USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1080 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 NoAdj-H: A 46 HIS HD1 : A 46 HIS ND1 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 48 HIS HE2 : A 48 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 63 HIS HD1 : A 63 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 71 HIS HD1 : A 71 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 80 HIS HD1 : A 80 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 120 HIS HE2 : A 120 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD Set 1.1: A 133 GLN :FLIP amide:sc= 0.0979 F(o=-0.9,f=0.51) USER MOD Set 1.2: A 137 THR OG1 : rot -113:sc= 0.415 USER MOD Set 2.1: A 131 ASN :FLIP amide:sc= 0.931 F(o=-0.64!,f=1.9) USER MOD Set 2.2: A 134 SER OG : rot 88:sc= 0.975 USER MOD Set 3.1: A 22 GLN : amide:sc= 0.814 K(o=1.7,f=-0.39) USER MOD Set 3.2: A 105 SER OG : rot 20:sc= 0.909 USER MOD Set 4.1: A 39 THR OG1 : rot 180:sc= 0.0459 USER MOD Set 4.2: A 43 HIS : +bothHN:sc= -2.26! C(o=-2.2!,f=-11!) USER MOD Single : A 1 ALA N :NH3+ -140:sc= 1.01 (180deg=0.114) USER MOD Single : A 2 THR OG1 : rot 100:sc= 0.0421 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 137:sc= 2.38 (180deg=0.802) USER MOD Single : A 15 GLN : amide:sc= -0.289 X(o=-0.29,f=-0.018) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=0.22) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0.0554 USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 138:sc= -0.116 (180deg=-0.371) USER MOD Single : A 34 SER OG : rot 33:sc= 0.098 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot -47:sc= 0.458 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -0.609 K(o=-0.61,f=-1.4) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 171:sc= -0.437 (180deg=-0.645) USER MOD Single : A 86 ASN :FLIP amide:sc= -0.117 F(o=-1.4,f=-0.12) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 179:sc= 1.19 (180deg=1.17) USER MOD Single : A 98 SER OG : rot 51:sc= 0.00377 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 178:sc=-0.00256 USER MOD Single : A 110 HIS : no HE2:sc= 0.765 K(o=0.77,f=-4.9!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 150:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ -162:sc= 1.12 (180deg=0.283) USER MOD Single : A 128 LYS NZ :NH3+ -169:sc= 0.483 (180deg=0.155!) USER MOD Single : A 135 THR OG1 : rot 82:sc= 0.463 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= 0.422 K(o=0.42,f=-0.13) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 18.634 4.748 7.839 1.00 0.00 N ATOM 2 CA ALA A 1 17.795 5.901 7.489 1.00 0.00 C ATOM 3 C ALA A 1 16.905 6.201 8.680 1.00 0.00 C ATOM 4 O ALA A 1 17.305 5.911 9.807 1.00 0.00 O ATOM 5 CB ALA A 1 18.602 7.161 7.145 1.00 0.00 C ATOM 0 H1 ALA A 1 19.597 4.897 7.476 1.00 0.00 H new ATOM 0 H2 ALA A 1 18.666 4.643 8.873 1.00 0.00 H new ATOM 0 H3 ALA A 1 18.234 3.886 7.416 1.00 0.00 H new ATOM 0 HA ALA A 1 17.226 5.641 6.597 1.00 0.00 H new ATOM 0 HB1 ALA A 1 17.919 7.974 6.896 1.00 0.00 H new ATOM 0 HB2 ALA A 1 19.211 7.448 8.002 1.00 0.00 H new ATOM 0 HB3 ALA A 1 19.249 6.957 6.292 1.00 0.00 H new ATOM 13 N THR A 2 15.754 6.815 8.424 1.00 0.00 N ATOM 14 CA THR A 2 14.831 7.321 9.418 1.00 0.00 C ATOM 15 C THR A 2 14.076 6.161 10.081 1.00 0.00 C ATOM 16 O THR A 2 14.363 4.997 9.807 1.00 0.00 O ATOM 17 CB THR A 2 13.914 8.281 8.649 1.00 0.00 C ATOM 18 OG1 THR A 2 13.378 7.587 7.537 1.00 0.00 O ATOM 19 CG2 THR A 2 14.727 9.460 8.092 1.00 0.00 C ATOM 0 H THR A 2 15.430 6.978 7.471 1.00 0.00 H new ATOM 0 HA THR A 2 15.322 7.842 10.239 1.00 0.00 H new ATOM 0 HB THR A 2 13.136 8.643 9.321 1.00 0.00 H new ATOM 0 HG1 THR A 2 12.468 7.289 7.745 1.00 0.00 H new ATOM 0 HG21 THR A 2 14.065 10.134 7.548 1.00 0.00 H new ATOM 0 HG22 THR A 2 15.197 9.999 8.915 1.00 0.00 H new ATOM 0 HG23 THR A 2 15.496 9.085 7.417 1.00 0.00 H new ATOM 27 N LYS A 3 13.110 6.466 10.954 1.00 0.00 N ATOM 28 CA LYS A 3 12.256 5.461 11.568 1.00 0.00 C ATOM 29 C LYS A 3 10.804 5.936 11.554 1.00 0.00 C ATOM 30 O LYS A 3 10.409 6.798 12.342 1.00 0.00 O ATOM 31 CB LYS A 3 12.719 5.161 12.993 1.00 0.00 C ATOM 32 CG LYS A 3 14.145 4.615 13.057 1.00 0.00 C ATOM 33 CD LYS A 3 14.331 4.071 14.477 1.00 0.00 C ATOM 34 CE LYS A 3 15.755 3.574 14.753 1.00 0.00 C ATOM 35 NZ LYS A 3 16.080 2.353 13.987 1.00 0.00 N ATOM 0 H LYS A 3 12.903 7.420 11.251 1.00 0.00 H new ATOM 0 HA LYS A 3 12.325 4.537 10.993 1.00 0.00 H new ATOM 0 HB2 LYS A 3 12.658 6.072 13.588 1.00 0.00 H new ATOM 0 HB3 LYS A 3 12.039 4.439 13.445 1.00 0.00 H new ATOM 0 HG2 LYS A 3 14.295 3.829 12.316 1.00 0.00 H new ATOM 0 HG3 LYS A 3 14.872 5.398 12.842 1.00 0.00 H new ATOM 0 HD2 LYS A 3 14.081 4.853 15.194 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.630 3.253 14.640 1.00 0.00 H new ATOM 0 HE2 LYS A 3 16.467 4.359 14.500 1.00 0.00 H new ATOM 0 HE3 LYS A 3 15.867 3.373 15.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 17.052 2.054 14.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 15.418 1.594 14.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 15.999 2.550 12.969 1.00 0.00 H new ATOM 49 N ALA A 4 10.015 5.365 10.649 1.00 0.00 N ATOM 50 CA ALA A 4 8.603 5.669 10.486 1.00 0.00 C ATOM 51 C ALA A 4 7.821 4.360 10.428 1.00 0.00 C ATOM 52 O ALA A 4 8.393 3.310 10.135 1.00 0.00 O ATOM 53 CB ALA A 4 8.427 6.526 9.236 1.00 0.00 C ATOM 0 H ALA A 4 10.352 4.660 9.993 1.00 0.00 H new ATOM 0 HA ALA A 4 8.214 6.241 11.329 1.00 0.00 H new ATOM 0 HB1 ALA A 4 7.371 6.761 9.102 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.994 7.451 9.346 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.790 5.979 8.366 1.00 0.00 H new ATOM 59 N VAL A 5 6.530 4.418 10.755 1.00 0.00 N ATOM 60 CA VAL A 5 5.670 3.268 10.973 1.00 0.00 C ATOM 61 C VAL A 5 4.259 3.641 10.517 1.00 0.00 C ATOM 62 O VAL A 5 3.921 4.822 10.537 1.00 0.00 O ATOM 63 CB VAL A 5 5.731 2.879 12.469 1.00 0.00 C ATOM 64 CG1 VAL A 5 5.103 3.953 13.367 1.00 0.00 C ATOM 65 CG2 VAL A 5 5.088 1.527 12.801 1.00 0.00 C ATOM 0 H VAL A 5 6.041 5.305 10.879 1.00 0.00 H new ATOM 0 HA VAL A 5 5.993 2.400 10.399 1.00 0.00 H new ATOM 0 HB VAL A 5 6.798 2.793 12.672 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.167 3.639 14.409 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.638 4.894 13.238 1.00 0.00 H new ATOM 0 HG13 VAL A 5 4.057 4.090 13.093 1.00 0.00 H new ATOM 0 HG21 VAL A 5 5.176 1.335 13.870 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.035 1.547 12.522 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.596 0.737 12.247 1.00 0.00 H new ATOM 75 N ALA A 6 3.422 2.679 10.119 1.00 0.00 N ATOM 76 CA ALA A 6 1.993 2.930 9.961 1.00 0.00 C ATOM 77 C ALA A 6 1.211 1.779 10.561 1.00 0.00 C ATOM 78 O ALA A 6 1.296 0.655 10.071 1.00 0.00 O ATOM 79 CB ALA A 6 1.619 3.141 8.495 1.00 0.00 C ATOM 0 H ALA A 6 3.710 1.725 9.902 1.00 0.00 H new ATOM 0 HA ALA A 6 1.740 3.850 10.489 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.548 3.325 8.416 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.165 3.998 8.100 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.877 2.251 7.922 1.00 0.00 H new ATOM 85 N VAL A 7 0.464 2.058 11.630 1.00 0.00 N ATOM 86 CA VAL A 7 -0.414 1.094 12.242 1.00 0.00 C ATOM 87 C VAL A 7 -1.727 1.049 11.448 1.00 0.00 C ATOM 88 O VAL A 7 -2.641 1.844 11.648 1.00 0.00 O ATOM 89 CB VAL A 7 -0.534 1.345 13.754 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.844 1.619 14.376 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.497 2.463 14.181 1.00 0.00 C ATOM 0 H VAL A 7 0.460 2.969 12.089 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.007 0.084 12.190 1.00 0.00 H new ATOM 0 HB VAL A 7 -0.968 0.418 14.129 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.732 1.793 15.446 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.494 0.759 14.215 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.285 2.500 13.909 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.498 2.547 15.268 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.174 3.408 13.744 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.503 2.228 13.834 1.00 0.00 H new ATOM 101 N LEU A 8 -1.804 0.127 10.492 1.00 0.00 N ATOM 102 CA LEU A 8 -3.039 -0.230 9.825 1.00 0.00 C ATOM 103 C LEU A 8 -4.043 -0.729 10.859 1.00 0.00 C ATOM 104 O LEU A 8 -3.651 -1.434 11.790 1.00 0.00 O ATOM 105 CB LEU A 8 -2.746 -1.284 8.743 1.00 0.00 C ATOM 106 CG LEU A 8 -2.622 -0.608 7.372 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.532 0.469 7.373 1.00 0.00 C ATOM 108 CD2 LEU A 8 -2.296 -1.669 6.323 1.00 0.00 C ATOM 0 H LEU A 8 -0.995 -0.397 10.159 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.475 0.638 9.331 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.824 -1.815 8.981 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.544 -2.026 8.721 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.569 -0.122 7.139 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.472 0.927 6.386 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.775 1.232 8.113 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.573 0.015 7.621 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.206 -1.198 5.344 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.355 -2.157 6.579 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.094 -2.411 6.296 1.00 0.00 H new ATOM 120 N LYS A 9 -5.322 -0.376 10.677 1.00 0.00 N ATOM 121 CA LYS A 9 -6.454 -0.885 11.436 1.00 0.00 C ATOM 122 C LYS A 9 -7.679 -0.825 10.516 1.00 0.00 C ATOM 123 O LYS A 9 -7.747 0.056 9.658 1.00 0.00 O ATOM 124 CB LYS A 9 -6.662 -0.066 12.726 1.00 0.00 C ATOM 125 CG LYS A 9 -6.534 -0.929 13.993 1.00 0.00 C ATOM 126 CD LYS A 9 -7.675 -1.950 14.176 1.00 0.00 C ATOM 127 CE LYS A 9 -8.960 -1.314 14.735 1.00 0.00 C ATOM 128 NZ LYS A 9 -10.168 -2.126 14.456 1.00 0.00 N ATOM 0 H LYS A 9 -5.600 0.300 9.966 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.280 -1.913 11.755 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.930 0.741 12.763 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.648 0.399 12.704 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -5.584 -1.463 13.962 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.503 -0.275 14.864 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.895 -2.419 13.217 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.344 -2.741 14.849 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.857 -1.182 15.812 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -9.087 -0.321 14.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -10.768 -2.159 15.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -10.701 -1.698 13.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.884 -3.092 14.195 1.00 0.00 H new ATOM 142 N GLY A 10 -8.617 -1.764 10.651 1.00 0.00 N ATOM 143 CA GLY A 10 -9.870 -1.753 9.916 1.00 0.00 C ATOM 144 C GLY A 10 -11.058 -1.715 10.857 1.00 0.00 C ATOM 145 O GLY A 10 -10.926 -1.339 12.023 1.00 0.00 O ATOM 0 H GLY A 10 -8.521 -2.560 11.282 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.899 -0.887 9.255 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -9.932 -2.639 9.284 1.00 0.00 H new ATOM 149 N ASP A 11 -12.209 -2.156 10.360 1.00 0.00 N ATOM 150 CA ASP A 11 -13.385 -2.433 11.161 1.00 0.00 C ATOM 151 C ASP A 11 -13.022 -3.449 12.245 1.00 0.00 C ATOM 152 O ASP A 11 -13.257 -3.221 13.432 1.00 0.00 O ATOM 153 CB ASP A 11 -14.506 -2.955 10.241 1.00 0.00 C ATOM 154 CG ASP A 11 -14.157 -4.251 9.508 1.00 0.00 C ATOM 155 OD1 ASP A 11 -12.949 -4.444 9.234 1.00 0.00 O ATOM 156 OD2 ASP A 11 -15.095 -5.036 9.265 1.00 0.00 O ATOM 0 H ASP A 11 -12.348 -2.333 9.365 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.743 -1.528 11.652 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -15.404 -3.117 10.836 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -14.745 -2.187 9.506 1.00 0.00 H new ATOM 161 N GLY A 12 -12.406 -4.555 11.835 1.00 0.00 N ATOM 162 CA GLY A 12 -12.246 -5.731 12.655 1.00 0.00 C ATOM 163 C GLY A 12 -10.864 -5.721 13.289 1.00 0.00 C ATOM 164 O GLY A 12 -10.336 -4.654 13.633 1.00 0.00 O ATOM 0 H GLY A 12 -12.000 -4.651 10.904 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.013 -5.755 13.429 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.374 -6.629 12.051 1.00 0.00 H new ATOM 168 N PRO A 13 -10.250 -6.903 13.423 1.00 0.00 N ATOM 169 CA PRO A 13 -8.903 -7.027 13.924 1.00 0.00 C ATOM 170 C PRO A 13 -7.879 -6.913 12.796 1.00 0.00 C ATOM 171 O PRO A 13 -6.693 -7.059 13.054 1.00 0.00 O ATOM 172 CB PRO A 13 -8.868 -8.408 14.577 1.00 0.00 C ATOM 173 CG PRO A 13 -9.774 -9.229 13.656 1.00 0.00 C ATOM 174 CD PRO A 13 -10.822 -8.219 13.178 1.00 0.00 C ATOM 0 HA PRO A 13 -8.646 -6.234 14.626 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -7.857 -8.813 14.618 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -9.243 -8.383 15.600 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.217 -9.653 12.821 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.234 -10.062 14.187 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.044 -8.358 12.120 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.760 -8.344 13.719 1.00 0.00 H new ATOM 182 N VAL A 14 -8.302 -6.649 11.553 1.00 0.00 N ATOM 183 CA VAL A 14 -7.386 -6.353 10.462 1.00 0.00 C ATOM 184 C VAL A 14 -6.533 -5.168 10.898 1.00 0.00 C ATOM 185 O VAL A 14 -7.031 -4.041 10.926 1.00 0.00 O ATOM 186 CB VAL A 14 -8.160 -6.036 9.170 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.164 -5.862 8.013 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.164 -7.131 8.790 1.00 0.00 C ATOM 0 H VAL A 14 -9.286 -6.636 11.284 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.754 -7.214 10.245 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.723 -5.121 9.353 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.708 -5.637 7.095 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.482 -5.043 8.240 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.595 -6.782 7.881 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.678 -6.850 7.871 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.636 -8.072 8.637 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.893 -7.250 9.592 1.00 0.00 H new ATOM 198 N GLN A 15 -5.279 -5.427 11.272 1.00 0.00 N ATOM 199 CA GLN A 15 -4.353 -4.408 11.730 1.00 0.00 C ATOM 200 C GLN A 15 -2.957 -4.767 11.243 1.00 0.00 C ATOM 201 O GLN A 15 -2.707 -5.941 10.996 1.00 0.00 O ATOM 202 CB GLN A 15 -4.425 -4.314 13.263 1.00 0.00 C ATOM 203 CG GLN A 15 -3.766 -5.524 13.953 1.00 0.00 C ATOM 204 CD GLN A 15 -4.537 -6.013 15.174 1.00 0.00 C ATOM 205 OE1 GLN A 15 -4.760 -5.262 16.119 1.00 0.00 O ATOM 206 NE2 GLN A 15 -4.939 -7.280 15.173 1.00 0.00 N ATOM 0 H GLN A 15 -4.879 -6.365 11.263 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.613 -3.429 11.327 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -3.934 -3.398 13.592 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -5.468 -4.245 13.572 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -3.679 -6.340 13.236 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.754 -5.255 14.254 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -4.738 -7.878 14.372 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -5.449 -7.654 15.973 1.00 0.00 H new ATOM 215 N GLY A 16 -2.044 -3.808 11.093 1.00 0.00 N ATOM 216 CA GLY A 16 -0.679 -4.144 10.701 1.00 0.00 C ATOM 217 C GLY A 16 0.300 -3.038 11.035 1.00 0.00 C ATOM 218 O GLY A 16 -0.034 -1.873 10.904 1.00 0.00 O ATOM 0 H GLY A 16 -2.220 -2.813 11.234 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.374 -5.062 11.204 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.649 -4.343 9.630 1.00 0.00 H new ATOM 222 N ILE A 17 1.509 -3.402 11.446 1.00 0.00 N ATOM 223 CA ILE A 17 2.574 -2.475 11.765 1.00 0.00 C ATOM 224 C ILE A 17 3.477 -2.383 10.533 1.00 0.00 C ATOM 225 O ILE A 17 4.404 -3.174 10.372 1.00 0.00 O ATOM 226 CB ILE A 17 3.305 -2.950 13.036 1.00 0.00 C ATOM 227 CG1 ILE A 17 2.339 -3.053 14.236 1.00 0.00 C ATOM 228 CG2 ILE A 17 4.413 -1.953 13.394 1.00 0.00 C ATOM 229 CD1 ILE A 17 1.788 -4.467 14.447 1.00 0.00 C ATOM 0 H ILE A 17 1.777 -4.379 11.568 1.00 0.00 H new ATOM 0 HA ILE A 17 2.204 -1.475 11.991 1.00 0.00 H new ATOM 0 HB ILE A 17 3.722 -3.936 12.830 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.857 -2.733 15.140 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.507 -2.365 14.085 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.929 -2.290 14.293 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.124 -1.888 12.570 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.975 -0.971 13.574 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.116 -4.471 15.305 1.00 0.00 H new ATOM 0 HD12 ILE A 17 1.242 -4.781 13.557 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.613 -5.156 14.629 1.00 0.00 H new ATOM 241 N ILE A 18 3.189 -1.432 9.645 1.00 0.00 N ATOM 242 CA ILE A 