 O SER A 74 -7.434 5.229 0.999 1.00 0.00 O ATOM 1138 CB SER A 74 -7.424 2.114 0.622 1.00 0.00 C ATOM 1139 OG SER A 74 -8.082 0.946 0.146 1.00 0.00 O ATOM 0 H SER A 74 -6.171 2.260 -1.578 1.00 0.00 H new ATOM 0 HA SER A 74 -8.624 3.466 -0.523 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.369 1.899 0.792 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.848 2.410 1.582 1.00 0.00 H new ATOM 0 HG SER A 74 -8.404 0.419 0.907 1.00 0.00 H new ATOM 1145 N CYS A 75 -5.710 4.814 -0.378 1.00 0.00 N ATOM 1146 CA CYS A 75 -4.983 6.014 -0.013 1.00 0.00 C ATOM 1147 C CYS A 75 -5.265 7.132 -1.014 1.00 0.00 C ATOM 1148 O CYS A 75 -5.147 6.938 -2.226 1.00 0.00 O ATOM 1149 CB CYS A 75 -3.488 5.715 0.062 1.00 0.00 C ATOM 1150 SG CYS A 75 -2.886 4.688 -1.293 1.00 0.00 S ATOM 0 H CYS A 75 -5.234 4.226 -1.062 1.00 0.00 H new ATOM 0 HA CYS A 75 -5.319 6.347 0.969 1.00 0.00 H new ATOM 0 HB2 CYS A 75 -2.938 6.656 0.065 1.00 0.00 H new ATOM 0 HB3 CYS A 75 -3.273 5.217 1.007 1.00 0.00 H new ATOM 0 HG CYS A 75 -3.449 3.518 -1.234 1.00 0.00 H new ATOM 1156 N SER A 76 -5.642 8.295 -0.499 1.00 0.00 N ATOM 1157 CA SER A 76 -5.996 9.435 -1.335 1.00 0.00 C ATOM 1158 C SER A 76 -4.816 9.889 -2.192 1.00 0.00 C ATOM 1159 O SER A 76 -4.999 10.337 -3.325 1.00 0.00 O ATOM 1160 CB SER A 76 -6.482 10.577 -0.445 1.00 0.00 C ATOM 1161 OG SER A 76 -5.638 10.716 0.688 1.00 0.00 O ATOM 0 H SER A 76 -5.711 8.474 0.503 1.00 0.00 H new ATOM 0 HA SER A 76 -6.793 9.135 -2.015 1.00 0.00 H new ATOM 0 HB2 SER A 76 -6.496 11.508 -1.012 1.00 0.00 H new ATOM 0 HB3 SER A 76 -7.505 10.385 -0.123 1.00 0.00 H new ATOM 0 HG SER A 76 -5.961 11.453 1.248 1.00 0.00 H new ATOM 1167 N PHE A 77 -3.612 9.753 -1.645 1.00 0.00 N ATOM 1168 CA PHE A 77 -2.384 10.121 -2.348 1.00 0.00 C ATOM 1169 C PHE A 77 -2.291 9.402 -3.693 1.00 0.00 C ATOM 1170 O PHE A 77 -2.148 10.036 -4.739 1.00 0.00 O ATOM 1171 CB PHE A 77 -1.171 9.787 -1.470 1.00 0.00 C ATOM 1172 CG PHE A 77 0.156 10.158 -2.075 1.00 0.00 C ATOM 1173 CD1 PHE A 77 0.498 11.485 -2.279 1.00 0.00 C ATOM 1174 CD2 PHE A 77 1.066 9.174 -2.424 1.00 0.00 C ATOM 1175 CE1 PHE A 77 1.725 11.822 -2.823 1.00 0.00 C ATOM 1176 CE2 PHE A 77 2.292 9.504 -2.969 1.00 0.00 C ATOM 1177 CZ PHE A 77 2.622 10.830 -3.169 1.00 0.00 C ATOM 0 H PHE A 77 -3.458 9.386 -0.706 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.397 11.193 -2.545 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -1.277 10.301 -0.514 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -1.174 8.718 -1.259 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -0.200 12.264 -2.011 1.00 0.00 H new ATOM 0 HD2 PHE A 77 0.814 8.135 -2.268 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.981 12.860 -2.977 1.00 0.00 H new ATOM 0 HE2 PHE A 77 2.991 8.726 -3.238 1.00 0.00 H new ATOM 0 HZ PHE A 77 3.579 11.091 -3.595 1.00 0.00 H new ATOM 1187 N ALA A 78 -2.402 8.082 -3.660 1.00 0.00 N ATOM 1188 CA ALA A 78 -2.338 7.282 -4.870 1.00 0.00 C ATOM 1189 C ALA A 78 -3.584 7.497 -5.724 1.00 0.00 C ATOM 1190 O ALA A 78 -3.502 7.600 -6.950 1.00 0.00 O ATOM 1191 CB ALA A 78 -2.191 5.815 -4.509 1.00 0.00 C ATOM 0 H ALA A 78 -2.537 7.543 -2.805 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.470 7.594 -5.451 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.143 5.219 -5.420 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -1.276 5.672 -3.934 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.048 5.499 -3.913 1.00 0.00 H new ATOM 1197 N LYS A 79 -4.728 7.593 -5.056 1.00 0.00 N ATOM 1198 CA LYS A 79 -6.018 7.719 -5.728 1.00 0.00 C ATOM 1199 C LYS A 79 -6.065 8.958 -6.619 1.00 0.00 C ATOM 1200 O LYS A 79 -6.527 8.892 -7.760 1.00 0.00 O ATOM 1201 CB LYS A 79 -7.142 7.776 -4.686 1.00 0.00 C ATOM 1202 CG LYS A 79 -8.542 7.769 -5.279 1.00 0.00 C ATOM 1203 CD LYS A 79 -9.599 7.745 -4.185 1.00 0.00 C ATOM 1204 CE LYS A 79 -11.010 7.673 -4.751 1.00 0.00 C ATOM 1205 NZ LYS A 79 -11.395 8.917 -5.471 1.00 0.00 N ATOM 0 H LYS A 79 -4.789 7.586 -4.038 1.00 0.00 H new ATOM 0 HA LYS A 79 -6.155 6.845 -6.365 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -7.041 6.925 -4.012 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -7.019 8.676 -4.084 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -8.680 8.652 -5.904 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -8.663 6.899 -5.925 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -9.426 6.888 -3.534 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -9.502 8.639 -3.568 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -11.083 6.825 -5.432 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.715 7.492 -3.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -12.381 8.840 -5.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -11.303 9.731 -4.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -10.771 9.050 -6.292 1.00 0.00 H new ATOM 1219 N HIS A 80 -5.568 10.077 -6.106 1.00 0.00 N ATOM 1220 CA HIS A 80 -5.643 11.341 -6.826 1.00 0.00 C ATOM 1221 C HIS A 80 -4.582 11.422 -7.928 1.00 0.00 C ATOM 1222 O HIS A 80 -4.781 12.098 -8.937 1.00 0.00 O ATOM 1223 CB HIS A 80 -5.491 12.517 -5.857 1.00 0.00 C ATOM 1224 CG HIS A 80 -5.823 13.844 -6.467 1.00 0.00 C ATOM 1225 ND1 HIS A 80 -4.934 14.897 -6.522 1.00 0.00 N ATOM 1226 CD2 HIS A 80 -6.964 14.288 -7.049 1.00 0.00 C ATOM 1227 CE1 HIS A 80 -5.514 15.928 -7.109 1.00 0.00 C ATOM 1228 NE2 HIS A 80 -6.745 15.585 -7.438 1.00 0.00 N ATOM 0 H HIS A 80 -5.110 10.134 -5.196 1.00 0.00 H new ATOM 0 HA HIS A 80 -6.623 11.396 -7.300 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -6.136 12.352 -4.994 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -4.466 12.543 -5.488 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -7.876 13.725 -7.182 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.058 16.890 -7.289 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -7.423 16.186 -7.905 1.00 0.00 H new ATOM 1237 N MET A 81 -3.460 10.732 -7.741 1.00 0.00 N ATOM 1238 CA MET A 81 -2.403 10.736 -8.750 1.00 0.00 C ATOM 1239 C MET A 81 -2.850 9.993 -10.002 1.00 0.00 C ATOM 1240 O MET A 81 -2.674 10.478 -11.118 1.00 0.00 O ATOM 1241 CB MET A 81 -1.107 10.117 -8.219 1.00 0.00 C ATOM 1242 CG MET A 81 -0.369 10.994 -7.219 1.00 0.00 C ATOM 1243 SD MET A 81 1.279 10.367 -6.837 1.00 0.00 S ATOM 1244 CE MET A 81 0.879 8.745 -6.191 1.00 0.00 C ATOM 0 H MET A 81 -3.260 10.171 -6.913 1.00 0.00 H new ATOM 0 HA MET A 81 -2.204 11.778 -9.001 1.00 0.00 H new ATOM 0 HB2 MET A 81 -1.339 9.162 -7.748 1.00 0.00 H new ATOM 0 HB3 MET A 81 -0.446 9.906 -9.059 1.00 0.00 H new ATOM 0 HG2 MET A 81 -0.286 12.005 -7.618 1.00 0.00 H new ATOM 0 HG3 MET A 81 -0.951 11.061 -6.300 1.00 0.00 H new ATOM 0 HE1 MET A 81 1.795 8.170 -6.059 1.00 0.00 H new ATOM 0 HE2 MET A 81 0.375 8.850 -5.230 1.00 0.00 H new ATOM 0 HE3 MET A 81 0.223 8.227 -6.890 1.00 0.00 H new ATOM 1254 N LEU A 82 -3.443 8.822 -9.805 1.00 0.00 N ATOM 1255 CA LEU A 82 -3.932 8.014 -10.916 1.00 0.00 C ATOM 1256 C LEU A 82 -5.166 8.654 -11.541 1.00 0.00 C ATOM 1257 O LEU A 82 -5.499 8.390 -12.694 1.00 0.00 O ATOM 1258 CB LEU