USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 883 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 487 THR OG1 : rot 54:sc= 0.0944 USER MOD Set 1.2: B 488 ASN : amide:sc= 0.106 X(o=0.2,f=-0.26) USER MOD Set 2.1: A 143 CYS SG : rot -6:sc= -3.21! USER MOD Set 2.2: B 473 CYS SG : rot 69:sc= -0.328 USER MOD Set 3.1: A 119 GLN : amide:sc= 1.3 K(o=2.7,f=-4.6) USER MOD Set 3.2: B 491 LYS NZ :NH3+ 175:sc= 1.39 (180deg=0.484) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 84 MET CE :methyl 164:sc= -0.0782 (180deg=-0.495) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 ASN : amide:sc= -0.305 K(o=-0.31,f=-5.1!) USER MOD Single : A 93 LYS NZ :NH3+ -146:sc= -0.972 (180deg=-2.58!) USER MOD Single : A 94 ASN : amide:sc= -0.0183 X(o=-0.018,f=-0.021) USER MOD Single : A 98 SER OG : rot 140:sc= 0.173 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= 1.14 K(o=1.1,f=-0.0026) USER MOD Single : A 109 HIS : no HD1:sc= 0.474 K(o=0.47,f=-3.5!) USER MOD Single : A 112 GLN : amide:sc= -1.28 K(o=-1.3,f=-0.33) USER MOD Single : A 114 MET CE :methyl 140:sc= -0.107 (180deg=-0.47) USER MOD Single : A 116 ASN : amide:sc= -0.0392 K(o=-0.039,f=-1.1) USER MOD Single : A 123 LYS NZ :NH3+ 176:sc= 0.107 (180deg=0.103) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 MET CE :methyl 156:sc= -0.402 (180deg=-1.4) USER MOD Single : A 130 TYR OH : rot -48:sc= -1.34 USER MOD Single : A 131 MET CE :methyl 151:sc= -5.03! (180deg=-6.35!) USER MOD Single : A 132 GLN : amide:sc= 0.343 K(o=0.34,f=-0.26) USER MOD Single : A 142 CYS SG : rot 80:sc= -1.06 USER MOD Single : A 150 SER OG : rot 45:sc= 1.22 USER MOD Single : A 151 GLN : amide:sc= -0.949 K(o=-0.95,f=-0.055) USER MOD Single : A 152 ASN : amide:sc= -0.0237 X(o=-0.024,f=-0.19) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : B 465 HIS : no HE2:sc= -0.321 K(o=-0.32,f=-2.7!) USER MOD Single : B 468 ASN : amide:sc= -1.64! C(o=-1.6!,f=-4!) USER MOD Single : B 472 GLN : amide:sc= -3.4! K(o=-3.4!,f=-2.6) USER MOD Single : B 476 TYR OH : rot 180:sc= -0.244 USER MOD Single : B 479 LYS NZ :NH3+ 173:sc= 0.102 (180deg=0.0617) USER MOD Single : B 480 LYS NZ :NH3+ -169:sc=-0.00951 (180deg=-0.148) USER MOD Single : B 489 SER OG : rot 180:sc= -0.0102 USER MOD Single : B 492 SER OG : rot -61:sc= 0.0617 USER MOD Single : B 493 LYS NZ :NH3+ -118:sc= 0.175 (180deg=0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 81 -3.877 -22.370 6.214 1.00 0.00 N ATOM 2 CA GLY A 81 -3.274 -21.027 6.366 1.00 0.00 C ATOM 3 C GLY A 81 -3.007 -20.374 5.028 1.00 0.00 C ATOM 4 O GLY A 81 -2.872 -21.069 4.022 1.00 0.00 O ATOM 0 HA2 GLY A 81 -3.940 -20.394 6.952 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -2.340 -21.109 6.923 1.00 0.00 H new ATOM 10 N PRO A 82 -2.930 -19.035 4.983 1.00 0.00 N ATOM 11 CA PRO A 82 -2.679 -18.292 3.744 1.00 0.00 C ATOM 12 C PRO A 82 -1.283 -18.557 3.189 1.00 0.00 C ATOM 13 O PRO A 82 -0.276 -18.213 3.813 1.00 0.00 O ATOM 14 CB PRO A 82 -2.816 -16.821 4.160 1.00 0.00 C ATOM 15 CG PRO A 82 -3.499 -16.849 5.486 1.00 0.00 C ATOM 16 CD PRO A 82 -3.087 -18.134 6.133 1.00 0.00 C ATOM 0 HA PRO A 82 -3.368 -18.585 2.952 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.841 -16.340 4.230 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -3.398 -16.258 3.430 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.205 -15.994 6.095 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -4.582 -16.800 5.369 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.158 -18.026 6.693 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -3.841 -18.496 6.832 1.00 0.00 H new ATOM 24 N HIS A 83 -1.227 -19.173 2.019 1.00 0.00 N ATOM 25 CA HIS A 83 0.047 -19.491 1.389 1.00 0.00 C ATOM 26 C HIS A 83 0.536 -18.306 0.570 1.00 0.00 C ATOM 27 O HIS A 83 1.732 -18.019 0.514 1.00 0.00 O ATOM 28 CB HIS A 83 -0.089 -20.725 0.498 1.00 0.00 C ATOM 29 CG HIS A 83 -0.616 -21.927 1.216 1.00 0.00 C ATOM 30 ND1 HIS A 83 -1.873 -22.419 0.958 1.00 0.00 N ATOM 31 CD2 HIS A 83 -0.026 -22.691 2.163 1.00 0.00 C ATOM 32 CE1 HIS A 83 -2.019 -23.465 1.752 1.00 0.00 C ATOM 33 NE2 HIS A 83 -0.926 -23.668 2.500 1.00 0.00 N ATOM 0 H HIS A 83 -2.047 -19.463 1.486 1.00 0.00 H new ATOM 0 HA HIS A 83 0.776 -19.706 2.171 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -0.752 -20.490 -0.335 1.00 0.00 H new ATOM 0 HB3 HIS A 83 0.885 -20.965 0.072 1.00 0.00 H new ATOM 0 HD2 HIS A 83 0.964 -22.557 2.574 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -2.907 -24.079 1.793 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -0.790 -24.408 3.189 1.00 0.00 H new ATOM 41 N MET A 84 -0.404 -17.622 -0.058 1.00 0.00 N ATOM 42 CA MET A 84 -0.105 -16.428 -0.823 1.00 0.00 C ATOM 43 C MET A 84 -1.223 -15.417 -0.633 1.00 0.00 C ATOM 44 O MET A 84 -2.151 -15.337 -1.435 1.00 0.00 O ATOM 45 CB MET A 84 0.065 -16.764 -2.308 1.00 0.00 C ATOM 46 CG MET A 84 0.512 -15.578 -3.151 1.00 0.00 C ATOM 47 SD MET A 84 2.066 -14.861 -2.577 1.00 0.00 S ATOM 48 CE MET A 84 3.176 -16.255 -2.772 1.00 0.00 C ATOM 0 H MET A 84 -1.391 -17.878 -0.051 1.00 0.00 H new ATOM 0 HA MET A 84 0.833 -16.002 -0.466 1.00 0.00 H new ATOM 0 HB2 MET A 84 0.795 -17.567 -2.409 1.00 0.00 H new ATOM 0 HB3 MET A 84 -0.881 -17.141 -2.698 1.00 0.00 H new ATOM 0 HG2 MET A 84 0.624 -15.896 -4.187 1.00 0.00 H new ATOM 0 HG3 MET A 84 -0.264 -14.813 -3.135 1.00 0.00 H new ATOM 0 HE1 MET A 84 4.208 -15.906 -2.735 1.00 0.00 H new ATOM 0 HE2 MET A 84 3.006 -16.971 -1.968 1.00 0.00 H new ATOM 0 HE3 MET A 84 2.990 -16.737 -3.732 1.00 0.00 H new ATOM 58 N ASP A 85 -1.137 -14.656 0.446 1.00 0.00 N ATOM 59 CA ASP A 85 -2.177 -13.690 0.784 1.00 0.00 C ATOM 60 C ASP A 85 -1.939 -12.373 0.055 1.00 0.00 C ATOM 61 O ASP A 85 -2.726 -11.434 0.169 1.00 0.00 O ATOM 62 CB ASP A 85 -2.234 -13.458 2.298 1.00 0.00 C ATOM 63 CG ASP A 85 -1.243 -12.417 2.785 1.00 0.00 C ATOM 64 OD1 ASP A 85 -1.666 -11.471 3.484 1.00 0.00 O ATOM 65 OD2 ASP A 85 -0.042 -12.533 2.468 1.00 0.00 O ATOM 0 H ASP A 85 -0.359 -14.686 1.105 1.00 0.00 H new ATOM 0 HA ASP A 85 -3.136 -14.098 0.464 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -3.242 -13.146 2.573 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -2.041 -14.401 2.810 1.00 0.00 H new ATOM 70 N ARG A 86 -0.836 -12.306 -0.682 1.00 0.00 N ATOM 71 CA ARG A 86 -0.551 -11.143 -1.508 1.00 0.00 C ATOM 72 C ARG A 86 -1.624 -11.010 -2.575 1.00 0.00 C ATOM 73 O ARG A 86 -2.001 -11.992 -3.213 1.00 0.00 O ATOM 74 CB ARG A 86 0.823 -11.257 -2.173 1.00 0.00 C ATOM 75 CG ARG A 86 1.973 -11.466 -1.203 1.00 0.00 C ATOM 76 CD ARG A 86 2.074 -10.351 -0.171 1.00 0.00 C ATOM 77 NE ARG A 86 1.723 -10.819 1.171 1.00 0.00 N ATOM 78 CZ ARG A 86 2.456 -10.593 2.262 1.00 0.00 C ATOM 79 NH1 ARG A 86 3.562 -9.859 2.195 1.00 0.00 N ATOM 80 NH2 ARG A 86 2.065 -11.099 3.424 1.00 0.00 N ATOM 0 H ARG A 86 -0.129 -13.040 -0.723 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.546 -10.260 -0.869 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.804 -12.087 -2.879 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.010 -10.352 -2.750 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.844 -12.420 -0.691 1.00 0.00 H new ATOM 0 HG3 ARG A 86 2.908 -11.527 -1.760 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.089 -9.954 -0.163 1.00 0.00 H new ATOM 0 HD3 ARG A 86 1.413 -9.532 -0.455 1.00 0.00 H new ATOM 0 HE ARG A 86 0.861 -11.353 1.279 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.858 -9.462 1.303 1.00 0.00 H new ATOM 0 HH12 ARG A 86 4.115 -9.692 3.036 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.211 -11.655 3.477 1.00 0.00 H new ATOM 0 HH22 ARG A 86 2.618 -10.932 4.265 1.00 0.00 H new ATOM 94 N VAL A 87 -2.115 -9.800 -2.760 1.00 0.00 N ATOM 95 CA VAL A 87 -3.216 -9.564 -3.678 1.00 0.00 C ATOM 96 C VAL A 87 -2.710 -9.472 -5.121 1.00 0.00 C ATOM 97 O VAL A 87 -1.574 -9.058 -5.367 1.00 0.00 O ATOM 98 CB VAL A 87 -3.997 -8.289 -3.283 1.00 0.00 C ATOM 99 CG1 VAL A 87 -3.151 -7.039 -3.466 1.00 0.00 C ATOM 100 CG2 VAL A 87 -5.301 -8.187 -4.061 1.00 0.00 C ATOM 0 H VAL A 87 -1.770 -8.964 -2.288 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.900 -10.411 -3.614 1.00 0.00 H new ATOM 0 HB VAL A 87 -4.241 -8.366 -2.224 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -3.731 -6.162 -3.179 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.262 -7.107 -2.840 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.853 -6.951 -4.511 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -5.831 -7.282 -3.765 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.086 -8.149 -5.129 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -5.921 -9.057 -3.847 1.00 0.00 H new ATOM 110 N SER A 88 -3.557 -9.896 -6.054 1.00 0.00 N ATOM 111 CA SER A 88 -3.218 -9.948 -7.470 1.00 0.00 C ATOM 112 C SER A 88 -2.750 -8.593 -8.003 1.00 0.00 C ATOM 113 O SER A 88 -3.303 -7.545 -7.663 1.00 0.00 O ATOM 114 CB SER A 88 -4.435 -10.430 -8.256 1.00 0.00 C ATOM 115 OG SER A 88 -4.895 -11.676 -7.757 1.00 0.00 O ATOM 0 H SER A 88 -4.503 -10.215 -5.846 1.00 0.00 H new ATOM 0 HA SER A 88 -2.388 -10.643 -7.595 1.00 0.00 H new ATOM 0 HB2 SER A 88 -5.233 -9.690 -8.190 1.00 0.00 H new ATOM 0 HB3 SER A 88 -4.177 -10.528 -9.311 1.00 0.00 H new ATOM 0 HG SER A 88 -5.676 -11.967 -8.273 1.00 0.00 H new ATOM 121 N LEU A 89 -1.727 -8.648 -8.855 1.00 0.00 N ATOM 122 CA LEU A 89 -1.129 -7.463 -9.458 1.00 0.00 C ATOM 123 C LEU A 89 -2.165 -6.725 -10.298 1.00 0.00 C ATOM 124 O LEU A 89 -2.177 -5.500 -10.350 1.00 0.00 O ATOM 125 CB LEU A 89 0.066 -7.877 -10.334 1.00 0.00 C ATOM 126 CG LEU A 89 1.292 -6.952 -10.304 1.00 0.00 C ATOM 127 CD1 LEU A 89 0.931 -5.530 -10.700 1.00 0.00 C ATOM 128 CD2 LEU A 89 1.946 -6.976 -8.931 1.00 0.00 C ATOM 0 H LEU A 89 -1.289 -9.522 -9.146 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.780 -6.796 -8.670 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.384 -8.874 -10.028 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.278 -7.954 -11.365 1.00 0.00 H new ATOM 0 HG LEU A 89 2.006 -7.327 -11.038 1.00 0.00 H new ATOM 0 HD11 LEU A 89 1.824 -4.905 -10.667 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.523 -5.526 -11.711 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.187 -5.137 -10.007 1.00 0.00 H new ATOM 0 HD21 LEU A 89 2.813 -6.315 -8.929 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.230 -6.638 -8.181 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.264 -7.992 -8.697 1.00 0.00 H new ATOM 140 N GLN A 90 -3.039 -7.486 -10.949 1.00 0.00 N ATOM 141 CA GLN A 90 -4.114 -6.911 -11.750 1.00 0.00 C ATOM 142 C GLN A 90 -5.028 -6.059 -10.887 1.00 0.00 C ATOM 143 O GLN A 90 -5.463 -4.986 -11.297 1.00 0.00 O ATOM 144 CB GLN A 90 -4.925 -8.012 -12.428 1.00 0.00 C ATOM 145 CG GLN A 90 -4.174 -8.713 -13.542 1.00 0.00 C ATOM 146 CD GLN A 90 -4.962 -9.865 -14.129 1.00 0.00 C ATOM 147 OE1 GLN A 90 -5.727 -9.688 -15.075 1.00 0.00 O ATOM 148 NE2 GLN A 90 -4.779 -11.049 -13.574 1.00 0.00 N ATOM 0 H GLN A 90 -3.024 -8.506 -10.937 1.00 0.00 H new ATOM 0 HA GLN A 90 -3.663 -6.280 -12.516 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.221 -8.748 -11.680 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -5.841 -7.582 -12.832 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -3.943 -7.995 -14.329 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -3.223 -9.084 -13.159 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -4.134 -11.151 -12.790 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -5.282 -11.862 -13.929 1.00 0.00 H new ATOM 157 N ASN A 91 -5.298 -6.540 -9.683 1.00 0.00 N ATOM 158 CA ASN A 91 -6.118 -5.810 -8.725 1.00 0.00 C ATOM 159 C ASN A 91 -5.465 -4.478 -8.398 1.00 0.00 C ATOM 160 O ASN A 91 -6.134 -3.452 -8.279 1.00 0.00 O ATOM 161 CB ASN A 91 -6.306 -6.623 -7.439 1.00 0.00 C ATOM 162 CG ASN A 91 -7.096 -7.900 -7.655 1.00 0.00 C ATOM 163 OD1 ASN A 91 -7.028 -8.519 -8.718 1.00 0.00 O ATOM 164 ND2 ASN A 91 -7.853 -8.306 -6.650 1.00 0.00 N ATOM 0 H ASN A 91 -4.959 -7.440 -9.343 1.00 0.00 H new ATOM 0 HA ASN A 91 -7.097 -5.636 -9.171 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.328 -6.873 -7.027 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.816 -6.008 -6.698 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.406 -9.158 -6.740 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.884 -7.767 -5.785 1.00 0.00 H new ATOM 171 N LEU A 92 -4.144 -4.505 -8.290 1.00 0.00 N ATOM 172 CA LEU A 92 -3.372 -3.308 -8.006 1.00 0.00 C ATOM 173 C LEU A 92 -3.395 -2.374 -9.209 1.00 0.00 C ATOM 174 O LEU A 92 -3.462 -1.161 -9.062 1.00 0.00 O ATOM 175 CB LEU A 92 -1.929 -3.680 -7.658 1.00 0.00 C ATOM 176 CG LEU A 92 -1.783 -4.685 -6.518 1.00 0.00 C ATOM 177 CD1 LEU A 92 -0.327 -5.085 -6.351 1.00 0.00 C ATOM 178 CD2 LEU A 92 -2.328 -4.103 -5.225 1.00 0.00 C ATOM 0 H LEU A 92 -3.583 -5.350 -8.396 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.818 -2.797 -7.153 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.450 -4.089 -8.547 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.388 -2.771 -7.394 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.360 -5.576 -6.764 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.238 -5.802 -5.535 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.034 -5.539 -7.274 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.269 -4.201 -6.124 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.216 -4.832 -4.422 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.776 -3.198 -4.972 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.383 -3.861 -5.351 1.00 0.00 H new ATOM 190 N LYS A 93 -3.367 -2.956 -10.401 1.00 0.00 N ATOM 191 CA LYS A 93 -3.378 -2.184 -11.643 1.00 0.00 C ATOM 192 C LYS A 93 -4.630 -1.311 -11.771 1.00 0.00 C ATOM 193 O LYS A 93 -4.657 -0.367 -12.560 1.00 0.00 O ATOM 194 CB LYS A 93 -3.268 -3.124 -12.844 1.00 0.00 C ATOM 195 CG LYS A 93 -1.921 -3.821 -12.941 1.00 0.00 C ATOM 196 CD LYS A 93 -1.833 -4.740 -14.153 1.00 0.00 C ATOM 197 CE LYS A 93 -1.471 -3.988 -15.433 1.00 0.00 C ATOM 198 NZ LYS A 93 -2.569 -3.109 -15.921 1.00 0.00 N ATOM 0 H LYS A 93 -3.336 -3.966 -10.537 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.517 -1.516 -11.620 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -4.055 -3.876 -12.781 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.442 -2.556 -13.758 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.130 -3.073 -12.997 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.748 -4.401 -12.034 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.087 -5.512 -13.966 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.788 -5.247 -14.291 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.582 -3.384 -15.254 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -1.216 -4.708 -16.