18 4.063 -1.121 8.520 1.00 0.00 C ATOM 243 C ILE A 18 5.234 -0.312 9.055 1.00 0.00 C ATOM 244 O ILE A 18 5.063 0.402 10.036 1.00 0.00 O ATOM 245 CB ILE A 18 3.287 -0.334 7.454 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.974 -1.039 7.081 1.00 0.00 C ATOM 247 CG2 ILE A 18 4.115 -0.046 6.191 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.189 -2.467 6.592 1.00 0.00 C ATOM 0 H ILE A 18 2.346 -0.859 9.687 1.00 0.00 H new ATOM 0 HA ILE A 18 4.430 -2.033 8.049 1.00 0.00 H new ATOM 0 HB ILE A 18 3.055 0.629 7.909 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.315 -1.052 7.949 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.467 -0.466 6.304 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.509 0.513 5.478 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.994 0.541 6.458 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.430 -0.987 5.740 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.227 -2.915 6.343 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.824 -2.457 5.706 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.670 -3.052 7.376 1.00 0.00 H new ATOM 260 N ASN A 19 6.394 -0.408 8.409 1.00 0.00 N ATOM 261 CA ASN A 19 7.625 0.289 8.720 1.00 0.00 C ATOM 262 C ASN A 19 8.117 0.953 7.442 1.00 0.00 C ATOM 263 O ASN A 19 7.990 0.378 6.359 1.00 0.00 O ATOM 264 CB ASN A 19 8.697 -0.693 9.198 1.00 0.00 C ATOM 265 CG ASN A 19 8.189 -1.725 10.202 1.00 0.00 C ATOM 266 OD1 ASN A 19 8.070 -2.903 9.886 1.00 0.00 O ATOM 267 ND2 ASN A 19 7.895 -1.303 11.427 1.00 0.00 N ATOM 0 H ASN A 19 6.498 -1.019 7.599 1.00 0.00 H new ATOM 0 HA ASN A 19 7.440 1.019 9.509 1.00 0.00 H new ATOM 0 HB2 ASN A 19 9.109 -1.214 8.334 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.514 -0.131 9.651 1.00 0.00 H new ATOM 0 HD21 ASN A 19 7.562 -1.965 12.128 1.00 0.00 H new ATOM 0 HD22 ASN A 19 8.002 -0.317 11.666 1.00 0.00 H new ATOM 274 N PHE A 20 8.693 2.145 7.586 1.00 0.00 N ATOM 275 CA PHE A 20 9.341 2.877 6.516 1.00 0.00 C ATOM 276 C PHE A 20 10.696 3.393 6.998 1.00 0.00 C ATOM 277 O PHE A 20 10.774 4.006 8.067 1.00 0.00 O ATOM 278 CB PHE A 20 8.466 4.058 6.093 1.00 0.00 C ATOM 279 CG PHE A 20 7.098 3.691 5.566 1.00 0.00 C ATOM 280 CD1 PHE A 20 6.027 3.466 6.450 1.00 0.00 C ATOM 281 CD2 PHE A 20 6.881 3.656 4.181 1.00 0.00 C ATOM 282 CE1 PHE A 20 4.750 3.190 5.941 1.00 0.00 C ATOM 283 CE2 PHE A 20 5.588 3.455 3.672 1.00 0.00 C ATOM 284 CZ PHE A 20 4.524 3.208 4.553 1.00 0.00 C ATOM 0 H PHE A 20 8.719 2.637 8.479 1.00 0.00 H new ATOM 0 HA PHE A 20 9.486 2.214 5.663 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.342 4.722 6.949 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.994 4.623 5.325 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.188 3.506 7.517 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.712 3.784 3.503 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.938 2.963 6.616 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.413 3.490 2.607 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.532 3.032 4.165 1.00 0.00 H new ATOM 294 N GLU A 21 11.741 3.187 6.190 1.00 0.00 N ATOM 295 CA GLU A 21 13.030 3.872 6.335 1.00 0.00 C ATOM 296 C GLU A 21 13.554 4.297 4.952 1.00 0.00 C ATOM 297 O GLU A 21 13.108 3.749 3.949 1.00 0.00 O ATOM 298 CB GLU A 21 14.000 3.007 7.160 1.00 0.00 C ATOM 299 CG GLU A 21 14.694 1.867 6.396 1.00 0.00 C ATOM 300 CD GLU A 21 16.092 2.228 5.872 1.00 0.00 C ATOM 301 OE1 GLU A 21 16.790 3.060 6.520 1.00 0.00 O ATOM 302 OE2 GLU A 21 16.461 1.613 4.848 1.00 0.00 O ATOM 0 H GLU A 21 11.716 2.533 5.408 1.00 0.00 H new ATOM 0 HA GLU A 21 12.917 4.796 6.902 1.00 0.00 H new ATOM 0 HB2 GLU A 21 14.767 3.656 7.582 1.00 0.00 H new ATOM 0 HB3 GLU A 21 13.451 2.577 7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 21 14.775 1.000 7.052 1.00 0.00 H new ATOM 0 HG3 GLU A 21 14.067 1.572 5.555 1.00 0.00 H new ATOM 309 N GLN A 22 14.435 5.307 4.878 1.00 0.00 N ATOM 310 CA GLN A 22 14.923 5.861 3.615 1.00 0.00 C ATOM 311 C GLN A 22 16.392 5.508 3.398 1.00 0.00 C ATOM 312 O GLN A 22 16.684 4.436 2.879 1.00 0.00 O ATOM 313 CB GLN A 22 14.544 7.351 3.516 1.00 0.00 C ATOM 314 CG GLN A 22 14.583 7.891 2.076 1.00 0.00 C ATOM 315 CD GLN A 22 13.960 9.288 1.936 1.00 0.00 C ATOM 316 OE1 GLN A 22 13.625 9.939 2.924 1.00 0.00 O ATOM 317 NE2 GLN A 22 13.773 9.750 0.705 1.00 0.00 N ATOM 0 H GLN A 22 14.829 5.762 5.702 1.00 0.00 H new ATOM 0 HA GLN A 22 14.426 5.398 2.763 1.00 0.00 H new ATOM 0 HB2 GLN A 22 13.543 7.493 3.923 1.00 0.00 H new ATOM 0 HB3 GLN A 22 15.226 7.935 4.135 1.00 0.00 H new ATOM 0 HG2 GLN A 22 15.618 7.926 1.736 1.00 0.00 H new ATOM 0 HG3 GLN A 22 14.056 7.198 1.421 1.00 0.00 H new ATOM 0 HE21 GLN A 22 14.060 9.191 -0.099 1.00 0.00 H new ATOM 0 HE22 GLN A 22 13.343 10.664 0.563 1.00 0.00 H new ATOM 326 N LYS A 23 17.298 6.411 3.785 1.00 0.00 N ATOM 327 CA LYS A 23 18.751 6.368 3.619 1.00 0.00 C ATOM 328 C LYS A 23 19.214 7.815 3.469 1.00 0.00 C ATOM 329 O LYS A 23 20.187 8.223 4.096 1.00 0.00 O ATOM 330 CB LYS A 23 19.220 5.527 2.405 1.00 0.00 C ATOM 331 CG LYS A 23 20.733 5.609 2.102 1.00 0.00 C ATOM 332 CD LYS A 23 21.010 5.684 0.589 1.00 0.00 C ATOM 333 CE LYS A 23 20.843 4.336 -0.132 1.00 0.00 C ATOM 334 NZ LYS A 23 22.107 3.568 -0.177 1.00 0.00 N ATOM 0 H LYS A 23 17.007 7.263 4.263 1.00 0.00 H new ATOM 0 HA LYS A 23 19.189 5.877 4.488 1.00 0.00 H new ATOM 0 HB2 LYS A 23 18.955 4.484 2.580 1.00 0.00 H new ATOM 0 HB3 LYS A 23 18.669 5.852 1.522 1.00 0.00 H new ATOM 0 HG2 LYS A 23 21.155 6.486 2.593 1.00 0.00 H new ATOM 0 HG3 LYS A 23 21.235 4.737 2.521 1.00 0.00 H new ATOM 0 HD2 LYS A 23 20.336 6.413 0.140 1.00 0.00 H new ATOM 0 HD3 LYS A 23 22.025 6.048 0.431 1.00 0.00 H new ATOM 0 HE2 LYS A 23 20.079 3.746 0.375 1.00 0.00 H new ATOM 0 HE3 LYS A 23 20.489 4.510 -1.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 21.948 2.667 -0.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 22.830 4.118 -0.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 22.433 3.378 0.792 1.00 0.00 H new ATOM 348 N GLU A 24 18.521 8.558 2.606 1.00 0.00 N ATOM 349 CA GLU A 24 18.951 9.860 2.108 1.00 0.00 C ATOM 350 C GLU A 24 17.684 10.648 1.796 1.00 0.00 C ATOM 351 O GLU A 24 16.718 10.042 1.338 1.00 0.00 O ATOM 352 CB GLU A 24 19.845 9.641 0.869 1.00 0.00 C ATOM 353 CG GLU A 24 21.020 10.622 0.734 1.00 0.00 C ATOM 354 CD GLU A 24 20.656 11.965 0.112 1.00 0.00 C ATOM 355 OE1 GLU A 24 19.446 12.205 -0.077 1.00 0.00 O ATOM 356 OE2 GLU A 24 21.603 12.726 -0.170 1.00 0.00 O ATOM 0 H GLU A 24 17.622 8.261 2.226 1.00 0.00 H new ATOM 0 HA GLU A 24 19.544 10.421 2.830 1.00 0.00 H new ATOM 0 HB2 GLU A 24 20.241 8.626 0.900 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.226 9.714 -0.025 1.00 0.00 H new ATOM 0 HG2 GLU A 24 21.445 10.797 1.722 1.00 0.00 H new ATOM 0 HG3 GLU A 24 21.798 10.156 0.130 1.00 0.00 H new ATOM 363 N SER A 25 17.667 11.953 2.069 1.00 0.00 N ATOM 364 CA SER A 25 16.580 12.869 1.755 1.00 0.00 C ATOM 365 C SER A 25 15.958 12.587 0.383 1.00 0.00 C ATOM 366 O SER A 25 14.737 12.567 0.239 1.00 0.00 O ATOM 367 CB SER A 25 17.162 14.286 1.793 1.00 0.00 C ATOM 368 OG SER A 25 17.878 14.461 3.003 1.00 0.00 O ATOM 0 H SER A 25 18.447 12.417 2.536 1.00 0.00 H new ATOM 0 HA SER A 25 15.778 12.745 2.483 1.00 0.00 H new ATOM 0 HB2 SER A 25 17.821 14.445 0.940 1.00 0.00 H new ATOM 0 HB3 SER A 25 16.362 15.023 1.719 1.00 0.00 H new ATOM 0 HG SER A 25 18.254 15.365 3.033 1.00 0.00 H new ATOM 374 N ASN A 26 16.815 12.377 -0.617 1.00 0.00 N ATOM 375 CA ASN A 26 16.445 12.080 -1.994 1.00 0.00 C ATOM 376 C ASN A 26 16.941 10.682 -2.364 1.00 0.00 C ATOM 377 O ASN A 26 17.356 10.441 -3.495 1.00 0.00 O ATOM 378 CB ASN A 26 17.016 13.163 -2.923 1.00 0.00 C ATOM 379 CG ASN A 26 16.286 14.490 -2.751 1.00 0.00 C ATOM 380 OD1 ASN A 26 16.760 15.391 -2.068 1.00 0.00 O ATOM 381 ND2 ASN A 26 15.116 14.627 -3.373 1.00 0.00 N ATOM 0 H ASN A 26 17.825 12.411 -0.480 1.00 0.00 H new ATOM 0 HA ASN A 26 15.361 12.087 -2.107 1.00 0.00 H new ATOM 0 HB2 ASN A 26 18.077 13.301 -2.714 1.00 0.00 H new ATOM 0 HB3 ASN A 26 16.936 12.834 -3.959 1.00 0.00 H new ATOM 0 HD21 ASN A 26 14.592 15.498 -3.287 1.00 0.00 H new ATOM 0 HD22 ASN A 26 14.745 13.861 -3.935 1.00 0.00 H new ATOM 388 N GLY A 27 16.876 9.746 -1.414 1.00 0.00 N ATOM 389 CA GLY A 27 17.154 8.337 -1.634 1.00 0.00 C ATOM 390 C GLY A 27 15.836 7.570 -1.710 1.00 0.00 C ATOM 391 O GLY A 27 14.805 8.081 -1.275 1.00 0.00 O ATOM 0 H GLY A 27 16.622 9.959 -0.449 1.00 0.00 H new ATOM 0 HA2 GLY A 27 17.719 8.205 -2.557 1.00 0.00 H new ATOM 0 HA3 GLY A 27 17.770 7.945 -0.825 1.00 0.00 H new ATOM 395 N PRO A 28 15.845 6.340 -2.241 1.00 0.00 N ATOM 396 CA PRO A 28 14.649 5.523 -2.311 1.00 0.00 C ATOM 397 C PRO A 28 14.172 5.184 -0.897 1.00 0.00 C ATOM 398 O PRO A 28 14.987 4.877 -0.026 1.00 0.00 O ATOM 399 CB PRO A 28 15.057 4.278 -3.103 1.00 0.00 C ATOM 400 CG PRO A 28 16.561 4.165 -2.840 1.00 0.00 C ATOM 401 CD PRO A 28 17.004 5.625 -2.744 1.00 0.00 C ATOM 0 HA PRO A 28 13.815 6.028 -2.798 1.00 0.00 H new ATOM 0 HB2 PRO A 28 14.522 3.392 -2.762 1.00 0.00 H new ATOM 0 HB3 PRO A 28 14.843 4.390 -4.166 1.00 0.00 H new ATOM 0 HG2 PRO A 28 16.770 3.619 -1.920 1.00 0.00 H new ATOM 0 HG3 PRO A 28 17.073 3.640 -3.646 1.00 0.00 H new ATOM 0 HD2 PRO A 28 17.856 5.735 -2.074 1.00 0.00 H new ATOM 0 HD3 PRO A 28 17.312 6.008 -3.717 1.00 0.00 H new ATOM 409 N VAL A 29 12.859 5.232 -0.668 1.00 0.00 N ATOM 410 CA VAL A 29 12.250 4.780 0.570 1.00 0.00 C ATOM 411 C VAL A 29 12.071 3.276 0.467 1.00 0.00 C ATOM 412 O VAL A 29 11.643 2.793 -0.573 1.00 0.00 O ATOM 413 CB VAL A 29 10.917 5.512 0.792 1.00 0.00 C ATOM 414 CG1 VAL A 29 9.962 4.749 1.717 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.196 6.881 1.410 1.00 0.00 C ATOM 0 H VAL A 29 12.188 5.590 -1.347 1.00 0.00 H new ATOM 0 HA VAL A 29 12.878 5.005 1.432 1.00 0.00 H new ATOM 0 HB VAL A 29 10.435 5.600 -0.182 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.039 5.316 1.835 1.00 0.00 H new ATOM 0 HG12 VAL A 29 9.736 3.775 1.283 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.431 4.613 2.691 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.255 7.406 1.570 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.707 6.752 2.364 1.00 0.00 H new ATOM 0 HG23 VAL A 29 11.826 7.463 0.737 1.00 0.00 H new ATOM 425 N LYS A 30 12.386 2.551 1.538 1.00 0.00 N ATOM 426 CA LYS A 30 12.048 1.161 1.741 1.00 0.00 C ATOM 427 C LYS A 30 10.827 1.116 2.650 1.00 0.00 C ATOM 428 O LYS A 30 10.833 1.719 3.725 1.00 0.00 O ATOM 429 CB LYS A 30 13.246 0.460 2.379 1.00 0.00 C ATOM 430 CG LYS A 30 14.181 0.025 1.252 1.00 0.00 C ATOM 431 CD LYS A 30 15.547 -0.421 1.778 1.00 0.00 C ATOM 432 CE LYS A 30 16.443 -0.875 0.617 1.00 0.00 C ATOM 433 NZ LYS A 30 16.589 0.174 -0.414 1.00 0.00 N ATOM 0 H LYS A 30 12.909 2.944 2.320 1.00 0.00 H new ATOM 0 HA LYS A 30 11.816 0.654 0.805 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.761 1.131 3.066 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.920 -0.402 2.960 1.00 0.00 H new ATOM 0 HG2 LYS A 30 13.722 -0.793 0.696 1.00 0.00 H new ATOM 0 HG3 LYS A 30 14.314 0.851 0.553 1.00 0.00 H new ATOM 0 HD2 LYS A 30 16.023 0.400 2.314 1.00 0.00 H new ATOM 0 HD3 LYS A 30 15.421 -1.237 2.490 1.00 0.00 H new ATOM 0 HE2 LYS A 30 17.427 -1.144 1.002 1.00 0.00 H new ATOM 0 HE3 LYS A 30 16.022 -1.772 0.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 17.579 0.214 -0.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 15.975 -0.047 -1.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 16.316 1.094 -0.014 1.00 0.00 H new ATOM 447 N VAL A 31 9.787 0.416 2.195 1.00 0.00 N ATOM 448 CA VAL A 31 8.519 0.253 2.871 1.00 0.00 C ATOM 449 C VAL A 31 8.345 -1.248 3.057 1.00 0.00 C ATOM 450 O VAL A 31 8.616 -2.028 2.147 1.00 0.00 O ATOM 451 CB VAL A 31 7.406 0.891 2.020 1.00 0.00 C ATOM 452 CG1 VAL A 31 7.622 0.673 0.527 1.00 0.00 C ATOM 453 CG2 VAL A 31 6.020 0.338 2.362 1.00 0.00 C ATOM 0 H VAL A 31 9.817 -0.073 1.300 1.00 0.00 H new ATOM 0 HA VAL A 31 8.476 0.748 3.841 1.00 0.00 H new ATOM 0 HB VAL A 31 7.453 1.954 2.255 1.00 0.00 H new ATOM 0 HG11 VAL A 31 6.811 1.142 -0.030 1.00 0.00 H new ATOM 0 HG12 VAL A 31 8.571 1.117 0.228 1.00 0.00 H new ATOM 0 HG13 VAL A 31 7.638 -0.396 0.314 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.271 0.820 1.734 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.004 -0.737 2.185 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.797 0.537 3.410 1.00 0.00 H new ATOM 463 N TRP A 32 7.916 -1.678 4.236 1.00 0.00 N ATOM 464 CA TRP A 32 7.759 -3.092 4.526 1.00 0.00 C ATOM 465 C TRP A 32 6.807 -3.209 5.704 1.00 0.00 C ATOM 466 O TRP A 32 6.518 -2.201 6.338 1.00 0.00 O ATOM 467 CB TRP A 32 9.132 -3.757 4.762 1.00 0.00 C ATOM 468 CG TRP A 32 9.647 -3.798 6.164 1.00 0.00 C ATOM 469 CD1 TRP A 32 9.399 -4.789 7.049 1.00 0.00 C ATOM 470 CD2 TRP A 32 10.510 -2.848 6.856 1.00 0.00 C ATOM 471 NE1 TRP A 32 10.044 -4.522 8.236 1.00 0.00 N ATOM 472 CE2 TRP A 32 10.747 -3.337 8.176 1.00 0.00 C ATOM 473 CE3 TRP A 32 11.093 -1.606 6.518 1.00 0.00 C ATOM 474 CZ2 TRP A 32 11.523 -2.636 9.110 1.00 0.00 C ATOM 475 CZ3 TRP A 32 11.866 -0.890 7.451 1.00 0.00 C ATOM 476 CH2 TRP A 32 12.087 -1.404 8.741 1.00 0.00 C ATOM 0 H TRP A 32 7.670 -1.061 5.010 1.00 0.00 H new ATOM 0 HA TRP A 32 7.329 -3.632 3.682 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.077 -4.781 4.394 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.868 -3.237 4.149 1.00 0.00 H new ATOM 0 HD1 TRP A 32 8.788 -5.658 6.855 1.00 0.00 H new ATOM 0 HE1 TRP A 32 10.006 -5.126 9.057 1.00 0.00 H new ATOM 0 HE3 TRP A 32 10.943 -1.200 5.529 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 11.685 -3.038 10.099 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 12.293 0.062 7.174 1.00 0.00 H new ATOM 0 HH2 TRP A 32 12.690 -0.852 9.447 1.00 0.00 H new ATOM 487 N GLY A 33 6.273 -4.389 6.000 1.00 0.00 N ATOM 488 CA GLY A 33 5.316 -4.491 7.096 1.00 0.00 C ATOM 489 C GLY A 33 4.738 -5.881 7.223 1.00 0.00 C ATOM 490 O GLY A 33 5.247 -6.797 6.582 1.00 0.00 O ATOM 0 H GLY A 33 6.477 -5.262 5.515 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.806 -4.217 8.030 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.508 -3.777 6.938 1.00 0.00 H new ATOM 494 N SER A 34 3.670 -6.018 8.018 1.00 0.00 N ATOM 495 CA SER A 34 3.039 -7.287 8.312 1.00 0.00 C ATOM 496 C SER A 34 1.667 -7.003 8.917 1.00 0.00 C ATOM 497 O SER A 34 1.568 -6.384 9.978 1.00 0.00 O ATOM 498 CB SER A 34 3.945 -8.128 9.219 1.00 0.00 C ATOM 499 OG SER A 34 4.371 -7.401 10.358 1.00 0.00 O ATOM 0 H SER A 34 3.220 -5.227 8.479 1.00 0.00 H new ATOM 0 HA SER A 34 2.892 -7.879 7.409 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.410 -9.023 9.538 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.816 -8.462 8.654 1.00 0.00 H new ATOM 0 HG SER A 34 3.666 -6.777 10.630 1.00 0.00 H new ATOM 505 N ILE A 35 0.598 -7.385 8.211 1.00 0.00 N ATOM 506 CA ILE A 35 -0.743 -7.335 8.775 1.00 0.00 C ATOM 507 C ILE A 35 -0.966 -8.515 9.720 1.00 0.00 C ATOM 508 O ILE A 35 -0.169 -9.447 9.772 1.00 0.00 O ATOM 509 CB ILE A 35 -1.792 -7.191 7.651 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.661 -5.943 7.879 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.685 -8.417 7.436 1.00 0.00 C ATOM 512 CD1 ILE A 35 -3.359 -5.487 6.608 1.00 0.00 C ATOM 0 H ILE A 35 0.641 -7.730 7.252 1.00 0.00 H new ATOM 0 HA ILE A 35 -0.863 -6.446 9.394 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.209 -7.089 6.736 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.407 -6.157 8.644 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.038 -5.134 8.259 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.388 -8.218 6.627 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.067 -9.276 7.177 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.237 -8.630 8.351 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.960 -4.603 6.820 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -2.614 -5.246 5.850 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.004 -6.285 6.241 1.00 0.00 H new ATOM 524 N LYS A 36 -2.071 -8.479 10.457 1.00 0.00 N ATOM 525 CA LYS A 36 -2.546 -9.564 11.287 1.00 0.00 C ATOM 526 C LYS A 36 -4.054 -9.393 11.406 1.00 0.00 C ATOM 527 O LYS A 36 -4.526 -8.683 12.295 1.00 0.00 O ATOM 528 CB LYS A 36 -1.844 -9.572 12.662 1.00 0.00 C ATOM 529 CG LYS A 36 -1.072 -10.883 12.839 1.00 0.00 C ATOM 530 CD LYS A 36 -0.643 -11.137 14.289 1.00 0.00 C ATOM 531 CE LYS A 36 -0.483 -12.655 14.483 1.00 0.00 C ATOM 532 NZ LYS A 36 0.120 -13.004 15.783 1.00 0.00 N ATOM 0 H LYS A 36 -2.678 -7.660 10.489 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.312 -10.531 10.842 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.163 -8.724 12.738 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.581 -9.462 13.458 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.693 -11.712 12.500 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.187 -10.866 12.202 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.295 -10.625 14.503 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -1.387 -10.742 14.981 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.460 -13.132 14.401 1.00 0.00 H new ATOM 0 HE3 LYS A 36 0.136 -13.056 13.