A 82 -4.260 6.600 -10.437 1.00 0.00 C ATOM 1259 CG LEU A 82 -3.082 5.816 -9.852 1.00 0.00 C ATOM 1260 CD1 LEU A 82 -3.554 4.478 -9.302 1.00 0.00 C ATOM 1261 CD2 LEU A 82 -2.003 5.601 -10.904 1.00 0.00 C ATOM 0 H LEU A 82 -3.597 8.410 -8.885 1.00 0.00 H new ATOM 0 HA LEU A 82 -3.149 7.958 -11.672 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -5.044 6.663 -9.682 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.669 6.036 -11.275 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.657 6.399 -9.035 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -2.704 3.934 -8.890 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -4.292 4.647 -8.517 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.005 3.894 -10.104 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -1.175 5.042 -10.467 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -2.418 5.040 -11.741 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.642 6.567 -11.258 1.00 0.00 H new ATOM 1273 N GLU A 83 -5.829 9.504 -10.768 1.00 0.00 N ATOM 1274 CA GLU A 83 -7.027 10.199 -11.225 1.00 0.00 C ATOM 1275 C GLU A 83 -6.699 11.172 -12.353 1.00 0.00 C ATOM 1276 O GLU A 83 -7.429 11.263 -13.341 1.00 0.00 O ATOM 1277 CB GLU A 83 -7.667 10.961 -10.068 1.00 0.00 C ATOM 1278 CG GLU A 83 -8.932 11.706 -10.456 1.00 0.00 C ATOM 1279 CD GLU A 83 -9.410 12.630 -9.360 1.00 0.00 C ATOM 1280 OE1 GLU A 83 -10.022 12.140 -8.393 1.00 0.00 O ATOM 1281 OE2 GLU A 83 -9.163 13.851 -9.461 1.00 0.00 O ATOM 0 H GLU A 83 -5.554 9.731 -9.812 1.00 0.00 H new ATOM 0 HA GLU A 83 -7.725 9.451 -11.601 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -7.900 10.260 -9.267 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -6.944 11.673 -9.669 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -8.748 12.284 -11.361 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -9.717 10.987 -10.691 1.00 0.00 H new ATOM 1288 N LYS A 84 -5.602 11.904 -12.197 1.00 0.00 N ATOM 1289 CA LYS A 84 -5.220 12.906 -13.182 1.00 0.00 C ATOM 1290 C LYS A 84 -4.450 12.263 -14.325 1.00 0.00 C ATOM 1291 O LYS A 84 -4.340 12.832 -15.412 1.00 0.00 O ATOM 1292 CB LYS A 84 -4.391 14.033 -12.527 1.00 0.00 C ATOM 1293 CG LYS A 84 -3.012 13.613 -12.008 1.00 0.00 C ATOM 1294 CD LYS A 84 -1.948 13.663 -13.102 1.00 0.00 C ATOM 1295 CE LYS A 84 -0.578 13.264 -12.580 1.00 0.00 C ATOM 1296 NZ LYS A 84 0.466 13.333 -13.641 1.00 0.00 N ATOM 0 H LYS A 84 -4.966 11.823 -11.404 1.00 0.00 H new ATOM 0 HA LYS A 84 -6.129 13.350 -13.588 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -4.259 14.834 -13.254 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -4.963 14.447 -11.697 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -2.719 14.268 -11.187 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -3.069 12.602 -11.604 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.234 12.998 -13.917 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -1.900 14.670 -13.515 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.300 13.919 -11.755 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -0.623 12.251 -12.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 1.393 13.102 -13.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 0.241 12.652 -14.