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.560 -3.087 -16.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.483 -3.479 -15.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.432 -2.146 -15.553 1.00 0.00 H new ATOM 212 N ASN A 94 -5.659 -1.620 -10.993 1.00 0.00 N ATOM 213 CA ASN A 94 -6.894 -0.842 -11.015 1.00 0.00 C ATOM 214 C ASN A 94 -6.788 0.394 -10.129 1.00 0.00 C ATOM 215 O ASN A 94 -7.578 1.328 -10.260 1.00 0.00 O ATOM 216 CB ASN A 94 -8.087 -1.688 -10.568 1.00 0.00 C ATOM 217 CG ASN A 94 -8.516 -2.701 -11.606 1.00 0.00 C ATOM 218 OD1 ASN A 94 -9.325 -2.403 -12.485 1.00 0.00 O ATOM 219 ND2 ASN A 94 -7.986 -3.910 -11.513 1.00 0.00 N ATOM 0 H ASN A 94 -5.665 -2.403 -10.339 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.051 -0.523 -12.045 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -7.831 -2.208 -9.645 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -8.927 -1.031 -10.341 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -8.245 -4.633 -12.184 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -7.319 -4.119 -10.770 1.00 0.00 H new ATOM 226 N LEU A 95 -5.808 0.398 -9.233 1.00 0.00 N ATOM 227 CA LEU A 95 -5.636 1.493 -8.279 1.00 0.00 C ATOM 228 C LEU A 95 -5.376 2.812 -8.994 1.00 0.00 C ATOM 229 O LEU A 95 -5.963 3.840 -8.655 1.00 0.00 O ATOM 230 CB LEU A 95 -4.481 1.188 -7.326 1.00 0.00 C ATOM 231 CG LEU A 95 -4.641 -0.083 -6.497 1.00 0.00 C ATOM 232 CD1 LEU A 95 -3.384 -0.352 -5.694 1.00 0.00 C ATOM 233 CD2 LEU A 95 -5.849 0.015 -5.580 1.00 0.00 C ATOM 0 H LEU A 95 -5.117 -0.347 -9.145 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.561 1.587 -7.709 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.562 1.110 -7.907 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.358 2.032 -6.647 1.00 0.00 H new ATOM 0 HG LEU A 95 -4.802 -0.917 -7.180 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.514 -1.262 -5.108 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.539 -0.474 -6.371 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.194 0.487 -5.024 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -5.941 -0.903 -5.000 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -5.725 0.861 -4.903 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -6.749 0.158 -6.178 1.00 0.00 H new ATOM 245 N GLY A 96 -4.510 2.772 -9.999 1.00 0.00 N ATOM 246 CA GLY A 96 -4.175 3.976 -10.740 1.00 0.00 C ATOM 247 C GLY A 96 -5.316 4.450 -11.617 1.00 0.00 C ATOM 248 O GLY A 96 -5.319 5.587 -12.092 1.00 0.00 O ATOM 0 H GLY A 96 -4.033 1.928 -10.315 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.905 4.767 -10.040 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.299 3.786 -11.360 1.00 0.00 H new ATOM 252 N GLU A 97 -6.296 3.580 -11.816 1.00 0.00 N ATOM 253 CA GLU A 97 -7.437 3.885 -12.664 1.00 0.00 C ATOM 254 C GLU A 97 -8.534 4.571 -11.857 1.00 0.00 C ATOM 255 O GLU A 97 -9.420 5.214 -12.416 1.00 0.00 O ATOM 256 CB GLU A 97 -7.979 2.600 -13.290 1.00 0.00 C ATOM 257 CG GLU A 97 -6.935 1.810 -14.065 1.00 0.00 C ATOM 258 CD GLU A 97 -6.411 2.558 -15.271 1.00 0.00 C ATOM 259 OE1 GLU A 97 -5.344 3.198 -15.166 1.00 0.00 O ATOM 260 OE2 GLU A 97 -7.065 2.506 -16.333 1.00 0.00 O ATOM 0 H GLU A 97 -6.322 2.650 -11.397 1.00 0.00 H new ATOM 0 HA GLU A 97 -7.112 4.561 -13.455 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.390 1.968 -12.503 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -8.802 2.851 -13.959 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -6.103 1.569 -13.403 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.369 0.864 -14.390 1.00 0.00 H new ATOM 267 N SER A 98 -8.458 4.439 -10.541 1.00 0.00 N ATOM 268 CA SER A 98 -9.463 4.999 -9.653 1.00 0.00 C ATOM 269 C SER A 98 -9.217 6.483 -9.428 1.00 0.00 C ATOM 270 O SER A 98 -8.199 6.873 -8.850 1.00 0.00 O ATOM 271 CB SER A 98 -9.458 4.264 -8.310 1.00 0.00 C ATOM 272 OG SER A 98 -10.292 4.915 -7.363 1.00 0.00 O ATOM 0 H SER A 98 -7.704 3.945 -10.063 1.00 0.00 H new ATOM 0 HA SER A 98 -10.438 4.873 -10.124 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.798 3.238 -8.453 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.439 4.211 -7.925 1.00 0.00 H new ATOM 0 HG SER A 98 -10.781 4.244 -6.842 1.00 0.00 H new ATOM 278 N ALA A 99 -10.158 7.306 -9.878 1.00 0.00 N ATOM 279 CA ALA A 99 -10.085 8.744 -9.671 1.00 0.00 C ATOM 280 C ALA A 99 -10.248 9.079 -8.193 1.00 0.00 C ATOM 281 O ALA A 99 -9.834 10.144 -7.734 1.00 0.00 O ATOM 282 CB ALA A 99 -11.144 9.454 -10.497 1.00 0.00 C ATOM 0 H ALA A 99 -10.984 6.997 -10.391 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.104 9.090 -9.997 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.075 10.529 -10.330 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -10.985 9.240 -11.554 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -12.132 9.103 -10.200 1.00 0.00 H new ATOM 288 N THR A 100 -10.845 8.157 -7.454 1.00 0.00 N ATOM 289 CA THR A 100 -11.055 8.335 -6.030 1.00 0.00 C ATOM 290 C THR A 100 -9.749 8.163 -5.261 1.00 0.00 C ATOM 291 O THR A 100 -9.429 8.957 -4.374 1.00 0.00 O ATOM 292 CB THR A 100 -12.090 7.330 -5.494 1.00 0.00 C ATOM 293 OG1 THR A 100 -13.288 7.400 -6.280 1.00 0.00 O ATOM 294 CG2 THR A 100 -12.411 7.616 -4.037 1.00 0.00 C ATOM 0 H THR A 100 -11.194 7.272 -7.822 1.00 0.00 H new ATOM 0 HA THR A 100 -11.430 9.348 -5.882 1.00 0.00 H new ATOM 0 HB THR A 100 -11.669 6.327 -5.565 1.00 0.00 H new ATOM 0 HG1 THR A 100 -13.943 6.757 -5.936 1.00 0.00 H new ATOM 0 HG21 THR A 100 -13.145 6.894 -3.678 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.501 7.536 -3.442 1.00 0.00 H new ATOM 0 HG23 THR A 100 -12.818 8.623 -3.945 1.00 0.00 H new ATOM 302 N LEU A 101 -8.987 7.141 -5.629 1.00 0.00 N ATOM 303 CA LEU A 101 -7.765 6.807 -4.912 1.00 0.00 C ATOM 304 C LEU A 101 -6.677 7.820 -5.219 1.00 0.00 C ATOM 305 O LEU A 101 -6.040 8.351 -4.313 1.00 0.00 O ATOM 306 CB LEU A 101 -7.293 5.398 -5.279 1.00 0.00 C ATOM 307 CG LEU A 101 -6.004 4.944 -4.587 1.00 0.00 C ATOM 308 CD1 LEU A 101 -6.183 4.910 -3.077 1.00 0.00 C ATOM 309 CD2 LEU A 101 -5.576 3.582 -5.103 1.00 0.00 C ATOM 0 H LEU A 101 -9.194 6.530 -6.419 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.977 6.834 -3.843 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -8.086 4.691 -5.036 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -7.144 5.351 -6.358 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.220 5.665 -4.820 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.254 4.585 -2.608 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.441 5.907 -2.719 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -6.982 4.214 -2.821 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.659 3.275 -4.601 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.361 2.853 -4.902 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.400 3.639 -6.177 1.00 0.00 H new ATOM 321 N ARG A 102 -6.488 8.103 -6.500 1.00 0.00 N ATOM 322 CA ARG A 102 -5.476 9.060 -6.932 1.00 0.00 C ATOM 323 C ARG A 102 -5.720 10.435 -6.312 1.00 0.00 C ATOM 324 O ARG A 102 -4.774 11.183 -6.072 1.00 0.00 O ATOM 325 CB ARG A 102 -5.468 9.175 -8.454 1.00 0.00 C ATOM 326 CG ARG A 102 -6.828 9.514 -9.027 1.00 0.00 C ATOM 327 CD ARG A 102 -6.743 9.946 -10.476 1.00 0.00 C ATOM 328 NE ARG A 102 -6.461 8.824 -11.370 1.00 0.00 N ATOM 329 CZ ARG A 102 -6.983 8.705 -12.591 1.00 0.00 C ATOM 330 NH1 ARG A 102 -7.805 9.635 -13.058 1.00 0.00 N ATOM 331 NH2 ARG A 102 -6.690 7.649 -13.343 1.00 0.00 N ATOM 0 H ARG A 102 -7.023 7.683 -7.261 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.506 8.695 -6.595 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -4.753 9.942 -8.752 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.123 8.234 -8.883 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.482 8.646 -8.946 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.281 10.311 -8.437 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -7.682 10.415 -10.769 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -5.963 10.700 -10.584 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.831 8.092 -11.042 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -8.039 10.444 -12.483 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -8.203 9.541 -13.993 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -6.064 6.927 -12.986 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -7.091 7.561 -14.277 1.00 0.00 H new ATOM 345 N SER A 103 -6.985 10.755 -6.037 1.00 0.00 N ATOM 346 CA SER A 103 -7.336 12.036 -5.439 1.00 0.00 C ATOM 347 C SER A 103 -6.711 12.152 -4.053 1.00 0.00 C ATOM 348 O SER A 103 -6.340 13.238 -3.612 1.00 0.00 O ATOM 349 CB SER A 103 -8.859 12.184 -5.352 1.00 0.00 C ATOM 350 OG SER A 103 -9.230 13.470 -4.882 1.00 0.00 O ATOM 0 H SER A 103 -7.780 10.143 -6.220 1.00 0.00 H new ATOM 0 HA SER A 103 -6.948 12.837 -6.068 1.00 0.00 H new ATOM 0 HB2 SER A 103 -9.299 12.014 -6.335 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.262 11.422 -4.686 1.00 0.00 H new ATOM 0 HG SER A 103 -10.207 13.533 -4.839 1.00 0.00 H new ATOM 356 N LEU A 104 -6.568 11.016 -3.387 1.00 0.00 N ATOM 357 CA LEU A 104 -5.992 10.982 -2.054 1.00 0.00 C ATOM 358 C LEU A 104 -4.481 11.164 -2.137 1.00 0.00 C ATOM 359 O LEU A 104 -3.880 11.857 -1.315 1.00 0.00 O ATOM 360 CB LEU A 104 -6.324 9.655 -1.366 1.00 0.00 C ATOM 361 CG LEU A 104 -7.788 9.219 -1.458 1.00 0.00 C ATOM 362 CD1 LEU A 104 -8.015 7.947 -0.661 1.00 0.00 C ATOM 363 CD2 LEU A 104 -8.715 10.323 -0.981 1.00 0.00 C ATOM 0 H LEU A 104 -6.844 10.104 -3.750 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.417 11.796 -1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.701 8.873 -1.801 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.050 9.732 -0.314 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.017 9.016 -2.504 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.061 7.652 -0.738 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.383 7.152 -1.057 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.763 8.123 0.385 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.749 9.988 -1.057 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.487 10.566 0.057 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.575 11.209 -1.600 1.00 0.00 H new ATOM 375 N LEU A 105 -3.881 10.564 -3.163 1.00 0.00 N ATOM 376 CA LEU A 105 -2.435 10.634 -3.376 1.00 0.00 C ATOM 377 C LEU A 105 -2.007 12.053 -3.718 1.00 0.00 C ATOM 378 O LEU A 105 -0.830 12.402 -3.622 1.00 0.00 O ATOM 379 CB LEU A 105 -2.000 9.690 -4.503 1.00 0.00 C ATOM 380 CG LEU A 105 -1.813 8.219 -4.117 1.00 0.00 C ATOM 381 CD1 LEU A 105 -3.114 7.595 -3.649 1.00 0.00 C ATOM 382 CD2 LEU A 105 -1.248 7.443 -5.292 1.00 0.00 C ATOM 0 H LEU A 105 -4.379 10.019 -3.867 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.953 10.327 -2.448 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.741 9.744 -5.300 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.061 10.058 -4.915 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.110 8.176 -3.286 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.942 6.552 -3.384 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.484 8.135 -2.777 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.852 7.649 -4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.118 6.398 -5.009 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -1.936 7.508 -6.135 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.284 7.864 -5.577 1.00 0.00 H new ATOM 394 N LEU A 106 -2.973 12.864 -4.126 1.00 0.00 N ATOM 