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.204 -14.038 15.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 1.064 -12.573 15.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.482 -12.647 16.552 1.00 0.00 H new ATOM 546 N GLY A 37 -4.801 -10.017 10.494 1.00 0.00 N ATOM 547 CA GLY A 37 -6.255 -10.071 10.607 1.00 0.00 C ATOM 548 C GLY A 37 -6.954 -10.165 9.254 1.00 0.00 C ATOM 549 O GLY A 37 -8.146 -10.456 9.188 1.00 0.00 O ATOM 0 H GLY A 37 -4.423 -10.490 9.673 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.535 -10.931 11.215 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.607 -9.182 11.131 1.00 0.00 H new ATOM 553 N LEU A 38 -6.224 -9.872 8.179 1.00 0.00 N ATOM 554 CA LEU A 38 -6.704 -9.912 6.815 1.00 0.00 C ATOM 555 C LEU A 38 -7.029 -11.340 6.391 1.00 0.00 C ATOM 556 O LEU A 38 -6.719 -12.301 7.084 1.00 0.00 O ATOM 557 CB LEU A 38 -5.589 -9.302 5.967 1.00 0.00 C ATOM 558 CG LEU A 38 -5.885 -8.899 4.526 1.00 0.00 C ATOM 559 CD1 LEU A 38 -7.036 -7.885 4.471 1.00 0.00 C ATOM 560 CD2 LEU A 38 -4.611 -8.293 3.925 1.00 0.00 C ATOM 0 H LEU A 38 -5.246 -9.591 8.246 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.633 -9.354 6.695 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.228 -8.415 6.488 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.766 -10.016 5.945 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.189 -9.775 3.954 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.230 -7.611 3.434 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.933 -8.329 4.903 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.763 -6.994 5.036 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.800 -7.997 2.893 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.316 -7.418 4.505 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.810 -9.032 3.949 1.00 0.00 H new ATOM 572 N THR A 39 -7.642 -11.461 5.224 1.00 0.00 N ATOM 573 CA THR A 39 -7.953 -12.735 4.592 1.00 0.00 C ATOM 574 C THR A 39 -6.814 -13.132 3.662 1.00 0.00 C ATOM 575 O THR A 39 -6.141 -12.262 3.110 1.00 0.00 O ATOM 576 CB THR A 39 -9.261 -12.594 3.810 1.00 0.00 C ATOM 577 OG1 THR A 39 -9.255 -11.371 3.087 1.00 0.00 O ATOM 578 CG2 THR A 39 -10.439 -12.603 4.786 1.00 0.00 C ATOM 0 H THR A 39 -7.945 -10.656 4.676 1.00 0.00 H new ATOM 0 HA THR A 39 -8.070 -13.512 5.348 1.00 0.00 H new ATOM 0 HB THR A 39 -9.358 -13.426 3.112 1.00 0.00 H new ATOM 0 HG1 THR A 39 -10.092 -11.283 2.586 1.00 0.00 H new ATOM 0 HG21 THR A 39 -11.372 -12.503 4.231 1.00 0.00 H new ATOM 0 HG22 THR A 39 -10.445 -13.542 5.340 1.00 0.00 H new ATOM 0 HG23 THR A 39 -10.340 -11.771 5.483 1.00 0.00 H new ATOM 586 N GLU A 40 -6.634 -14.435 3.472 1.00 0.00 N ATOM 587 CA GLU A 40 -5.684 -15.052 2.566 1.00 0.00 C ATOM 588 C GLU A 40 -5.795 -14.471 1.148 1.00 0.00 C ATOM 589 O GLU A 40 -6.857 -13.988 0.748 1.00 0.00 O ATOM 590 CB GLU A 40 -5.904 -16.576 2.580 1.00 0.00 C ATOM 591 CG GLU A 40 -7.345 -17.039 2.279 1.00 0.00 C ATOM 592 CD GLU A 40 -8.225 -17.157 3.520 1.00 0.00 C ATOM 593 OE1 GLU A 40 -8.642 -16.088 4.024 1.00 0.00 O ATOM 594 OE2 GLU A 40 -8.461 -18.306 3.943 1.00 0.00 O ATOM 0 H GLU A 40 -7.184 -15.127 3.980 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.670 -14.835 2.903 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -5.235 -17.029 1.849 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.614 -16.959 3.558 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.805 -16.336 1.584 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.309 -18.006 1.777 1.00 0.00 H new ATOM 601 N GLY A 41 -4.707 -14.523 0.371 1.00 0.00 N ATOM 602 CA GLY A 41 -4.747 -14.168 -1.041 1.00 0.00 C ATOM 603 C GLY A 41 -4.201 -12.764 -1.246 1.00 0.00 C ATOM 604 O GLY A 41 -3.628 -12.180 -0.328 1.00 0.00 O ATOM 0 H GLY A 41 -3.787 -14.810 0.704 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -4.161 -14.882 -1.620 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.772 -14.225 -1.409 1.00 0.00 H new ATOM 608 N LEU A 42 -4.337 -12.228 -2.461 1.00 0.00 N ATOM 609 CA LEU A 42 -3.716 -10.961 -2.812 1.00 0.00 C ATOM 610 C LEU A 42 -4.582 -9.783 -2.363 1.00 0.00 C ATOM 611 O LEU A 42 -5.809 -9.860 -2.414 1.00 0.00 O ATOM 612 CB LEU A 42 -3.375 -10.908 -4.307 1.00 0.00 C ATOM 613 CG LEU A 42 -1.999 -11.501 -4.645 1.00 0.00 C ATOM 614 CD1 LEU A 42 -1.834 -12.944 -4.160 1.00 0.00 C ATOM 615 CD2 LEU A 42 -1.791 -11.465 -6.163 1.00 0.00 C ATOM 0 H LEU A 42 -4.874 -12.657 -3.215 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.772 -10.879 -2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -4.141 -11.447 -4.865 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.407 -9.871 -4.642 1.00 0.00 H new ATOM 0 HG LEU A 42 -1.256 -10.894 -4.128 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -0.842 -13.307 -4.429 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.953 -12.980 -3.077 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.590 -13.574 -4.629 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.815 -11.885 -6.407 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.570 -12.050 -6.651 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.839 -10.434 -6.513 1.00 0.00 H new ATOM 627 N HIS A 43 -3.941 -8.704 -1.898 1.00 0.00 N ATOM 628 CA HIS A 43 -4.589 -7.492 -1.413 1.00 0.00 C ATOM 629 C HIS A 43 -3.887 -6.240 -1.944 1.00 0.00 C ATOM 630 O HIS A 43 -2.673 -6.133 -1.798 1.00 0.00 O ATOM 631 CB HIS A 43 -4.586 -7.542 0.112 1.00 0.00 C ATOM 632 CG HIS A 43 -5.641 -8.471 0.632 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.933 -8.108 0.951 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.469 -9.783 0.963 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.538 -9.186 1.478 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.674 -10.212 1.476 1.00 0.00 N ATOM 0 H HIS A 43 -2.923 -8.655 -1.850 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.616 -7.439 -1.776 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.607 -7.867 0.465 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.752 -6.541 0.510 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.353 -7.189 0.812 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.569 -10.368 0.846 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.554 -9.221 1.843 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.876 -11.157 1.802 1.00 0.00 H new ATOM 645 N GLY A 44 -4.629 -5.324 -2.577 1.00 0.00 N ATOM 646 CA GLY A 44 -4.084 -4.178 -3.282 1.00 0.00 C ATOM 647 C GLY A 44 -3.657 -3.106 -2.300 1.00 0.00 C ATOM 648 O GLY A 44 -4.472 -2.663 -1.505 1.00 0.00 O ATOM 0 H GLY A 44 -5.648 -5.368 -2.609 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.231 -4.487 -3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.831 -3.776 -3.967 1.00 0.00 H new ATOM 652 N PHE A 45 -2.405 -2.668 -2.335 1.00 0.00 N ATOM 653 CA PHE A 45 -1.835 -1.860 -1.263 1.00 0.00 C ATOM 654 C PHE A 45 -1.426 -0.508 -1.826 1.00 0.00 C ATOM 655 O PHE A 45 -0.619 -0.459 -2.755 1.00 0.00 O ATOM 656 CB PHE A 45 -0.617 -2.578 -0.663 1.00 0.00 C ATOM 657 CG PHE A 45 -0.686 -2.734 0.840 1.00 0.00 C ATOM 658 CD1 PHE A 45 -0.341 -1.669 1.692 1.00 0.00 C ATOM 659 CD2 PHE A 45 -1.128 -3.947 1.390 1.00 0.00 C ATOM 660 CE1 PHE A 45 -0.335 -1.865 3.084 1.00 0.00 C ATOM 661 CE2 PHE A 45 -1.056 -4.165 2.775 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.639 -3.127 3.621 1.00 0.00 C ATOM 0 H PHE A 45 -1.760 -2.861 -3.101 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.574 -1.714 -0.476 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.526 -3.564 -1.118 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.285 -2.023 -0.921 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.082 -0.705 1.279 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -1.525 -4.716 0.745 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.096 -1.043 3.742 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.321 -5.128 3.187 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.552 -3.298 4.684 1.00 0.00 H new ATOM 672 N HIS A 46 -1.982 0.594 -1.311 1.00 0.00 N ATOM 673 CA HIS A 46 -1.723 1.901 -1.911 1.00 0.00 C ATOM 674 C HIS A 46 -1.703 3.024 -0.886 1.00 0.00 C ATOM 675 O HIS A 46 -2.339 2.922 0.165 1.00 0.00 O ATOM 676 CB HIS A 46 -2.763 2.235 -2.993 1.00 0.00 C ATOM 677 CG HIS A 46 -3.422 1.052 -3.648 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.771 0.702 -3.546 1.00 0.00 N ATOM 679 CD2 HIS A 46 -2.861 0.213 -4.563 1.00 0.00 C ATOM 680 CE1 HIS A 46 -4.975 -0.369 -4.340 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.843 -0.618 -4.996 1.00 0.00 N ATOM 0 H HIS A 46 -2.600 0.606 -0.499 1.00 0.00 H new ATOM 0 HA HIS A 46 -0.732 1.829 -2.360 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.538 2.859 -2.547 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.278 2.832 -3.765 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -1.830 0.210 -4.883 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.895 -0.927 -4.428 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.730 -1.329 -5.718 1.00 0.00 H new ATOM 689 N VAL A 47 -1.035 4.126 -1.246 1.00 0.00 N ATOM 690 CA VAL A 47 -1.172 5.406 -0.565 1.00 0.00 C ATOM 691 C VAL A 47 -2.346 6.162 -1.192 1.00 0.00 C ATOM 692 O VAL A 47 -2.288 6.610 -2.341 1.00 0.00 O ATOM 693 CB VAL A 47 0.136 6.213 -0.624 1.00 0.00 C ATOM 694 CG1 VAL A 47 -0.076 7.622 -0.059 1.00 0.00 C ATOM 695 CG2 VAL A 47 1.251 5.523 0.171 1.00 0.00 C ATOM 0 H VAL A 47 -0.379 4.148 -2.027 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.377 5.245 0.493 1.00 0.00 H new ATOM 0 HB VAL A 47 0.432 6.276 -1.671 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.860 8.179 -0.109 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -0.837 8.138 -0.645 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.402 7.553 0.979 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.163 6.117 0.110 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.949 5.428 1.214 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.435 4.533 -0.245 1.00 0.00 H new ATOM 705 N HIS A 48 -3.432 6.291 -0.432 1.00 0.00 N ATOM 706 CA HIS A 48 -4.527 7.180 -0.748 1.00 0.00 C ATOM 707 C HIS A 48 -4.133 8.612 -0.411 1.00 0.00 C ATOM 708 O HIS A 48 -3.164 8.841 0.313 1.00 0.00 O ATOM 709 CB HIS A 48 -5.754 6.749 0.053 1.00 0.00 C ATOM 710 CG HIS A 48 -6.363 5.489 -0.499 1.00 0.00 C ATOM 711 ND1 HIS A 48 -7.660 5.382 -0.886 1.00 0.00 N ATOM 712 CD2 HIS A 48 -5.680 4.364 -0.867 1.00 0.00 C ATOM 713 CE1 HIS A 48 -7.820 4.187 -1.457 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.619 3.592 -1.547 1.00 0.00 N ATOM 0 H HIS A 48 -3.569 5.768 0.433 1.00 0.00 H new ATOM 0 HA HIS A 48 -4.762 7.133 -1.811 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -5.472 6.591 1.094 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -6.496 7.548 0.041 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -8.384 6.090 -0.762 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.644 4.127 -0.674 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -8.758 3.768 -1.791 1.00 0.00 H new ATOM 722 N GLU A 49 -4.879 9.568 -0.966 1.00 0.00 N ATOM 723 CA GLU A 49 -4.661 10.981 -0.704 1.00 0.00 C ATOM 724 C GLU A 49 -5.214 11.376 0.679 1.00 0.00 C ATOM 725 O GLU A 49 -5.181 10.551 1.596 1.00 0.00 O ATOM 726 CB GLU A 49 -5.222 11.764 -1.895 1.00 0.00 C ATOM 727 CG GLU A 49 -6.751 11.663 -2.017 1.00 0.00 C ATOM 728 CD GLU A 49 -7.406 13.036 -2.013 1.00 0.00 C ATOM 729 OE1 GLU A 49 -6.925 13.879 -1.225 1.00 0.00 O ATOM 730 OE2 GLU A 49 -8.363 13.209 -2.797 1.00 0.00 O ATOM 0 H GLU A 49 -5.649 9.379 -1.608 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.602 11.229 -0.631 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.940 12.812 -1.798 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.765 11.394 -2.813 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -7.009 11.139 -2.937 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -7.144 11.070 -1.191 1.00 0.00 H new ATOM 737 N GLU A 50 -5.710 12.608 0.842 1.00 0.00 N ATOM 738 CA GLU A 50 -6.173 13.222 2.088 1.00 0.00 C ATOM 739 C GLU A 50 -5.094 13.403 3.155 1.00 0.00 C ATOM 740 O GLU A 50 -4.916 14.507 3.666 1.00 0.00 O ATOM 741 CB GLU A 50 -7.372 12.469 2.677 1.00 0.00 C ATOM 742 CG GLU A 50 -8.554 12.409 1.708 1.00 0.00 C ATOM 743 CD GLU A 50 -9.806 12.042 2.465 1.00 0.00 C ATOM 744 OE1 GLU A 50 -10.440 12.958 3.016 1.00 0.00 O ATOM 745 OE2 GLU A 50 -10.103 10.830 2.517 1.00 0.00 O ATOM 0 H GLU A 50 -5.804 13.245 0.051 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.478 14.227 1.795 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -7.068 11.455 2.939 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -7.686 12.956 3.600 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -8.683 13.373 1.215 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.360 11.675 0.926 1.00 0.00 H new ATOM 752 N GLU A 51 -4.415 12.319 3.517 1.00 0.00 N ATOM 753 CA GLU A 51 -3.367 12.285 4.508 1.00 0.00 C ATOM 754 C GLU A 51 -3.958 12.549 5.899 1.00 0.00 C ATOM 755 O GLU A 51 -4.299 11.604 6.609 1.00 0.00 O ATOM 756 CB GLU A 51 -2.217 13.248 4.119 1.00 0.00 C ATOM 757 CG GLU A 51 -1.827 13.175 2.628 1.00 0.00 C ATOM 758 CD GLU A 51 -0.704 14.133 2.267 1.00 0.00 C ATOM 759 OE1 GLU A 51 -0.471 15.087 3.054 1.00 0.00 O ATOM 760 OE2 GLU A 51 -0.028 13.873 1.261 1.00 0.00 O ATOM 0 H GLU A 51 -4.595 11.404 3.104 1.00 0.00 H new ATOM 0 HA GLU A 51 -2.918 11.292 4.546 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -2.513 14.269 4.359 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.341 13.019 4.726 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -1.522 12.157 2.386 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -2.701 13.400 2.017 1.00 0.00 H new ATOM 767 N ASP A 52 -4.141 13.823 6.256 1.00 0.00 N ATOM 768 CA ASP A 52 -4.629 14.254 7.557 1.00 0.00 C ATOM 769 C ASP A 52 -6.076 14.714 7.430 1.00 0.00 C ATOM 770 O ASP A 52 -6.370 15.908 7.387 1.00 0.00 O ATOM 771 CB ASP A 52 -3.709 15.342 8.128 1.00 0.00 C ATOM 772 CG ASP A 52 -4.167 15.809 9.506 1.00 0.00 C ATOM 773 OD1 ASP A 52 -4.879 15.026 10.173 1.00 0.00 O ATOM 774 OD2 ASP A 52 -3.767 16.932 9.884 1.00 0.00 O ATOM 0 H ASP A 52 -3.946 14.601 5.626 1.00 0.00 H new ATOM 0 HA ASP A 52 -4.612 13.423 8.262 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -2.691 14.958 8.195 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -3.685 16.192 7.446 1.00 0.00 H new ATOM 779 N ASN A 53 -6.993 13.747 7.338 1.00 0.00 N ATOM 780 CA ASN A 53 -8.420 14.029 7.327 1.00 0.00 C ATOM 781 C ASN A 53 -9.247 12.789 7.618 1.00 0.00 C ATOM 782 O ASN A 53 -10.091 12.799 8.512 1.00 0.00 O ATOM 783 CB ASN A 53 -8.849 14.634 5.990 1.00 0.00 C ATOM 784 CG ASN A 53 -10.206 15.293 6.172 1.00 0.00 C ATOM 785 OD1 ASN A 53 -11.249 14.726 5.860 1.00 0.00 O ATOM 786 ND2 ASN A 53 -10.199 16.490 6.746 1.00 0.00 N ATOM 0 H ASN A 53 -6.764 12.755 7.270 1.00 0.00 H new ATOM 0 HA ASN A 53 -8.603 14.752 8.122 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -8.115 15.366 5.652 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -8.903 13.860 5.224 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -11.079 16.967 6.941 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -9.314 16.932 6.992 1.00 0.00 H new ATOM 793 N THR A 54 -8.999 11.710 6.873 1.00 0.00 N ATOM 794 CA THR A 54 -9.756 10.471 6.979 1.00 0.00 C ATOM 795 C THR A 54 -9.334 9.664 8.216 1.00 0.00 C ATOM 796 O THR A 54 -9.002 8.485 8.105 1.00 0.00 O ATOM 797 CB THR A 54 -9.657 9.692 5.653 1.00 0.00 C ATOM 798 OG1 THR A 54 -10.365 8.475 5.756 1.00 0.00 O ATOM 799 CG2 THR A 54 -8.219 9.393 5.205 1.00 0.00 C ATOM 0 H THR A 54 -8.258 11.676 6.173 1.00 0.00 H new ATOM 0 HA THR A 54 -10.812 10.692 7.136 1.00 0.00 H new ATOM 0 HB THR A 54 -10.094 10.343 4.896 1.00 0.00 H new ATOM 0 HG1 THR A 54 -10.122 8.025 6.592 1.00 0.00 H new ATOM 0 HG21 THR A 54 -8.238 8.843 4.264 1.00 0.00 H new ATOM 0 HG22 THR A 54 -7.679 10.330 5.067 1.00 0.00 H new ATOM 0 HG23 THR A 54 -7.718 8.794 5.966 1.00 0.00 H new ATOM 807 N ALA A 55 -9.395 10.290 9.396 1.00 0.00 N ATOM 808 CA ALA A 55 -8.988 9.725 10.677 1.00 0.00 C ATOM 809 C ALA A 55 -9.593 8.341 10.925 1.00 0.00 C ATOM 810 O ALA A 55 -8.907 7.446 11.413 1.00 0.00 O ATOM 811 CB ALA A 55 -9.383 10.695 11.793 1.00 0.00 C ATOM 0 H ALA A 55 -9.745 11.244 9.483 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.907 9.589 10.662 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.083 10.283 12.756 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.884 11.652 