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 0.493 14.293 -14.040 1.00 0.00 H new ATOM 1310 N GLU A 85 -3.928 11.068 -14.078 1.00 0.00 N ATOM 1311 CA GLU A 85 -3.075 10.404 -15.042 1.00 0.00 C ATOM 1312 C GLU A 85 -3.880 9.438 -15.901 1.00 0.00 C ATOM 1313 O GLU A 85 -4.069 8.274 -15.542 1.00 0.00 O ATOM 1314 CB GLU A 85 -1.938 9.667 -14.333 1.00 0.00 C ATOM 1315 CG GLU A 85 -0.805 9.281 -15.265 1.00 0.00 C ATOM 1316 CD GLU A 85 -0.245 10.480 -15.995 1.00 0.00 C ATOM 1317 OE1 GLU A 85 0.520 11.250 -15.382 1.00 0.00 O ATOM 1318 OE2 GLU A 85 -0.592 10.674 -17.180 1.00 0.00 O ATOM 0 H GLU A 85 -4.083 10.543 -13.217 1.00 0.00 H new ATOM 0 HA GLU A 85 -2.643 11.163 -15.694 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -1.545 10.298 -13.536 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -2.335 8.768 -13.861 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -0.011 8.801 -14.693 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -1.163 8.549 -15.989 1.00 0.00 H new ATOM 1325 N ASP A 86 -4.346 9.930 -17.040 1.00 0.00 N ATOM 1326 CA ASP A 86 -5.135 9.119 -17.965 1.00 0.00 C ATOM 1327 C ASP A 86 -4.260 8.088 -18.670 1.00 0.00 C ATOM 1328 O ASP A 86 -4.762 7.229 -19.391 1.00 0.00 O ATOM 1329 CB ASP A 86 -5.851 10.004 -18.999 1.00 0.00 C ATOM 1330 CG ASP A 86 -4.904 10.888 -19.789 1.00 0.00 C ATOM 1331 OD1 ASP A 86 -4.222 10.376 -20.702 1.00 0.00 O ATOM 1332 OD2 ASP A 86 -4.850 12.104 -19.509 1.00 0.00 O ATOM 0 H ASP A 86 -4.192 10.890 -17.349 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.889 8.591 -17.381 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.405 9.368 -19.690 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.581 10.631 -18.487 1.00 0.00 H new ATOM 1337 N SER A 87 -2.955 8.167 -18.444 1.00 0.00 N ATOM 1338 CA SER A 87 -2.013 7.225 -19.036 1.00 0.00 C ATOM 1339 C SER A 87 -2.166 5.833 -18.412 1.00 0.00 C ATOM 1340 O SER A 87 -1.762 4.829 -18.998 1.00 0.00 O ATOM 1341 CB SER A 87 -0.585 7.737 -18.843 1.00 0.00 C ATOM 1342 OG SER A 87 -0.468 9.089 -19.266 1.00 0.00 O ATOM 0 H SER A 87 -2.523 8.877 -17.852 1.00 0.00 H new ATOM 0 HA SER A 87 -2.226 7.142 -20.102 1.00 0.00 H new ATOM 0 HB2 SER A 87 -0.304 7.655 -17.793 1.00 0.00 H new ATOM 0 HB3 SER A 87 0.108 7.114 -19.408 1.00 0.00 H new ATOM 0 HG SER A 87 -0.213 9.649 -18.503 1.00 0.00 H new ATOM 1348 N TYR A 88 -2.756 5.779 -17.220 1.00 0.00 N ATOM 1349 CA TYR A 88 -2.958 4.513 -16.522 1.00 0.00 C ATOM 1350 C TYR A 88 -4.440 4.146 -16.495 1.00 0.00 C ATOM 1351 O TYR A 88 -4.890 3.386 -15.636 1.00 0.00 O ATOM 1352 CB TYR A 88 -2.417 4.602 -15.091 1.00 0.00 C ATOM 1353 CG TYR A 88 -0.935 4.901 -15.002 1.00 0.00 C ATOM 1354 CD1 TYR A 88 -0.008 4.158 -15.722 1.00 0.00 C ATOM 1355 CD2 TYR A 88 -0.465 5.920 -14.187 1.00 0.00 C ATOM 1356 CE1 TYR A 88 1.346 4.422 -15.628 1.00 0.00 C ATOM 1357 CE2 TYR A 88 0.885 6.193 -14.088 1.00 0.00 C ATOM 1358 CZ TYR A 88 1.787 5.441 -14.811 1.00 0.00 C ATOM 1359 OH TYR A 88 3.134 5.708 -14.715 1.00 0.00 O ATOM 0 H TYR A 88 -3.102 6.597 -16.718 1.00 0.00 H new ATOM 0 HA TYR A 88 -2.414 3.736 -17.059 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -2.965 5.377 -14.556 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -2.617 3.660 -14.580 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -0.350 3.361 -16.366 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -1.168 6.511 -13.619 1.00 0.00 H new ATOM 0 HE1 TYR A 88 2.054 3.833 -16.192 1.00 0.00 H new ATOM 0 HE2 TYR A 88 1.232 6.991 -13.448 1.00 0.00 H new ATOM 0 HH TYR A 88 3.276 6.457 -14.099 1.00 0.00 H new ATOM 1369 N GLN A 89 -5.180 4.658 -17.472 1.00 0.00 N ATOM 1370 CA GLN A 89 -6.634 4.509 -17.517 1.00 0.00 C ATOM 1371 C GLN A 89 -7.052 3.057 -17.787 1.00 0.00 C ATOM 1372 O GLN A 89 -8.233 2.717 -17.711 1.00 0.00 O ATOM 1373 CB GLN A 89 -7.204 5.432 -18.597 