395 CA LEU A 106 -2.722 14.256 -4.456 1.00 0.00 C ATOM 396 C LEU A 106 -2.302 15.039 -3.214 1.00 0.00 C ATOM 397 O LEU A 106 -1.711 16.113 -3.317 1.00 0.00 O ATOM 398 CB LEU A 106 -3.962 14.873 -5.091 1.00 0.00 C ATOM 399 CG LEU A 106 -4.417 14.211 -6.395 1.00 0.00 C ATOM 400 CD1 LEU A 106 -5.573 14.979 -7.002 1.00 0.00 C ATOM 401 CD2 LEU A 106 -3.266 14.109 -7.387 1.00 0.00 C ATOM 0 H LEU A 106 -3.945 12.576 -4.236 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.903 14.303 -5.174 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.781 14.828 -4.373 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.766 15.928 -5.285 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.753 13.200 -6.162 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -5.885 14.496 -7.928 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -6.408 14.993 -6.301 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -5.259 16.001 -7.214 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.617 13.635 -8.304 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.892 15.107 -7.614 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.464 13.511 -6.954 1.00 0.00 H new ATOM 413 N ASN A 107 -2.604 14.487 -2.042 1.00 0.00 N ATOM 414 CA ASN A 107 -2.145 15.067 -0.786 1.00 0.00 C ATOM 415 C ASN A 107 -0.669 14.757 -0.598 1.00 0.00 C ATOM 416 O ASN A 107 -0.273 13.587 -0.563 1.00 0.00 O ATOM 417 CB ASN A 107 -2.927 14.511 0.412 1.00 0.00 C ATOM 418 CG ASN A 107 -4.392 14.882 0.394 1.00 0.00 C ATOM 419 OD1 ASN A 107 -4.782 15.950 0.865 1.00 0.00 O ATOM 420 ND2 ASN A 107 -5.220 13.988 -0.118 1.00 0.00 N ATOM 0 H ASN A 107 -3.163 13.641 -1.937 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.309 16.144 -0.833 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.835 13.425 0.425 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.477 14.880 1.334 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.223 14.172 -0.133 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.856 13.115 -0.499 1.00 0.00 H new ATOM 427 N PRO A 108 0.169 15.799 -0.479 1.00 0.00 N ATOM 428 CA PRO A 108 1.616 15.636 -0.322 1.00 0.00 C ATOM 429 C PRO A 108 1.976 14.835 0.925 1.00 0.00 C ATOM 430 O PRO A 108 3.026 14.200 0.981 1.00 0.00 O ATOM 431 CB PRO A 108 2.147 17.069 -0.216 1.00 0.00 C ATOM 432 CG PRO A 108 0.961 17.905 0.122 1.00 0.00 C ATOM 433 CD PRO A 108 -0.222 17.219 -0.497 1.00 0.00 C ATOM 0 HA PRO A 108 2.048 15.080 -1.154 1.00 0.00 H new ATOM 0 HB2 PRO A 108 2.915 17.148 0.553 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.600 17.391 -1.154 1.00 0.00 H new ATOM 0 HG2 PRO A 108 0.840 17.992 1.202 1.00 0.00 H new ATOM 0 HG3 PRO A 108 1.073 18.917 -0.268 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -1.134 17.393 0.074 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -0.408 17.573 -1.511 1.00 0.00 H new ATOM 441 N HIS A 109 1.094 14.856 1.916 1.00 0.00 N ATOM 442 CA HIS A 109 1.313 14.100 3.139 1.00 0.00 C ATOM 443 C HIS A 109 1.160 12.600 2.893 1.00 0.00 C ATOM 444 O HIS A 109 2.018 11.810 3.285 1.00 0.00 O ATOM 445 CB HIS A 109 0.342 14.553 4.231 1.00 0.00 C ATOM 446 CG HIS A 109 0.497 13.796 5.514 1.00 0.00 C ATOM 447 ND1 HIS A 109 1.377 14.202 6.487 1.00 0.00 N ATOM 448 CD2 HIS A 109 -0.120 12.660 5.920 1.00 0.00 C ATOM 449 CE1 HIS A 109 1.277 13.307 7.457 1.00 0.00 C ATOM 450 NE2 HIS A 109 0.384 12.357 7.158 1.00 0.00 N ATOM 0 H HIS A 109 0.223 15.387 1.896 1.00 0.00 H new ATOM 0 HA HIS A 109 2.333 14.291 3.471 1.00 0.00 H new ATOM 0 HB2 HIS A 109 0.493 15.615 4.424 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -0.680 14.437 3.870 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -0.865 12.101 5.373 1.00 0.00 H new ATOM 0 HE1 HIS A 109 1.845 13.340 8.375 1.00 0.00 H new ATOM 0 HE2 HIS A 109 0.127 11.560 7.740 1.00 0.00 H new ATOM 458 N LEU A 110 0.072 12.209 2.234 1.00 0.00 N ATOM 459 CA LEU A 110 -0.226 10.803 2.038 1.00 0.00 C ATOM 460 C LEU A 110 0.815 10.141 1.143 1.00 0.00 C ATOM 461 O LEU A 110 1.208 8.996 1.371 1.00 0.00 O ATOM 462 CB LEU A 110 -1.622 10.638 1.440 1.00 0.00 C ATOM 463 CG LEU A 110 -1.996 9.202 1.087 1.00 0.00 C ATOM 464 CD1 LEU A 110 -1.965 8.315 2.322 1.00 0.00 C ATOM 465 CD2 LEU A 110 -3.363 9.153 0.433 1.00 0.00 C ATOM 0 H LEU A 110 -0.613 12.848 1.830 1.00 0.00 H new ATOM 0 HA LEU A 110 -0.197 10.311 3.010 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -2.354 11.027 2.148 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.692 11.249 0.540 1.00 0.00 H new ATOM 0 HG LEU A 110 -1.259 8.824 0.378 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -2.235 7.296 2.045 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.962 8.321 2.749 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -2.675 8.691 3.058 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -3.613 8.121 0.188 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -4.109 9.554 1.119 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -3.351 9.749 -0.479 1.00 0.00 H new ATOM 477 N ARG A 111 1.282 10.870 0.141 1.00 0.00 N ATOM 478 CA ARG A 111 2.294 10.335 -0.760 1.00 0.00 C ATOM 479 C ARG A 111 3.623 10.183 -0.027 1.00 0.00 C ATOM 480 O ARG A 111 4.431 9.318 -0.361 1.00 0.00 O ATOM 481 CB ARG A 111 2.454 11.209 -2.009 1.00 0.00 C ATOM 482 CG ARG A 111 2.918 12.627 -1.727 1.00 0.00 C ATOM 483 CD ARG A 111 3.056 13.427 -3.013 1.00 0.00 C ATOM 484 NE ARG A 111 1.814 13.440 -3.783 1.00 0.00 N ATOM 485 CZ ARG A 111 1.656 14.089 -4.936 1.00 0.00 C ATOM 486 NH1 ARG A 111 2.646 14.817 -5.438 1.00 0.00 N ATOM 487 NH2 ARG A 111 0.504 14.006 -5.585 1.00 0.00 N ATOM 0 H ARG A 111 0.982 11.822 -0.068 1.00 0.00 H new ATOM 0 HA ARG A 111 1.964 9.351 -1.094 1.00 0.00 H new ATOM 0 HB2 ARG A 111 3.168 10.733 -2.682 1.00 0.00 H new ATOM 0 HB3 ARG A 111 1.500 11.250 -2.534 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.207 13.120 -1.064 1.00 0.00 H new ATOM 0 HG3 ARG A 111 3.875 12.602 -1.207 1.00 0.00 H new ATOM 0 HD2 ARG A 111 3.346 14.450 -2.775 1.00 0.00 H new ATOM 0 HD3 ARG A 111 3.855 13.003 -3.621 1.00 0.00 H new ATOM 0 HE ARG A 111 1.018 12.919 -3.415 1.00 0.00 H new ATOM 0 HH11 ARG A 111 3.534 14.882 -4.941 1.00 0.00 H new ATOM 0 HH12 ARG A 111 2.519 15.311 -6.321 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -0.258 13.447 -5.202 1.00 0.00 H new ATOM 0 HH22 ARG A 111 0.379 14.501 -6.468 1.00 0.00 H new ATOM 501 N GLN A 112 3.836 11.017 0.987 1.00 0.00 N ATOM 502 CA GLN A 112 5.011 10.893 1.834 1.00 0.00 C ATOM 503 C GLN A 112 4.908 9.651 2.704 1.00 0.00 C ATOM 504 O GLN A 112 5.894 8.953 2.918 1.00 0.00 O ATOM 505 CB GLN A 112 5.203 12.138 2.700 1.00 0.00 C ATOM 506 CG GLN A 112 5.923 13.262 1.975 1.00 0.00 C ATOM 507 CD GLN A 112 7.321 12.863 1.531 1.00 0.00 C ATOM 508 OE1 GLN A 112 7.826 13.349 0.518 1.00 0.00 O ATOM 509 NE2 GLN A 112 7.963 11.990 2.293 1.00 0.00 N ATOM 0 H GLN A 112 3.211 11.782 1.239 1.00 0.00 H new ATOM 0 HA GLN A 112 5.883 10.797 1.187 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.229 12.495 3.034 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.768 11.869 3.593 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.340 13.561 1.104 1.00 0.00 H new ATOM 0 HG3 GLN A 112 5.987 14.131 2.630 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.511 11.610 3.125 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.909 11.698 2.048 1.00 0.00 H new ATOM 518 N LEU A 113 3.707 9.373 3.192 1.00 0.00 N ATOM 519 CA LEU A 113 3.458 8.153 3.946 1.00 0.00 C ATOM 520 C LEU A 113 3.779 6.933 3.088 1.00 0.00 C ATOM 521 O LEU A 113 4.478 6.017 3.519 1.00 0.00 O ATOM 522 CB LEU A 113 2.000 8.102 4.416 1.00 0.00 C ATOM 523 CG LEU A 113 1.602 9.171 5.439 1.00 0.00 C ATOM 524 CD1 LEU A 113 0.119 9.080 5.758 1.00 0.00 C ATOM 525 CD2 LEU A 113 2.421 9.021 6.709 1.00 0.00 C ATOM 0 H LEU A 113 2.891 9.975 3.079 1.00 0.00 H new ATOM 0 HA LEU A 113 4.104 8.147 4.824 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.352 8.197 3.545 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.810 7.120 4.849 1.00 0.00 H new ATOM 0 HG LEU A 113 1.804 10.151 5.006 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.144 9.847 6.486 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.459 9.231 4.846 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.105 8.096 6.171 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.126 9.788 7.425 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.246 8.035 7.140 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.480 9.132 6.474 1.00 0.00 H new ATOM 537 N MET A 114 3.285 6.945 1.857 1.00 0.00 N ATOM 538 CA MET A 114 3.525 5.854 0.924 1.00 0.00 C ATOM 539 C MET A 114 5.019 5.623 0.698 1.00 0.00 C ATOM 540 O MET A 114 5.502 4.500 0.853 1.00 0.00 O ATOM 541 CB MET A 114 2.814 6.131 -0.402 1.00 0.00 C ATOM 542 CG MET A 114 1.326 5.810 -0.367 1.00 0.00 C ATOM 543 SD MET A 114 0.437 6.485 -1.781 1.00 0.00 S ATOM 544 CE MET A 114 1.280 5.673 -3.135 1.00 0.00 C ATOM 0 H MET A 114 2.714 7.702 1.481 1.00 0.00 H new ATOM 0 HA MET A 114 3.118 4.942 1.361 1.00 0.00 H new ATOM 0 HB2 MET A 114 2.946 7.181 -0.664 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.287 5.544 -1.189 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.192 4.729 -0.341 1.00 0.00 H new ATOM 0 HG3 MET A 114 0.894 6.207 0.552 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.553 5.378 -3.892 1.00 0.00 H new ATOM 0 HE2 MET A 114 2.005 6.358 -3.575 1.00 0.00 H new ATOM 0 HE3 MET A 114 1.796 4.788 -2.764 1.00 0.00 H new ATOM 554 N VAL A 115 5.756 6.680 0.358 1.00 0.00 N ATOM 555 CA VAL A 115 7.185 6.538 0.080 1.00 0.00 C ATOM 556 C VAL A 115 7.962 6.129 1.332 1.00 0.00 C ATOM 557 O VAL A 115 8.959 5.423 1.242 1.00 0.00 O ATOM 558 CB VAL A 115 7.809 7.817 -0.532 1.00 0.00 C ATOM 559 CG1 VAL A 115 7.179 8.130 -1.880 1.00 0.00 C ATOM 560 CG2 VAL A 115 7.674 9.002 0.406 1.00 0.00 C ATOM 0 H VAL A 115 5.395 7.630 0.269 1.00 0.00 H new ATOM 0 HA VAL A 115 7.265 5.745 -0.663 1.00 0.00 H new ATOM 0 HB VAL A 115 8.872 7.628 -0.681 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.631 9.032 -2.292 1.00 0.00 H new ATOM 0 HG12 VAL A 115 7.345 7.296 -2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.108 8.287 -1.753 1.00 0.00 H new ATOM 0 HG21 VAL A 115 8.122 9.883 -0.054 1.00 0.00 H new ATOM 0 HG22 VAL A 115 6.619 9.192 0.603 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.184 8.783 1.344 1.00 0.00 H new ATOM 570 N ASN A 116 7.500 6.561 2.499 1.00 0.00 N ATOM 571 CA ASN A 116 8.133 6.176 3.758 1.00 0.00 C ATOM 572 C ASN A 116 8.002 4.676 3.988 1.00 0.00 C ATOM 573 O ASN A 116 8.973 4.001 4.345 1.00 0.00 O ATOM 574 CB ASN A 116 7.504 6.933 4.929 1.00 0.00 C ATOM 575 CG ASN A 116 8.018 8.350 5.077 1.00 0.00 C ATOM 576 OD1 ASN A 116 9.167 8.651 4.747 1.00 0.00 O ATOM 577 ND2 ASN A 116 7.170 9.231 5.583 1.00 0.00 N ATOM 0 H ASN A 116 6.693 7.176 2.602 1.00 0.00 H new ATOM 0 HA ASN A 116 9.190 6.433 3.696 1.00 0.00 H new ATOM 0 HB2 ASN A 116 6.422 6.959 4.796 1.00 0.00 H new ATOM 0 HB3 ASN A 116 7.698 6.386 5.852 1.00 0.00 H new ATOM 0 HD21 ASN A 116 7.459 10.201 5.713 1.00 0.00 H new ATOM 0 HD22 ASN A 116 6.228 8.940 5.843 1.00 0.00 H new ATOM 584 N LEU A 117 6.799 4.164 3.768 1.00 0.00 N ATOM 585 CA LEU A 117 6.508 2.750 3.965 1.00 0.00 C ATOM 586 C LEU A 117 7.261 1.885 2.956 1.00 0.00 C ATOM 587 O LEU A 117 7.777 0.821 3.302 1.00 0.00 O ATOM 588 CB LEU A 117 5.001 2.510 3.842 1.00 0.00 C ATOM 589 CG LEU A 117 4.544 1.070 4.068 1.00 0.00 C ATOM 590 CD1 LEU A 117 4.812 0.641 5.503 1.00 0.00 C ATOM 591 CD2 LEU A 117 3.068 0.923 3.730 1.00 0.00 C ATOM 0 H LEU A 117 6.001 4.713 3.450 1.00 0.00 H new ATOM 0 HA LEU A 117 6.841 2.468 4.964 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.489 3.152 4.559 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.681 2.823 2.848 1.00 0.00 H new ATOM 0 HG LEU A 117 5.115 0.419 3.406 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.479 -0.387 5.643 1.00 0.00 H new ATOM 0 HD12 LEU A 117 5.880 0.708 5.709 1.00 0.00 H new ATOM 0 HD13 LEU A 117 4.269 1.294 6.186 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.758 -0.109 3.896 1.00 0.00 H new ATOM 0 HD22 LEU A 117 2.481 1.585 4.366 1.00 0.00 H new ATOM 0 HD23 LEU A 117 2.906 1.187 2.685 1.00 0.00 H new ATOM 603 N ASP A 118 7.325 2.354 1.715 1.00 0.00 N ATOM 604 CA ASP A 118 7.990 1.619 0.638 1.00 0.00 C ATOM 605 C ASP A 118 9.481 1.450 0.906 1.00 0.00 C ATOM 606 O ASP A 118 10.045 0.380 0.675 1.00 0.00 O ATOM 607 CB ASP A 118 7.785 2.338 -0.695 1.00 0.00 C ATOM 608 CG ASP A 118 8.602 1.733 -1.822 1.00 0.00 C ATOM 609 OD1 ASP A 118 8.133 0.760 -2.447 1.00 0.00 O ATOM 610 OD2 ASP A 118 9.713 2.234 -2.093 1.00 0.00 O ATOM 0 H ASP A 118 6.923 3.245 1.426 1.00 0.00 H new ATOM 0 HA ASP A 118 7.541 0.627 0.593 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.728 2.306 -0.961 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.054 3.388 -0.581 1.00 0.00 H new ATOM 615 N GLN A 119 10.110 2.506 1.406 1.00 0.00 N ATOM 616 CA GLN A 119 11.549 2.489 1.660 1.00 0.00 C ATOM 617 C GLN A 119 11.877 1.552 2.804 1.00 0.00 C ATOM 618 O GLN A 119 12.964 0.977 2.874 1.00 0.00 O ATOM 619 CB GLN A 119 