11.637 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -10.463 10.842 11.782 1.00 0.00 H new ATOM 817 N GLY A 56 -10.883 8.181 10.613 1.00 0.00 N ATOM 818 CA GLY A 56 -11.545 6.886 10.632 1.00 0.00 C ATOM 819 C GLY A 56 -11.319 6.208 9.282 1.00 0.00 C ATOM 820 O GLY A 56 -10.244 5.680 9.024 1.00 0.00 O ATOM 0 H GLY A 56 -11.493 8.952 10.340 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.147 6.269 11.437 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -12.612 7.008 10.821 1.00 0.00 H new ATOM 824 N CYS A 57 -12.326 6.248 8.406 1.00 0.00 N ATOM 825 CA CYS A 57 -12.157 5.857 7.006 1.00 0.00 C ATOM 826 C CYS A 57 -13.306 6.421 6.149 1.00 0.00 C ATOM 827 O CYS A 57 -13.736 5.792 5.188 1.00 0.00 O ATOM 828 CB CYS A 57 -12.008 4.331 6.870 1.00 0.00 C ATOM 829 SG CYS A 57 -10.692 3.820 5.733 1.00 0.00 S ATOM 0 H CYS A 57 -13.271 6.549 8.644 1.00 0.00 H new ATOM 0 HA CYS A 57 -11.231 6.291 6.628 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -11.810 3.906 7.854 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -12.954 3.913 6.527 1.00 0.00 H new ATOM 834 N THR A 58 -13.834 7.585 6.540 1.00 0.00 N ATOM 835 CA THR A 58 -15.074 8.137 6.010 1.00 0.00 C ATOM 836 C THR A 58 -14.886 8.624 4.572 1.00 0.00 C ATOM 837 O THR A 58 -15.410 8.023 3.637 1.00 0.00 O ATOM 838 CB THR A 58 -15.567 9.252 6.949 1.00 0.00 C ATOM 839 OG1 THR A 58 -15.538 8.765 8.277 1.00 0.00 O ATOM 840 CG2 THR A 58 -16.982 9.721 6.593 1.00 0.00 C ATOM 0 H THR A 58 -13.399 8.177 7.247 1.00 0.00 H new ATOM 0 HA THR A 58 -15.838 7.361 5.970 1.00 0.00 H new ATOM 0 HB THR A 58 -14.909 10.114 6.840 1.00 0.00 H new ATOM 0 HG1 THR A 58 -15.848 9.465 8.889 1.00 0.00 H new ATOM 0 HG21 THR A 58 -17.288 10.508 7.282 1.00 0.00 H new ATOM 0 HG22 THR A 58 -16.992 10.107 5.574 1.00 0.00 H new ATOM 0 HG23 THR A 58 -17.674 8.882 6.670 1.00 0.00 H new ATOM 848 N SER A 59 -14.158 9.730 4.403 1.00 0.00 N ATOM 849 CA SER A 59 -13.916 10.347 3.114 1.00 0.00 C ATOM 850 C SER A 59 -13.197 9.362 2.189 1.00 0.00 C ATOM 851 O SER A 59 -13.640 9.134 1.065 1.00 0.00 O ATOM 852 CB SER A 59 -13.115 11.628 3.354 1.00 0.00 C ATOM 853 OG SER A 59 -13.780 12.430 4.313 1.00 0.00 O ATOM 0 H SER A 59 -13.716 10.225 5.178 1.00 0.00 H new ATOM 0 HA SER A 59 -14.849 10.609 2.615 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.112 11.382 3.703 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.001 12.179 2.420 1.00 0.00 H new ATOM 0 HG SER A 59 -13.265 13.250 4.467 1.00 0.00 H new ATOM 859 N ALA A 60 -12.124 8.743 2.696 1.00 0.00 N ATOM 860 CA ALA A 60 -11.344 7.725 2.007 1.00 0.00 C ATOM 861 C ALA A 60 -11.061 8.106 0.553 1.00 0.00 C ATOM 862 O ALA A 60 -11.399 7.360 -0.370 1.00 0.00 O ATOM 863 CB ALA A 60 -12.050 6.373 2.120 1.00 0.00 C ATOM 0 H ALA A 60 -11.768 8.949 3.630 1.00 0.00 H new ATOM 0 HA ALA A 60 -10.370 7.648 2.491 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -11.464 5.612 1.604 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.151 6.102 3.171 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -13.039 6.440 1.666 1.00 0.00 H new ATOM 869 N GLY A 61 -10.424 9.262 0.369 1.00 0.00 N ATOM 870 CA GLY A 61 -10.076 9.828 -0.918 1.00 0.00 C ATOM 871 C GLY A 61 -9.280 8.828 -1.753 1.00 0.00 C ATOM 872 O GLY A 61 -8.727 7.862 -1.220 1.00 0.00 O ATOM 0 H GLY A 61 -10.128 9.848 1.150 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -10.982 10.114 -1.452 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.491 10.736 -0.775 1.00 0.00 H new ATOM 876 N PRO A 62 -9.273 8.999 -3.079 1.00 0.00 N ATOM 877 CA PRO A 62 -8.844 7.956 -3.991 1.00 0.00 C ATOM 878 C PRO A 62 -7.324 7.730 -3.972 1.00 0.00 C ATOM 879 O PRO A 62 -6.595 8.298 -3.157 1.00 0.00 O ATOM 880 CB PRO A 62 -9.386 8.393 -5.361 1.00 0.00 C ATOM 881 CG PRO A 62 -9.463 9.917 -5.249 1.00 0.00 C ATOM 882 CD PRO A 62 -9.868 10.116 -3.791 1.00 0.00 C ATOM 0 HA PRO A 62 -9.233 6.979 -3.705 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -8.725 8.084 -6.171 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.364 7.956 -5.563 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -8.507 10.390 -5.474 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.197 10.339 -5.936 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -9.503 11.068 -3.407 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -10.952 10.122 -3.680 1.00 0.00 H new ATOM 890 N HIS A 63 -6.852 6.866 -4.883 1.00 0.00 N ATOM 891 CA HIS A 63 -5.428 6.644 -5.111 1.00 0.00 C ATOM 892 C HIS A 63 -4.742 7.981 -5.347 1.00 0.00 C ATOM 893 O HIS A 63 -5.139 8.720 -6.248 1.00 0.00 O ATOM 894 CB HIS A 63 -5.191 5.784 -6.359 1.00 0.00 C ATOM 895 CG HIS A 63 -5.301 4.299 -6.146 1.00 0.00 C ATOM 896 ND1 HIS A 63 -4.556 3.293 -6.780 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.193 3.685 -5.318 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.044 2.105 -6.349 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.024 2.347 -5.470 1.00 0.00 N ATOM 0 H HIS A 63 -7.455 6.302 -5.482 1.00 0.00 H new ATOM 0 HA HIS A 63 -5.028 6.136 -4.234 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -5.908 6.079 -7.125 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -4.198 6.006 -6.750 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -6.901 4.172 -4.664 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.701 1.130 -6.661 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -6.565 1.631 -4.985 1.00 0.00 H new ATOM 907 N PHE A 64 -3.697 8.272 -4.575 1.00 0.00 N ATOM 908 CA PHE A 64 -3.017 9.544 -4.708 1.00 0.00 C ATOM 909 C PHE A 64 -2.264 9.570 -6.042 1.00 0.00 C ATOM 910 O PHE A 64 -1.375 8.742 -6.257 1.00 0.00 O ATOM 911 CB PHE A 64 -2.080 9.723 -3.509 1.00 0.00 C ATOM 912 CG PHE A 64 -1.647 11.134 -3.148 1.00 0.00 C ATOM 913 CD1 PHE A 64 -2.210 12.285 -3.743 1.00 0.00 C ATOM 914 CD2 PHE A 64 -0.755 11.286 -2.073 1.00 0.00 C ATOM 915 CE1 PHE A 64 -1.814 13.566 -3.321 1.00 0.00 C ATOM 916 CE2 PHE A 64 -0.376 12.566 -1.639 1.00 0.00 C ATOM 917 CZ PHE A 64 -0.901 13.707 -2.264 1.00 0.00 C ATOM 0 H PHE A 64 -3.313 7.651 -3.863 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.723 10.374 -4.712 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.568 9.290 -2.636 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.181 9.135 -3.697 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.947 12.180 -4.525 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.358 10.412 -1.577 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.212 14.442 -3.810 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.322 12.673 -0.822 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.604 14.691 -1.933 1.00 0.00 H new ATOM 927 N ASN A 65 -2.634 10.482 -6.950 1.00 0.00 N ATOM 928 CA ASN A 65 -2.047 10.572 -8.284 1.00 0.00 C ATOM 929 C ASN A 65 -1.539 11.976 -8.630 1.00 0.00 C ATOM 930 O ASN A 65 -1.842 12.477 -9.707 1.00 0.00 O ATOM 931 CB ASN A 65 -3.045 10.029 -9.327 1.00 0.00 C ATOM 932 CG ASN A 65 -4.135 11.002 -9.763 1.00 0.00 C ATOM 933 OD1 ASN A 65 -4.679 11.742 -8.951 1.00 0.00 O ATOM 934 ND2 ASN A 65 -4.459 10.986 -11.055 1.00 0.00 N ATOM 0 H ASN A 65 -3.355 11.182 -6.774 1.00 0.00 H new ATOM 0 HA ASN A 65 -1.154 9.947 -8.298 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -2.487 9.717 -10.210 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.521 9.137 -8.919 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.188 11.607 -11.406 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -3.978 10.352 -11.694 1.00 0.00 H new ATOM 941 N PRO A 66 -0.690 12.603 -7.802 1.00 0.00 N ATOM 942 CA PRO A 66 -0.210 13.953 -8.061 1.00 0.00 C ATOM 943 C PRO A 66 0.639 14.021 -9.340 1.00 0.00 C ATOM 944 O PRO A 66 0.739 15.082 -9.950 1.00 0.00 O ATOM 945 CB PRO A 66 0.571 14.354 -6.806 1.00 0.00 C ATOM 946 CG PRO A 66 1.076 13.021 -6.260 1.00 0.00 C ATOM 947 CD PRO A 66 -0.047 12.047 -6.624 1.00 0.00 C ATOM 0 HA PRO A 66 -1.029 14.648 -8.245 1.00 0.00 H new ATOM 0 HB2 PRO A 66 1.394 15.028 -7.044 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -0.064 14.868 -6.085 1.00 0.00 H new ATOM 0 HG2 PRO A 66 2.023 12.732 -6.715 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.240 13.063 -5.183 1.00 0.00 H new ATOM 0 HD2 PRO A 66 0.350 11.052 -6.828 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.757 11.945 -5.803 1.00 0.00 H new ATOM 955 N LEU A 67 1.238 12.898 -9.761 1.00 0.00 N ATOM 956 CA LEU A 67 1.979 12.816 -11.018 1.00 0.00 C ATOM 957 C LEU A 67 1.034 12.603 -12.209 1.00 0.00 C ATOM 958 O LEU A 67 1.448 12.749 -13.357 1.00 0.00 O ATOM 959 CB LEU A 67 3.034 11.703 -10.922 1.00 0.00 C ATOM 960 CG LEU A 67 4.430 12.151 -11.373 1.00 0.00 C ATOM 961 CD1 LEU A 67 5.432 11.023 -11.103 1.00 0.00 C ATOM 962 CD2 LEU A 67 4.484 12.539 -12.856 1.00 0.00 C ATOM 0 H LEU A 67 1.220 12.023 -9.236 1.00 0.00 H new ATOM 0 HA LEU A 67 2.491 13.763 -11.190 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.088 11.351 -9.892 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.717 10.857 -11.532 1.00 0.00 H new ATOM 0 HG LEU A 67 4.685 13.043 -10.801 1.00 0.00 H new ATOM 0 HD11 LEU A 67 6.426 11.336 -11.422 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.447 10.797 -10.037 1.00 0.00 H new ATOM 0 HD13 LEU A 67 5.136 10.133 -11.658 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.497 12.847 -13.115 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.198 11.683 -13.467 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.796 13.364 -13.042 1.00 0.00 H new ATOM 974 N SER A 68 -0.230 12.250 -11.953 1.00 0.00 N ATOM 975 CA SER A 68 -1.288 12.258 -12.955 1.00 0.00 C ATOM 976 C SER A 68 -1.005 11.247 -14.061 1.00 0.00 C ATOM 977 O SER A 68 -0.878 11.589 -15.235 1.00 0.00 O ATOM 978 CB SER A 68 -1.519 13.667 -13.513 1.00 0.00 C ATOM 979 OG SER A 68 -1.831 14.548 -12.453 1.00 0.00 O ATOM 0 H SER A 68 -0.546 11.948 -11.031 1.00 0.00 H new ATOM 0 HA SER A 68 -2.213 11.953 -12.466 1.00 0.00 H new ATOM 0 HB2 SER A 68 -0.628 14.013 -14.037 1.00 0.00 H new ATOM 0 HB3 SER A 68 -2.331 13.653 -14.240 1.00 0.00 H new ATOM 0 HG SER A 68 -1.977 15.449 -12.809 1.00 0.00 H new ATOM 985 N ARG A 69 -0.941 9.978 -13.666 1.00 0.00 N ATOM 986 CA ARG A 69 -0.870 8.830 -14.555 1.00 0.00 C ATOM 987 C ARG A 69 -1.943 7.877 -14.030 1.00 0.00 C ATOM 988 O ARG A 69 -2.457 8.109 -12.939 1.00 0.00 O ATOM 989 CB ARG A 69 0.543 8.216 -14.574 1.00 0.00 C ATOM 990 CG ARG A 69 1.643 9.165 -14.063 1.00 0.00 C ATOM 991 CD ARG A 69 3.053 8.671 -14.418 1.00 0.00 C ATOM 992 NE ARG A 69 3.566 9.362 -15.616 1.00 0.00 N ATOM 993 CZ ARG A 69 4.424 8.881 -16.534 1.00 0.00 C ATOM 994 NH1 ARG A 69 4.854 7.616 -16.475 1.00 0.00 N ATOM 995 NH2 ARG A 69 4.853 9.684 -17.516 1.00 0.00 N ATOM 0 H ARG A 69 -0.937 9.715 -12.680 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.054 9.087 -15.598 1.00 0.00 H new ATOM 0 HB2 ARG A 69 0.544 7.313 -13.964 1.00 0.00 H new ATOM 0 HB3 ARG A 69 0.783 7.913 -15.593 1.00 0.00 H new ATOM 0 HG2 ARG A 69 1.490 10.157 -14.489 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.558 9.266 -12.981 1.00 0.00 H new ATOM 0 HD2 ARG A 69 3.726 8.843 -13.578 1.00 0.00 H new ATOM 0 HD3 ARG A 69 3.032 7.596 -14.594 1.00 0.00 H new ATOM 0 HE ARG A 69 3.232 10.314 -15.766 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.531 7.002 -15.727 1.00 0.00 H new ATOM 0 HH12 ARG A 69 5.504 7.265 -17.178 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.529 10.650 -17.563 1.00 0.00 H new ATOM 0 HH22 ARG A 69 5.504 9.330 -18.217 1.00 0.00 H new ATOM 1009 N LYS A 70 -2.344 6.867 -14.797 1.00 0.00 N ATOM 1010 CA LYS A 70 -3.446 6.005 -14.441 1.00 0.00 C ATOM 1011 C LYS A 70 -3.003 4.949 -13.422 1.00 0.00 C ATOM 1012 O LYS A 70 -1.807 4.805 -13.170 1.00 0.00 O ATOM 1013 CB LYS A 70 -3.957 5.358 -15.725 1.00 0.00 C ATOM 1014 CG LYS A 70 -4.336 6.374 -16.822 1.00 0.00 C ATOM 1015 CD LYS A 70 -3.232 6.464 -17.887 1.00 0.00 C ATOM 1016 CE LYS A 70 -3.078 7.845 -18.530 1.00 0.00 C ATOM 1017 NZ LYS A 70 -1.889 7.874 -19.410 1.00 0.00 N ATOM 0 H LYS A 70 -1.905 6.630 -15.687 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.244 6.579 -13.970 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.191 4.686 -16.113 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.829 4.746 -15.492 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.275 6.078 -17.289 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.498 7.355 -16.375 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.283 6.182 -17.432 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -3.440 5.734 -18.670 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -3.971 8.086 -19.106 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -2.983 8.606 -17.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -1.798 8.817 -19.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -1.038 7.664 -18.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -1.995 7.161 -20.160 1.00 0.00 H new ATOM 1031 N HIS A 71 -3.953 4.207 -12.834 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.578 3.120 -11.940 1.00 0.00 C ATOM 1033 C HIS A 71 -2.720 2.094 -12.668 1.00 0.00 C ATOM 1034 O HIS A 71 -2.924 1.834 -13.852 1.00 0.00 O ATOM 1035 CB HIS A 71 -4.789 2.388 -11.344 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.388 1.485 -10.200 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -3.511 1.774 -9.148 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -4.731 0.174 -10.056 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.196 0.613 -8.547 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.021 -0.327 -9.008 1.00 0.00 N ATOM 0 H HIS A 71 -4.956 4.339 -12.960 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.021 3.587 -11.128 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.519 3.118 -10.993 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.276 1.798 -12.120 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.439 -0.370 -10.664 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.412 0.468 -7.819 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -4.107 -1.272 -8.635 1.00 0.00 H new ATOM 1048 N GLY A 72 -1.823 1.463 -11.919 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.124 0.272 -12.336 1.00 0.00 C ATOM 1050 C GLY A 72 -0.247 -0.159 -11.177 1.00 0.00 C ATOM 1051 O GLY A 72 -0.610 0.107 -10.034 1.00 0.00 O ATOM 0 H GLY A 72 -1.562 1.779 -10.985 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.829 -0.516 -12.599 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.521 0.470 -13.222 1.00 0.00 H new ATOM 1055 N GLY A 73 0.884 -0.804 -11.440 1.00 0.00 N ATOM 1056 CA GLY A 73 1.801 -1.236 -10.394 1.00 0.00 C ATOM 1057 C GLY A 73 3.226 -1.282 -10.921 1.00 0.00 C ATOM 1058 O GLY A 73 3.453 -1.007 -12.095 1.00 0.00 O ATOM 0 H GLY A 73 1.190 -1.042 -12.384 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.742 -0.553 -9.546 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.509 -2.221 -10.031 1.00 0.00 H new ATOM 1062 N PRO A 74 4.199 -1.645 -10.075 1.00 0.00 N ATOM 1063 CA PRO A 74 5.613 -1.555 -10.404 1.00 0.00 C ATOM 1064 C PRO A 74 5.990 -2.423 -11.606 1.00 0.00 C ATOM 1065 O PRO A 74 6.936 -2.096 -12.318 1.00 0.00 O ATOM 1066 CB PRO A 74 6.358 -1.964 -9.131 1.00 0.00 C ATOM 1067 CG PRO A 74 5.348 -2.844 -8.394 1.00 0.00 C ATOM 1068 CD PRO A 74 4.007 -2.202 -8.746 1.00 0.00 C ATOM 0 HA PRO A 74 5.882 -0.544 -10.711 1.00 0.00 H new ATOM 0 HB2 PRO A 74 7.274 -2.509 -9.359 1.00 0.00 H new ATOM 0 HB3 PRO A 74 6.643 -1.096 -8.536 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.398 -3.881 -8.727 1.00 0.00 H new ATOM 0 HG3 PRO A 74 5.524 -2.846 -7.318 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.202 -2.937 -8.738 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.739 -1.427 -8.028 1.00 0.00 H new ATOM 1076 N LYS A 75 5.254 -3.514 -11.848 1.00 0.00 N ATOM 1077 CA LYS A 75 5.500 -4.371 -13.004 1.00 0.00 C ATOM 1078 C LYS A 75 5.066 -3.734 -14.330 1.00 0.00 C ATOM 1079 O LYS A 75 5.339 -4.319 -15.379 1.00 0.00 O ATOM 1080 CB LYS A 75 4.836 -5.742 -12.819 1.00 0.00 C ATOM 1081 CG LYS A 75 3.300 -5.687 -12.810 1.00 0.00 C ATOM 1082 CD LYS A 75 2.653 -7.051 -13.098 1.00 0.00 C ATOM 1083 CE LYS A 75 2.417 -7.311 -14.599 1.00 0.00 C ATOM 1084 NZ LYS A 75 3.661 -7.334 -15.392 1.00 0.00 N ATOM 0 H LYS A 75 4.483 -3.821 -11.255 1.00 0.00 H new ATOM 0 HA LYS A 75 6.580 -4.504 -13.062 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.163 -6.405 -13.620 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.181 -6.180 -11.882 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.960 -5.326 -11.839 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.963 -4.966 -13.554 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.290 -7.839 -12.696 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.700 -7.111 -12.572 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.901 -8.264 -14.718 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.757 -6.539 -14.