1.00 0.00 C ATOM 1374 CG GLN A 89 -8.715 5.596 -18.551 1.00 0.00 C ATOM 1375 CD GLN A 89 -9.239 6.504 -19.650 1.00 0.00 C ATOM 1376 OE1 GLN A 89 -10.366 6.346 -20.120 1.00 0.00 O ATOM 1377 NE2 GLN A 89 -8.423 7.457 -20.074 1.00 0.00 N ATOM 0 H GLN A 89 -4.793 5.187 -18.254 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.035 4.785 -16.542 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -6.741 6.414 -18.499 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -6.923 5.043 -19.576 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -9.186 4.617 -18.639 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -9.003 6.002 -17.581 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.496 7.556 -19.660 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -8.721 8.092 -20.815 1.00 0.00 H new ATOM 1386 N ASP A 90 -6.081 2.208 -18.106 1.00 0.00 N ATOM 1387 CA ASP A 90 -6.348 0.793 -18.365 1.00 0.00 C ATOM 1388 C ASP A 90 -6.881 0.104 -17.118 1.00 0.00 C ATOM 1389 O ASP A 90 -7.931 -0.534 -17.143 1.00 0.00 O ATOM 1390 CB ASP A 90 -5.076 0.067 -18.810 1.00 0.00 C ATOM 1391 CG ASP A 90 -4.493 0.613 -20.093 1.00 0.00 C ATOM 1392 OD1 ASP A 90 -4.915 0.175 -21.179 1.00 0.00 O ATOM 1393 OD2 ASP A 90 -3.588 1.472 -20.017 1.00 0.00 O ATOM 0 H ASP A 90 -5.100 2.473 -18.192 1.00 0.00 H new ATOM 0 HA ASP A 90 -7.094 0.748 -19.159 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -4.329 0.140 -18.020 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -5.298 -0.992 -18.942 1.00 0.00 H new ATOM 1398 N VAL A 91 -6.145 0.249 -16.026 1.00 0.00 N ATOM 1399 CA VAL A 91 -6.448 -0.478 -14.802 1.00 0.00 C ATOM 1400 C VAL A 91 -7.145 0.405 -13.775 1.00 0.00 C ATOM 1401 O VAL A 91 -7.667 -0.088 -12.777 1.00 0.00 O ATOM 1402 CB VAL A 91 -5.167 -1.070 -14.177 1.00 0.00 C ATOM 1403 CG1 VAL A 91 -4.555 -2.115 -15.098 1.00 0.00 C ATOM 1404 CG2 VAL A 91 -4.161 0.030 -13.886 1.00 0.00 C ATOM 0 H VAL A 91 -5.333 0.864 -15.962 1.00 0.00 H new ATOM 0 HA VAL A 91 -7.123 -1.287 -15.079 1.00 0.00 H new ATOM 0 HB VAL A 91 -5.436 -1.553 -13.238 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.653 -2.520 -14.640 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -5.272 -2.920 -15.262 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.301 -1.655 -16.053 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -3.264 -0.405 -13.446 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.900 0.539 -14.814 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.597 0.746 -13.189 1.00 0.00 H new ATOM 1414 N TYR A 92 -7.150 1.707 -14.018 1.00 0.00 N ATOM 1415 CA TYR A 92 -7.771 2.645 -13.098 1.00 0.00 C ATOM 1416 C TYR A 92 -9.249 2.794 -13.425 1.00 0.00 C ATOM 1417 O TYR A 92 -9.617 3.079 -14.566 1.00 0.00 O ATOM 1418 CB TYR A 92 -7.068 4.003 -13.164 1.00 0.00 C ATOM 1419 CG TYR A 92 -7.533 4.990 -12.113 1.00 0.00 C ATOM 1420 CD1 TYR A 92 -7.222 4.801 -10.773 1.00 0.00 C ATOM 1421 CD2 TYR A 92 -8.269 6.116 -12.463 1.00 0.00 C ATOM 1422 CE1 TYR A 92 -7.629 5.703 -9.810 1.00 0.00 C ATOM 1423 CE2 TYR A 92 -8.683 7.024 -11.505 1.00 0.00 C ATOM 1424 CZ TYR A 92 -8.360 6.812 -10.180 1.00 0.00 C ATOM 1425 OH TYR A 92 -8.763 7.717 -9.221 1.00 0.00 O ATOM 0 H TYR A 92 -6.732 2.136 -14.843 1.00 0.00 H new ATOM 0 HA TYR A 92 -7.674 2.258 -12.084 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -5.994 3.850 -13.054 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -7.229 4.436 -14.151 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -6.651 3.933 -10.479 