12.049 3.888 1.983 1.00 0.00 C ATOM 620 CG GLN A 119 11.796 4.869 0.864 1.00 0.00 C ATOM 621 CD GLN A 119 12.260 6.263 1.185 1.00 0.00 C ATOM 622 OE1 GLN A 119 13.406 6.626 0.929 1.00 0.00 O ATOM 623 NE2 GLN A 119 11.374 7.060 1.739 1.00 0.00 N ATOM 0 H GLN A 119 9.649 3.384 1.644 1.00 0.00 H new ATOM 0 HA GLN A 119 12.048 2.133 0.758 1.00 0.00 H new ATOM 0 HB2 GLN A 119 11.560 4.244 2.890 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.118 3.848 2.191 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.303 4.522 -0.037 1.00 0.00 H new ATOM 0 HG3 GLN A 119 10.729 4.890 0.641 1.00 0.00 H new ATOM 0 HE21 GLN A 119 10.433 6.719 1.935 1.00 0.00 H new ATOM 0 HE22 GLN A 119 11.627 8.020 1.973 1.00 0.00 H new ATOM 632 N GLY A 120 10.918 1.422 3.698 1.00 0.00 N ATOM 633 CA GLY A 120 11.031 0.466 4.781 1.00 0.00 C ATOM 634 C GLY A 120 11.829 0.993 5.952 1.00 0.00 C ATOM 635 O GLY A 120 12.457 0.215 6.669 1.00 0.00 O ATOM 0 H GLY A 120 10.054 1.964 3.697 1.00 0.00 H new ATOM 0 HA2 GLY A 120 10.033 0.192 5.122 1.00 0.00 H new ATOM 0 HA3 GLY A 120 11.501 -0.444 4.408 1.00 0.00 H new ATOM 639 N GLU A 121 11.786 2.311 6.150 1.00 0.00 N ATOM 640 CA GLU A 121 12.534 2.967 7.225 1.00 0.00 C ATOM 641 C GLU A 121 12.238 2.292 8.561 1.00 0.00 C ATOM 642 O GLU A 121 13.146 1.857 9.272 1.00 0.00 O ATOM 643 CB GLU A 121 12.144 4.445 7.303 1.00 0.00 C ATOM 644 CG GLU A 121 12.223 5.175 5.970 1.00 0.00 C ATOM 645 CD GLU A 121 13.629 5.244 5.417 1.00 0.00 C ATOM 646 OE1 GLU A 121 14.293 6.290 5.593 1.00 0.00 O ATOM 647 OE2 GLU A 121 14.076 4.266 4.794 1.00 0.00 O ATOM 0 H GLU A 121 11.237 2.950 5.575 1.00 0.00 H new ATOM 0 HA GLU A 121 13.600 2.883 7.011 1.00 0.00 H new ATOM 0 HB2 GLU A 121 11.128 4.522 7.689 1.00 0.00 H new ATOM 0 HB3 GLU A 121 12.796 4.945 8.019 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.579 4.673 5.248 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.837 6.187 6.093 1.00 0.00 H new ATOM 654 N ASP A 122 10.959 2.210 8.884 1.00 0.00 N ATOM 655 CA ASP A 122 10.490 1.466 10.044 1.00 0.00 C ATOM 656 C ASP A 122 9.048 1.071 9.802 1.00 0.00 C ATOM 657 O ASP A 122 8.132 1.548 10.471 1.00 0.00 O ATOM 658 CB ASP A 122 10.612 2.300 11.326 1.00 0.00 C ATOM 659 CG ASP A 122 10.569 1.452 12.588 1.00 0.00 C ATOM 660 OD1 ASP A 122 11.459 1.626 13.453 1.00 0.00 O ATOM 661 OD2 ASP A 122 9.667 0.598 12.717 1.00 0.00 O ATOM 0 H ASP A 122 10.214 2.657 8.350 1.00 0.00 H new ATOM 0 HA ASP A 122 11.106 0.577 10.180 1.00 0.00 H new ATOM 0 HB2 ASP A 122 11.547 2.860 11.302 1.00 0.00 H new ATOM 0 HB3 ASP A 122 9.804 3.030 11.357 1.00 0.00 H new ATOM 666 N LYS A 123 8.860 0.209 8.810 1.00 0.00 N ATOM 667 CA LYS A 123 7.531 -0.233 8.407 1.00 0.00 C ATOM 668 C LYS A 123 6.772 -0.839 9.581 1.00 0.00 C ATOM 669 O LYS A 123 5.545 -0.792 9.615 1.00 0.00 O ATOM 670 CB LYS A 123 7.606 -1.246 7.254 1.00 0.00 C ATOM 671 CG LYS A 123 8.452 -2.474 7.555 1.00 0.00 C ATOM 672 CD LYS A 123 9.907 -2.270 7.166 1.00 0.00 C ATOM 673 CE LYS A 123 10.844 -2.689 8.283 1.00 0.00 C ATOM 674 NZ LYS A 123 12.256 -2.786 7.819 1.00 0.00 N ATOM 0 H LYS A 123 9.619 -0.201 8.266 1.00 0.00 H new ATOM 0 HA LYS A 123 6.990 0.648 8.060 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.596 -1.568 7.002 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.010 -0.747 6.373 1.00 0.00 H new ATOM 0 HG2 LYS A 123 8.390 -2.706 8.618 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.050 -3.333 7.017 1.00 0.00 H new ATOM 0 HD2 LYS A 123 10.129 -2.846 6.268 1.00 0.00 H new ATOM 0 HD3 LYS A 123 10.076 -1.221 6.922 1.00 0.00 H new ATOM 0 HE2 LYS A 123 10.779 -1.970 9.100 1.00 0.00 H new ATOM 0 HE3 LYS A 123 10.526 -3.653 8.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 12.872 -3.009 8.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 12.336 -3.538 7.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 12.547 -1.879 7.401 1.00 0.00 H new ATOM 688 N ALA A 124 7.506 -1.386 10.547 1.00 0.00 N ATOM 689 CA ALA A 124 6.887 -1.985 11.716 1.00 0.00 C ATOM 690 C ALA A 124 6.070 -0.946 12.479 1.00 0.00 C ATOM 691 O ALA A 124 4.918 -1.186 12.846 1.00 0.00 O ATOM 692 CB ALA A 124 7.932 -2.610 12.625 1.00 0.00 C ATOM 0 H ALA A 124 8.525 -1.425 10.540 1.00 0.00 H new ATOM 0 HA ALA A 124 6.217 -2.775 11.377 1.00 0.00 H new ATOM 0 HB1 ALA A 124 7.442 -3.051 13.493 1.00 0.00 H new ATOM 0 HB2 ALA A 124 8.472 -3.384 12.080 1.00 0.00 H new ATOM 0 HB3 ALA A 124 8.633 -1.843 12.955 1.00 0.00 H new ATOM 698 N LYS A 125 6.675 0.213 12.701 1.00 0.00 N ATOM 699 CA LYS A 125 6.015 1.316 13.364 1.00 0.00 C ATOM 700 C LYS A 125 5.023 1.992 12.425 1.00 0.00 C ATOM 701 O LYS A 125 3.906 2.329 12.819 1.00 0.00 O ATOM 702 CB LYS A 125 7.075 2.315 13.807 1.00 0.00 C ATOM 703 CG LYS A 125 6.550 3.472 14.627 1.00 0.00 C ATOM 704 CD LYS A 125 7.691 4.380 15.033 1.00 0.00 C ATOM 705 CE LYS A 125 8.171 5.242 13.874 1.00 0.00 C ATOM 706 NZ LYS A 125 9.311 6.113 14.266 1.00 0.00 N ATOM 0 H LYS A 125 7.637 0.409 12.424 1.00 0.00 H new ATOM 0 HA LYS A 125 5.462 0.945 14.227 1.00 0.00 H new ATOM 0 HB2 LYS A 125 7.831 1.788 14.390 1.00 0.00 H new ATOM 0 HB3 LYS A 125 7.574 2.711 12.922 1.00 0.00 H new ATOM 0 HG2 LYS A 125 5.815 4.034 14.050 1.00 0.00 H new ATOM 0 HG3 LYS A 125 6.039 3.097 15.514 1.00 0.00 H new ATOM 0 HD2 LYS A 125 7.370 5.021 15.854 1.00 0.00 H new ATOM 0 HD3 LYS A 125 8.520 3.777 15.405 1.00 0.00 H new ATOM 0 HE2 LYS A 125 8.472 4.601 13.045 1.00 0.00 H new ATOM 0 HE3 LYS A 125 7.348 5.860 13.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 9.608 6.684 13.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 9.017 6.742 15.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 10.106 5.522 14.583 1.00 0.00 H new ATOM 720 N LEU A 126 5.442 2.170 11.175 1.00 0.00 N ATOM 721 CA LEU A 126 4.647 2.887 10.184 1.00 0.00 C ATOM 722 C LEU A 126 3.281 2.236 9.986 1.00 0.00 C ATOM 723 O LEU A 126 2.272 2.924 9.948 1.00 0.00 O ATOM 724 CB LEU A 126 5.390 2.965 8.847 1.00 0.00 C ATOM 725 CG LEU A 126 6.763 3.644 8.896 1.00 0.00 C ATOM 726 CD1 LEU A 126 7.428 3.613 7.529 1.00 0.00 C ATOM 727 CD2 LEU A 126 6.659 5.072 9.407 1.00 0.00 C ATOM 0 H LEU A 126 6.335 1.824 10.823 1.00 0.00 H new ATOM 0 HA LEU A 126 4.490 3.898 10.561 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.518 1.953 8.462 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.764 3.501 8.134 1.00 0.00 H new ATOM 0 HG LEU A 126 7.383 3.084 9.596 1.00 0.00 H new ATOM 0 HD11 LEU A 126 8.401 4.100 7.587 1.00 0.00 H new ATOM 0 HD12 LEU A 126 7.558 2.579 7.211 1.00 0.00 H new ATOM 0 HD13 LEU A 126 6.802 4.138 6.808 1.00 0.00 H new ATOM 0 HD21 LEU A 126 7.651 5.524 9.429 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.012 5.649 8.746 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.239 5.069 10.413 1.00 0.00 H new ATOM 739 N MET A 127 3.245 0.912 9.886 1.00 0.00 N ATOM 740 CA MET A 127 1.983 0.193 9.685 1.00 0.00 C ATOM 741 C MET A 127 0.940 0.595 10.726 1.00 0.00 C ATOM 742 O MET A 127 -0.244 0.721 10.420 1.00 0.00 O ATOM 743 CB MET A 127 2.205 -1.317 9.758 1.00 0.00 C ATOM 744 CG MET A 127 2.865 -1.924 8.527 1.00 0.00 C ATOM 745 SD MET A 127 1.682 -2.652 7.370 1.00 0.00 S ATOM 746 CE MET A 127 0.886 -1.203 6.684 1.00 0.00 C ATOM 0 H MET A 127 4.069 0.313 9.940 1.00 0.00 H new ATOM 0 HA MET A 127 1.614 0.461 8.695 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.821 -1.538 10.630 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.243 -1.805 9.915 1.00 0.00 H new ATOM 0 HG2 MET A 127 3.439 -1.153 8.013 1.00 0.00 H new ATOM 0 HG3 MET A 127 3.573 -2.690 8.843 1.00 0.00 H new ATOM 0 HE1 MET A 127 0.473 -1.444 5.704 1.00 0.00 H new ATOM 0 HE2 MET A 127 0.083 -0.881 7.347 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.616 -0.400 6.582 1.00 0.00 H new ATOM 756 N ARG A 128 1.393 0.807 11.952 1.00 0.00 N ATOM 757 CA ARG A 128 0.505 1.187 13.040 1.00 0.00 C ATOM 758 C ARG A 128 0.263 2.692 13.041 1.00 0.00 C ATOM 759 O ARG A 128 -0.867 3.148 13.215 1.00 0.00 O ATOM 760 CB ARG A 128 1.108 0.745 14.375 1.00 0.00 C ATOM 761 CG ARG A 128 1.268 -0.762 14.499 1.00 0.00 C ATOM 762 CD ARG A 128 -0.080 -1.462 14.558 1.00 0.00 C ATOM 763 NE ARG A 128 -0.819 -1.115 15.771 1.00 0.00 N ATOM 764 CZ ARG A 128 -2.147 -1.093 15.866 1.00 0.00 C ATOM 765 NH1 ARG A 128 -2.901 -1.377 14.809 1.00 0.00 N ATOM 766 NH2 ARG A 128 -2.722 -0.786 17.021 1.00 0.00 N ATOM 0 H ARG A 128 2.374 0.722 12.219 1.00 0.00 H new ATOM 0 HA ARG A 128 -0.455 0.691 12.898 1.00 0.00 H new ATOM 0 HB2 ARG A 128 2.083 1.217 14.498 1.00 0.00 H new ATOM 0 HB3 ARG A 128 0.475 1.103 15.187 1.00 0.00 H new ATOM 0 HG2 ARG A 128 1.838 -1.139 13.650 1.00 0.00 H new ATOM 0 HG3 ARG A 128 1.840 -0.996 15.397 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -0.670 -1.190 13.683 1.00 0.00 H new ATOM 0 HD3 ARG A 128 0.069 -2.541 14.519 1.00 0.00 H new ATOM 0 HE ARG A 128 -0.280 -0.873 16.602 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -2.463 -1.614 13.919 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -3.918 -1.358 14.888 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -2.147 -0.567 17.835 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -3.739 -0.769 17.096 1.00 0.00 H new ATOM 780 N ALA A 129 1.325 3.451 12.820 1.00 0.00 N ATOM 781 CA ALA A 129 1.254 4.906 12.864 1.00 0.00 C ATOM 782 C ALA A 129 0.447 5.474 11.700 1.00 0.00 C ATOM 783 O ALA A 129 -0.055 6.592 11.774 1.00 0.00 O ATOM 784 CB ALA A 129 2.655 5.496 12.872 1.00 0.00 C ATOM 0 H ALA A 129 2.252 3.082 12.607 1.00 0.00 H new ATOM 0 HA ALA A 129 0.739 5.184 13.783 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.592 6.584 12.905 1.00 0.00 H new ATOM 0 HB2 ALA A 129 3.196 5.137 13.748 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.184 5.191 11.969 1.00 0.00 H new ATOM 790 N TYR A 130 0.316 4.706 10.630 1.00 0.00 N ATOM 791 CA TYR A 130 -0.414 5.167 9.454 1.00 0.00 C ATOM 792 C TYR A 130 -1.912 4.962 9.621 1.00 0.00 C ATOM 793 O TYR A 130 -2.717 5.688 9.041 1.00 0.00 O ATOM 794 CB TYR A 130 0.067 4.439 8.198 1.00 0.00 C ATOM 795 CG TYR A 130 1.446 4.845 7.722 1.00 0.00 C ATOM 796 CD1 TYR A 130 2.354 5.469 8.569 1.00 0.00 C ATOM 797 CD2 TYR A 130 1.843 4.588 6.421 1.00 0.00 C ATOM 798 CE1 TYR A 130 3.609 5.823 8.131 1.00 0.00 C ATOM 799 CE2 TYR A 130 3.096 4.941 5.978 1.00 0.00 C ATOM 800 CZ TYR A 130 3.973 5.558 6.836 1.00 0.00 C ATOM 801 OH TYR A 130 5.220 5.908 6.397 1.00 0.00 O ATOM 0 H TYR A 130 0.702 3.765 10.549 1.00 0.00 H new ATOM 0 HA TYR A 130 -0.218 6.234 9.345 1.00 0.00 H new ATOM 0 HB2 TYR A 130 0.066 3.367 8.393 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -0.647 4.618 7.394 1.00 0.00 H new ATOM 0 HD1 TYR A 130 2.069 5.680 9.589 1.00 0.00 H new ATOM 0 HD2 TYR A 130 1.157 4.102 5.743 1.00 0.00 H new ATOM 0 HE1 TYR A 130 4.303 6.306 8.803 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.389 4.734 4.959 1.00 0.00 H new ATOM 0 HH TYR A 130 5.411 6.833 6.657 1.00 0.00 H new ATOM 811 N MET A 131 -2.289 3.987 10.436 1.00 0.00 N ATOM 812 CA MET A 131 -3.696 3.637 10.602 1.00 0.00 C ATOM 813 C MET A 131 -4.392 4.572 11.583 1.00 0.00 C ATOM 814 O MET A 131 -5.568 4.397 11.901 1.00 0.00 O ATOM 815 CB MET A 131 -3.842 2.181 11.053 1.00 0.00 C ATOM 816 CG MET A 131 -3.475 1.158 9.984 1.00 0.00 C ATOM 817 SD MET A 131 -4.827 0.783 8.838 1.00 0.00 S ATOM 818 CE MET A 131 -5.003 2.315 7.920 1.00 0.00 C ATOM 0 H MET A 131 -1.644 3.425 10.992 1.00 0.00 H new ATOM 0 HA MET A 131 -4.180 3.751 9.632 1.00 0.00 H new ATOM 0 HB2 MET A 131 -3.212 2.018 11.928 1.00 0.00 H new ATOM 0 HB3 MET A 131 -4.872 2.010 11.365 1.00 0.00 H new ATOM 0 HG2 MET A 131 -2.622 1.530 9.416 1.00 0.00 H new ATOM 0 HG3 MET A 131 -3.157 0.236 10.470 1.00 0.00 H new ATOM 0 HE1 MET A 131 -5.377 2.099 6.919 1.00 0.00 H new ATOM 0 HE2 MET A 131 -5.706 2.970 8.436 1.00 0.00 H new ATOM 0 HE3 MET A 131 -4.034 2.809 7.847 1.00 0.00 H new ATOM 828 N GLN A 132 -3.660 5.562 12.064 1.00 0.00 N ATOM 829 CA GLN A 132 -4.237 6.586 12.920 1.00 0.00 C ATOM 830 C GLN A 132 -4.461 7.865 12.119 1.00 0.00 C ATOM 831 O GLN A 132 -5.054 8.825 12.612 1.00 0.00 O ATOM 832 CB GLN A 132 -3.315 6.875 14.104 1.00 0.00 C ATOM 833 CG GLN A 132 -2.064 7.634 13.708 1.00 0.00 C ATOM 834 CD GLN A 132 -1.031 7.702 14.807 1.00 0.00 C ATOM 835 OE1 GLN A 132 -1.355 7.701 15.994 1.00 0.00 O ATOM 836 NE2 GLN A 132 0.224 7.754 14.410 1.00 0.00 N ATOM 0 H GLN A 132 -2.664 5.679 11.877 1.00 0.00 H new ATOM 0 HA GLN A 132 -5.193 6.224 13.300 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -3.861 7.451 14.851 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -3.029 5.934 14.573 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.622 7.159 12.832 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.340 8.647 13.416 1.00 0.00 H new ATOM 0 HE21 GLN A 132 0.444 7.752 13.414 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.975 7.796 15.099 1.00 0.00 H new ATOM 845 N GLU A 133 -3.974 7.874 10.883 1.00 0.00 N ATOM 846 CA GLU A 133 -4.057 9.058 10.046 1.00 0.00 C ATOM 847 C GLU A 133 -5.220 8.938 9.076 1.00 0.00 C ATOM 848 O GLU A 133 -5.275 7.996 8.283 1.00 0.00 O ATOM 849 CB GLU A 133 -2.758 9.265 