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.452 -7.662 -16.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.065 -6.377 -15.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 4.344 -7.980 -14.947 1.00 0.00 H new ATOM 1098 N ASP A 76 4.340 -2.613 -14.271 1.00 0.00 N ATOM 1099 CA ASP A 76 3.789 -1.904 -15.412 1.00 0.00 C ATOM 1100 C ASP A 76 4.392 -0.502 -15.449 1.00 0.00 C ATOM 1101 O ASP A 76 4.951 -0.013 -14.466 1.00 0.00 O ATOM 1102 CB ASP A 76 2.259 -1.870 -15.302 1.00 0.00 C ATOM 1103 CG ASP A 76 1.655 -3.268 -15.187 1.00 0.00 C ATOM 1104 OD1 ASP A 76 2.131 -4.186 -15.891 1.00 0.00 O ATOM 1105 OD2 ASP A 76 0.757 -3.420 -14.328 1.00 0.00 O ATOM 0 H ASP A 76 4.115 -2.162 -13.384 1.00 0.00 H new ATOM 0 HA ASP A 76 4.038 -2.410 -16.345 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.973 -1.280 -14.431 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.845 -1.369 -16.177 1.00 0.00 H new ATOM 1110 N GLU A 77 4.297 0.147 -16.609 1.00 0.00 N ATOM 1111 CA GLU A 77 4.852 1.481 -16.805 1.00 0.00 C ATOM 1112 C GLU A 77 3.925 2.529 -16.185 1.00 0.00 C ATOM 1113 O GLU A 77 4.378 3.570 -15.696 1.00 0.00 O ATOM 1114 CB GLU A 77 5.089 1.759 -18.298 1.00 0.00 C ATOM 1115 CG GLU A 77 6.423 2.492 -18.483 1.00 0.00 C ATOM 1116 CD GLU A 77 6.518 3.141 -19.855 1.00 0.00 C ATOM 1117 OE1 GLU A 77 6.969 2.441 -20.785 1.00 0.00 O ATOM 1118 OE2 GLU A 77 6.131 4.327 -19.934 1.00 0.00 O ATOM 0 H GLU A 77 3.835 -0.237 -17.434 1.00 0.00 H new ATOM 0 HA GLU A 77 5.818 1.538 -16.304 1.00 0.00 H new ATOM 0 HB2 GLU A 77 5.098 0.822 -18.855 1.00 0.00 H new ATOM 0 HB3 GLU A 77 4.274 2.361 -18.699 1.00 0.00 H new ATOM 0 HG2 GLU A 77 6.531 3.254 -17.711 1.00 0.00 H new ATOM 0 HG3 GLU A 77 7.246 1.789 -18.354 1.00 0.00 H new ATOM 1125 N GLU A 78 2.623 2.238 -16.184 1.00 0.00 N ATOM 1126 CA GLU A 78 1.602 3.120 -15.646 1.00 0.00 C ATOM 1127 C GLU A 78 1.363 2.779 -14.175 1.00 0.00 C ATOM 1128 O GLU A 78 1.327 1.615 -13.795 1.00 0.00 O ATOM 1129 CB GLU A 78 0.332 3.038 -16.500 1.00 0.00 C ATOM 1130 CG GLU A 78 0.616 3.629 -17.892 1.00 0.00 C ATOM 1131 CD GLU A 78 -0.623 3.693 -18.774 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -1.680 4.061 -18.225 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -0.487 3.451 -19.990 1.00 0.00 O ATOM 0 H GLU A 78 2.249 1.368 -16.564 1.00 0.00 H new ATOM 0 HA GLU A 78 1.933 4.158 -15.687 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.008 2.001 -16.592 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.479 3.584 -16.019 1.00 0.00 H new ATOM 0 HG2 GLU A 78 1.027 4.632 -17.778 1.00 0.00 H new ATOM 0 HG3 GLU A 78 1.378 3.027 -18.388 1.00 0.00 H new ATOM 1140 N ARG A 79 1.304 3.815 -13.342 1.00 0.00 N ATOM 1141 CA ARG A 79 1.013 3.794 -11.915 1.00 0.00 C ATOM 1142 C ARG A 79 0.806 5.264 -11.537 1.00 0.00 C ATOM 1143 O ARG A 79 1.512 6.108 -12.085 1.00 0.00 O ATOM 1144 CB ARG A 79 2.111 3.113 -11.071 1.00 0.00 C ATOM 1145 CG ARG A 79 3.586 3.345 -11.442 1.00 0.00 C ATOM 1146 CD ARG A 79 4.079 2.390 -12.540 1.00 0.00 C ATOM 1147 NE ARG A 79 5.534 2.182 -12.516 1.00 0.00 N ATOM 1148 CZ ARG A 79 6.459 3.036 -12.976 1.00 0.00 C ATOM 1149 NH1 ARG A 79 6.109 4.076 -13.738 1.00 0.00 N ATOM 1150 NH2 ARG A 79 7.747 2.846 -12.666 1.00 0.00 N ATOM 0 H ARG A 79 1.472 4.764 -13.676 1.00 0.00 H new ATOM 0 HA ARG A 79 0.131 3.189 -11.704 1.00 0.00 H new ATOM 0 HB2 ARG A 79 1.977 3.432 -10.037 1.00 0.00 H new ATOM 0 HB3 ARG A 79 1.929 2.039 -11.099 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.714 4.374 -11.777 1.00 0.00 H new ATOM 0 HG3 ARG A 79 4.204 3.220 -10.553 1.00 0.00 H new ATOM 0 HD2 ARG A 79 3.579 1.428 -12.427 1.00 0.00 H new ATOM 0 HD3 ARG A 79 3.791 2.787 -13.514 1.00 0.00 H new ATOM 0 HE ARG A 79 5.870 1.308 -12.112 1.00 0.00 H new ATOM 0 HH11 ARG A 79 5.129 4.227 -13.976 1.00 0.00 H new ATOM 0 HH12 ARG A 79 6.822 4.719 -14.082 1.00 0.00 H new ATOM 0 HH21 ARG A 79 8.020 2.055 -12.083 1.00 0.00 H new ATOM 0 HH22 ARG A 79 8.456 3.492 -13.013 1.00 0.00 H new ATOM 1164 N HIS A 80 -0.170 5.573 -10.676 1.00 0.00 N ATOM 1165 CA HIS A 80 -0.515 6.927 -10.247 1.00 0.00 C ATOM 1166 C HIS A 80 0.716 7.619 -9.624 1.00 0.00 C ATOM 1167 O HIS A 80 1.447 8.336 -10.304 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.711 6.880 -9.266 1.00 0.00 C ATOM 1169 CG HIS A 80 -3.029 6.323 -9.758 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.700 5.203 -9.248 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -3.917 6.938 -10.596 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -4.954 5.222 -9.728 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -5.053 6.188 -10.640 1.00 0.00 N ATOM 0 H HIS A 80 -0.760 4.861 -10.246 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.818 7.518 -11.111 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.406 6.293 -8.400 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.891 7.896 -8.915 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.747 7.860 -11.131 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.753 4.561 -9.424 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -5.845 6.340 -11.265 1.00 0.00 H new ATOM 1181 N VAL A 81 0.926 7.405 -8.324 1.00 0.00 N ATOM 1182 CA VAL A 81 2.199 7.474 -7.617 1.00 0.00 C ATOM 1183 C VAL A 81 2.245 6.285 -6.658 1.00 0.00 C ATOM 1184 O VAL A 81 3.007 5.345 -6.860 1.00 0.00 O ATOM 1185 CB VAL A 81 2.361 8.808 -6.859 1.00 0.00 C ATOM 1186 CG1 VAL A 81 3.482 8.764 -5.808 1.00 0.00 C ATOM 1187 CG2 VAL A 81 2.693 9.915 -7.858 1.00 0.00 C ATOM 0 H VAL A 81 0.158 7.163 -7.698 1.00 0.00 H new ATOM 0 HA VAL A 81 3.025 7.430 -8.327 1.00 0.00 H new ATOM 0 HB VAL A 81 1.420 8.997 -6.343 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.549 9.730 -5.307 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.262 7.989 -5.074 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.431 8.542 -6.297 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.809 10.861 -7.328 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.622 9.672 -8.375 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.886 10.003 -8.585 1.00 0.00 H new ATOM 1197 N GLY A 82 1.420 6.325 -5.608 1.00 0.00 N ATOM 1198 CA GLY A 82 1.554 5.429 -4.467 1.00 0.00 C ATOM 1199 C GLY A 82 0.900 4.067 -4.683 1.00 0.00 C ATOM 1200 O GLY A 82 0.192 3.577 -3.803 1.00 0.00 O ATOM 0 H GLY A 82 0.643 6.981 -5.530 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.613 5.285 -4.251 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.111 5.901 -3.590 1.00 0.00 H new ATOM 1204 N ASP A 83 1.112 3.478 -5.857 1.00 0.00 N ATOM 1205 CA ASP A 83 0.491 2.251 -6.321 1.00 0.00 C ATOM 1206 C ASP A 83 1.408 1.072 -6.004 1.00 0.00 C ATOM 1207 O ASP A 83 2.074 0.542 -6.894 1.00 0.00 O ATOM 1208 CB ASP A 83 0.274 2.329 -7.838 1.00 0.00 C ATOM 1209 CG ASP A 83 -0.381 3.605 -8.330 1.00 0.00 C ATOM 1210 OD1 ASP A 83 0.121 4.692 -7.987 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.358 3.491 -9.096 1.00 0.00 O ATOM 0 H ASP A 83 1.757 3.869 -6.543 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.469 2.117 -5.822 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.239 2.220 -8.333 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -0.340 1.482 -8.146 1.00 0.00 H new ATOM 1216 N LEU A 84 1.450 0.634 -4.748 1.00 0.00 N ATOM 1217 CA LEU A 84 2.421 -0.367 -4.320 1.00 0.00 C ATOM 1218 C LEU A 84 1.899 -1.774 -4.626 1.00 0.00 C ATOM 1219 O LEU A 84 1.880 -2.642 -3.755 1.00 0.00 O ATOM 1220 CB LEU A 84 2.773 -0.147 -2.841 1.00 0.00 C ATOM 1221 CG LEU A 84 3.084 1.325 -2.510 1.00 0.00 C ATOM 1222 CD1 LEU A 84 3.574 1.428 -1.064 1.00 0.00 C ATOM 1223 CD2 LEU A 84 4.137 1.936 -3.444 1.00 0.00 C ATOM 0 H LEU A 84 0.823 0.957 -4.011 1.00 0.00 H new ATOM 0 HA LEU A 84 3.349 -0.260 -4.881 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.943 -0.486 -2.221 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.635 -0.762 -2.583 1.00 0.00 H new ATOM 0 HG LEU A 84 2.161 1.887 -2.649 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.795 2.469 -0.828 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.800 1.059 -0.391 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.477 0.829 -0.942 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.315 2.974 -3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.067 1.373 -3.361 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.778 1.895 -4.473 1.00 0.00 H new ATOM 1235 N GLY A 85 1.490 -1.976 -5.887 1.00 0.00 N ATOM 1236 CA GLY A 85 0.745 -3.120 -6.390 1.00 0.00 C ATOM 1237 C GLY A 85 -0.130 -3.769 -5.321 1.00 0.00 C ATOM 1238 O GLY A 85 -0.927 -3.091 -4.673 1.00 0.00 O ATOM 0 H GLY A 85 1.687 -1.297 -6.622 1.00 0.00 H new ATOM 0 HA2 GLY A 85 0.118 -2.802 -7.223 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.443 -3.860 -6.781 1.00 0.00 H new ATOM 1242 N ASN A 86 0.070 -5.075 -5.116 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.619 -5.864 -4.109 1.00 0.00 C ATOM 1244 C ASN A 86 0.389 -6.636 -3.271 1.00 0.00 C ATOM 1245 O ASN A 86 1.521 -6.856 -3.699 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.636 -6.829 -4.749 1.00 0.00 C ATOM 1247 CG ASN A 86 -1.047 -7.767 -5.802 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -0.104 -8.633 -5.437 1.00 0.00 O flip ATOM 1249 ND2 ASN A 86 -1.460 -7.748 -6.956 1.00 0.00 N flip ATOM 0 H ASN A 86 0.735 -5.620 -5.665 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.171 -5.180 -3.464 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.093 -7.429 -3.962 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.433 -6.244 -5.208 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.183 -7.082 -7.228 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -1.081 -8.399 -7.644 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.059 -7.114 -2.111 1.00 0.00 N ATOM 1257 CA VAL A 87 0.659 -8.032 -1.239 1.00 0.00 C ATOM 1258 C VAL A 87 -0.115 -9.343 -1.223 1.00 0.00 C ATOM 1259 O VAL A 87 -1.203 -9.393 -1.788 1.00 0.00 O ATOM 1260 CB VAL A 87 0.760 -7.434 0.172 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.432 -6.059 0.106 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.620 -7.335 0.836 1.00 0.00 C ATOM 0 H VAL A 87 -0.974 -6.858 -1.740 1.00 0.00 H new ATOM 0 HA VAL A 87 1.674 -8.204 -1.597 1.00 0.00 H new ATOM 0 HB VAL A 87 1.370 -8.098 0.785 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.501 -5.639 1.110 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.433 -6.163 -0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.841 -5.395 -0.525 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.514 -6.908 1.833 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.268 -6.697 0.235 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.059 -8.330 0.912 1.00 0.00 H new ATOM 1272 N THR A 88 0.408 -10.359 -0.536 1.00 0.00 N ATOM 1273 CA THR A 88 -0.171 -11.694 -0.427 1.00 0.00 C ATOM 1274 C THR A 88 -0.289 -12.038 1.051 1.00 0.00 C ATOM 1275 O THR A 88 0.724 -12.069 1.744 1.00 0.00 O ATOM 1276 CB THR A 88 0.752 -12.681 -1.153 1.00 0.00 C ATOM 1277 OG1 THR A 88 0.876 -12.276 -2.503 1.00 0.00 O ATOM 1278 CG2 THR A 88 0.221 -14.118 -1.096 1.00 0.00 C ATOM 0 H THR A 88 1.283 -10.268 -0.020 1.00 0.00 H new ATOM 0 HA THR A 88 -1.160 -11.743 -0.882 1.00 0.00 H new ATOM 0 HB THR A 88 1.721 -12.672 -0.653 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.465 -12.898 -2.978 1.00 0.00 H new ATOM 0 HG21 THR A 88 0.907 -14.781 -1.623 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.138 -14.434 -0.056 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.760 -14.162 -1.568 1.00 0.00 H new ATOM 1286 N ALA A 89 -1.510 -12.286 1.529 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.742 -12.732 2.889 1.00 0.00 C ATOM 1288 C ALA A 89 -1.627 -14.246 2.985 1.00 0.00 C ATOM 1289 O ALA A 89 -2.152 -14.966 2.132 1.00 0.00 O ATOM 1290 CB ALA A 89 -3.114 -12.298 3.374 1.00 0.00 C ATOM 0 H ALA A 89 -2.361 -12.181 0.977 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.981 -12.274 3.522 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.265 -12.644 4.396 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -3.183 -11.211 3.345 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.881 -12.727 2.729 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.969 -14.693 4.055 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.870 -16.082 4.458 1.00 0.00 C ATOM 1298 C ASP A 90 -2.237 -16.615 4.887 1.00 0.00 C ATOM 1299 O ASP A 90 -3.159 -15.850 5.172 1.00 0.00 O ATOM 1300 CB ASP A 90 0.156 -16.204 5.597 1.00 0.00 C ATOM 1301 CG ASP A 90 0.330 -17.649 6.036 1.00 0.00 C ATOM 1302 OD1 ASP A 90 0.284 -18.525 5.150 1.00 0.00 O ATOM 1303 OD2 ASP A 90 0.352 -17.871 7.264 1.00 0.00 O ATOM 0 H ASP A 90 -0.472 -14.065 4.686 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.535 -16.684 3.614 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.115 -15.804 5.269 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -0.167 -15.601 6.446 1.00 0.00 H new ATOM 1308 N LYS A 91 -2.333 -17.937 5.009 1.00 0.00 N ATOM 1309 CA LYS A 91 -3.451 -18.667 5.564 1.00 0.00 C ATOM 1310 C LYS A 91 -3.800 -18.200 6.982 1.00 0.00 C ATOM 1311 O LYS A 91 -4.922 -18.411 7.431 1.00 0.00 O ATOM 1312 CB LYS A 91 -3.100 -20.163 5.503 1.00 0.00 C ATOM 1313 CG LYS A 91 -1.978 -20.610 6.457 1.00 0.00 C ATOM 1314 CD LYS A 91 -2.510 -21.077 7.820 1.00 0.00 C ATOM 1315 CE LYS A 91 -1.343 -21.345 8.779 1.00 0.00 C ATOM 1316 NZ LYS A 91 -1.810 -21.478 10.172 1.00 0.00 N ATOM 0 H LYS A 91 -1.583 -18.557 4.702 1.00 0.00 H new ATOM 0 HA LYS A 91 -4.352 -18.477 4.980 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.997 -20.740 5.727 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -2.808 -20.410 4.482 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.415 -21.420 5.994 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.283 -19.784 6.607 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -3.170 -20.318 8.241 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -3.104 -21.982 7.696 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.825 -22.256 8.479 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.621 -20.531 8.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.999 -21.675 10.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -2.267 -20.593 10.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -2.493 -22.259 10.236 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.842 -17.597 7.701 1.00 0.00 N ATOM 1331 CA ASP A 92 -3.059 -17.093 9.059 1.00 0.00 C ATOM 1332 C ASP A 92 -3.569 -15.651 9.020 1.00 0.00 C ATOM 1333 O ASP A 92 -3.855 -15.054 10.055 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.763 -17.193 9.882 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.978 -17.905 11.209 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -2.299 -19.115 11.151 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.789 -17.257 12.259 1.00 0.00 O ATOM 0 H ASP A 92 -1.895 -17.446 7.354 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.818 -17.709 9.541 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -1.008 -17.726 9.304 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.374 -16.192 10.068 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.663 -15.075 7.820 1.00 0.00 N ATOM 1343 CA GLY A 93 -4.182 -13.742 7.620 1.00 0.00 C ATOM 1344 C GLY A 93 -3.137 -12.666 7.911 1.00 0.00 C ATOM 1345 O GLY A 93 -3.461 -11.581 8.408 1.00 0.00 O ATOM 0 H GLY A 93 -3.375 -15.535 6.957 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.530 -13.640 6.592 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.047 -13.590 8.266 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.881 -12.981 7.573 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.723 -12.106 7.686 1.00 0.00 C ATOM 1351 C VAL A 94 -0.209 -11.826 6.277 1.00 0.00 C ATOM 1352 O VAL A 94 0.294 -12.739 5.629 1.00 0.00 O ATOM 1353 CB VAL A 94 0.358 -12.792 8.543 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.666 -11.981 8.561 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.168 -12.985 9.969 1.00 0.00 C ATOM 0 H VAL A 94 -1.640 -13.898 7.196 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.988 -11.166 8.171 1.00 0.00 H new ATOM 0 HB VAL A 94 0.582 -13.762 8.100 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.405 -12.496 9.175 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.046 -11.881 7.544 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.475 -10.991 8.976 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.596 -13.470 10.576 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.413 -12.015 10.401 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.062 -13.608 9.946 1.00 0.00 H new ATOM 1365 N ALA A 95 -0.344 -10.589 5.793 1.00 0.00 N ATOM 1366 CA ALA A 95 0.309 -10.148 4.575 1.00 0.00 C ATOM 1367 C ALA A 95 1.531 -9.346 4.972 1.00 0.00 C ATOM 1368 O ALA A 95 1.385 -8.260 5.539 