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -8.522 6.285 -13.499 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.376 5.541 -8.773 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -9.256 7.894 -11.792 1.00 0.00 H new ATOM 0 HH TYR A 92 -7.977 8.079 -8.762 1.00 0.00 H new ATOM 1435 N LEU A 93 -10.090 2.578 -12.425 1.00 0.00 N ATOM 1436 CA LEU A 93 -11.531 2.688 -12.603 1.00 0.00 C ATOM 1437 C LEU A 93 -11.986 4.129 -12.406 1.00 0.00 C ATOM 1438 O LEU A 93 -12.516 4.754 -13.322 1.00 0.00 O ATOM 1439 CB LEU A 93 -12.260 1.759 -11.625 1.00 0.00 C ATOM 1440 CG LEU A 93 -11.944 0.272 -11.785 1.00 0.00 C ATOM 1441 CD1 LEU A 93 -12.677 -0.543 -10.731 1.00 0.00 C ATOM 1442 CD2 LEU A 93 -12.316 -0.205 -13.180 1.00 0.00 C ATOM 0 H LEU A 93 -9.800 2.325 -11.480 1.00 0.00 H new ATOM 0 HA LEU A 93 -11.778 2.386 -13.621 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -12.010 2.060 -10.608 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -13.334 1.901 -11.745 1.00 0.00 H new ATOM 0 HG LEU A 93 -10.872 0.131 -11.648 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.441 -1.599 -10.859 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -12.364 -0.219 -9.738 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -13.752 -0.395 -10.839 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -12.084 -1.266 -13.276 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -13.382 -0.050 -13.345 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -11.749 0.359 -13.921 1.00 0.00 H new ATOM 1454 N GLY A 94 -11.769 4.653 -11.207 1.00 0.00 N ATOM 1455 CA GLY A 94 -12.145 6.024 -10.916 1.00 0.00 C ATOM 1456 C GLY A 94 -13.627 6.169 -10.637 1.00 0.00 C ATOM 1457 O GLY A 94 -14.274 5.220 -10.194 1.00 0.00 O ATOM 0 H GLY A 94 -11.339 4.153 -10.429 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.579 6.378 -10.054 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -11.873 6.659 -11.759 1.00 0.00 H new ATOM 1461 N LEU A 95 -14.160 7.359 -10.887 1.00 0.00 N ATOM 1462 CA LEU A 95 -15.574 7.626 -10.681 1.00 0.00 C ATOM 1463 C LEU A 95 -16.023 8.787 -11.561 1.00 0.00 C ATOM 1464 O LEU A 95 -15.308 9.779 -11.709 1.00 0.00 O ATOM 1465 CB LEU A 95 -15.855 7.943 -9.209 1.00 0.00 C ATOM 1466 CG LEU A 95 -17.330 8.147 -8.854 1.00 0.00 C ATOM 1467 CD1 LEU A 95 -18.124 6.875 -9.110 1.00 0.00 C ATOM 1468 CD2 LEU A 95 -17.473 8.588 -7.407 1.00 0.00 C ATOM 0 H LEU A 95 -13.629 8.157 -11.235 1.00 0.00 H new ATOM 0 HA LEU A 95 -16.136 6.734 -10.956 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -15.460 7.131 -8.598 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -15.305 8.844 -8.937 1.00 0.00 H new ATOM 0 HG LEU A 95 -17.732 8.933 -9.493 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -19.170 7.041 -8.851 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -18.049 6.605 -10.163 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -17.723 6.066 -8.499 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -18.528 8.728 -7.172 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -17.053 7.825 -6.751 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -16.940 9.527 -7.259 1.00 0.00 H new ATOM 1480 N GLU A 96 -17.206 8.654 -12.144 1.00 0.00 N ATOM 1481 CA GLU A 96 -17.747 9.676 -13.026 1.00 0.00 C ATOM 1482 C GLU A 96 -19.275 9.634 -12.955 1.00 0.00 C ATOM 1483 O GLU A 96 -19.860 8.565 -12.766 1.00 0.00 O ATOM 1484 CB GLU A 96 -17.238 9.437 -14.457 1.00 0.00 C ATOM 1485 CG GLU A 96 -17.106 10.697 -15.304 1.00 0.00 C ATOM 1486 CD GLU A 96 -18.438 11.227 -15.777 1.00 0.00 C ATOM 