9.266 1.00 0.00 C ATOM 850 CG GLU A 133 -1.510 9.093 10.110 1.00 0.00 C ATOM 851 CD GLU A 133 -0.336 9.888 9.587 1.00 0.00 C ATOM 852 OE1 GLU A 133 -0.470 11.122 9.442 1.00 0.00 O ATOM 853 OE2 GLU A 133 0.731 9.298 9.347 1.00 0.00 O ATOM 0 H GLU A 133 -3.519 7.075 10.442 1.00 0.00 H new ATOM 0 HA GLU A 133 -4.217 9.919 10.695 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -2.726 8.559 8.436 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.759 10.265 8.833 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.724 9.400 11.134 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -1.242 8.037 10.143 1.00 0.00 H new ATOM 860 N PRO A 134 -6.154 9.904 9.115 1.00 0.00 N ATOM 861 CA PRO A 134 -7.359 9.888 8.275 1.00 0.00 C ATOM 862 C PRO A 134 -7.042 9.935 6.781 1.00 0.00 C ATOM 863 O PRO A 134 -7.904 9.660 5.953 1.00 0.00 O ATOM 864 CB PRO A 134 -8.125 11.145 8.703 1.00 0.00 C ATOM 865 CG PRO A 134 -7.101 12.021 9.338 1.00 0.00 C ATOM 866 CD PRO A 134 -6.113 11.092 9.985 1.00 0.00 C ATOM 0 HA PRO A 134 -7.924 8.966 8.411 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -8.589 11.636 7.847 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -8.925 10.901 9.402 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -6.614 12.655 8.597 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -7.555 12.683 10.075 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -5.115 11.529 10.025 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -6.397 10.852 11.010 1.00 0.00 H new ATOM 874 N LEU A 135 -5.812 10.277 6.435 1.00 0.00 N ATOM 875 CA LEU A 135 -5.410 10.268 5.039 1.00 0.00 C ATOM 876 C LEU A 135 -5.012 8.868 4.586 1.00 0.00 C ATOM 877 O LEU A 135 -5.263 8.492 3.444 1.00 0.00 O ATOM 878 CB LEU A 135 -4.265 11.252 4.788 1.00 0.00 C ATOM 879 CG LEU A 135 -4.638 12.731 4.918 1.00 0.00 C ATOM 880 CD1 LEU A 135 -3.456 13.613 4.551 1.00 0.00 C ATOM 881 CD2 LEU A 135 -5.840 13.060 4.045 1.00 0.00 C ATOM 0 H LEU A 135 -5.084 10.560 7.091 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.272 10.585 4.451 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -3.459 11.034 5.489 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -3.872 11.079 3.786 1.00 0.00 H new ATOM 0 HG LEU A 135 -4.905 12.927 5.957 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -3.740 14.661 4.649 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -2.621 13.399 5.218 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -3.158 13.413 3.522 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -6.089 14.116 4.152 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.602 12.847 3.003 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -6.691 12.453 4.354 1.00 0.00 H new ATOM 893 N PHE A 136 -4.420 8.078 5.477 1.00 0.00 N ATOM 894 CA PHE A 136 -3.939 6.762 5.086 1.00 0.00 C ATOM 895 C PHE A 136 -5.036 5.726 5.278 1.00 0.00 C ATOM 896 O PHE A 136 -5.115 4.742 4.545 1.00 0.00 O ATOM 897 CB PHE A 136 -2.690 6.370 5.874 1.00 0.00 C ATOM 898 CG PHE A 136 -1.952 5.205 5.274 1.00 0.00 C ATOM 899 CD1 PHE A 136 -2.221 3.910 5.684 1.00 0.00 C ATOM 900 CD2 PHE A 136 -0.991 5.407 4.296 1.00 0.00 C ATOM 901 CE1 PHE A 136 -1.547 2.838 5.131 1.00 0.00 C ATOM 902 CE2 PHE A 136 -0.313 4.341 3.739 1.00 0.00 C ATOM 903 CZ PHE A 136 -0.591 3.056 4.156 1.00 0.00 C ATOM 0 H PHE A 136 -4.265 8.321 6.455 1.00 0.00 H new ATOM 0 HA PHE A 136 -3.667 6.800 4.031 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -2.019 7.227 5.929 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -2.976 6.123 6.896 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -2.967 3.736 6.445 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -0.770 6.411 3.965 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -1.766 1.833 5.459 1.00 0.00 H new ATOM 0 HE2 PHE A 136 0.434 4.513 2.978 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.062 2.221 3.721 1.00 0.00 H new ATOM 913 N VAL A 137 -5.887 5.960 6.266 1.00 0.00 N ATOM 914 CA VAL A 137 -7.019 5.083 6.523 1.00 0.00 C ATOM 915 C VAL A 137 -7.958 5.033 5.322 1.00 0.00 C ATOM 916 O VAL A 137 -8.358 3.957 4.882 1.00 0.00 O ATOM 917 CB VAL A 137 -7.805 5.533 7.763 1.00 0.00 C ATOM 918 CG1 VAL A 137 -7.025 5.275 9.041 1.00 0.00 C ATOM 919 CG2 VAL A 137 -8.176 6.978 7.661 1.00 0.00 C ATOM 0 H VAL A 137 -5.814 6.752 6.904 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.616 4.087 6.704 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.719 4.941 7.804 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -7.611 5.606 9.898 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.818 4.209 9.132 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -6.085 5.825 9.011 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.732 7.275 8.550 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.272 7.581 7.581 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.795 7.133 6.777 1.00 0.00 H new ATOM 929 N GLU A 138 -8.304 6.205 4.804 1.00 0.00 N ATOM 930 CA GLU A 138 -9.140 6.319 3.616 1.00 0.00 C ATOM 931 C GLU A 138 -8.420 5.775 2.394 1.00 0.00 C ATOM 932 O GLU A 138 -9.036 5.171 1.519 1.00 0.00 O ATOM 933 CB GLU A 138 -9.531 7.773 3.379 1.00 0.00 C ATOM 934 CG GLU A 138 -10.268 8.386 4.551 1.00 0.00 C ATOM 935 CD GLU A 138 -11.528 7.626 4.905 1.00 0.00 C ATOM 936 OE1 GLU A 138 -12.498 7.679 4.120 1.00 0.00 O ATOM 937 OE2 GLU A 138 -11.554 6.977 5.972 1.00 0.00 O ATOM 0 H GLU A 138 -8.014 7.101 5.195 1.00 0.00 H new ATOM 0 HA GLU A 138 -10.042 5.729 3.781 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -8.633 8.357 3.176 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -10.159 7.834 2.490 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -9.608 8.412 5.418 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -10.525 9.419 4.315 1.00 0.00 H new ATOM 944 N PHE A 139 -7.113 5.999 2.340 1.00 0.00 N ATOM 945 CA PHE A 139 -6.282 5.421 1.294 1.00 0.00 C ATOM 946 C PHE A 139 -6.439 3.908 1.303 1.00 0.00 C ATOM 947 O PHE A 139 -6.700 3.286 0.272 1.00 0.00 O ATOM 948 CB PHE A 139 -4.818 5.816 1.510 1.00 0.00 C ATOM 949 CG PHE A 139 -3.838 5.051 0.663 1.00 0.00 C ATOM 950 CD1 PHE A 139 -3.101 4.015 1.211 1.00 0.00 C ATOM 951 CD2 PHE A 139 -3.655 5.364 -0.673 1.00 0.00 C ATOM 952 CE1 PHE A 139 -2.201 3.303 0.443 1.00 0.00 C ATOM 953 CE2 PHE A 139 -2.753 4.653 -1.447 1.00 0.00 C ATOM 954 CZ PHE A 139 -2.027 3.622 -0.887 1.00 0.00 C ATOM 0 H PHE A 139 -6.606 6.578 3.010 1.00 0.00 H new ATOM 0 HA PHE A 139 -6.598 5.802 0.323 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.707 6.880 1.302 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.565 5.668 2.560 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -3.232 3.760 2.252 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -4.221 6.170 -1.116 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -1.634 2.497 0.884 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -2.618 4.905 -2.488 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.324 3.066 -1.489 1.00 0.00 H new ATOM 964 N ALA A 140 -6.312 3.334 2.491 1.00 0.00 N ATOM 965 CA ALA A 140 -6.498 1.909 2.679 1.00 0.00 C ATOM 966 C ALA A 140 -7.932 1.513 2.365 1.00 0.00 C ATOM 967 O ALA A 140 -8.171 0.521 1.681 1.00 0.00 O ATOM 968 CB ALA A 140 -6.131 1.512 4.100 1.00 0.00 C ATOM 0 H ALA A 140 -6.079 3.842 3.344 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.839 1.379 1.991 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -6.276 0.439 4.227 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -5.087 1.762 4.290 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -6.767 2.049 4.804 1.00 0.00 H new ATOM 974 N ASP A 141 -8.878 2.320 2.832 1.00 0.00 N ATOM 975 CA ASP A 141 -10.301 2.053 2.623 1.00 0.00 C ATOM 976 C ASP A 141 -10.610 1.973 1.135 1.00 0.00 C ATOM 977 O ASP A 141 -11.420 1.155 0.690 1.00 0.00 O ATOM 978 CB ASP A 141 -11.139 3.158 3.272 1.00 0.00 C ATOM 979 CG ASP A 141 -12.620 3.017 2.995 1.00 0.00 C ATOM 980 OD1 ASP A 141 -13.159 3.813 2.196 1.00 0.00 O ATOM 981 OD2 ASP A 141 -13.256 2.111 3.574 1.00 0.00 O ATOM 0 H ASP A 141 -8.686 3.170 3.361 1.00 0.00 H new ATOM 0 HA ASP A 141 -10.551 1.097 3.084 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -10.974 3.146 4.349 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -10.797 4.127 2.908 1.00 0.00 H new ATOM 986 N CYS A 142 -9.930 2.811 0.377 1.00 0.00 N ATOM 987 CA CYS A 142 -10.113 2.877 -1.055 1.00 0.00 C ATOM 988 C CYS A 142 -9.416 1.718 -1.759 1.00 0.00 C ATOM 989 O CYS A 142 -10.031 1.022 -2.564 1.00 0.00 O ATOM 990 CB CYS A 142 -9.594 4.214 -1.575 1.00 0.00 C ATOM 991 SG CYS A 142 -10.653 5.619 -1.160 1.00 0.00 S ATOM 0 H CYS A 142 -9.236 3.464 0.739 1.00 0.00 H new ATOM 0 HA CYS A 142 -11.178 2.796 -1.272 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -8.598 4.389 -1.169 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -9.491 4.156 -2.659 1.00 0.00 H new ATOM 0 HG CYS A 142 -10.425 5.987 0.066 1.00 0.00 H new ATOM 997 N CYS A 143 -8.144 1.485 -1.440 1.00 0.00 N ATOM 998 CA CYS A 143 -7.379 0.453 -2.125 1.00 0.00 C ATOM 999 C CYS A 143 -7.967 -0.927 -1.852 1.00 0.00 C ATOM 1000 O CYS A 143 -8.023 -1.771 -2.745 1.00 0.00 O ATOM 1001 CB CYS A 143 -5.899 0.503 -1.725 1.00 0.00 C ATOM 1002 SG CYS A 143 -5.582 0.258 0.037 1.00 0.00 S ATOM 0 H CYS A 143 -7.629 1.992 -0.720 1.00 0.00 H new ATOM 0 HA CYS A 143 -7.442 0.646 -3.196 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -5.359 -0.260 -2.286 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -5.489 1.468 -2.023 1.00 0.00 H new ATOM 0 HG CYS A 143 -6.712 0.209 0.678 1.00 0.00 H new ATOM 1008 N LEU A 144 -8.449 -1.137 -0.630 1.00 0.00 N ATOM 1009 CA LEU A 144 -9.041 -2.414 -0.257 1.00 0.00 C ATOM 1010 C LEU A 144 -10.345 -2.632 -1.005 1.00 0.00 C ATOM 1011 O LEU A 144 -10.669 -3.755 -1.383 1.00 0.00 O ATOM 1012 CB LEU A 144 -9.288 -2.491 1.253 1.00 0.00 C ATOM 1013 CG LEU A 144 -8.041 -2.343 2.127 1.00 0.00 C ATOM 1014 CD1 LEU A 144 -8.371 -2.618 3.584 1.00 0.00 C ATOM 1015 CD2 LEU A 144 -6.933 -3.260 1.640 1.00 0.00 C ATOM 0 H LEU A 144 -8.440 -0.441 0.115 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.336 -3.199 -0.530 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -9.999 -1.712 1.528 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.759 -3.448 1.479 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.688 -1.315 2.049 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.471 -2.507 4.188 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.126 -1.910 3.926 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -8.753 -3.634 3.685 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -6.055 -3.139 2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.272 -4.295 1.683 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -6.675 -3.005 0.612 1.00 0.00 H new ATOM 1027 N GLY A 145 -11.074 -1.545 -1.240 1.00 0.00 N ATOM 1028 CA GLY A 145 -12.334 -1.630 -1.955 1.00 0.00 C ATOM 1029 C GLY A 145 -12.135 -1.864 -3.436 1.00 0.00 C ATOM 1030 O GLY A 145 -13.061 -2.260 -4.144 1.00 0.00 O ATOM 0 H GLY A 145 -10.813 -0.604 -0.947 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -12.933 -2.440 -1.538 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -12.897 -0.708 -1.807 1.00 0.00 H new ATOM 1034 N ILE A 146 -10.924 -1.607 -3.905 1.00 0.00 N ATOM 1035 CA ILE A 146 -10.574 -1.835 -5.296 1.00 0.00 C ATOM 1036 C ILE A 146 -10.015 -3.242 -5.490 1.00 0.00 C ATOM 1037 O ILE A 146 -10.469 -3.983 -6.359 1.00 0.00 O ATOM 1038 CB ILE A 146 -9.538 -0.795 -5.779 1.00 0.00 C ATOM 1039 CG1 ILE A 146 -10.123 0.614 -5.657 1.00 0.00 C ATOM 1040 CG2 ILE A 146 -9.114 -1.075 -7.217 1.00 0.00 C ATOM 1041 CD1 ILE A 146 -9.096 1.711 -5.804 1.00 0.00 C ATOM 0 H ILE A 146 -10.162 -1.237 -3.336 1.00 0.00 H new ATOM 0 HA ILE A 146 -11.483 -1.730 -5.888 1.00 0.00 H new ATOM 0 HB ILE A 146 -8.652 -0.868 -5.149 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -10.893 0.745 -6.417 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -10.611 0.713 -4.687 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -8.385 -0.329 -7.533 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -8.668 -2.068 -7.278 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -9.986 -1.029 -7.869 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -9.583 2.681 -5.706 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -8.338 1.606 -5.028 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -8.624 1.639 -6.784 1.00 0.00 H new ATOM 1053 N VAL A 147 -9.061 -3.625 -4.646 1.00 0.00 N ATOM 1054 CA VAL A 147 -8.331 -4.875 -4.833 1.00 0.00 C ATOM 1055 C VAL A 147 -9.047 -6.060 -4.198 1.00 0.00 C ATOM 1056 O VAL A 147 -8.540 -7.180 -4.234 1.00 0.00 O ATOM 1057 CB VAL A 147 -6.897 -4.791 -4.260 1.00 0.00 C ATOM 1058 CG1 VAL A 147 -6.154 -3.605 -4.850 1.00 0.00 C ATOM 1059 CG2 VAL A 147 -6.915 -4.715 -2.738 1.00 0.00 C ATOM 0 H VAL A 147 -8.776 -3.088 -3.827 1.00 0.00 H new ATOM 0 HA VAL A 147 -8.280 -5.031 -5.911 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.369 -5.702 -4.541 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -5.147 -3.563 -4.434 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -6.095 -3.715 -5.933 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -6.686 -2.685 -4.607 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -5.893 -4.657 -2.364 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.467 -3.829 -2.424 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -7.398 -5.605 -2.335 1.00 0.00 H new ATOM 1069 N GLU A 148 -10.212 -5.816 -3.615 1.00 0.00 N ATOM 1070 CA GLU A 148 -10.990 -6.881 -2.996 1.00 0.00 C ATOM 1071 C GLU A 148 -11.459 -7.900 -4.034 1.00 0.00 C ATOM 1072 O GLU A 148 -12.218 -7.570 -4.949 1.00 0.00 O ATOM 1073 CB GLU A 148 -12.201 -6.306 -2.259 1.00 0.00 C ATOM 1074 CG GLU A 148 -12.989 -5.306 -3.085 1.00 0.00 C ATOM 1075 CD GLU A 148 -14.373 -5.056 -2.540 1.00 0.00 C ATOM 1076 OE1 GLU A 148 -14.493 -4.452 -1.456 1.00 0.00 O ATOM 1077 OE2 GLU A 148 -15.349 -5.454 -3.206 1.00 0.00 O ATOM 0 H GLU A 148 -10.639 -4.892 -3.557 1.00 0.00 H new ATOM 0 HA GLU A 148 -10.341 -7.387 -2.281 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -12.860 -7.123 -1.965 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -11.864 -5.823 -1.342 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -12.443 -4.363 -3.123 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -13.068 -5.670 -4.109 1.00 0.00 H new ATOM 1084 N PRO A 149 -11.001 -9.155 -3.911 1.00 0.00 N ATOM 1085 CA PRO A 149 -11.451 -10.241 -4.781 1.00 0.00 C ATOM 1086 C PRO A 149 -12.889 -10.641 -4.466 1.00 0.00 C ATOM 1087 O PRO A 149 -13.617 -11.146 -5.323 1.00 0.00 O ATOM 1088 CB PRO A 149 -10.485 -11.385 -4.464 1.00 0.00 C ATOM 1089 CG PRO A 149 -9.983 -11.101 -3.088 1.00 0.00 C ATOM 1090 CD PRO A 149 -9.995 -9.604 -2.929 1.00 0.00 C ATOM 0 HA PRO A 149 -11.447 -9.962 -5.835 1.00 0.00 H new ATOM 0 HB2 PRO A 149 -10.989 -12.350 -4.508 1.00 0.00 H new ATOM 0 HB3 PRO A 149 -9.666 -11.420 -5.183 1.00 0.00 H new ATOM 0 HG2 PRO A 149 -10.616 -11.576 -2.338 1.00 0.00 H new ATOM 0 HG3 PRO A 149 -8.977 -11.497 -2.953 1.00 0.00 H new ATOM 0 HD2 PRO A 149 -10.267 -9.311 -1.915 1.00 0.00 H new ATOM 0 HD3 PRO A 149 -9.015 -9.172 -3.133 1.00 0.00 H new ATOM 1098 N SER A 150 -13.281 -10.403 -3.223 1.00 0.00 N ATOM 1099 CA SER A 150 -14.636 -10.645 -2.770 1.00 0.00 C ATOM 1100 C SER A 150 -14.866 -9.872 -1.479 1.00 0.00 C ATOM 1101 O SER A 150 -13.954 -9.734 -0.662 1.00 0.00 O ATOM 1102 CB SER A 150 -14.876 -12.144 -2.551 1.00 0.00 C ATOM 1103 OG SER A 150 -16.241 -12.417 -2.268 1.00 0.00 O ATOM 0 H SER A 150 -12.663 -10.035 -2.500 1.00 0.00 H new ATOM 0 HA SER A 150 -15.339 -10.306 -3.530 1.00 0.00 H new ATOM 0 HB2 SER A 150 -14.570 -12.696 -3.440 1.00 0.00 H new ATOM 0 HB3 SER A 150 -14.255 -12.496 -1.727 1.00 0.00 H new ATOM 0 HG SER A 150 -16.810 -11.921 -2.893 1.00 0.00 H new ATOM 1109 N GLN A 151 -16.065 -9.346 -1.310 1.00 0.00 N ATOM 1110 CA GLN A 151 -16.400 -8.586 -0.122 1.00 0.00 C ATOM 1111 C GLN A 151 -17.578 -9.239 0.589 1.00 0.00 C ATOM 1112 O GLN A 151 -18.425 -9.858 -0.057 1.00 0.00 O ATOM 1113 CB GLN A 151 -16.739 -7.142 -0.511 1.00 0.00 C ATOM 1114 CG GLN A 151 -17.108 -6.259 0.668 1.00 0.00 C ATOM 1115 CD GLN A 151 -15.963 -6.074 1.647 1.00 0.00 C ATOM 1116 OE1 GLN A 151 -16.177 -5.947 2.852 1.00 0.00 O ATOM 1117 NE2 GLN A 151 -14.744 -6.023 1.135 1.00 0.00 N ATOM 0 H GLN A 151 -16.826 -9.432 -1.984 1.00 0.00 H new ATOM 0 HA GLN A 151 -15.547 -8.573 0.556 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -15.884 -6.705 -1.027 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -17.568 -7.152 -1.219 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -17.426 -5.284 0.300 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -17.959 -6.696 1.190 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -14.608 -6.133 0.130 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -13.940 -5.874 1.745 1.00 0.00 H new ATOM 1126 N ASN A 152 -17.603 -9.127 1.917 1.00 0.00 N ATOM 1127 CA ASN A 152 -18.713 -9.639 2.717 1.00 0.00 C ATOM 1128 C ASN A 152 -20.021 -9.046 2.216 1.00 0.00 C ATOM 1129 O ASN A 152 -20.254 -7.846 2.378 1.00 0.00 O ATOM 1130 CB ASN A 152 -18.515 -9.293 4.196 1.00 0.00 C ATOM 1131 CG ASN A 152 -17.219 -9.847 4.756 1.00 0.00 C ATOM 1132 OD1 ASN A 152 -16.181 -9.186 4.718 1.00 0.00 O ATOM 1133 ND2 ASN A 152 -17.270 -11.062 5.277 1.00 0.00 N ATOM 0 H ASN A 152 -16.863 -8.684 2.462 1.00 0.00 H new ATOM 0 HA ASN A 152 -18.746 -10.724 2.618 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -18.525 -8.210 4.316 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -19.353 -9.685 4.772 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -16.428 -11.485 5.667 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -18.151 -11.575 5.288 1.00 0.00 H new ATOM 1140 N GLU A 153 -20.865 -9.908 1.641 1.00 0.00 N ATOM 1141 CA GLU A 153 -22.032 -9.508 0.856 1.00 0.00 C ATOM 1142 C GLU A 153 -21.753 -8.288 -0.005 1.00 0.00 C ATOM 1143 O GLU A 153 -21.951 -7.140 0.396 1.00 0.00 O ATOM 1144 CB GLU A 153 -23.287 -9.312 1.695 1.00 0.00 C ATOM 1145 CG GLU A 153 -23.144 -8.378 2.889 1.00 0.00 C ATOM 1146 CD GLU A 153 -24.478 -8.000 3.494 1.00 0.00 C ATOM 1147 OE1 GLU A 153 -25.042 -6.958 3.097 1.00 0.00 O ATOM 1148 OE2 GLU A 153 -24.979 -8.744 4.365 1.00 0.00 O ATOM 0 H GLU A 153 -20.753 -10.919 1.710 1.00 0.00 H new ATOM 0 HA GLU A 153 -22.233 -10.348 0.191 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -24.077 -8.928 1.049 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -23.616 -10.286 2.057 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -22.527 -8.858 3.649 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -22.621 -7.474 2.578 1.00 0.00 H new ATOM 1155 N GLU A 154 -21.332 -8.568 -1.212 1.00 0.00 N ATOM 1156 CA GLU A 154 -20.898 -7.533 -2.139 1.00 0.00 C ATOM 1157 C GLU A 154 -22.034 -7.132 -3.074 1.00 0.00 C ATOM 1158 O GLU A 154 -21.948 -7.283 -4.293 1.00 0.00 O ATOM 1159 CB GLU A 154 -19.664 -7.998 -2.925 1.00 0.00 C ATOM 1160 CG GLU A 154 -19.795 -9.379 -3.547 1.00 0.00 C ATOM 1161 CD GLU A 154 -18.495 -9.862 -4.156 1.00 0.00 C ATOM 1162 OE1 GLU A 154 -17.690 -10.487 -3.432 1.00 0.00 O ATOM 1163 OE2 GLU A 154 -18.271 -9.621 -5.361 1.00 0.00 O ATOM 0 H GLU A 154 -21.277 -9.515 -1.587 1.00 0.00 H new ATOM 0 HA GLU A 154 -20.617 -6.650 -1.565 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -19.459 -7.276 -3.715 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -18.802 -7.994 -2.258 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -20.123 -10.088 -2.786 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -20.567 -9.357 -4.316 1.00 0.00 H new ATOM 1170 N SER A 155 -23.112 -6.645 -2.481 1.00 0.00 N ATOM 1171 CA SER A 155 -24.257 -6.177 -3.236 1.00 0.00 C ATOM 1172 C SER A 155 -24.048 -4.717 -3.630 1.00 0.00 C ATOM 1173 O SER A 155 -24.466 -3.822 -2.865 1.00 0.00 O ATOM 1174 CB SER A 155 -25.537 -6.342 -2.407 1.00 0.00 C ATOM 1175 OG SER A 155 -26.698 -6.135 -3.195 1.00 0.00 O ATOM 1176 OXT SER A 155 -23.433 -4.466 -4.689 1.00 0.00 O ATOM 0 H SER A 155 -23.215 -6.564 -1.469 1.00 0.00 H new ATOM 0 HA SER A 155 -24.362 -6.771 -4.144 1.00 0.00 H new ATOM 0 HB2 SER A 155 -25.564 -7.342 -1.973 1.00 0.00 H new ATOM 0 HB3 SER A 155 -25.528 -5.635 -1.578 1.00 0.00 H new ATOM 0 HG SER A 155 -27.496 -6.249 -2.638 1.00 0.00 H new TER 1182 SER A 155 ATOM 1183 N ASP B 462 -9.752 -10.113 8.635 1.00 0.00 N ATOM 1184 CA ASP B 462 -8.804 -9.613 9.656 1.00 0.00 C ATOM 1185 C ASP B 462 -8.004 -8.444 9.099 1.00 0.00 C ATOM 1186 O ASP B 462 -7.578 -8.458 7.941 1.00 0.00 O ATOM 1187 CB ASP B 462 -7.860 -10.733 10.107 1.00 0.00 C ATOM 1188 CG ASP B 462 -6.962 -11.231 8.994 1.00 0.00 C ATOM 1189 OD1 ASP B 462 -7.447 -11.999 8.132 1.00 0.00 O ATOM 1190 OD2 ASP B 462 -5.769 -10.866 8.979 1.00 0.00 O ATOM 0 HA ASP B 462 -9.373 -9.272 10.521 1.00 0.00 H new ATOM 0 HB2 ASP B 462 -7.244 -10.372 10.930 1.00 0.00 H new ATOM 0 HB3 ASP B 462 -8.450 -11.565 10.491 1.00 0.00 H new ATOM 1197 N ILE B 463 -7.809 -7.432 9.936 1.00 0.00 N ATOM 1198 CA ILE B 463 -7.141 -6.201 9.531 1.00 0.00 C ATOM 1199 C ILE B 463 -5.655 -6.442 9.305 1.00 0.00 C ATOM 1200 O ILE B 463 -5.018 -5.742 8.527 1.00 0.00 O ATOM 1201 CB ILE B 463 -7.324 -5.091 10.590 1.00 0.00 C ATOM 1202 CG1 ILE B 463 -8.813 -4.852 10.843 1.00 0.00 C ATOM 1203 CG2 ILE B 463 -6.642 -3.798 10.154 1.00 0.00 C ATOM 1204 CD1 ILE B 463 -9.093 -3.845 11.935 1.00 0.00 C ATOM 0 H ILE B 463 -8.108 -7.441 10.911 1.00 0.00 H new ATOM 0 HA ILE B 463 -7.599 -5.875 8.597 1.00 0.00 H new ATOM 0 HB ILE B 463 -6.854 -5.419 11.517 1.00 0.00 H new ATOM 0 HG12 ILE B 463 -9.279 -4.510 9.919 1.00 0.00 H new ATOM 0 HG13 ILE B 463 -9.284 -5.799 11.106 1.00 0.00 H new ATOM 0 HG21 ILE B 463 -6.787 -3.034 10.918 1.00 0.00 H new ATOM 0 HG22 ILE B 463 -5.575 -3.977 10.018 1.00 0.00 H new ATOM 0 HG23 ILE B 463 -7.075 -3.457 9.214 1.00 0.00 H new ATOM 0 HD11 ILE B 463 -10.170 -3.729 12.056 1.00 0.00 H new ATOM 0 HD12 ILE B 463 -8.658 -4.194 12.872 1.00 0.00 H new ATOM 0 HD13 ILE B 463 -8.653 -2.885 11.666 1.00 0.00 H new ATOM 1216 N ARG B 464 -5.114 -7.443 9.988 1.00 0.00 N ATOM 1217 CA ARG B 464 -3.710 -7.803 9.834 1.00 0.00 C ATOM 1218 C ARG B 464 -3.389 -8.108 8.375 1.00 0.00 C ATOM 1219 O ARG B 464 -2.376 -7.651 7.846 1.00 0.00 O ATOM 1220 CB ARG B 464 -3.369 -9.002 10.721 1.00 0.00 C ATOM 1221 CG ARG B 464 -3.438 -8.681 12.204 1.00 0.00 C ATOM 1222 CD ARG B 464 -3.231 -9.918 13.062 1.00 0.00 C ATOM 1223 NE ARG B 464 -3.229 -9.590 14.487 1.00 0.00 N ATOM 1224 CZ ARG B 464 -3.414 -10.480 15.461 1.00 0.00 C ATOM 1225 NH1 ARG B 464 -3.644 -11.752 15.170 1.00 0.00 N ATOM 1226 NH2 ARG B 464 -3.378 -10.091 16.729 1.00 0.00 N ATOM 0 H ARG B 464 -5.627 -8.020 10.654 1.00 0.00 H new ATOM 0 HA ARG B 464 -3.100 -6.955 10.146 1.00 0.00 H new ATOM 0 HB2 ARG B 464 -4.056 -9.818 10.499 1.00 0.00 H new ATOM 0 HB3 ARG B 464 -2.367 -9.354 10.477 1.00 0.00 H new ATOM 0 HG2 ARG B 464 -2.680 -7.938 12.450 1.00 0.00 H new ATOM 0 HG3 ARG B 464 -4.406 -8.237 12.435 1.00 0.00 H new ATOM 0 HD2 ARG B 464 -4.020 -10.641 12.856 1.00 0.00 H new ATOM 0 HD3 ARG B 464 -2.286 -10.392 12.796 1.00 0.00 H new ATOM 0 HE ARG B 464 -3.076 -8.617 14.752 1.00 0.00 H new ATOM 0 HH11 ARG B 464 -3.680 -12.054 14.196 1.00 0.00 H new ATOM 0 HH12 ARG B 464 -3.785 -12.429 15.920 1.00 0.00 H new ATOM 0 HH21 ARG B 464 -3.209 -9.111 16.957 1.00 0.00 H new ATOM 0 HH22 ARG B 464 -3.520 -10.772 17.475 1.00 0.00 H new ATOM 1240 N HIS B 465 -4.270 -8.862 7.729 1.00 0.00 N ATOM 1241 CA HIS B 465 -4.128 -9.177 6.312 1.00 0.00 C ATOM 1242 C HIS B 465 -4.314 -7.929 5.460 1.00 0.00 C ATOM 1243 O HIS B 465 -3.546 -7.675 4.533 1.00 0.00 O ATOM 1244 CB HIS B 465 -5.136 -10.257 5.905 1.00 0.00 C ATOM 1245 CG HIS B 465 -5.322 -10.395 4.424 1.00 0.00 C ATOM 1246 ND1 HIS B 465 -4.427 -11.039 3.600 1.00 0.00 N ATOM 1247 CD2 HIS B 465 -6.318 -9.956 3.622 1.00 0.00 C ATOM 1248 CE1 HIS B 465 -4.869 -10.994 2.357 1.00 0.00 C ATOM 1249 NE2 HIS B 465 -6.014 -10.344 2.343 1.00 0.00 N ATOM 0 H HIS B 465 -5.096 -9.269 8.167 1.00 0.00 H new ATOM 0 HA HIS B 465 -3.120 -9.557 6.144 1.00 0.00 H new ATOM 0 HB2 HIS B 465 -4.809 -11.215 6.310 1.00 0.00 H new ATOM 0 HB3 HIS B 465 -6.099 -10.030 6.362 1.00 0.00 H new ATOM 0 HD1 HIS B 465 -3.559 -11.481 3.902 1.00 0.00 H new ATOM 0 HD2 HIS B 465 -7.192 -9.402 3.932 1.00 0.00 H new ATOM 0 HE1 HIS B 465 -4.374 -11.419 1.496 1.00 0.00 H new ATOM 1258 N GLU B 466 -5.339 -7.159 5.780 1.00 0.00 N ATOM 1259 CA GLU B 466 -5.646 -5.946 5.037 1.00 0.00 C ATOM 1260 C GLU B 466 -4.476 -4.969 5.099 1.00 0.00 C ATOM 1261 O GLU B 466 -4.142 -4.315 4.116 1.00 0.00 O ATOM 1262 CB GLU B 466 -6.904 -5.293 5.607 1.00 0.00 C ATOM 1263 CG GLU B 466 -8.120 -6.203 5.601 1.00 0.00 C ATOM 1264 CD GLU B 466 -9.352 -5.546 6.192 1.00 0.00 C ATOM 1265 OE1 GLU B 466 -9.460 -5.473 7.433 1.00 0.00 O ATOM 1266 OE2 GLU B 466 -10.229 -5.117 5.418 1.00 0.00 O ATOM 0 H GLU B 466 -5.976 -7.352 6.553 1.00 0.00 H new ATOM 0 HA GLU B 466 -5.820 -6.210 3.994 1.00 0.00 H new ATOM 0 HB2 GLU B 466 -6.705 -4.974 6.630 1.00 0.00 H new ATOM 0 HB3 GLU B 466 -7.130 -4.396 5.031 1.00 0.00 H new ATOM 0 HG2 GLU B 466 -8.334 -6.509 4.577 1.00 0.00 H new ATOM 0 HG3 GLU B 466 -7.892 -7.109 6.163 1.00 0.00 H new ATOM 1273 N ARG B 467 -3.846 -4.909 6.261 1.00 0.00 N ATOM 1274 CA ARG B 467 -2.767 -3.991 6.523 1.00 0.00 C ATOM 1275 C ARG B 467 -1.522 -4.335 5.708 1.00 0.00 C ATOM 1276 O ARG B 467 -0.904 -3.447 5.134 1.00 0.00 O ATOM 1277 CB ARG B 467 -2.482 -4.023 8.018 1.00 0.00 C ATOM 1278 CG ARG B 467 -1.820 -2.776 8.537 1.00 0.00 C ATOM 1279 CD ARG B 467 -1.974 -2.661 10.045 1.00 0.00 C ATOM 1280 NE ARG B 467 -1.411 -3.812 10.750 1.00 0.00 N ATOM 1281 CZ ARG B 467 -1.949 -4.352 11.845 1.00 0.00 C ATOM 1282 NH1 ARG B 467 -3.074 -3.858 12.349 1.00 0.00 N ATOM 1283 NH2 ARG B 467 -1.364 -5.385 12.433 1.00 0.00 N ATOM 0 H ARG B 467 -4.078 -5.507 7.054 1.00 0.00 H new ATOM 0 HA ARG B 467 -3.056 -2.985 6.219 1.00 0.00 H new ATOM 0 HB2 ARG B 467 -3.419 -4.176 8.554 1.00 0.00 H new ATOM 0 HB3 ARG B 467 -1.845 -4.880 8.239 1.00 0.00 H new ATOM 0 HG2 ARG B 467 -0.762 -2.787 8.276 1.00 0.00 H new ATOM 0 HG3 ARG B 467 -2.258 -1.901 8.056 1.00 0.00 H new ATOM 0 HD2 ARG B 467 -1.483 -1.751 10.390 1.00 0.00 H new ATOM 0 HD3 ARG B 467 -3.031 -2.567 10.294 1.00 0.00 H new ATOM 0 HE ARG B 467 -0.555 -4.227 10.382 1.00 0.00 H new ATOM 0 HH11 ARG B 467 -3.529 -3.064 11.899 1.00 0.00 H new ATOM 0 HH12 ARG B 467 -3.483 -4.273 13.186 1.00 0.00 H new ATOM 0 HH21 ARG B 467 -0.501 -5.769 12.049 1.00 0.00 H new ATOM 0 HH22 ARG B 467 -1.777 -5.796 13.270 1.00 0.00 H new ATOM 1297 N ASN B 468 -1.173 -5.620 5.619 1.00 0.00 N ATOM 1298 CA ASN B 468 0.011 -6.035 4.862 1.00 0.00 C ATOM 1299 C ASN B 468 -0.286 -6.000 3.366 1.00 0.00 C ATOM 1300 O ASN B 468 0.614 -6.044 2.527 1.00 0.00 O ATOM 1301 CB ASN B 468 0.512 -7.425 5.283 1.00 0.00 C ATOM 1302 CG ASN B 468 -0.433 -8.556 4.926 1.00 0.00 C ATOM 1303 OD1 ASN B 468 -1.264 -8.957 5.729 1.00 0.00 O ATOM 1304 ND2 ASN B 468 -0.294 -9.100 3.729 1.00 0.00 N ATOM 0 H ASN B 468 -1.687 -6.385 6.057 1.00 0.00 H new ATOM 0 HA ASN B 468 0.810 -5.328 5.086 1.00 0.00 H new ATOM 0 HB2 ASN B 468 1.478 -7.610 4.812 1.00 0.00 H new ATOM 0 HB3 ASN B 468 0.677 -7.429 6.360 1.00 0.00 H new ATOM 0 HD21 ASN B 468 -0.890 -9.879 3.451 1.00 0.00 H new ATOM 0 HD22 ASN B 468 0.410 -8.740 3.084 1.00 0.00 H new ATOM 1311 N VAL B 469 -1.564 -5.955 3.049 1.00 0.00 N ATOM 1312 CA VAL B 469 -2.032 -5.857 1.676 1.00 0.00 C ATOM 1313 C VAL B 469 -1.827 -4.442 1.117 1.00 0.00 C ATOM 1314 O VAL B 469 -1.713 -4.250 -0.098 1.00 0.00 O ATOM 1315 CB VAL B 469 -3.520 -6.289 1.589 1.00 0.00 C ATOM 1316 CG1 VAL B 469 -4.303 -5.462 0.582 1.00 0.00 C ATOM 1317 CG2 VAL B 469 -3.614 -7.764 1.239 1.00 0.00 C ATOM 0 H VAL B 469 -2.314 -5.985 3.739 1.00 0.00 H new ATOM 0 HA VAL B 469 -1.440 -6.534 1.060 1.00 0.00 H new ATOM 0 HB VAL B 469 -3.967 -6.115 2.568 1.00 0.00 H new ATOM 0 HG11 VAL B 469 -5.338 -5.803 0.558 1.00 0.00 H new ATOM 0 HG12 VAL B 469 -4.273 -4.412 0.872 1.00 0.00 H new ATOM 0 HG13 VAL B 469 -3.860 -5.578 -0.407 1.00 0.00 H new ATOM 0 HG21 VAL B 469 -4.662 -8.058 1.180 1.00 0.00 H new ATOM 0 HG22 VAL B 469 -3.133 -7.941 0.277 1.00 0.00 H new ATOM 0 HG23 VAL B 469 -3.115 -8.353 2.008 1.00 0.00 H new ATOM 1327 N ILE B 470 -1.709 -3.463 2.012 1.00 0.00 N ATOM 1328 CA ILE B 470 -1.618 -2.060 1.602 1.00 0.00 C ATOM 1329 C ILE B 470 -0.289 -1.832 0.908 1.00 0.00 C ATOM 1330 O ILE B 470 -0.157 -1.027 -0.012 1.00 0.00 O ATOM 1331 CB ILE B 470 -1.709 -1.103 2.812 1.00 0.00 C ATOM 1332 CG1 ILE B 470 -2.933 -1.423 3.672 1.00 0.00 C ATOM 1333 CG2 ILE B 470 -1.765 0.339 2.338 1.00 0.00 C ATOM 1334 CD1 ILE B 470 -4.249 -1.277 2.941 1.00 0.00 C ATOM 0 H ILE B 470 -1.674 -3.612 3.020 1.00 0.00 H new ATOM 0 HA ILE B 470 -2.453 -1.852 0.933 1.00 0.00 H new ATOM 0 HB ILE B 470 -0.817 -1.242 3.423 1.00 0.00 H new ATOM 0 HG12 ILE B 470 -2.847 -2.444 4.045 1.00 0.00 H new ATOM 0 HG13 ILE B 470 -2.936 -0.766 4.541 1.00 0.00 H new ATOM 0 HG21 ILE B 470 -1.829 1.003 3.200 1.00 0.00 H new ATOM 0 HG22 ILE B 470 -0.865 0.570 1.768 1.00 0.00 H new ATOM 0 HG23 ILE B 470 -2.641 0.480 1.705 1.00 0.00 H new ATOM 0 HD11 ILE B 470 -5.069 -1.521 3.616 1.00 0.00 H new ATOM 0 HD12 ILE B 470 -4.359 -0.250 2.592 1.00 0.00 H new ATOM 0 HD13 ILE B 470 -4.268 -1.955 2.087 1.00 0.00 H new ATOM 1346 N LEU B 471 0.675 -2.580 1.388 1.00 0.00 N ATOM 1347 CA LEU B 471 2.037 -2.584 0.906 1.00 0.00 C ATOM 1348 C LEU B 471 2.074 -2.759 -0.602 1.00 0.00 C ATOM 1349 O LEU B 471 2.662 -1.952 -1.319 1.00 0.00 O ATOM 1350 CB LEU B 471 2.768 -3.748 1.575 1.00 0.00 C ATOM 1351 CG LEU B 471 2.959 -3.672 3.102 1.00 0.00 C ATOM 1352 CD1 LEU B 471 4.075 -2.716 3.445 1.00 0.00 C ATOM 1353 CD2 LEU B 471 1.717 -3.239 3.850 1.00 0.00 C ATOM 0 H LEU B 471 0.526 -3.231 2.159 1.00 0.00 H new ATOM 0 HA LEU B 471 2.515 -1.635 1.147 1.00 0.00 H new ATOM 0 HB2 LEU B 471 2.224 -4.665 1.347 1.00 0.00 H new ATOM 0 HB3 LEU B 471 3.752 -3.839 1.115 1.00 0.00 H new ATOM 0 HG LEU B 471 3.199 -4.688 3.416 1.00 0.00 H new ATOM 0 HD11 LEU B 471 4.198 -2.673 4.527 1.00 0.00 H new ATOM 0 HD12 LEU B 471 5.003 -3.061 2.988 1.00 0.00 H new ATOM 0 HD13 LEU B 471 3.832 -1.723 3.068 1.00 0.00 H new ATOM 0 HD21 LEU B 471 1.928 -3.209 4.919 1.00 0.00 H new ATOM 0 HD22 LEU B 471 1.415 -2.248 3.511 1.00 0.00 H new ATOM 0 HD23 LEU B 471 0.912 -3.948 3.659 1.00 0.00 H new ATOM 1365 N GLN B 472 1.433 -3.828 -1.060 1.00 0.00 N ATOM 1366 CA GLN B 472 1.309 -4.118 -2.490 1.00 0.00 C ATOM 1367 C GLN B 472 0.790 -2.903 -3.249 1.00 0.00 C ATOM 1368 O GLN B 472 1.314 -2.549 -4.303 1.00 0.00 O ATOM 1369 CB GLN B 472 0.370 -5.306 -2.730 1.00 0.00 C ATOM 1370 CG GLN B 472 0.958 -6.666 -2.383 1.00 0.00 C ATOM 1371 CD GLN B 472 1.268 -6.821 -0.908 1.00 0.00 C ATOM 1372 OE1 GLN B 472 2.383 -6.565 -0.463 1.00 0.00 O ATOM 1373 NE2 GLN B 472 0.273 -7.220 -0.140 1.00 0.00 N ATOM 0 H GLN B 472 0.985 -4.518 -0.456 1.00 0.00 H new ATOM 0 HA GLN B 472 2.303 -4.371 -2.859 1.00 0.00 H new ATOM 0 HB2 GLN B 472 -0.537 -5.158 -2.144 1.00 0.00 H new ATOM 0 HB3 GLN B 472 0.074 -5.311 -3.779 1.00 0.00 H new ATOM 0 HG2 GLN B 472 0.258 -7.445 -2.685 1.00 0.00 H new ATOM 0 HG3 GLN B 472 1.872 -6.818 -2.958 1.00 0.00 H new ATOM 0 HE21 GLN B 472 -0.639 -7.422 -0.550 1.00 0.00 H new ATOM 0 HE22 GLN B 472 0.415 -7.326 0.864 1.00 0.00 H new ATOM 1382 N CYS B 473 -0.230 -2.265 -2.693 1.00 0.00 N ATOM 1383 CA CYS B 473 -0.843 -1.099 -3.307 1.00 0.00 C ATOM 1384 C CYS B 473 0.164 0.044 -3.408 1.00 0.00 C ATOM 1385 O CYS B 473 0.431 0.557 -4.497 1.00 0.00 O ATOM 1386 CB CYS B 473 -2.060 -0.668 -2.485 1.00 0.00 C ATOM 1387 SG CYS B 473 -3.253 -1.998 -2.187 1.00 0.00 S ATOM 0 H CYS B 473 -0.654 -2.541 -1.807 1.00 0.00 H new ATOM 0 HA CYS B 473 -1.166 -1.356 -4.316 1.00 0.00 H new ATOM 0 HB2 CYS B 473 -1.719 -0.278 -1.526 1.00 0.00 H new ATOM 0 HB3 CYS B 473 -2.564 0.150 -3.001 1.00 0.00 H new ATOM 0 HG CYS B 473 -2.732 -2.877 -1.383 1.00 0.00 H new ATOM 1393 N VAL B 474 0.725 0.418 -2.265 1.00 0.00 N ATOM 1394 CA VAL B 474 1.725 1.468 -2.179 1.00 0.00 C ATOM 1395 C VAL B 474 2.876 1.243 -3.155 1.00 0.00 C ATOM 1396 O VAL B 474 3.185 2.114 -3.972 1.00 0.00 O ATOM 1397 CB VAL B 474 2.293 1.553 -0.744 1.00 0.00 C ATOM 1398 CG1 VAL B 474 3.416 2.569 -0.659 1.00 0.00 C ATOM 1399 CG2 VAL B 474 1.192 1.889 0.249 1.00 0.00 C ATOM 0 H VAL B 474 0.495 -0.004 -1.365 1.00 0.00 H new ATOM 0 HA VAL B 474 1.228 2.402 -2.442 1.00 0.00 H new ATOM 0 HB VAL B 474 2.704 0.576 -0.488 1.00 0.00 H new ATOM 0 HG11 VAL B 474 3.796 2.607 0.362 1.00 0.00 H new ATOM 0 HG12 VAL B 474 4.221 2.279 -1.335 1.00 0.00 H new ATOM 0 HG13 VAL B 474 3.040 3.552 -0.943 1.00 0.00 H new ATOM 0 HG21 VAL B 474 1.612 1.944 1.253 1.00 0.00 H new ATOM 0 HG22 VAL B 474 0.748 2.850 -0.012 1.00 0.00 H new ATOM 0 HG23 VAL B 474 0.426 1.114 0.218 1.00 0.00 H new ATOM 1409 N ARG B 475 3.486 0.067 -3.091 1.00 0.00 N ATOM 1410 CA ARG B 475 4.709 -0.190 -3.840 1.00 0.00 C ATOM 1411 C ARG B 475 4.434 -0.334 -5.332 1.00 0.00 C ATOM 1412 O ARG B 475 5.305 -0.046 -6.150 1.00 0.00 O ATOM 1413 CB ARG B 475 5.428 -1.430 -3.307 1.00 0.00 C ATOM 1414 CG ARG B 475 5.669 -1.388 -1.807 1.00 0.00 C ATOM 1415 CD ARG B 475 6.783 -2.330 -1.392 1.00 0.00 C ATOM 1416 NE ARG B 475 8.100 -1.784 -1.710 1.00 0.00 N ATOM 1417 CZ ARG B 475 9.239 -2.463 -1.608 1.00 0.00 C ATOM 1418 NH1 ARG B 475 9.223 -3.749 -1.268 1.00 0.00 N ATOM 1419 NH2 ARG B 475 10.394 -1.856 -1.848 1.00 0.00 N ATOM 0 H ARG B 475 3.157 -0.720 -2.532 1.00 0.00 H new ATOM 0 HA ARG B 475 5.360 0.673 -3.702 1.00 0.00 H new ATOM 0 HB2 ARG B 475 4.839 -2.315 -3.549 1.00 0.00 H new ATOM 0 HB3 ARG B 475 6.385 -1.535 -3.819 1.00 0.00 H new ATOM 0 HG2 ARG B 475 5.922 -0.371 -1.507 1.00 0.00 H new ATOM 0 HG3 ARG B 475 4.751 -1.656 -1.283 1.00 0.00 H new ATOM 0 HD2 ARG B 475 6.717 -2.521 -0.321 1.00 0.00 H new ATOM 0 HD3 ARG B 475 6.655 -3.288 -1.895 1.00 0.00 H new ATOM 0 HE ARG B 475 8.149 -0.817 -2.032 1.00 0.00 H new ATOM 0 HH11 ARG B 475 8.335 -4.217 -1.085 1.00 0.00 H new ATOM 0 HH12 ARG B 475 10.098 -4.267 -1.191 1.00 0.00 H new ATOM 0 HH21 ARG B 475 10.407 -0.870 -2.110 1.00 0.00 H new ATOM 0 HH22 ARG B 475 11.269 -2.375 -1.770 1.00 0.00 H new ATOM 1433 N TYR B 476 3.230 -0.765 -5.694 1.00 0.00 N ATOM 1434 CA TYR B 476 2.863 -0.847 -7.097 1.00 0.00 C ATOM 1435 C TYR B 476 2.777 0.552 -7.692 1.00 0.00 C ATOM 1436 O TYR B 476 3.297 0.814 -8.779 1.00 0.00 O ATOM 1437 CB TYR B 476 1.526 -1.579 -7.277 1.00 0.00 C ATOM 1438 CG TYR B 476 0.709 -1.026 -8.424 1.00 0.00 C ATOM 1439 CD1 TYR B 476 0.978 -1.376 -9.741 1.00 0.00 C ATOM 1440 CD2 TYR B 476 -0.305 -0.114 -8.179 1.00 0.00 C ATOM 1441 CE1 TYR B 476 0.254 -0.829 -10.784 1.00 0.00 C ATOM 1442 CE2 TYR B 476 -1.036 0.432 -9.213 1.00 0.00 C ATOM 1443 CZ TYR B 476 -0.753 0.074 -10.515 1.00 0.00 C ATOM 1444 OH TYR B 476 -1.477 0.626 -11.551 1.00 0.00 O ATOM 0 H TYR B 476 2.502 -1.059 -5.042 1.00 0.00 H new ATOM 0 HA TYR B 476 3.633 -1.415 -7.619 1.00 0.00 H new ATOM 0 HB2 TYR B 476 1.716 -2.638 -7.449 1.00 0.00 H new ATOM 0 HB3 TYR B 476 0.948 -1.505 -6.356 1.00 0.00 H new ATOM 0 HD1 TYR B 476 1.764 -2.086 -9.953 1.00 0.00 H new ATOM 0 HD2 TYR B 476 -0.526 0.174 -7.162 1.00 0.00 H new ATOM 0 HE1 TYR B 476 0.476 -1.107 -11.804 1.00 0.00 H new ATOM 0 HE2 TYR B 476 -1.827 1.137 -9.004 1.00 0.00 H new ATOM 0 HH TYR B 476 -2.149 1.241 -11.189 1.00 0.00 H new ATOM 1454 N ILE B 477 2.108 1.446 -6.974 1.00 0.00 N ATOM 1455 CA ILE B 477 1.935 2.811 -7.434 1.00 0.00 C ATOM 1456 C ILE B 477 3.285 3.488 -7.545 1.00 0.00 C ATOM 1457 O ILE B 477 3.664 3.963 -8.611 1.00 0.00 O ATOM 1458 CB ILE B 477 1.033 3.620 -6.484 1.00 0.00 C ATOM 1459 CG1 ILE B 477 -0.332 2.942 -6.355 1.00 0.00 C ATOM 1460 CG2 ILE B 477 0.878 5.049 -6.988 1.00 0.00 C ATOM 1461 CD1 ILE B 477 -1.220 3.562 -5.302 1.00 0.00 C ATOM 0 H ILE B 477 1.678 1.246 -6.071 1.00 0.00 H new ATOM 0 HA ILE B 477 1.453 2.775 -8.411 1.00 0.00 H new ATOM 0 HB ILE B 477 1.499 3.655 -5.499 1.00 0.00 H new ATOM 0 HG12 ILE B 477 -0.841 2.984 -7.318 1.00 0.00 H new ATOM 0 HG13 ILE B 477 -0.184 1.888 -6.118 1.00 0.00 H new ATOM 0 HG21 ILE B 477 0.238 5.608 -6.306 1.00 0.00 H new ATOM 0 HG22 ILE B 477 1.857 5.525 -7.039 1.00 0.00 H new ATOM 0 HG23 ILE B 477 0.428 5.038 -7.981 1.00 0.00 H new ATOM 0 HD11 ILE B 477 -2.170 3.029 -5.268 1.00 0.00 H new ATOM 0 HD12 ILE B 477 -0.732 3.496 -4.330 1.00 0.00 H new ATOM 0 HD13 ILE B 477 -1.400 4.609 -5.548 1.00 0.00 H new ATOM 1473 N ILE B 478 4.027 3.470 -6.445 1.00 0.00 N ATOM 1474 CA ILE B 478 5.346 4.082 -6.390 1.00 0.00 C ATOM 1475 C ILE B 478 6.261 3.511 -7.471 1.00 0.00 C ATOM 1476 O ILE B 478 7.152 4.206 -7.965 1.00 0.00 O ATOM 1477 CB ILE B 478 5.988 3.879 -4.999 1.00 0.00 C ATOM 1478 CG1 ILE B 478 5.135 4.562 -3.928 1.00 0.00 C ATOM 1479 CG2 ILE B 478 7.417 4.411 -4.962 1.00 0.00 C ATOM 1480 CD1 ILE B 478 5.742 4.509 -2.548 1.00 0.00 C ATOM 0 H ILE B 478 3.733 3.033 -5.571 1.00 0.00 H new ATOM 0 HA ILE B 478 5.221 5.150 -6.568 1.00 0.00 H new ATOM 0 HB ILE B 478 6.030 2.809 -4.796 1.00 0.00 H new ATOM 0 HG12 ILE B 478 4.981 5.604 -4.208 1.00 0.00 H new ATOM 0 HG13 ILE B 478 4.153 4.090 -3.902 1.00 0.00 H new ATOM 0 HG21 ILE B 478 7.839 4.252 -3.969 1.00 0.00 H new ATOM 0 HG22 ILE B 478 8.021 3.884 -5.701 1.00 0.00 H new ATOM 0 HG23 ILE B 478 7.414 5.477 -5.189 1.00 0.00 H new ATOM 0 HD11 ILE B 478 5.083 5.013 -1.841 1.00 0.00 H new ATOM 0 HD12 ILE B 478 5.871 3.469 -2.247 1.00 0.00 H new ATOM 0 HD13 ILE B 478 6.712 5.007 -2.558 1.00 0.00 H new ATOM 1492 N LYS B 479 6.002 2.263 -7.858 1.00 0.00 N ATOM 1493 CA LYS B 479 6.824 1.564 -8.832 1.00 0.00 C ATOM 1494 C LYS B 479 6.916 2.324 -10.152 1.00 0.00 C ATOM 1495 O LYS B 479 7.979 2.374 -10.771 1.00 0.00 O ATOM 1496 CB LYS B 479 6.287 0.153 -9.074 1.00 0.00 C ATOM 1497 CG LYS B 479 7.283 -0.767 -9.756 1.00 0.00 C ATOM 1498 CD LYS B 479 8.495 -1.012 -8.873 1.00 0.00 C ATOM 1499 CE LYS B 479 9.510 -1.914 -9.549 1.00 0.00 C ATOM 1500 NZ LYS B 479 10.131 -1.268 -10.739 1.00 0.00 N ATOM 0 H LYS B 479 5.219 1.714 -7.504 1.00 0.00 H new ATOM 0 HA LYS B 479 7.830 1.498 -8.417 1.00 0.00 H new ATOM 0 HB2 LYS B 479 5.995 -0.285 -8.119 1.00 0.00 H new ATOM 0 HB3 LYS B 479 5.386 0.216 -9.684 1.00 0.00 H new ATOM 0 HG2 LYS B 479 6.803 -1.717 -9.992 1.00 0.00 H new ATOM 0 HG3 LYS B 479 7.601 -0.327 -10.701 1.00 0.00 H new ATOM 0 HD2 LYS B 479 8.963 -0.059 -8.625 1.00 0.00 H new ATOM 0 HD3 LYS B 479 8.175 -1.464 -7.934 1.00 0.00 H new ATOM 0 HE2 LYS B 479 10.289 -2.181 -8.835 1.00 0.00 H new ATOM 0 HE3 LYS B 479 9.024 -2.841 -9.853 1.00 0.00 H new ATOM 0 HZ1 LYS B 479 10.900 -1.869 -11.099 1.00 0.00 H new ATOM 0 HZ2 LYS B 479 9.413 -1.144 -11.481 1.00 0.00 H new ATOM 0 HZ3 LYS B 479 10.515 -0.340 -10.469 1.00 0.00 H new ATOM 1514 N LYS B 480 5.813 2.916 -10.583 1.00 0.00 N ATOM 1515 CA LYS B 480 5.807 3.647 -11.843 1.00 0.00 C ATOM 1516 C LYS B 480 5.574 5.134 -11.611 1.00 0.00 C ATOM 1517 O LYS B 480 5.791 5.952 -12.502 1.00 0.00 O ATOM 1518 CB LYS B 480 4.731 3.104 -12.794 1.00 0.00 C ATOM 1519 CG LYS B 480 4.822 1.607 -13.052 1.00 0.00 C ATOM 1520 CD LYS B 480 4.043 0.809 -12.021 1.00 0.00 C ATOM 1521 CE LYS B 480 4.321 -0.679 -12.143 1.00 0.00 C ATOM 1522 NZ LYS B 480 4.111 -1.175 -13.527 1.00 0.00 N ATOM 0 H LYS B 480 4.921 2.906 -10.088 1.00 0.00 H new ATOM 