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.622 -9.302 3.705 1.00 0.00 C ATOM 0 H ALA A 95 -0.912 -9.870 6.241 1.00 0.00 H new ATOM 0 HA ALA A 95 0.590 -11.017 3.980 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -0.095 -8.992 2.803 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.497 -9.890 3.430 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.938 -8.420 4.262 1.00 0.00 H new ATOM 1375 N ASP A 96 2.709 -9.895 4.673 1.00 0.00 N ATOM 1376 CA ASP A 96 3.968 -9.197 4.820 1.00 0.00 C ATOM 1377 C ASP A 96 4.172 -8.314 3.593 1.00 0.00 C ATOM 1378 O ASP A 96 3.779 -8.681 2.485 1.00 0.00 O ATOM 1379 CB ASP A 96 5.116 -10.188 5.044 1.00 0.00 C ATOM 1380 CG ASP A 96 5.016 -10.936 6.371 1.00 0.00 C ATOM 1381 OD1 ASP A 96 4.350 -10.415 7.294 1.00 0.00 O ATOM 1382 OD2 ASP A 96 5.624 -12.024 6.444 1.00 0.00 O ATOM 0 H ASP A 96 2.807 -10.847 4.319 1.00 0.00 H new ATOM 0 HA ASP A 96 3.953 -8.558 5.703 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.128 -10.910 4.228 1.00 0.00 H new ATOM 0 HB3 ASP A 96 6.063 -9.650 5.008 1.00 0.00 H new ATOM 1387 N VAL A 97 4.751 -7.134 3.804 1.00 0.00 N ATOM 1388 CA VAL A 97 5.047 -6.160 2.763 1.00 0.00 C ATOM 1389 C VAL A 97 6.555 -5.964 2.754 1.00 0.00 C ATOM 1390 O VAL A 97 7.173 -6.056 3.815 1.00 0.00 O ATOM 1391 CB VAL A 97 4.325 -4.823 3.034 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.247 -3.973 1.759 1.00 0.00 C ATOM 1393 CG2 VAL A 97 2.927 -5.050 3.617 1.00 0.00 C ATOM 0 H VAL A 97 5.035 -6.823 4.733 1.00 0.00 H new ATOM 0 HA VAL A 97 4.696 -6.517 1.795 1.00 0.00 H new ATOM 0 HB VAL A 97 4.911 -4.278 3.774 1.00 0.00 H new ATOM 0 HG11 VAL A 97 3.734 -3.036 1.977 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.254 -3.760 1.401 1.00 0.00 H new ATOM 0 HG13 VAL A 97 3.697 -4.518 0.992 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.447 -4.088 3.796 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.329 -5.629 2.913 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.009 -5.595 4.557 1.00 0.00 H new ATOM 1403 N SER A 98 7.124 -5.660 1.585 1.00 0.00 N ATOM 1404 CA SER A 98 8.552 -5.442 1.389 1.00 0.00 C ATOM 1405 C SER A 98 8.797 -4.912 -0.027 1.00 0.00 C ATOM 1406 O SER A 98 8.902 -5.691 -0.971 1.00 0.00 O ATOM 1407 CB SER A 98 9.329 -6.739 1.666 1.00 0.00 C ATOM 1408 OG SER A 98 8.656 -7.866 1.134 1.00 0.00 O ATOM 0 H SER A 98 6.584 -5.557 0.726 1.00 0.00 H new ATOM 0 HA SER A 98 8.915 -4.694 2.094 1.00 0.00 H new ATOM 0 HB2 SER A 98 10.325 -6.669 1.230 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.460 -6.865 2.741 1.00 0.00 H new ATOM 0 HG SER A 98 8.430 -7.699 0.195 1.00 0.00 H new ATOM 1414 N ILE A 99 8.866 -3.588 -0.184 1.00 0.00 N ATOM 1415 CA ILE A 99 9.100 -2.931 -1.464 1.00 0.00 C ATOM 1416 C ILE A 99 9.814 -1.596 -1.234 1.00 0.00 C ATOM 1417 O ILE A 99 10.104 -1.241 -0.091 1.00 0.00 O ATOM 1418 CB ILE A 99 7.757 -2.828 -2.217 1.00 0.00 C ATOM 1419 CG1 ILE A 99 7.936 -2.426 -3.691 1.00 0.00 C ATOM 1420 CG2 ILE A 99 6.729 -1.907 -1.546 1.00 0.00 C ATOM 1421 CD1 ILE A 99 6.796 -2.914 -4.585 1.00 0.00 C ATOM 0 H ILE A 99 8.758 -2.934 0.591 1.00 0.00 H new ATOM 0 HA ILE A 99 9.768 -3.508 -2.103 1.00 0.00 H new ATOM 0 HB ILE A 99 7.354 -3.840 -2.175 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.006 -1.340 -3.760 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.879 -2.830 -4.060 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.814 -1.890 -2.138 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.507 -2.278 -0.545 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.135 -0.898 -1.477 1.00 0.00 H new ATOM 0 HD11 ILE A 99 6.979 -2.600 -5.612 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.741 -4.002 -4.543 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.854 -2.489 -4.238 1.00 0.00 H new ATOM 1433 N GLU A 100 10.120 -0.865 -2.305 1.00 0.00 N ATOM 1434 CA GLU A 100 10.807 0.409 -2.276 1.00 0.00 C ATOM 1435 C GLU A 100 10.122 1.367 -3.245 1.00 0.00 C ATOM 1436 O GLU A 100 9.620 0.932 -4.281 1.00 0.00 O ATOM 1437 CB GLU A 100 12.285 0.252 -2.674 1.00 0.00 C ATOM 1438 CG GLU A 100 13.012 -0.925 -2.005 1.00 0.00 C ATOM 1439 CD GLU A 100 13.128 -2.147 -2.910 1.00 0.00 C ATOM 1440 OE1 GLU A 100 12.097 -2.544 -3.494 1.00 0.00 O ATOM 1441 OE2 GLU A 100 14.269 -2.651 -2.995 1.00 0.00 O ATOM 0 H GLU A 100 9.883 -1.163 -3.251 1.00 0.00 H new ATOM 0 HA GLU A 100 10.766 0.802 -1.260 1.00 0.00 H new ATOM 0 HB2 GLU A 100 12.344 0.130 -3.755 1.00 0.00 H new ATOM 0 HB3 GLU A 100 12.813 1.174 -2.428 1.00 0.00 H new ATOM 0 HG2 GLU A 100 14.010 -0.605 -1.706 1.00 0.00 H new ATOM 0 HG3 GLU A 100 12.480 -1.203 -1.095 1.00 0.00 H new ATOM 1448 N ASP A 101 10.148 2.664 -2.929 1.00 0.00 N ATOM 1449 CA ASP A 101 9.657 3.738 -3.773 1.00 0.00 C ATOM 1450 C ASP A 101 10.785 4.728 -4.023 1.00 0.00 C ATOM 1451 O ASP A 101 11.674 4.881 -3.186 1.00 0.00 O ATOM 1452 CB ASP A 101 8.538 4.482 -3.049 1.00 0.00 C ATOM 1453 CG ASP A 101 7.187 3.817 -3.207 1.00 0.00 C ATOM 1454 OD1 ASP A 101 6.615 3.991 -4.305 1.00 0.00 O ATOM 1455 OD2 ASP A 101 6.741 3.191 -2.221 1.00 0.00 O ATOM 0 H ASP A 101 10.527 3.000 -2.044 1.00 0.00 H new ATOM 0 HA ASP A 101 9.292 3.319 -4.711 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.781 4.550 -1.989 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.482 5.502 -3.430 1.00 0.00 H new ATOM 1460 N SER A 102 10.710 5.431 -5.157 1.00 0.00 N ATOM 1461 CA SER A 102 11.632 6.491 -5.542 1.00 0.00 C ATOM 1462 C SER A 102 10.930 7.857 -5.632 1.00 0.00 C ATOM 1463 O SER A 102 11.590 8.870 -5.849 1.00 0.00 O ATOM 1464 CB SER A 102 12.311 6.105 -6.865 1.00 0.00 C ATOM 1465 OG SER A 102 13.601 6.678 -6.956 1.00 0.00 O ATOM 0 H SER A 102 9.980 5.269 -5.851 1.00 0.00 H new ATOM 0 HA SER A 102 12.394 6.598 -4.770 1.00 0.00 H new ATOM 0 HB2 SER A 102 12.385 5.020 -6.938 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.700 6.440 -7.703 1.00 0.00 H new ATOM 0 HG SER A 102 14.015 6.418 -7.805 1.00 0.00 H new ATOM 1471 N VAL A 103 9.596 7.896 -5.502 1.00 0.00 N ATOM 1472 CA VAL A 103 8.817 9.125 -5.635 1.00 0.00 C ATOM 1473 C VAL A 103 8.538 9.707 -4.249 1.00 0.00 C ATOM 1474 O VAL A 103 8.914 10.842 -3.964 1.00 0.00 O ATOM 1475 CB VAL A 103 7.524 8.860 -6.427 1.00 0.00 C ATOM 1476 CG1 VAL A 103 6.707 10.153 -6.576 1.00 0.00 C ATOM 1477 CG2 VAL A 103 7.850 8.323 -7.828 1.00 0.00 C ATOM 0 H VAL A 103 9.030 7.071 -5.301 1.00 0.00 H new ATOM 0 HA VAL A 103 9.388 9.863 -6.198 1.00 0.00 H new ATOM 0 HB VAL A 103 6.944 8.120 -5.875 1.00 0.00 H new ATOM 0 HG11 VAL A 103 5.797 9.945 -7.139 1.00 0.00 H new ATOM 0 HG12 VAL A 103 6.445 10.533 -5.589 1.00 0.00 H new ATOM 0 HG13 VAL A 103 7.299 10.899 -7.106 1.00 0.00 H new ATOM 0 HG21 VAL A 103 6.924 8.142 -8.373 1.00 0.00 H new ATOM 0 HG22 VAL A 103 8.451 9.055 -8.368 1.00 0.00 H new ATOM 0 HG23 VAL A 103 8.407 7.390 -7.740 1.00 0.00 H new ATOM 1487 N ILE A 104 7.856 8.946 -3.390 1.00 0.00 N ATOM 1488 CA ILE A 104 7.562 9.387 -2.046 1.00 0.00 C ATOM 1489 C ILE A 104 8.853 9.485 -1.213 1.00 0.00 C ATOM 1490 O ILE A 104 9.901 8.979 -1.617 1.00 0.00 O ATOM 1491 CB ILE A 104 6.434 8.520 -1.463 1.00 0.00 C ATOM 1492 CG1 ILE A 104 6.654 7.000 -1.392 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.122 8.770 -2.223 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.899 6.598 -0.604 1.00 0.00 C ATOM 0 H ILE A 104 7.500 8.017 -3.614 1.00 0.00 H new ATOM 0 HA ILE A 104 7.172 10.405 -2.033 1.00 0.00 H new ATOM 0 HB ILE A 104 6.405 8.849 -0.424 1.00 0.00 H new ATOM 0 HG12 ILE A 104 5.780 6.536 -0.935 1.00 0.00 H new ATOM 0 HG13 ILE A 104 6.732 6.605 -2.405 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.332 8.150 -1.799 1.00 0.00 H new ATOM 0 HG22 ILE A 104 4.845 9.820 -2.135 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.257 8.518 -3.275 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.990 5.512 -0.596 1.00 0.00 H new ATOM 0 HD12 ILE A 104 8.782 7.033 -1.072 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.815 6.962 0.420 1.00 0.00 H new ATOM 1506 N SER A 105 8.818 10.193 -0.081 1.00 0.00 N ATOM 1507 CA SER A 105 9.983 10.530 0.732 1.00 0.00 C ATOM 1508 C SER A 105 9.449 10.995 2.073 1.00 0.00 C ATOM 1509 O SER A 105 8.278 11.349 2.142 1.00 0.00 O ATOM 1510 CB SER A 105 10.817 11.624 0.052 1.00 0.00 C ATOM 1511 OG SER A 105 11.591 11.073 -0.994 1.00 0.00 O ATOM 0 H SER A 105 7.947 10.558 0.305 1.00 0.00 H new ATOM 0 HA SER A 105 10.643 9.672 0.858 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.160 12.399 -0.342 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.469 12.101 0.784 1.00 0.00 H new ATOM 0 HG SER A 105 11.204 10.217 -1.271 1.00 0.00 H new ATOM 1517 N LEU A 106 10.274 11.015 3.121 1.00 0.00 N ATOM 1518 CA LEU A 106 9.910 11.532 4.436 1.00 0.00 C ATOM 1519 C LEU A 106 10.309 13.004 4.522 1.00 0.00 C ATOM 1520 O LEU A 106 10.719 13.489 5.573 1.00 0.00 O ATOM 1521 CB LEU A 106 10.585 10.710 5.542 1.00 0.00 C ATOM 1522 CG LEU A 106 10.219 9.219 5.465 1.00 0.00 C ATOM 1523 CD1 LEU A 106 11.347 8.403 4.839 1.00 0.00 C ATOM 1524 CD2 LEU A 106 9.899 8.666 6.855 1.00 0.00 C ATOM 0 H LEU A 106 11.231 10.665 3.076 1.00 0.00 H new ATOM 0 HA LEU A 106 8.832 11.449 4.577 1.00 0.00 H new ATOM 0 HB2 LEU A 106 11.667 10.821 5.466 1.00 0.00 H new ATOM 0 HB3 LEU A 106 10.292 11.104 6.515 1.00 0.00 H new ATOM 0 HG LEU A 106 9.335 9.134 4.833 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.057 7.353 4.799 1.00 0.00 H new ATOM 0 HD12 LEU A 106 11.541 8.765 3.829 1.00 0.00 H new ATOM 0 HD13 LEU A 106 12.249 8.508 5.441 1.00 0.00 H new ATOM 0 HD21 LEU A 106 9.643 7.609 6.776 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.769 8.781 7.502 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.057 9.213 7.279 1.00 0.00 H new ATOM 1536 N SER A 107 10.216 13.711 3.396 1.00 0.00 N ATOM 1537 CA SER A 107 10.686 15.077 3.263 1.00 0.00 C ATOM 1538 C SER A 107 9.898 15.765 2.151 1.00 0.00 C ATOM 1539 O SER A 107 9.170 15.110 1.401 1.00 0.00 O ATOM 1540 CB SER A 107 12.200 15.053 3.001 1.00 0.00 C ATOM 1541 OG SER A 107 12.529 14.063 2.042 1.00 0.00 O ATOM 0 H SER A 107 9.804 13.339 2.540 1.00 0.00 H new ATOM 0 HA SER A 107 10.522 15.650 4.176 1.00 0.00 H new ATOM 0 HB2 SER A 107 12.528 16.031 2.648 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.732 14.855 3.932 1.00 0.00 H new ATOM 0 HG SER A 107 13.492 14.088 1.863 1.00 0.00 H new ATOM 1547 N GLY A 108 10.030 17.090 2.066 1.00 0.00 N ATOM 1548 CA GLY A 108 9.285 17.891 1.113 1.00 0.00 C ATOM 1549 C GLY A 108 7.776 17.775 1.338 1.00 0.00 C ATOM 1550 O GLY A 108 7.314 17.374 2.406 1.00 0.00 O ATOM 0 H GLY A 108 10.659 17.631 2.659 1.00 0.00 H new ATOM 0 HA2 GLY A 108 9.587 18.935 1.199 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.528 17.571 0.100 1.00 0.00 H new ATOM 1554 N ASP A 109 7.019 18.108 0.297 1.00 0.00 N ATOM 1555 CA ASP A 109 5.581 17.914 0.189 1.00 0.00 C ATOM 1556 C ASP A 109 5.243 16.419 0.193 1.00 0.00 C ATOM 1557 O ASP A 109 4.185 16.011 0.667 1.00 0.00 O ATOM 1558 CB ASP A 109 5.118 18.566 -1.124 1.00 0.00 C ATOM 1559 CG ASP A 109 5.743 17.902 -2.349 1.00 0.00 C ATOM 1560 OD1 ASP A 109 6.931 17.508 -2.242 1.00 0.00 O ATOM 1561 OD2 ASP A 109 5.029 17.746 -3.358 1.00 0.00 O ATOM 0 H ASP A 109 7.415 18.543 -0.536 1.00 0.00 H new ATOM 0 HA ASP A 109 5.072 18.370 1.038 1.00 0.00 H new ATOM 0 HB2 ASP A 109 4.032 18.506 -1.194 1.00 0.00 H new ATOM 0 HB3 ASP A 109 5.378 19.624 -1.114 1.00 0.00 H new ATOM 1566 N HIS A 110 6.145 15.599 -0.345 1.00 0.00 N ATOM 1567 CA HIS A 110 5.960 14.160 -0.439 1.00 0.00 C ATOM 1568 C HIS A 110 5.903 13.477 0.932 1.00 0.00 C ATOM 1569 O HIS A 110 5.176 12.495 1.053 1.00 0.00 O ATOM 1570 CB HIS A 110 7.026 13.554 -1.358 1.00 0.00 C ATOM 1571 CG HIS A 110 6.748 13.836 -2.817 1.00 0.00 C ATOM 1572 ND1 HIS A 110 6.702 15.079 -3.409 1.00 0.00 N ATOM 1573 CD2 HIS A 110 6.267 12.937 -3.732 1.00 0.00 C ATOM 1574 CE1 HIS A 110 6.208 14.926 -4.648 1.00 0.00 C ATOM 1575 NE2 HIS A 110 5.934 13.635 -4.896 1.00 0.00 N ATOM 0 H HIS A 110 7.032 15.923 -0.730 1.00 0.00 H new ATOM 0 HA HIS A 110 4.983 13.975 -0.886 1.00 0.00 H new ATOM 0 HB2 HIS A 110 8.004 13.955 -1.092 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.070 12.476 -1.200 1.00 0.00 H new ATOM 0 HD1 HIS A 110 6.992 15.959 -2.982 1.00 0.00 H new ATOM 0 HD2 HIS A 110 6.163 11.873 -3.580 1.00 0.00 H new ATOM 0 HE1 HIS A 110 6.052 15.732 -5.350 1.00 0.00 H new ATOM 1583 N SER A 111 6.643 13.989 1.931 1.00 0.00 N ATOM 1584 CA SER A 111 6.688 13.540 3.331 1.00 0.00 C ATOM 1585 C SER A 111 5.632 12.493 3.688 1.00 0.00 C ATOM 1586 O SER A 111 4.567 12.864 4.171 1.00 0.00 O ATOM 1587 CB SER A 111 6.525 14.742 4.273 1.00 0.00 C ATOM 1588 OG SER A 111 6.412 14.323 5.621 1.00 0.00 O ATOM 0 H SER A 111 7.266 14.780 1.770 1.00 0.00 H new ATOM 0 HA SER A 111 7.661 13.065 3.455 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.380 15.409 4.167 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.640 15.311 3.991 1.00 0.00 H new ATOM 0 HG SER A 111 6.311 15.107 6.200 1.00 0.00 H new ATOM 1594 N ILE A 112 5.934 11.200 3.559 1.00 0.00 N ATOM 1595 CA ILE A 112 4.973 10.130 3.808 1.00 0.00 C ATOM 1596 C ILE A 112 4.352 10.198 5.201 1.00 0.00 C ATOM 1597 O ILE A 112 3.288 9.631 5.422 1.00 0.00 O ATOM 1598 CB ILE A 112 5.593 8.745 3.573 1.00 0.00 C ATOM 1599 CG1 ILE A 112 6.544 8.352 4.712 1.00 0.00 C ATOM 1600 CG2 ILE A 112 6.270 8.696 2.206 1.00 0.00 C ATOM 1601 CD1 ILE A 112 7.327 7.080 4.396 1.00 0.00 C ATOM 0 H ILE A 112 6.856 10.867 3.278 1.00 0.00 H new ATOM 0 HA ILE A 112 4.170 10.282 3.087 1.00 0.00 H new ATOM 0 HB ILE A 112 4.795 8.002 3.574 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.241 9.169 4.899 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.971 8.206 5.628 1.00 0.00 H new ATOM 0 HG21 ILE A 112 6.706 7.709 2.051 1.00 0.00 H new ATOM 0 HG22 ILE A 112 5.533 8.894 1.428 1.00 0.00 H new ATOM 0 HG23 ILE A 112 7.055 9.450 2.162 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.986 6.842 5.231 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.632 6.256 4.235 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.922 7.233 3.496 1.00 0.00 H new ATOM 1613 N ILE A 113 4.992 10.895 6.141 1.00 0.00 N ATOM 1614 CA ILE A 113 4.419 11.114 7.453 1.00 0.00 C ATOM 1615 C ILE A 113 3.093 11.842 7.232 1.00 0.00 C ATOM 1616 O ILE A 113 3.056 12.900 6.604 1.00 0.00 O ATOM 1617 CB ILE A 113 5.413 11.894 8.331 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.747 11.141 8.500 1.00 0.00 C ATOM 1619 CG2 ILE A 113 4.805 12.225 9.701 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.593 9.698 8.988 1.00 0.00 C ATOM 0 H ILE A 113 5.912 11.316 6.009 1.00 0.00 H new ATOM 0 HA ILE A 113 4.224 10.185 7.989 1.00 0.00 H new ATOM 0 HB ILE A 113 5.625 12.830 7.813 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.273 11.136 7.545 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.373 11.687 9.206 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.532 12.776 10.298 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.911 12.833 9.565 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.540 11.301 10.214 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.577 9.238 9.081 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.097 9.693 9.959 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.995 9.134 8.272 1.00 0.00 H new ATOM 1632 N GLY A 114 1.999 11.223 7.667 1.00 0.00 N ATOM 1633 CA GLY A 114 0.653 11.719 7.476 1.00 0.00 C ATOM 1634 C GLY A 114 -0.141 10.899 6.457 1.00 0.00 C ATOM 1635 O GLY A 114 -1.364 10.854 6.532 1.00 0.00 O ATOM 0 H GLY A 114 2.033 10.339 8.175 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.128 11.710 8.431 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.696 12.757 7.146 1.00 0.00 H new ATOM 1639 N ARG A 115 0.522 10.287 5.473 1.00 0.00 N ATOM 1640 CA ARG A 115 -0.160 9.760 4.295 1.00 0.00 C ATOM 1641 C ARG A 115 -0.987 8.522 4.663 1.00 0.00 C ATOM 1642 O ARG A 115 -0.565 7.719 5.498 1.00 0.00 O ATOM 1643 CB ARG A 115 0.853 9.502 3.164 1.00 0.00 C ATOM 1644 CG ARG A 115 1.259 10.767 2.385 1.00 0.00 C ATOM 1645 CD ARG A 115 1.667 11.924 3.307 1.00 0.00 C ATOM 1646 NE ARG A 115 2.103 13.119 2.573 1.00 0.00 N ATOM 1647 CZ ARG A 115 2.261 14.304 3.183 1.00 0.00 C ATOM 1648 NH1 ARG A 115 2.257 14.397 4.518 1.00 0.00 N ATOM 1649 NH2 ARG A 115 2.382 15.422 2.468 1.00 0.00 N ATOM 0 H ARG A 115 1.532 10.145 5.471 1.00 0.00 H new ATOM 0 HA ARG A 115 -0.866 10.500 3.918 1.00 0.00 H new ATOM 0 HB2 ARG A 115 1.748 9.047 3.589 1.00 0.00 H new ATOM 0 HB3 ARG A 115 0.428 8.780 2.467 1.00 0.00 H new ATOM 0 HG2 ARG A 115 2.088 10.528 1.719 1.00 0.00 H new ATOM 0 HG3 ARG A 115 0.427 11.085 1.756 1.00 0.00 H new ATOM 0 HD2 ARG A 115 0.824 12.185 3.947 1.00 0.00 H new ATOM 0 HD3 ARG A 115 2.473 11.592 3.961 1.00 0.00 H new ATOM 0 HE ARG A 115 2.291 13.046 1.573 1.00 0.00 H new ATOM 0 HH11 ARG A 115 2.133 13.560 5.087 