1487 OE1 GLU A 96 -19.020 10.622 -16.698 1.00 0.00 O ATOM 1488 OE2 GLU A 96 -18.920 12.235 -15.210 1.00 0.00 O ATOM 0 H GLU A 96 -17.812 7.843 -12.020 1.00 0.00 H new ATOM 0 HA GLU A 96 -17.416 10.667 -12.715 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -16.266 8.947 -14.405 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -17.916 8.747 -14.959 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -16.599 11.468 -14.724 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -16.477 10.484 -16.169 1.00 0.00 H new ATOM 1495 N HIS A 97 -19.917 10.788 -13.102 1.00 0.00 N ATOM 1496 CA HIS A 97 -21.363 10.900 -12.919 1.00 0.00 C ATOM 1497 C HIS A 97 -22.084 10.843 -14.271 1.00 0.00 C ATOM 1498 O HIS A 97 -23.193 11.360 -14.430 1.00 0.00 O ATOM 1499 CB HIS A 97 -21.688 12.201 -12.172 1.00 0.00 C ATOM 1500 CG HIS A 97 -23.104 12.293 -11.677 1.00 0.00 C ATOM 1501 ND1 HIS A 97 -23.684 11.337 -10.873 1.00 0.00 N ATOM 1502 CD2 HIS A 97 -24.049 13.242 -11.868 1.00 0.00 C ATOM 1503 CE1 HIS A 97 -24.922 11.695 -10.591 1.00 0.00 C ATOM 1504 NE2 HIS A 97 -25.173 12.850 -11.181 1.00 0.00 N ATOM 0 H HIS A 97 -19.457 11.665 -13.349 1.00 0.00 H new ATOM 0 HA HIS A 97 -21.715 10.059 -12.322 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -21.012 12.297 -11.323 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -21.491 13.045 -12.833 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -23.940 14.143 -12.453 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -25.615 11.137 -9.979 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -26.053 13.364 -11.135 1.00 0.00 H new ATOM 1513 N HIS A 98 -21.421 10.217 -15.234 1.00 0.00 N ATOM 1514 CA HIS A 98 -21.980 9.948 -16.560 1.00 0.00 C ATOM 1515 C HIS A 98 -22.153 11.234 -17.367 1.00 0.00 C ATOM 1516 O HIS A 98 -22.843 11.255 -18.386 1.00 0.00 O ATOM 1517 CB HIS A 98 -23.314 9.193 -16.464 1.00 0.00 C ATOM 1518 CG HIS A 98 -23.683 8.477 -17.728 1.00 0.00 C ATOM 1519 ND1 HIS A 98 -24.626 8.941 -18.616 1.00 0.00 N ATOM 1520 CD2 HIS A 98 -23.220 7.319 -18.249 1.00 0.00 C ATOM 1521 CE1 HIS A 98 -24.725 8.102 -19.627 1.00 0.00 C ATOM 1522 NE2 HIS A 98 -23.881 7.107 -19.431 1.00 0.00 N ATOM 0 H HIS A 98 -20.467 9.876 -15.119 1.00 0.00 H new ATOM 0 HA HIS A 98 -21.266 9.313 -17.084 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -23.257 8.471 -15.649 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -24.105 9.898 -16.210 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -22.467 6.678 -17.814 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -25.386 8.211 -20.474 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -23.743 6.312 -20.055 1.00 0.00 H new ATOM 1531 N HIS A 99 -21.504 12.300 -16.933 1.00 0.00 N ATOM 1532 CA HIS A 99 -21.523 13.540 -17.689 1.00 0.00 C ATOM 1533 C HIS A 99 -20.270 13.589 -18.550 1.00 0.00 C ATOM 1534 O HIS A 99 -19.433 14.482 -18.422 1.00 0.00 O ATOM 1535 CB HIS A 99 -21.605 14.759 -16.760 1.00 0.00 C ATOM 1536 CG HIS A 99 -21.962 16.029 -17.474 1.00 0.00 C ATOM 1537 ND1 HIS A 99 -21.558 17.274 -17.047 1.00 0.00 N ATOM 1538 CD2 HIS A 99 -22.706 16.240 -18.587 1.00 0.00 C ATOM 1539 CE1 HIS A 99 -22.036 18.194 -17.863 1.00 0.00 C ATOM 1540 NE2 HIS A 99 -22.735 17.595 -18.810 1.00 0.00 N ATOM 0 H HIS A 99 -20.962 12.333 -16.069 1.00 0.00 H new ATOM 0 HA HIS A 99 -22.410 13.571 -18.322 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -22.346 14.566 -15.984 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -20.646 14.890 -16.259 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -23.187 