0 HA LYS B 480 6.786 3.508 -12.301 1.00 0.00 H new ATOM 0 HB2 LYS B 480 3.749 3.331 -12.380 1.00 0.00 H new ATOM 0 HB3 LYS B 480 4.805 3.630 -13.746 1.00 0.00 H new ATOM 0 HG2 LYS B 480 4.439 1.386 -14.048 1.00 0.00 H new ATOM 0 HG3 LYS B 480 5.867 1.298 -13.037 1.00 0.00 H new ATOM 0 HD2 LYS B 480 4.308 1.149 -11.020 1.00 0.00 H new ATOM 0 HD3 LYS B 480 2.976 0.992 -12.148 1.00 0.00 H new ATOM 0 HE2 LYS B 480 5.347 -0.882 -11.838 1.00 0.00 H new ATOM 0 HE3 LYS B 480 3.671 -1.226 -11.460 1.00 0.00 H new ATOM 0 HZ1 LYS B 480 4.128 -2.215 -13.529 1.00 0.00 H new ATOM 0 HZ2 LYS B 480 3.190 -0.843 -13.879 1.00 0.00 H new ATOM 0 HZ3 LYS B 480 4.867 -0.815 -14.143 1.00 0.00 H new ATOM 1536 N ASP B 481 5.137 5.477 -10.411 1.00 0.00 N ATOM 1537 CA ASP B 481 4.755 6.851 -10.111 1.00 0.00 C ATOM 1538 C ASP B 481 5.950 7.673 -9.644 1.00 0.00 C ATOM 1539 O ASP B 481 6.312 8.668 -10.270 1.00 0.00 O ATOM 1540 CB ASP B 481 3.665 6.879 -9.044 1.00 0.00 C ATOM 1541 CG ASP B 481 2.798 8.113 -9.135 1.00 0.00 C ATOM 1542 OD1 ASP B 481 3.100 9.116 -8.460 1.00 0.00 O ATOM 1543 OD2 ASP B 481 1.799 8.078 -9.884 1.00 0.00 O ATOM 0 H ASP B 481 5.037 4.828 -9.630 1.00 0.00 H new ATOM 0 HA ASP B 481 4.373 7.294 -11.031 1.00 0.00 H new ATOM 0 HB2 ASP B 481 3.040 5.992 -9.144 1.00 0.00 H new ATOM 0 HB3 ASP B 481 4.126 6.835 -8.057 1.00 0.00 H new ATOM 1548 N PHE B 482 6.572 7.243 -8.553 1.00 0.00 N ATOM 1549 CA PHE B 482 7.623 8.035 -7.922 1.00 0.00 C ATOM 1550 C PHE B 482 9.016 7.495 -8.234 1.00 0.00 C ATOM 1551 O PHE B 482 9.682 7.975 -9.152 1.00 0.00 O ATOM 1552 CB PHE B 482 7.413 8.105 -6.408 1.00 0.00 C ATOM 1553 CG PHE B 482 6.162 8.831 -5.998 1.00 0.00 C ATOM 1554 CD1 PHE B 482 5.019 8.128 -5.650 1.00 0.00 C ATOM 1555 CD2 PHE B 482 6.129 10.215 -5.960 1.00 0.00 C ATOM 1556 CE1 PHE B 482 3.867 8.791 -5.274 1.00 0.00 C ATOM 1557 CE2 PHE B 482 4.979 10.885 -5.584 1.00 0.00 C ATOM 1558 CZ PHE B 482 3.847 10.171 -5.241 1.00 0.00 C ATOM 0 H PHE B 482 6.370 6.357 -8.089 1.00 0.00 H new ATOM 0 HA PHE B 482 7.558 9.040 -8.339 1.00 0.00 H new ATOM 0 HB2 PHE B 482 7.380 7.091 -6.009 1.00 0.00 H new ATOM 0 HB3 PHE B 482 8.273 8.599 -5.955 1.00 0.00 H new ATOM 0 HD1 PHE B 482 5.029 7.048 -5.673 1.00 0.00 H new ATOM 0 HD2 PHE B 482 7.011 10.778 -6.227 1.00 0.00 H new ATOM 0 HE1 PHE B 482 2.983 8.231 -5.006 1.00 0.00 H new ATOM 0 HE2 PHE B 482 4.966 11.965 -5.559 1.00 0.00 H new ATOM 0 HZ PHE B 482 2.948 10.692 -4.947 1.00 0.00 H new ATOM 1568 N PHE B 483 9.460 6.494 -7.476 1.00 0.00 N ATOM 1569 CA PHE B 483 10.817 5.989 -7.621 1.00 0.00 C ATOM 1570 C PHE B 483 10.800 4.581 -8.192 1.00 0.00 C ATOM 1571 O PHE B 483 11.473 4.297 -9.185 1.00 0.00 O ATOM 1572 CB PHE B 483 11.521 5.977 -6.260 1.00 0.00 C ATOM 1573 CG PHE B 483 11.550 7.311 -5.572 1.00 0.00 C ATOM 1574 CD1 PHE B 483 12.557 8.221 -5.842 1.00 0.00 C ATOM 1575 CD2 PHE B 483 10.575 7.651 -4.648 1.00 0.00 C ATOM 1576 CE1 PHE B 483 12.591 9.446 -5.208 1.00 0.00 C ATOM 1577 CE2 PHE B 483 10.602 8.875 -4.010 1.00 0.00 C ATOM 1578 CZ PHE B 483 11.611 9.775 -4.290 1.00 0.00 C ATOM 0 H PHE B 483 8.903 6.023 -6.763 1.00 0.00 H new ATOM 0 HA PHE B 483 11.357 6.644 -8.304 1.00 0.00 H new ATOM 0 HB2 PHE B 483 11.022 5.257 -5.612 1.00 0.00 H new ATOM 0 HB3 PHE B 483 12.545 5.628 -6.396 1.00 0.00 H new ATOM 0 HD1 PHE B 483 13.326 7.969 -6.558 1.00 0.00 H new ATOM 0 HD2 PHE B 483 9.784 6.950 -4.424 1.00 0.00 H new ATOM 0 HE1 PHE B 483 13.382 10.147 -5.429 1.00 0.00 H new ATOM 0 HE2 PHE B 483 9.835 9.128 -3.293 1.00 0.00 H new ATOM 0 HZ PHE B 483 11.635 10.734 -3.793 1.00 0.00 H new ATOM 1588 N GLY B 484 10.009 3.717 -7.578 1.00 0.00 N ATOM 1589 CA GLY B 484 9.893 2.348 -8.034 1.00 0.00 C ATOM 1590 C GLY B 484 11.198 1.598 -7.964 1.00 0.00 C ATOM 1591 O GLY B 484 11.510 0.781 -8.834 1.00 0.00 O ATOM 0 H GLY B 484 9.439 3.942 -6.763 1.00 0.00 H new ATOM 0 HA2 GLY B 484 9.148 1.830 -7.429 1.00 0.00 H new ATOM 0 HA3 GLY B 484 9.530 2.341 -9.062 1.00 0.00 H new ATOM 1595 N LEU B 485 11.965 1.887 -6.932 1.00 0.00 N ATOM 1596 CA LEU B 485 13.216 1.197 -6.700 1.00 0.00 C ATOM 1597 C LEU B 485 13.200 0.494 -5.350 1.00 0.00 C ATOM 1598 O LEU B 485 12.437 0.859 -4.455 1.00 0.00 O ATOM 1599 CB LEU B 485 14.390 2.177 -6.793 1.00 0.00 C ATOM 1600 CG LEU B 485 14.242 3.469 -5.978 1.00 0.00 C ATOM 1601 CD1 LEU B 485 14.570 3.240 -4.511 1.00 0.00 C ATOM 1602 CD2 LEU B 485 15.119 4.565 -6.559 1.00 0.00 C ATOM 0 H LEU B 485 11.741 2.600 -6.237 1.00 0.00 H new ATOM 0 HA LEU B 485 13.342 0.438 -7.472 1.00 0.00 H new ATOM 0 HB2 LEU B 485 15.295 1.664 -6.466 1.00 0.00 H new ATOM 0 HB3 LEU B 485 14.535 2.444 -7.840 1.00 0.00 H new ATOM 0 HG LEU B 485 13.201 3.786 -6.038 1.00 0.00 H new ATOM 0 HD11 LEU B 485 14.455 4.175 -3.962 1.00 0.00 H new ATOM 0 HD12 LEU B 485 13.893 2.492 -4.099 1.00 0.00 H new ATOM 0 HD13 LEU B 485 15.598 2.889 -4.418 1.00 0.00 H new ATOM 0 HD21 LEU B 485 15.003 5.475 -5.970 1.00 0.00 H new ATOM 0 HD22 LEU B 485 16.162 4.248 -6.535 1.00 0.00 H new ATOM 0 HD23 LEU B 485 14.823 4.760 -7.590 1.00 0.00 H new ATOM 1614 N ASP B 486 14.026 -0.524 -5.226 1.00 0.00 N ATOM 1615 CA ASP B 486 14.170 -1.259 -3.975 1.00 0.00 C ATOM 1616 C ASP B 486 15.643 -1.555 -3.721 1.00 0.00 C ATOM 1617 O ASP B 486 16.050 -1.880 -2.609 1.00 0.00 O ATOM 1618 CB ASP B 486 13.362 -2.562 -4.042 1.00 0.00 C ATOM 1619 CG ASP B 486 13.481 -3.412 -2.791 1.00 0.00 C ATOM 1620 OD1 ASP B 486 12.741 -3.155 -1.817 1.00 0.00 O ATOM 1621 OD2 ASP B 486 14.297 -4.358 -2.786 1.00 0.00 O ATOM 0 H ASP B 486 14.617 -0.868 -5.983 1.00 0.00 H new ATOM 0 HA ASP B 486 13.788 -0.655 -3.152 1.00 0.00 H new ATOM 0 HB2 ASP B 486 12.312 -2.321 -4.210 1.00 0.00 H new ATOM 0 HB3 ASP B 486 13.697 -3.144 -4.901 1.00 0.00 H new ATOM 1626 N THR B 487 16.440 -1.400 -4.768 1.00 0.00 N ATOM 1627 CA THR B 487 17.854 -1.731 -4.724 1.00 0.00 C ATOM 1628 C THR B 487 18.719 -0.488 -4.524 1.00 0.00 C ATOM 1629 O THR B 487 19.949 -0.570 -4.498 1.00 0.00 O ATOM 1630 CB THR B 487 18.257 -2.423 -6.034 1.00 0.00 C ATOM 1631 OG1 THR B 487 17.776 -1.651 -7.144 1.00 0.00 O ATOM 1632 CG2 THR B 487 17.671 -3.822 -6.105 1.00 0.00 C ATOM 0 H THR B 487 16.124 -1.042 -5.669 1.00 0.00 H new ATOM 0 HA THR B 487 18.017 -2.397 -3.876 1.00 0.00 H new ATOM 0 HB THR B 487 19.344 -2.497 -6.070 1.00 0.00 H new ATOM 0 HG1 THR B 487 18.087 -0.726 -7.058 1.00 0.00 H new ATOM 0 HG21 THR B 487 17.969 -4.294 -7.041 1.00 0.00 H new ATOM 0 HG22 THR B 487 18.039 -4.414 -5.267 1.00 0.00 H new ATOM 0 HG23 THR B 487 16.584 -3.764 -6.058 1.00 0.00 H new ATOM 1640 N ASN B 488 18.073 0.660 -4.374 1.00 0.00 N ATOM 1641 CA ASN B 488 18.780 1.924 -4.272 1.00 0.00 C ATOM 1642 C ASN B 488 18.375 2.649 -3.004 1.00 0.00 C ATOM 1643 O ASN B 488 17.196 2.923 -2.786 1.00 0.00 O ATOM 1644 CB ASN B 488 18.479 2.808 -5.482 1.00 0.00 C ATOM 1645 CG ASN B 488 18.882 2.164 -6.786 1.00 0.00 C ATOM 1646 OD1 ASN B 488 18.093 1.463 -7.420 1.00 0.00 O ATOM 1647 ND2 ASN B 488 20.109 2.403 -7.194 1.00 0.00 N ATOM 0 H ASN B 488 17.058 0.739 -4.320 1.00 0.00 H new ATOM 0 HA ASN B 488 19.849 1.715 -4.243 1.00 0.00 H new ATOM 0 HB2 ASN B 488 17.413 3.033 -5.507 1.00 0.00 H new ATOM 0 HB3 ASN B 488 19.003 3.758 -5.373 1.00 0.00 H new ATOM 0 HD21 ASN B 488 20.443 2.001 -8.070 1.00 0.00 H new ATOM 0 HD22 ASN B 488 20.727 2.991 -6.634 1.00 0.00 H new ATOM 1654 N SER B 489 19.341 2.927 -2.151 1.00 0.00 N ATOM 1655 CA SER B 489 19.088 3.701 -0.949 1.00 0.00 C ATOM 1656 C SER B 489 20.306 4.527 -0.568 1.00 0.00 C ATOM 1657 O SER B 489 21.164 4.087 0.202 1.00 0.00 O ATOM 1658 CB SER B 489 18.694 2.788 0.206 1.00 0.00 C ATOM 1659 OG SER B 489 17.551 2.013 -0.122 1.00 0.00 O ATOM 0 H SER B 489 20.310 2.629 -2.267 1.00 0.00 H new ATOM 0 HA SER B 489 18.261 4.380 -1.157 1.00 0.00 H new ATOM 0 HB2 SER B 489 19.526 2.128 0.452 1.00 0.00 H new ATOM 0 HB3 SER B 489 18.489 3.387 1.093 1.00 0.00 H new ATOM 0 HG SER B 489 17.320 1.435 0.635 1.00 0.00 H new ATOM 1665 N ALA B 490 20.370 5.728 -1.110 1.00 0.00 N ATOM 1666 CA ALA B 490 21.443 6.658 -0.798 1.00 0.00 C ATOM 1667 C ALA B 490 21.102 7.431 0.464 1.00 0.00 C ATOM 1668 O ALA B 490 20.956 8.654 0.454 1.00 0.00 O ATOM 1669 CB ALA B 490 21.680 7.605 -1.958 1.00 0.00 C ATOM 0 H ALA B 490 19.685 6.087 -1.775 1.00 0.00 H new ATOM 0 HA ALA B 490 22.361 6.096 -0.629 1.00 0.00 H new ATOM 0 HB1 ALA B 490 22.486 8.294 -1.706 1.00 0.00 H new ATOM 0 HB2 ALA B 490 21.954 7.033 -2.844 1.00 0.00 H new ATOM 0 HB3 ALA B 490 20.770 8.170 -2.158 1.00 0.00 H new ATOM 1675 N LYS B 491 20.962 6.694 1.544 1.00 0.00 N ATOM 1676 CA LYS B 491 20.557 7.261 2.817 1.00 0.00 C ATOM 1677 C LYS B 491 21.750 7.411 3.741 1.00 0.00 C ATOM 1678 O LYS B 491 22.095 6.482 4.475 1.00 0.00 O ATOM 1679 CB LYS B 491 19.501 6.374 3.465 1.00 0.00 C ATOM 1680 CG LYS B 491 18.222 6.276 2.656 1.00 0.00 C ATOM 1681 CD LYS B 491 17.281 5.230 3.223 1.00 0.00 C ATOM 1682 CE LYS B 491 15.917 5.319 2.570 1.00 0.00 C ATOM 1683 NZ LYS B 491 15.207 6.570 2.951 1.00 0.00 N ATOM 0 H LYS B 491 21.125 5.687 1.567 1.00 0.00 H new ATOM 0 HA LYS B 491 20.135 8.250 2.639 1.00 0.00 H new ATOM 0 HB2 LYS B 491 19.912 5.374 3.605 1.00 0.00 H new ATOM 0 HB3 LYS B 491 19.267 6.764 4.456 1.00 0.00 H new ATOM 0 HG2 LYS B 491 17.724 7.245 2.643 1.00 0.00 H new ATOM 0 HG3 LYS B 491 18.463 6.028 1.622 1.00 0.00 H new ATOM 0 HD2 LYS B 491 17.699 4.236 3.067 1.00 0.00 H new ATOM 0 HD3 LYS B 491 17.183 5.369 4.300 1.00 0.00 H new ATOM 0 HE2 LYS B 491 16.029 5.279 1.486 1.00 0.00 H new ATOM 0 HE3 LYS B 491 15.317 4.457 2.861 1.00 0.00 H new ATOM 0 HZ1 LYS B 491 14.315 6.638 2.421 1.00 0.00 H new ATOM 0 HZ2 LYS B 491 15.004 6.557 3.971 1.00 0.00 H new ATOM 0 HZ3 LYS B 491 15.806 7.391 2.728 1.00 0.00 H new ATOM 1697 N SER B 492 22.386 8.576 3.680 1.00 0.00 N ATOM 1698 CA SER B 492 23.533 8.884 4.523 1.00 0.00 C ATOM 1699 C SER B 492 24.585 7.788 4.411 1.00 0.00 C ATOM 1700 O SER B 492 24.969 7.160 5.397 1.00 0.00 O ATOM 1701 CB SER B 492 23.090 9.058 5.976 1.00 0.00 C ATOM 1702 OG SER B 492 24.140 9.569 6.778 1.00 0.00 O ATOM 0 H SER B 492 22.121 9.330 3.047 1.00 0.00 H new ATOM 0 HA SER B 492 23.976 9.820 4.182 1.00 0.00 H new ATOM 0 HB2 SER B 492 22.235 9.733 6.019 1.00 0.00 H new ATOM 0 HB3 SER B 492 22.759 8.099 6.375 1.00 0.00 H new ATOM 0 HG SER B 492 24.893 8.942 6.769 1.00 0.00 H new ATOM 1708 N LYS B 493 25.034 7.546 3.195 1.00 0.00 N ATOM 1709 CA LYS B 493 26.046 6.536 2.945 1.00 0.00 C ATOM 1710 C LYS B 493 27.420 7.186 2.913 1.00 0.00 C ATOM 1711 O LYS B 493 28.346 6.706 2.256 1.00 0.00 O ATOM 1712 CB LYS B 493 25.749 5.798 1.636 1.00 0.00 C ATOM 1713 CG LYS B 493 24.384 5.114 1.616 1.00 0.00 C ATOM 1714 CD LYS B 493 24.436 3.673 2.125 1.00 0.00 C ATOM 1715 CE LYS B 493 24.835 3.565 3.593 1.00 0.00 C ATOM 1716 NZ LYS B 493 23.866 4.238 4.502 1.00 0.00 N ATOM 0 H LYS B 493 24.713 8.037 2.361 1.00 0.00 H new ATOM 0 HA LYS B 493 26.032 5.801 3.750 1.00 0.00 H new ATOM 0 HB2 LYS B 493 25.803 6.506 0.809 1.00 0.00 H new ATOM 0 HB3 LYS B 493 26.523 5.050 1.467 1.00 0.00 H new ATOM 0 HG2 LYS B 493 23.687 5.686 2.229 1.00 0.00 H new ATOM 0 HG3 LYS B 493 23.994 5.121 0.598 1.00 0.00 H new ATOM 0 HD2 LYS B 493 23.459 3.211 1.987 1.00 0.00 H new ATOM 0 HD3 LYS B 493 25.145 3.107 1.521 1.00 0.00 H new ATOM 0 HE2 LYS B 493 24.914 2.513 3.867 1.00 0.00 H new ATOM 0 HE3 LYS B 493 25.822 4.006 3.730 1.00 0.00 H new ATOM 0 HZ1 LYS B 493 24.344 5.010 5.009 1.00 0.00 H new ATOM 0 HZ2 LYS B 493 23.078 4.626 3.944 1.00 0.00 H new ATOM 0 HZ3 LYS B 493 23.498 3.549 5.188 1.00 0.00 H new ATOM 1730 N ASP B 494 27.526 8.292 3.636 1.00 0.00 N ATOM 1731 CA ASP B 494 28.768 9.034 3.754 1.00 0.00 C ATOM 1732 C ASP B 494 29.748 8.276 4.635 1.00 0.00 C ATOM 1733 O ASP B 494 29.748 8.434 5.856 1.00 0.00 O ATOM 1734 CB ASP B 494 28.505 10.419 4.354 1.00 0.00 C ATOM 1735 CG ASP B 494 27.498 11.228 3.563 1.00 0.00 C ATOM 1736 OD1 ASP B 494 26.283 10.979 3.702 1.00 0.00 O ATOM 1737 OD2 ASP B 494 27.915 12.135 2.811 1.00 0.00 O ATOM 0 H ASP B 494 26.750 8.699 4.158 1.00 0.00 H new ATOM 0 HA ASP B 494 29.196 9.152 2.759 1.00 0.00 H new ATOM 0 HB2 ASP B 494 28.146 10.303 5.377 1.00 0.00 H new ATOM 0 HB3 ASP B 494 29.444 10.970 4.406 1.00 0.00 H new ATOM 1742 N VAL B 495 30.558 7.434 4.015 1.00 0.00 N ATOM 1743 CA VAL B 495 31.563 6.676 4.737 1.00 0.00 C ATOM 1744 C VAL B 495 32.737 7.579 5.083 1.00 0.00 C ATOM 1745 O VAL B 495 32.839 8.004 6.255 1.00 0.00 O ATOM 1746 CB VAL B 495 32.062 5.464 3.919 1.00 0.00 C ATOM 1747 CG1 VAL B 495 33.080 4.656 4.712 1.00 0.00 C ATOM 1748 CG2 VAL B 495 30.892 4.585 3.499 1.00 0.00 C ATOM 1749 OXT VAL B 495 33.531 7.895 4.173 1.00 0.00 O ATOM 0 H VAL B 495 30.538 7.259 3.010 1.00 0.00 H new ATOM 0 HA VAL B 495 31.104 6.297 5.650 1.00 0.00 H new ATOM 0 HB VAL B 495 32.552 5.839 3.021 1.00 0.00 H new ATOM 0 HG11 VAL B 495 33.416 3.808 4.115 1.00 0.00 H new ATOM 0 HG12 VAL B 495 33.933 5.288 4.958 1.00 0.00 H new ATOM 0 HG13 VAL B 495 32.620 4.293 5.631 1.00 0.00 H new ATOM 0 HG21 VAL B 495 31.263 3.736 2.924 1.00 0.00 H new ATOM 0 HG22 VAL B 495 30.372 4.223 4.386 1.00 0.00 H new ATOM 0 HG23 VAL B 495 30.203 5.165 2.886 1.00 0.00 H new TER 1759 VAL B 495