1.00 0.00 H new ATOM 0 HH12 ARG A 115 2.378 15.305 4.966 1.00 0.00 H new ATOM 0 HH21 ARG A 115 2.355 15.381 1.449 1.00 0.00 H new ATOM 0 HH22 ARG A 115 2.502 16.318 2.940 1.00 0.00 H new ATOM 1663 N THR A 116 -2.178 8.391 4.061 1.00 0.00 N ATOM 1664 CA THR A 116 -3.134 7.334 4.344 1.00 0.00 C ATOM 1665 C THR A 116 -2.814 6.084 3.519 1.00 0.00 C ATOM 1666 O THR A 116 -3.066 6.052 2.314 1.00 0.00 O ATOM 1667 CB THR A 116 -4.566 7.826 4.083 1.00 0.00 C ATOM 1668 OG1 THR A 116 -4.869 8.912 4.936 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.591 6.723 4.376 1.00 0.00 C ATOM 0 H THR A 116 -2.503 9.041 3.345 1.00 0.00 H new ATOM 0 HA THR A 116 -3.058 7.064 5.397 1.00 0.00 H new ATOM 0 HB THR A 116 -4.620 8.121 3.035 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.510 9.507 4.493 1.00 0.00 H new ATOM 0 HG21 THR A 116 -6.596 7.099 4.183 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.395 5.864 3.734 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.512 6.421 5.420 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.300 5.038 4.165 1.00 0.00 N ATOM 1678 CA LEU A 117 -1.997 3.764 3.534 1.00 0.00 C ATOM 1679 C LEU A 117 -3.210 2.831 3.661 1.00 0.00 C ATOM 1680 O LEU A 117 -3.860 2.814 4.710 1.00 0.00 O ATOM 1681 CB LEU A 117 -0.747 3.185 4.207 1.00 0.00 C ATOM 1682 CG LEU A 117 -0.028 2.119 3.366 1.00 0.00 C ATOM 1683 CD1 LEU A 117 0.751 2.736 2.200 1.00 0.00 C ATOM 1684 CD2 LEU A 117 0.959 1.394 4.278 1.00 0.00 C ATOM 0 H LEU A 117 -2.080 5.058 5.161 1.00 0.00 H new ATOM 0 HA LEU A 117 -1.793 3.885 2.470 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.051 3.997 4.420 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.030 2.749 5.165 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.775 1.443 2.949 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.243 1.946 1.633 1.00 0.00 H new ATOM 0 HD12 LEU A 117 0.064 3.276 1.549 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.501 3.425 2.588 1.00 0.00 H new ATOM 0 HD21 LEU A 117 1.486 0.629 3.708 1.00 0.00 H new ATOM 0 HD22 LEU A 117 1.678 2.109 4.677 1.00 0.00 H new ATOM 0 HD23 LEU A 117 0.418 0.926 5.100 1.00 0.00 H new ATOM 1696 N VAL A 118 -3.534 2.086 2.595 1.00 0.00 N ATOM 1697 CA VAL A 118 -4.704 1.210 2.498 1.00 0.00 C ATOM 1698 C VAL A 118 -4.289 -0.124 1.866 1.00 0.00 C ATOM 1699 O VAL A 118 -3.356 -0.140 1.067 1.00 0.00 O ATOM 1700 CB VAL A 118 -5.782 1.912 1.653 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.038 1.058 1.460 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.192 3.248 2.289 1.00 0.00 C ATOM 0 H VAL A 118 -2.966 2.078 1.748 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.112 1.006 3.488 1.00 0.00 H new ATOM 0 HB VAL A 118 -5.330 2.080 0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.761 1.606 0.856 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -6.773 0.130 0.954 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.475 0.829 2.432 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -6.955 3.725 1.674 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.591 3.068 3.287 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.321 3.900 2.358 1.00 0.00 H new ATOM 1712 N VAL A 119 -4.984 -1.214 2.229 1.00 0.00 N ATOM 1713 CA VAL A 119 -4.651 -2.612 1.909 1.00 0.00 C ATOM 1714 C VAL A 119 -5.668 -3.306 0.969 1.00 0.00 C ATOM 1715 O VAL A 119 -5.369 -4.320 0.346 1.00 0.00 O ATOM 1716 CB VAL A 119 -4.457 -3.379 3.235 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -5.475 -3.012 4.319 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.506 -4.897 3.058 1.00 0.00 C ATOM 0 H VAL A 119 -5.838 -1.140 2.782 1.00 0.00 H new ATOM 0 HA VAL A 119 -3.725 -2.618 1.335 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.463 -3.069 3.558 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.273 -3.592 5.219 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -5.396 -1.949 4.547 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.481 -3.233 3.963 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.364 -5.381 4.024 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.474 -5.184 2.648 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.715 -5.209 2.376 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.885 -2.770 0.888 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.030 -3.220 0.097 1.00 0.00 C ATOM 1730 C HIS A 120 -8.497 -4.639 0.370 1.00 0.00 C ATOM 1731 O HIS A 120 -7.819 -5.480 0.956 1.00 0.00 O ATOM 1732 CB HIS A 120 -7.881 -2.968 -1.410 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.052 -1.522 -1.753 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.215 -0.814 -1.920 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -6.987 -0.717 -1.959 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.875 0.423 -2.294 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.528 0.504 -2.334 1.00 0.00 N ATOM 0 H HIS A 120 -7.116 -1.933 1.423 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.829 -2.574 0.461 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -6.898 -3.305 -1.739 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.619 -3.559 -1.952 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.163 -1.166 -1.784 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -5.942 -0.969 -1.855 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.562 1.223 -2.525 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.731 -4.873 -0.055 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.428 -6.107 0.177 1.00 0.00 C ATOM 1747 C GLU A 121 -9.820 -7.241 -0.640 1.00 0.00 C ATOM 1748 O GLU A 121 -9.649 -8.339 -0.124 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.899 -5.888 -0.204 1.00 0.00 C ATOM 1750 CG GLU A 121 -12.803 -7.120 -0.102 1.00 0.00 C ATOM 1751 CD GLU A 121 -14.069 -6.887 -0.903 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.491 -5.707 -0.991 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -14.534 -7.897 -1.472 1.00 0.00 O ATOM 0 H GLU A 121 -10.277 -4.190 -0.580 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.346 -6.393 1.226 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.308 -5.106 0.436 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.938 -5.515 -1.228 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -12.280 -8.000 -0.477 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -13.051 -7.317 0.941 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.503 -6.981 -1.908 1.00 0.00 N ATOM 1761 CA LYS A 122 -8.857 -7.944 -2.788 1.00 0.00 C ATOM 1762 C LYS A 122 -7.620 -7.312 -3.437 1.00 0.00 C ATOM 1763 O LYS A 122 -7.257 -6.172 -3.130 1.00 0.00 O ATOM 1764 CB LYS A 122 -9.840 -8.444 -3.860 1.00 0.00 C ATOM 1765 CG LYS A 122 -11.213 -8.833 -3.299 1.00 0.00 C ATOM 1766 CD LYS A 122 -11.951 -9.674 -4.352 1.00 0.00 C ATOM 1767 CE LYS A 122 -13.478 -9.734 -4.164 1.00 0.00 C ATOM 1768 NZ LYS A 122 -13.893 -10.035 -2.781 1.00 0.00 N ATOM 0 H LYS A 122 -9.691 -6.084 -2.355 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.540 -8.803 -2.196 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.971 -7.666 -4.612 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.406 -9.306 -4.366 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.098 -9.400 -2.375 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -11.789 -7.940 -3.056 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.735 -9.268 -5.340 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -11.555 -10.689 -4.331 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -13.910 -8.779 -4.464 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -13.888 -10.493 -4.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -14.881 -10.358 -2.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.283 -10.781 -2.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -13.807 -9.178 -2.198 1.00 0.00 H new ATOM 1782 N ALA A 123 -6.978 -8.070 -4.329 1.00 0.00 N ATOM 1783 CA ALA A 123 -5.896 -7.625 -5.184 1.00 0.00 C ATOM 1784 C ALA A 123 -6.376 -6.461 -6.038 1.00 0.00 C ATOM 1785 O ALA A 123 -7.557 -6.381 -6.362 1.00 0.00 O ATOM 1786 CB ALA A 123 -5.491 -8.778 -6.103 1.00 0.00 C ATOM 0 H ALA A 123 -7.215 -9.051 -4.475 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.048 -7.310 -4.575 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.677 -8.457 -6.753 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -5.162 -9.625 -5.501 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.345 -9.075 -6.712 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.456 -5.584 -6.419 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.706 -4.513 -7.362 1.00 0.00 C ATOM 1794 C ASP A 124 -5.156 -4.931 -8.737 1.00 0.00 C ATOM 1795 O ASP A 124 -3.983 -5.257 -8.888 1.00 0.00 O ATOM 1796 CB ASP A 124 -5.106 -3.227 -6.784 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.600 -3.182 -6.814 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -2.968 -4.181 -6.427 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.149 -2.064 -7.146 1.00 0.00 O ATOM 0 H ASP A 124 -4.497 -5.602 -6.071 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.767 -4.315 -7.517 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.495 -2.375 -7.341 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.442 -3.114 -5.753 1.00 0.00 H new ATOM 1804 N ASP A 125 -6.000 -4.929 -9.771 1.00 0.00 N ATOM 1805 CA ASP A 125 -5.723 -5.449 -11.107 1.00 0.00 C ATOM 1806 C ASP A 125 -4.783 -4.552 -11.912 1.00 0.00 C ATOM 1807 O ASP A 125 -4.848 -4.542 -13.140 1.00 0.00 O ATOM 1808 CB ASP A 125 -7.063 -5.627 -11.848 1.00 0.00 C ATOM 1809 CG ASP A 125 -7.787 -6.911 -11.483 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -8.059 -7.117 -10.285 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -8.005 -7.689 -12.440 1.00 0.00 O ATOM 0 H ASP A 125 -6.942 -4.545 -9.693 1.00 0.00 H new ATOM 0 HA ASP A 125 -5.210 -6.405 -11.000 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -7.709 -4.778 -11.625 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -6.880 -5.614 -12.922 1.00 0.00 H new ATOM 1816 N LEU A 126 -3.925 -3.788 -11.237 1.00 0.00 N ATOM 1817 CA LEU A 126 -3.029 -2.806 -11.819 1.00 0.00 C ATOM 1818 C LEU A 126 -3.659 -2.093 -13.020 1.00 0.00 C ATOM 1819 O LEU A 126 -3.050 -1.936 -14.073 1.00 0.00 O ATOM 1820 CB LEU A 126 -1.719 -3.493 -12.185 1.00 0.00 C ATOM 1821 CG LEU A 126 -1.095 -4.285 -11.029 1.00 0.00 C ATOM 1822 CD1 LEU A 126 0.312 -4.703 -11.441 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -1.070 -3.560 -9.680 1.00 0.00 C ATOM 0 H LEU A 126 -3.836 -3.844 -10.222 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.830 -2.025 -11.085 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.894 -4.168 -13.023 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.007 -2.741 -12.525 1.00 0.00 H new ATOM 0 HG LEU A 126 -1.738 -5.148 -10.856 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.775 -5.268 -10.632 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.260 -5.325 -12.335 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.909 -3.815 -11.651 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.610 -4.203 -8.930 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.493 -2.640 -9.772 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -2.089 -3.320 -9.377 1.00 0.00 H new ATOM 1835 N GLY A 127 -4.910 -1.669 -12.858 1.00 0.00 N ATOM 1836 CA GLY A 127 -5.595 -0.846 -13.842 1.00 0.00 C ATOM 1837 C GLY A 127 -6.006 -1.601 -15.107 1.00 0.00 C ATOM 1838 O GLY A 127 -6.763 -1.051 -15.903 1.00 0.00 O ATOM 0 H GLY A 127 -5.475 -1.889 -12.038 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.485 -0.415 -13.384 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -4.946 -0.016 -14.121 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.572 -2.855 -15.291 1.00 0.00 N ATOM 1843 CA LYS A 128 -5.600 -3.531 -16.583 1.00 0.00 C ATOM 1844 C LYS A 128 -7.011 -3.664 -17.165 1.00 0.00 C ATOM 1845 O LYS A 128 -7.174 -3.780 -18.376 1.00 0.00 O ATOM 1846 CB LYS A 128 -4.873 -4.882 -16.491 1.00 0.00 C ATOM 1847 CG LYS A 128 -5.725 -6.008 -15.886 1.00 0.00 C ATOM 1848 CD LYS A 128 -4.839 -7.230 -15.608 1.00 0.00 C ATOM 1849 CE LYS A 128 -5.637 -8.498 -15.262 1.00 0.00 C ATOM 1850 NZ LYS A 128 -6.119 -8.532 -13.865 1.00 0.00 N ATOM 0 H LYS A 128 -5.190 -3.428 -14.538 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.063 -2.901 -17.292 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -4.552 -5.179 -17.489 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -3.972 -4.758 -15.890 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -6.193 -5.668 -14.962 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -6.529 -6.277 -16.571 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -4.220 -7.427 -16.483 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -4.163 -6.999 -14.785 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -6.492 -8.574 -15.934 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -5.011 -9.372 -15.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -6.482 -9.482 -13.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -5.334 -8.304 -13.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -6.880 -7.834 -13.743 1.00 0.00 H new ATOM 1864 N GLY A 129 -8.031 -3.647 -16.299 1.00 0.00 N ATOM 1865 CA GLY A 129 -9.429 -3.626 -16.705 1.00 0.00 C ATOM 1866 C GLY A 129 -9.738 -2.495 -17.692 1.00 0.00 C ATOM 1867 O GLY A 129 -10.617 -2.647 -18.534 1.00 0.00 O ATOM 0 H GLY A 129 -7.901 -3.648 -15.287 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -9.686 -4.582 -17.161 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -10.059 -3.515 -15.822 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.026 -1.367 -17.597 1.00 0.00 N ATOM 1872 CA GLY A 130 -9.188 -0.264 -18.531 1.00 0.00 C ATOM 1873 C GLY A 130 -10.579 0.353 -18.400 1.00 0.00 C ATOM 1874 O GLY A 130 -11.319 0.471 -19.373 1.00 0.00 O ATOM 0 H GLY A 130 -8.327 -1.200 -16.873 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -8.429 0.495 -18.341 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -9.036 -0.619 -19.550 1.00 0.00 H new ATOM 1878 N ASN A 131 -10.927 0.762 -17.179 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.209 1.369 -16.845 1.00 0.00 C ATOM 1880 C ASN A 131 -12.011 2.242 -15.621 1.00 0.00 C ATOM 1881 O ASN A 131 -11.149 1.907 -14.814 1.00 0.00 O ATOM 1882 CB ASN A 131 -13.333 0.334 -16.685 1.00 0.00 C ATOM 1883 CG ASN A 131 -12.891 -0.838 -15.831 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -12.250 -0.546 -14.712 1.00 0.00 O flip ATOM 1885 ND2 ASN A 131 -13.045 -1.995 -16.203 1.00 0.00 N flip ATOM 0 H ASN A 131 -10.305 0.676 -16.375 1.00 0.00 H new ATOM 0 HA ASN A 131 -12.547 1.993 -17.672 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.204 0.808 -16.232 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -13.641 -0.025 -17.667 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -13.544 -2.189 -17.071 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -12.674 -2.764 -15.645 1.00 0.00 H new ATOM 1892 N GLU A 132 -12.785 3.320 -15.445 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.516 4.262 -14.363 1.00 0.00 C ATOM 1894 C GLU A 132 -12.310 3.543 -13.026 1.00 0.00 C ATOM 1895 O GLU A 132 -11.379 3.886 -12.310 1.00 0.00 O ATOM 1896 CB GLU A 132 -13.570 5.373 -14.273 1.00 0.00 C ATOM 1897 CG GLU A 132 -13.027 6.509 -13.390 1.00 0.00 C ATOM 1898 CD GLU A 132 -14.077 7.562 -13.086 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -14.491 8.235 -14.053 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -14.431 7.656 -11.887 1.00 0.00 O ATOM 0 H GLU A 132 -13.588 3.555 -16.029 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.577 4.760 -14.605 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.806 5.750 -15.268 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -14.496 4.980 -13.853 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.655 6.091 -12.455 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.180 6.979 -13.889 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.103 2.500 -12.740 1.00 0.00 N ATOM 1908 CA GLN A 133 -12.883 1.602 -11.609 1.00 0.00 C ATOM 1909 C GLN A 133 -11.400 1.207 -11.493 1.00 0.00 C ATOM 1910 O GLN A 133 -10.659 1.841 -10.761 1.00 0.00 O ATOM 1911 CB GLN A 133 -13.846 0.392 -11.672 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.800 0.330 -10.468 1.00 0.00 C ATOM 1913 CD GLN A 133 -14.096 0.271 -9.108 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -12.843 -0.179 -9.064 1.00 0.00 O flip ATOM 1915 NE2 GLN A 133 -14.667 0.670 -8.099 1.00 0.00 N flip ATOM 0 H GLN A 133 -13.923 2.258 -13.297 1.00 0.00 H new ATOM 0 HA GLN A 133 -13.121 2.131 -10.686 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -14.430 0.445 -12.591 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -13.264 -0.528 -11.717 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -15.451 1.204 -10.490 