15.482 -19.188 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -21.881 19.259 -17.772 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -23.216 18.061 -19.579 1.00 0.00 H new ATOM 1549 N HIS A 100 -20.150 12.604 -19.426 1.00 0.00 N ATOM 1550 CA HIS A 100 -18.928 12.396 -20.168 1.00 0.00 C ATOM 1551 C HIS A 100 -19.178 12.402 -21.672 1.00 0.00 C ATOM 1552 O HIS A 100 -19.038 11.378 -22.342 1.00 0.00 O ATOM 1553 CB HIS A 100 -18.281 11.074 -19.732 1.00 0.00 C ATOM 1554 CG HIS A 100 -16.887 10.854 -20.241 1.00 0.00 C ATOM 1555 ND1 HIS A 100 -15.780 11.437 -19.669 1.00 0.00 N ATOM 1556 CD2 HIS A 100 -16.423 10.095 -21.261 1.00 0.00 C ATOM 1557 CE1 HIS A 100 -14.697 11.039 -20.308 1.00 0.00 C ATOM 1558 NE2 HIS A 100 -15.057 10.222 -21.281 1.00 0.00 N ATOM 0 H HIS A 100 -20.891 11.936 -19.637 1.00 0.00 H new ATOM 0 HA HIS A 100 -18.248 13.220 -19.950 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -18.264 11.037 -18.643 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -18.910 10.250 -20.070 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -17.019 9.498 -21.936 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -13.684 11.332 -20.074 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -14.426 9.763 -21.937 1.00 0.00 H new ATOM 1567 N HIS A 101 -19.586 13.545 -22.196 1.00 0.00 N ATOM 1568 CA HIS A 101 -19.535 13.752 -23.633 1.00 0.00 C ATOM 1569 C HIS A 101 -18.076 14.003 -23.972 1.00 0.00 C ATOM 1570 O HIS A 101 -17.568 13.589 -25.011 1.00 0.00 O ATOM 1571 CB HIS A 101 -20.421 14.926 -24.069 1.00 0.00 C ATOM 1572 CG HIS A 101 -20.690 14.968 -25.546 1.00 0.00 C ATOM 1573 ND1 HIS A 101 -20.889 16.138 -26.242 1.00 0.00 N ATOM 1574 CD2 HIS A 101 -20.821 13.970 -26.455 1.00 0.00 C ATOM 1575 CE1 HIS A 101 -21.126 15.862 -27.510 1.00 0.00 C ATOM 1576 NE2 HIS A 101 -21.090 14.553 -27.667 1.00 0.00 N ATOM 0 H HIS A 101 -19.950 14.332 -21.659 1.00 0.00 H new ATOM 0 HA HIS A 101 -19.919 12.882 -24.165 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -21.371 14.869 -23.538 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -19.944 15.859 -23.769 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -20.730 12.912 -26.260 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -21.317 16.586 -28.288 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -21.238 14.056 -28.545 1.00 0.00 H new ATOM 1585 N HIS A 102 -17.417 14.673 -23.036 1.00 0.00 N ATOM 1586 CA HIS A 102 -15.970 14.740 -22.972 1.00 0.00 C ATOM 1587 C HIS A 102 -15.569 15.026 -21.532 1.00 0.00 C ATOM 1588 O HIS A 102 -15.292 14.072 -20.790 1.00 0.00 O ATOM 1589 CB HIS A 102 -15.389 15.813 -23.893 1.00 0.00 C ATOM 1590 CG HIS A 102 -13.888 15.804 -23.903 1.00 0.00 C ATOM 1591 ND1 HIS A 102 -13.123 16.742 -23.250 1.00 0.00 N ATOM 1592 CD2 HIS A 102 -13.012 14.934 -24.460 1.00 0.00 C ATOM 1593 CE1 HIS A 102 -11.848 16.452 -23.405 1.00 0.00 C ATOM 1594 NE2 HIS A 102 -11.748 15.356 -24.132 1.00 0.00 N ATOM 1595 OXT HIS A 102 -15.586 16.207 -21.136 1.00 0.00 O ATOM 0 H HIS A 102 -17.883 15.191 -22.291 1.00 0.00 H new ATOM 0 HA HIS A 102 -15.569 13.785 -23.311 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -15.758 15.657 -24.907 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -15.742 16.793 -23.573 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -13.262 14.067 -25.053 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -11.021 17.018 -23.003 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -10.878 14.899 -24.405 1.00 0.00 H new TER 1604 HIS A 102