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.440 -0.546 -10.571 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -15.627 1.010 -8.157 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -14.182 0.662 -7.202 1.00 0.00 H new ATOM 1924 N SER A 134 -10.935 0.167 -12.180 1.00 0.00 N ATOM 1925 CA SER A 134 -9.546 -0.264 -12.249 1.00 0.00 C ATOM 1926 C SER A 134 -8.565 0.908 -12.336 1.00 0.00 C ATOM 1927 O SER A 134 -7.624 0.985 -11.550 1.00 0.00 O ATOM 1928 CB SER A 134 -9.345 -1.232 -13.419 1.00 0.00 C ATOM 1929 OG SER A 134 -10.414 -2.156 -13.441 1.00 0.00 O ATOM 0 H SER A 134 -11.552 -0.428 -12.732 1.00 0.00 H new ATOM 0 HA SER A 134 -9.326 -0.783 -11.316 1.00 0.00 H new ATOM 0 HB2 SER A 134 -9.303 -0.682 -14.359 1.00 0.00 H new ATOM 0 HB3 SER A 134 -8.396 -1.757 -13.314 1.00 0.00 H new ATOM 0 HG SER A 134 -11.153 -1.789 -13.969 1.00 0.00 H new ATOM 1935 N THR A 135 -8.796 1.819 -13.281 1.00 0.00 N ATOM 1936 CA THR A 135 -7.922 2.937 -13.594 1.00 0.00 C ATOM 1937 C THR A 135 -7.788 3.898 -12.398 1.00 0.00 C ATOM 1938 O THR A 135 -6.811 4.650 -12.320 1.00 0.00 O ATOM 1939 CB THR A 135 -8.482 3.602 -14.863 1.00 0.00 C ATOM 1940 OG1 THR A 135 -8.746 2.594 -15.822 1.00 0.00 O ATOM 1941 CG2 THR A 135 -7.528 4.588 -15.528 1.00 0.00 C ATOM 0 H THR A 135 -9.629 1.793 -13.868 1.00 0.00 H new ATOM 0 HA THR A 135 -6.902 2.604 -13.788 1.00 0.00 H new ATOM 0 HB THR A 135 -9.368 4.151 -14.545 1.00 0.00 H new ATOM 0 HG1 THR A 135 -9.617 2.186 -15.636 1.00 0.00 H new ATOM 0 HG21 THR A 135 -8.001 5.011 -16.414 1.00 0.00 H new ATOM 0 HG22 THR A 135 -7.287 5.389 -14.829 1.00 0.00 H new ATOM 0 HG23 THR A 135 -6.613 4.071 -15.817 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.736 3.845 -11.454 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.750 4.594 -10.212 1.00 0.00 C ATOM 1951 C LYS A 136 -8.361 3.713 -9.021 1.00 0.00 C ATOM 1952 O LYS A 136 -7.749 4.241 -8.095 1.00 0.00 O ATOM 1953 CB LYS A 136 -10.158 5.166 -10.010 1.00 0.00 C ATOM 1954 CG LYS A 136 -10.292 6.064 -8.778 1.00 0.00 C ATOM 1955 CD LYS A 136 -11.698 6.680 -8.697 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.817 5.640 -8.515 1.00 0.00 C ATOM 1957 NZ LYS A 136 -14.150 6.276 -8.478 1.00 0.00 N ATOM 0 H LYS A 136 -9.554 3.243 -11.551 1.00 0.00 H new ATOM 0 HA LYS A 136 -8.017 5.398 -10.271 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.438 5.737 -10.895 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.866 4.341 -9.925 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -10.093 5.484 -7.877 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -9.545 6.857 -8.818 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.730 7.384 -7.866 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.888 7.251 -9.606 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.780 4.918 -9.331 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.652 5.085 -7.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.880 5.546 -8.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -14.193 6.946 -7.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -14.317 6.785 -9.370 1.00 0.00 H new ATOM 1971 N THR A 137 -8.746 2.424 -8.988 1.00 0.00 N ATOM 1972 CA THR A 137 -8.615 1.630 -7.754 1.00 0.00 C ATOM 1973 C THR A 137 -7.819 0.349 -7.963 1.00 0.00 C ATOM 1974 O THR A 137 -7.014 -0.037 -7.115 1.00 0.00 O ATOM 1975 CB THR A 137 -9.970 1.348 -7.056 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.397 0.000 -7.189 1.00 0.00 O ATOM 1977 CG2 THR A 137 -11.126 2.247 -7.489 1.00 0.00 C ATOM 0 H THR A 137 -9.141 1.920 -9.782 1.00 0.00 H new ATOM 0 HA THR A 137 -8.043 2.259 -7.072 1.00 0.00 H new ATOM 0 HB THR A 137 -9.739 1.573 -6.015 1.00 0.00 H new ATOM 0 HG1 THR A 137 -11.202 -0.035 -7.746 1.00 0.00 H new ATOM 0 HG21 THR A 137 -12.027 1.969 -6.943 1.00 0.00 H new ATOM 0 HG22 THR A 137 -10.878 3.287 -7.275 1.00 0.00 H new ATOM 0 HG23 THR A 137 -11.299 2.128 -8.559 1.00 0.00 H new ATOM 1985 N GLY A 138 -8.132 -0.344 -9.054 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.675 -1.686 -9.344 1.00 0.00 C ATOM 1987 C GLY A 138 -8.815 -2.701 -9.334 1.00 0.00 C ATOM 1988 O GLY A 138 -8.551 -3.880 -9.498 1.00 0.00 O ATOM 0 H GLY A 138 -8.735 0.035 -9.784 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.189 -1.699 -10.319 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.925 -1.979 -8.610 1.00 0.00 H new ATOM 1992 N ASN A 139 -10.070 -2.285 -9.129 1.00 0.00 N ATOM 1993 CA ASN A 139 -11.204 -3.214 -9.146 1.00 0.00 C ATOM 1994 C ASN A 139 -11.088 -4.238 -8.010 1.00 0.00 C ATOM 1995 O ASN A 139 -11.552 -5.370 -8.112 1.00 0.00 O ATOM 1996 CB ASN A 139 -11.334 -3.879 -10.529 1.00 0.00 C ATOM 1997 CG ASN A 139 -12.746 -4.375 -10.827 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -13.485 -3.730 -11.564 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -13.135 -5.516 -10.271 1.00 0.00 N ATOM 0 H ASN A 139 -10.325 -1.314 -8.950 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.123 -2.654 -8.971 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -11.037 -3.165 -11.297 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -10.641 -4.718 -10.588 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -14.071 -5.879 -10.452 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -12.498 -6.030 -9.662 1.00 0.00 H new ATOM 2006 N ALA A 140 -10.465 -3.814 -6.908 1.00 0.00 N ATOM 2007 CA ALA A 140 -10.218 -4.665 -5.761 1.00 0.00 C ATOM 2008 C ALA A 140 -11.504 -4.867 -4.971 1.00 0.00 C ATOM 2009 O ALA A 140 -11.922 -5.994 -4.717 1.00 0.00 O ATOM 2010 CB ALA A 140 -9.134 -4.025 -4.892 1.00 0.00 C ATOM 0 H ALA A 140 -10.118 -2.861 -6.794 1.00 0.00 H new ATOM 0 HA ALA A 140 -9.874 -5.645 -6.093 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -8.941 -4.658 -4.026 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -8.218 -3.917 -5.473 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -9.469 -3.044 -4.556 1.00 0.00 H new ATOM 2016 N GLY A 141 -12.111 -3.756 -4.553 1.00 0.00 N ATOM 2017 CA GLY A 141 -13.278 -3.750 -3.694 1.00 0.00 C ATOM 2018 C GLY A 141 -13.035 -2.797 -2.533 1.00 0.00 C ATOM 2019 O GLY A 141 -12.267 -1.834 -2.660 1.00 0.00 O ATOM 0 H GLY A 141 -11.793 -2.822 -4.811 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.158 -3.440 -4.257 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.476 -4.755 -3.321 1.00 0.00 H new ATOM 2023 N SER A 142 -13.695 -3.059 -1.406 1.00 0.00 N ATOM 2024 CA SER A 142 -13.705 -2.134 -0.285 1.00 0.00 C ATOM 2025 C SER A 142 -12.337 -2.051 0.401 1.00 0.00 C ATOM 2026 O SER A 142 -11.363 -2.683 -0.008 1.00 0.00 O ATOM 2027 CB SER A 142 -14.844 -2.522 0.663 1.00 0.00 C ATOM 2028 OG SER A 142 -16.074 -2.241 0.024 1.00 0.00 O ATOM 0 H SER A 142 -14.232 -3.912 -1.249 1.00 0.00 H new ATOM 0 HA SER A 142 -13.894 -1.122 -0.643 1.00 0.00 H new ATOM 0 HB2 SER A 142 -14.782 -3.580 0.917 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.766 -1.965 1.597 1.00 0.00 H new ATOM 0 HG SER A 142 -16.814 -2.486 0.618 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.253 -1.204 1.424 1.00 0.00 N ATOM 2035 CA ARG A 143 -11.052 -0.928 2.192 1.00 0.00 C ATOM 2036 C ARG A 143 -11.138 -1.686 3.519 1.00 0.00 C ATOM 2037 O ARG A 143 -11.662 -1.145 4.487 1.00 0.00 O ATOM 2038 CB ARG A 143 -10.967 0.591 2.407 1.00 0.00 C ATOM 2039 CG ARG A 143 -10.844 1.337 1.069 1.00 0.00 C ATOM 2040 CD ARG A 143 -11.021 2.847 1.269 1.00 0.00 C ATOM 2041 NE ARG A 143 -12.443 3.217 1.416 1.00 0.00 N ATOM 2042 CZ ARG A 143 -13.315 3.369 0.403 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -12.932 3.093 -0.849 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -14.564 3.783 0.641 1.00 0.00 N ATOM 0 H ARG A 143 -13.058 -0.670 1.751 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.152 -1.258 1.673 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.854 0.936 2.938 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -10.108 0.824 3.036 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -9.869 1.136 0.624 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -11.595 0.968 0.371 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -10.470 3.164 2.154 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -10.593 3.379 0.419 1.00 0.00 H new ATOM 0 HE ARG A 143 -12.792 3.370 2.362 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -11.982 2.769 -1.032 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -13.590 3.207 -1.620 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -14.861 3.986 1.596 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -15.220 3.896 -0.132 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.638 -2.930 3.561 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.598 -3.738 4.785 1.00 0.00 C ATOM 2060 C LEU A 144 -10.021 -2.929 5.947 1.00 0.00 C ATOM 2061 O LEU A 144 -10.604 -2.889 7.025 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.742 -5.007 4.585 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.460 -6.299 4.136 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -10.731 -7.203 5.343 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.800 -6.054 3.433 1.00 0.00 C ATOM 0 H LEU A 144 -10.250 -3.403 2.745 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.622 -4.030 5.016 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.972 -4.779 3.848 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.231 -5.217 5.525 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.784 -6.768 3.421 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.237 -8.110 5.012 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.787 -7.468 5.819 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -11.362 -6.676 6.058 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -12.242 -7.009 3.149 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.475 -5.529 4.109 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -11.638 -5.449 2.541 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.860 -2.309 5.729 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.188 -1.504 6.731 1.00 0.00 C ATOM 2079 C ALA A 145 -7.491 -0.331 6.062 1.00 0.00 C ATOM 2080 O ALA A 145 -7.242 -0.356 4.854 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.214 -2.372 7.533 1.00 0.00 C ATOM 0 H ALA A 145 -8.361 -2.357 4.841 1.00 0.00 H new ATOM 0 HA ALA A 145 -8.917 -1.100 7.433 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.714 -1.759 8.283 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.763 -3.174 8.027 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.471 -2.801 6.861 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.205 0.695 6.863 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.639 1.959 6.429 1.00 0.00 C ATOM 2089 C CYS A 146 -5.933 2.569 7.628 1.00 0.00 C ATOM 2090 O CYS A 146 -6.368 2.373 8.763 1.00 0.00 O ATOM 2091 CB CYS A 146 -7.744 2.866 5.864 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.099 3.296 6.985 1.00 0.00 S ATOM 0 H CYS A 146 -7.370 0.661 7.869 1.00 0.00 H new ATOM 0 HA CYS A 146 -5.918 1.824 5.623 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.281 3.791 5.520 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.170 2.377 4.988 1.00 0.00 H new ATOM 2097 N GLY A 147 -4.796 3.235 7.416 1.00 0.00 N ATOM 2098 CA GLY A 147 -4.012 3.772 8.518 1.00 0.00 C ATOM 2099 C GLY A 147 -3.055 4.848 8.030 1.00 0.00 C ATOM 2100 O GLY A 147 -2.505 4.735 6.936 1.00 0.00 O ATOM 0 H GLY A 147 -4.403 3.412 6.492 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.678 4.188 9.274 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.450 2.969 8.995 1.00 0.00 H new ATOM 2104 N VAL A 148 -2.869 5.898 8.833 1.00 0.00 N ATOM 2105 CA VAL A 148 -1.995 7.009 8.496 1.00 0.00 C ATOM 2106 C VAL A 148 -0.568 6.707 8.964 1.00 0.00 C ATOM 2107 O VAL A 148 -0.370 6.143 10.040 1.00 0.00 O ATOM 2108 CB VAL A 148 -2.551 8.337 9.041 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -3.987 8.561 8.546 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -2.523 8.434 10.571 1.00 0.00 C ATOM 0 H VAL A 148 -3.326 5.996 9.739 1.00 0.00 H new ATOM 0 HA VAL A 148 -1.957 7.129 7.413 1.00 0.00 H new ATOM 0 HB VAL A 148 -1.890 9.115 8.659 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -4.365 9.504 8.941 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -3.995 8.594 7.457 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -4.622 7.744 8.889 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -2.930 9.396 10.882 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -3.124 7.631 10.998 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.495 8.344 10.923 1.00 0.00 H new ATOM 2120 N ILE A 149 0.426 7.043 8.142 1.00 0.00 N ATOM 2121 CA ILE A 149 1.832 6.805 8.454 1.00 0.00 C ATOM 2122 C ILE A 149 2.320 7.870 9.453 1.00 0.00 C ATOM 2123 O ILE A 149 1.887 9.020 9.378 1.00 0.00 O ATOM 2124 CB ILE A 149 2.636 6.804 7.141 1.00 0.00 C ATOM 2125 CG1 ILE A 149 2.123 5.766 6.119 1.00 0.00 C ATOM 2126 CG2 ILE A 149 4.127 6.555 7.409 1.00 0.00 C ATOM 2127 CD1 ILE A 149 2.387 6.191 4.675 1.00 0.00 C ATOM 0 H ILE A 149 0.276 7.490 7.237 1.00 0.00 H new ATOM 0 HA ILE A 149 1.973 5.834 8.929 1.00 0.00 H new ATOM 0 HB ILE A 149 2.497 7.794 6.707 1.00 0.00 H new ATOM 0 HG12 ILE A 149 2.605 4.807 6.306 1.00 0.00 H new ATOM 0 HG13 ILE A 149 1.053 5.618 6.261 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.672 6.559 6.465 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.516 7.341 8.056 1.00 0.00 H new ATOM 0 HG23 ILE A 149 4.253 5.588 7.896 1.00 0.00 H new ATOM 0 HD11 ILE A 149 2.008 5.428 3.996 1.00 0.00 H new ATOM 0 HD12 ILE A 149 1.883 7.137 4.476 1.00 0.00 H new ATOM 0 HD13 ILE A 149 3.459 6.312 4.522 1.00 0.00 H new ATOM 2139 N GLY A 150 3.213 7.510 10.382 1.00 0.00 N ATOM 2140 CA GLY A 150 3.704 8.363 11.453 1.00 0.00 C ATOM 2141 C GLY A 150 5.139 7.977 11.816 1.00 0.00 C ATOM 2142 O GLY A 150 5.703 7.045 11.246 1.00 0.00 O ATOM 0 H GLY A 150 3.626 6.577 10.403 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.667 9.407 11.143 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.061 8.268 12.328 1.00 0.00 H new ATOM 2146 N ILE A 151 5.746 8.712 12.748 1.00 0.00 N ATOM 2147 CA ILE A 151 7.083 8.470 13.255 1.00 0.00 C ATOM 2148 C ILE A 151 7.056 7.240 14.164 1.00 0.00 C ATOM 2149 O ILE A 151 6.077 7.003 14.872 1.00 0.00 O ATOM 2150 CB ILE A 151 7.574 9.720 14.005 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.367 10.990 13.154 1.00 0.00 C ATOM 2152 CG2 ILE A 151 9.058 9.578 14.378 1.00 0.00 C ATOM 2153 CD1 ILE A 151 6.236 11.877 13.686 1.00 0.00 C ATOM 0 H ILE A 151 5.298 9.519 13.182 1.00 0.00 H new ATOM 0 HA ILE A 151 7.776 8.274 12.437 1.00 0.00 H new ATOM 0 HB ILE A 151 6.987 9.814 14.918 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.294 11.563 13.132 1.00 0.00 H new ATOM 0 HG13 ILE A 151 7.146 10.702 12.126 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.387 10.472 14.908 1.00 0.00 H new ATOM 0 HG22 ILE A 151 9.190 8.707 15.019 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.651 9.455 13.472 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.134 12.756 13.050 1.00 0.00 H new ATOM 0 HD12 ILE A 151 5.301 11.316 13.683 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.468 12.190 14.704 1.00 0.00 H new ATOM 2165 N ALA A 152 8.119 6.438 14.120 1.00 0.00 N ATOM 2166 CA ALA A 152 8.209 5.209 14.892 1.00 0.00 C ATOM 2167 C ALA A 152 8.760 5.460 16.295 1.00 0.00 C ATOM 2168 O ALA A 152 9.973 5.424 16.496 1.00 0.00 O ATOM 2169 CB ALA A 152 9.054 4.182 14.142 1.00 0.00 C ATOM 0 H ALA A 152 8.941 6.626 13.546 1.00 0.00 H new ATOM 0 HA ALA A 152 7.202 4.811 15.015 1.00 0.00 H new ATOM 0 HB1 ALA A 152 9.116 3.265 14.727 1.00 0.00 H new ATOM 0 HB2 ALA A 152 8.594 3.967 13.178 1.00 0.00 H new ATOM 0 HB3 ALA A 152 10.056 4.581 13.985 1.00 0.00 H new ATOM 2175 N GLN A 153 7.841 5.616 17.248 1.00 0.00 N ATOM 2176 CA GLN A 153 8.109 5.668 18.679 1.00 0.00 C ATOM 2177 C GLN A 153 8.691 7.028 19.085 1.00 0.00 C ATOM 2178 O GLN A 153 9.245 7.099 20.203 1.00 0.00 O ATOM 2179 CB GLN A 153 8.978 4.471 19.119 1.00 0.00 C ATOM 2180 CG GLN A 153 8.594 3.969 20.517 1.00 0.00 C ATOM 2181 CD GLN A 153 9.452 2.794 20.977 1.00 0.00 C ATOM 2182 OE1 GLN A 153 10.223 2.221 20.212 1.00 0.00 O ATOM 2183 NE2 GLN A 153 9.317 2.400 22.241 1.00 0.00 N ATOM 2184 OXT GLN A 153 8.540 7.980 18.285 1.00 0.00 O ATOM 0 H GLN A 153 6.849 5.713 17.031 1.00 0.00 H new ATOM 0 HA GLN A 153 7.166 5.574 19.217 1.00 0.00 H new ATOM 0 HB2 GLN A 153 8.869 3.660 18.399 1.00 0.00 H new ATOM 0 HB3 GLN A 153 10.028 4.763 19.114 1.00 0.00 H new ATOM 0 HG2 GLN A 153 8.691 4.786 21.232 1.00 0.00 H new ATOM 0 HG3 GLN A 153 7.546 3.670 20.516 1.00 0.00 H new ATOM 0 HE21 GLN A 153 8.671 2.889 22.861 1.00 0.00 H new ATOM 0 HE22 GLN A 153 9.859 1.609 22.589 1.00 0.00 H new TER 2193 GLN A 153 HETATM 2194 ZN ZN A 154 -3.071 3.546 -8.223 1.00 0.00 ZN HETATM 2195 CU CU1 A 155 -6.274 2.006 -2.798 1.00 0.00 CU